data_17919 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 17919 _Entry.PDB_ID 2LJ5 save_ save_delta_chem_shifts _Entity_delta_chem_shifts.Sf_category delta_chem_shifts _Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts _Entity_delta_chem_shifts.Model_type single _Entity_delta_chem_shifts.Entry_ID 17919 _Entity_delta_chem_shifts.ID 1 loop_ _Delta_CS.Atom_chem_shift_ID _Delta_CS.Entity_delta_chem_shifts_ID _Delta_CS.Conformer_ID _Delta_CS.Assembly_atom_ID _Delta_CS.Entity_assembly_ID _Delta_CS.Entity_ID _Delta_CS.Comp_index_ID _Delta_CS.Seq_ID _Delta_CS.Comp_ID _Delta_CS.Atom_ID _Delta_CS.Atom_type _Delta_CS.Auth_seq_ID _Delta_CS.Original_CS_value _Delta_CS.Corrected_CS_value _Delta_CS.Sparta_CS_value _Delta_CS.Delta_CS_value _Delta_CS.Entry_ID 1 1 1 . 1 1 2 2 GLN N N 2 123.220 123.220 127.761 -4.541 17919 2 1 1 . 1 1 2 2 GLN HA H 2 5.249 5.249 4.925 0.324 17919 3 1 1 . 1 1 2 2 GLN C C 2 175.920 175.920 174.553 1.367 17919 4 1 1 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.942 0.138 17919 5 1 1 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.342 0.418 17919 6 1 1 . 1 1 2 2 GLN H H 2 8.900 8.900 8.770 0.130 17919 7 1 1 . 1 1 3 3 ILE N N 3 115.340 115.340 119.948 -4.608 17919 8 1 1 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.205 0.008 17919 9 1 1 . 1 1 3 3 ILE C C 3 172.450 172.450 173.557 -1.107 17919 10 1 1 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.652 -0.082 17919 11 1 1 . 1 1 3 3 ILE CB C 3 42.210 42.210 40.969 1.241 17919 12 1 1 . 1 1 3 3 ILE H H 3 8.320 8.320 7.727 0.593 17919 13 1 1 . 1 1 4 4 PHE N N 4 118.110 118.110 120.370 -2.260 17919 14 1 1 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.288 0.342 17919 15 1 1 . 1 1 4 4 PHE C C 4 175.320 175.320 175.398 -0.078 17919 16 1 1 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.486 -0.276 17919 17 1 1 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.024 -0.544 17919 18 1 1 . 1 1 4 4 PHE H H 4 8.610 8.610 7.997 0.613 17919 19 1 1 . 1 1 5 5 VAL N N 5 121.000 121.000 121.716 -0.716 17919 20 1 1 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.658 0.067 17919 21 1 1 . 1 1 5 5 VAL C C 5 174.870 174.870 174.700 0.170 17919 22 1 1 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.556 -0.936 17919 23 1 1 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.830 0.400 17919 24 1 1 . 1 1 5 5 VAL H H 5 9.300 9.300 9.040 0.260 17919 25 1 1 . 1 1 6 6 LYS N N 6 127.520 127.520 128.667 -1.147 17919 26 1 1 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.261 0.106 17919 27 1 1 . 1 1 6 6 LYS C C 6 177.140 177.140 176.362 0.778 17919 28 1 1 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.278 0.242 17919 29 1 1 . 1 1 6 6 LYS CB C 6 35.050 35.050 36.126 -1.076 17919 30 1 1 . 1 1 6 6 LYS H H 6 8.820 8.820 9.329 -0.509 17919 31 1 1 . 1 1 7 7 THR N N 7 115.400 115.400 116.181 -0.781 17919 32 1 1 . 1 1 7 7 THR HA H 7 4.970 4.970 4.722 0.248 17919 33 1 1 . 1 1 7 7 THR C C 7 176.910 176.910 176.198 0.712 17919 34 1 1 . 1 1 7 7 THR CA C 7 60.470 60.470 60.776 -0.306 17919 35 1 1 . 1 1 7 7 THR CB C 7 70.630 70.630 70.356 0.274 17919 36 1 1 . 1 1 7 7 THR H H 7 8.730 8.730 8.551 0.179 17919 37 1 1 . 1 1 8 8 LEU N N 8 121.330 121.330 120.920 0.410 17919 38 1 1 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.530 -0.220 17919 39 1 1 . 1 1 8 8 LEU C C 8 178.800 178.800 177.700 1.100 17919 40 1 1 . 1 1 8 8 LEU CA C 8 57.580 57.580 56.794 0.786 17919 41 1 1 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.134 -0.164 17919 42 1 1 . 1 1 8 8 LEU H H 8 9.100 9.100 8.778 0.322 17919 43 1 1 . 1 1 9 9 THR N N 9 105.590 105.590 110.209 -4.619 17919 44 1 1 . 1 1 9 9 THR HA H 9 4.428 4.428 4.406 0.022 17919 45 1 1 . 1 1 9 9 THR C C 9 175.520 175.520 174.576 0.944 17919 46 1 1 . 1 1 9 9 THR CA C 9 61.400 61.400 61.761 -0.361 17919 47 1 1 . 1 1 9 9 THR CB C 9 69.140 69.140 69.076 0.064 17919 48 1 1 . 1 1 9 9 THR H H 9 7.630 7.630 7.955 -0.325 17919 49 1 1 . 1 1 10 10 GLY N N 10 108.890 108.890 110.668 -1.778 17919 50 1 1 . 1 1 10 10 GLY C C 10 174.070 174.070 172.723 1.347 17919 51 1 1 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.609 0.851 17919 52 1 1 . 1 1 10 10 GLY H H 10 7.810 7.810 7.409 0.401 17919 53 1 1 . 1 1 11 11 LYS N N 11 121.600 121.600 120.112 1.488 17919 54 1 1 . 1 1 11 11 LYS HA H 11 4.361 4.361 3.993 0.368 17919 55 1 1 . 1 1 11 11 LYS C C 11 175.940 175.940 175.330 0.610 17919 56 1 1 . 1 1 11 11 LYS CA C 11 56.280 56.280 57.706 -1.426 17919 57 1 1 . 1 1 11 11 LYS CB C 11 33.200 33.200 32.706 0.494 17919 58 1 1 . 1 1 11 11 LYS H H 11 7.280 7.280 8.361 -1.081 17919 59 1 1 . 1 1 12 12 THR N N 12 120.440 120.440 116.530 3.910 17919 60 1 1 . 1 1 12 12 THR HA H 12 5.046 5.046 4.823 0.223 17919 61 1 1 . 1 1 12 12 THR C C 12 174.320 174.320 174.184 0.136 17919 62 1 1 . 1 1 12 12 THR CA C 12 62.390 62.390 61.323 1.067 17919 63 1 1 . 1 1 12 12 THR CB C 12 69.910 69.910 70.306 -0.396 17919 64 1 1 . 1 1 12 12 THR H H 12 8.650 8.650 8.170 0.480 17919 65 1 1 . 1 1 13 13 ILE N N 13 127.110 127.110 125.149 1.961 17919 66 1 1 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.558 -0.014 17919 67 1 1 . 1 1 13 13 ILE C C 13 175.220 175.220 174.964 0.256 17919 68 1 1 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.343 -0.363 17919 69 1 1 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.812 -0.862 17919 70 1 1 . 1 1 13 13 ILE H H 13 9.450 9.450 9.172 0.278 17919 71 1 1 . 1 1 14 14 THR N N 14 121.520 121.520 122.942 -1.422 17919 72 1 1 . 1 1 14 14 THR HA H 14 4.964 4.964 4.905 0.059 17919 73 1 1 . 1 1 14 14 THR C C 14 173.790 173.790 173.897 -0.107 17919 74 1 1 . 1 1 14 14 THR CA C 14 61.940 61.940 62.160 -0.221 17919 75 1 1 . 1 1 14 14 THR CB C 14 69.650 69.650 69.690 -0.040 17919 76 1 1 . 1 1 14 14 THR H H 14 8.710 8.710 8.301 0.409 17919 77 1 1 . 1 1 15 15 LEU N N 15 124.800 124.800 127.419 -2.619 17919 78 1 1 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.664 0.116 17919 79 1 1 . 1 1 15 15 LEU C C 15 174.670 174.670 175.187 -0.517 17919 80 1 1 . 1 1 15 15 LEU CA C 15 52.830 52.830 54.109 -1.280 17919 81 1 1 . 1 1 15 15 LEU CB C 15 47.070 47.070 44.976 2.094 17919 82 1 1 . 1 1 15 15 LEU H H 15 8.710 8.710 8.345 0.365 17919 83 1 1 . 1 1 16 16 GLU N N 16 122.160 122.160 123.713 -1.553 17919 84 1 1 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.804 0.113 17919 85 1 1 . 1 1 16 16 GLU C C 16 175.860 175.860 176.461 -0.601 17919 86 1 1 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.253 -0.433 17919 87 1 1 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.517 -1.067 17919 88 1 1 . 1 1 16 16 GLU H H 16 8.140 8.140 8.577 -0.437 17919 89 1 1 . 1 1 17 17 VAL N N 17 117.210 117.210 120.584 -3.374 17919 90 1 1 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.751 -0.037 17919 91 1 1 . 1 1 17 17 VAL C C 17 174.160 174.160 175.535 -1.375 17919 92 1 1 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.112 -0.682 17919 93 1 1 . 1 1 17 17 VAL CB C 17 36.400 36.400 34.014 2.386 17919 94 1 1 . 1 1 17 17 VAL H H 17 8.900 8.900 8.759 0.141 17919 95 1 1 . 1 1 18 18 GLU N N 18 118.990 118.990 119.456 -0.466 17919 96 1 1 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.908 0.171 17919 97 1 1 . 1 1 18 18 GLU C C 18 176.160 176.160 175.961 0.199 17919 98 1 1 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.439 0.281 17919 99 1 1 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.844 -0.534 17919 100 1 1 . 1 1 18 18 GLU H H 18 8.640 8.640 8.162 0.478 17919 101 1 1 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.194 -0.053 17919 102 1 1 . 1 1 19 19 PRO C C 19 175.310 175.310 177.766 -2.456 17919 103 1 1 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.623 -0.153 17919 104 1 1 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.979 -0.029 17919 105 1 1 . 1 1 20 20 SER N N 20 103.400 103.400 109.269 -5.869 17919 106 1 1 . 1 1 20 20 SER HA H 20 4.370 4.370 4.339 0.031 17919 107 1 1 . 1 1 20 20 SER C C 20 174.660 174.660 174.178 0.482 17919 108 1 1 . 1 1 20 20 SER CA C 20 57.400 57.400 58.225 -0.825 17919 109 1 1 . 1 1 20 20 SER CB C 20 63.370 63.370 62.952 0.418 17919 110 1 1 . 1 1 20 20 SER H H 20 7.040 7.040 7.929 -0.889 17919 111 1 1 . 1 1 21 21 ASP N N 21 123.480 123.480 124.173 -0.693 17919 112 1 1 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.717 -0.022 17919 113 1 1 . 1 1 21 21 ASP C C 21 176.360 176.360 175.816 0.544 17919 114 1 1 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.218 0.482 17919 115 1 1 . 1 1 21 21 ASP CB C 21 40.800 40.800 42.241 -1.441 17919 116 1 1 . 1 1 21 21 ASP H H 21 8.030 8.030 7.927 0.103 17919 117 1 1 . 1 1 22 22 THR N N 22 108.800 108.800 113.363 -4.563 17919 118 1 1 . 1 1 22 22 THR HA H 22 4.920 4.920 4.719 0.201 17919 119 1 1 . 1 1 22 22 THR C C 22 176.750 176.750 175.765 0.985 17919 120 1 1 . 1 1 22 22 THR CA C 22 59.690 59.690 60.958 -1.268 17919 121 1 1 . 1 1 22 22 THR CB C 22 71.200 71.200 70.215 0.985 17919 122 1 1 . 1 1 22 22 THR H H 22 7.900 7.900 8.375 -0.475 17919 123 1 1 . 1 1 23 23 ILE N N 23 121.190 121.190 121.190 0.000 17919 124 1 1 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.880 -0.223 17919 125 1 1 . 1 1 23 23 ILE C C 23 179.040 179.040 177.475 1.565 17919 126 1 1 . 1 1 23 23 ILE CA C 23 62.260 62.260 61.257 1.003 17919 127 1 1 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.455 -2.105 17919 128 1 1 . 1 1 23 23 ILE H H 23 8.560 8.560 8.918 -0.358 17919 129 1 1 . 1 1 24 24 GLU N N 24 120.830 120.830 120.679 0.151 17919 130 1 1 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.873 0.044 17919 131 1 1 . 1 1 24 24 GLU C C 24 178.640 178.640 178.468 0.172 17919 132 1 1 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.085 0.135 17919 133 1 1 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.483 -1.203 17919 134 1 1 . 1 1 24 24 GLU H H 24 9.760 9.760 8.358 1.402 17919 135 1 1 . 1 1 25 25 ASN N N 25 120.570 120.570 117.690 2.880 17919 136 1 1 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.461 0.064 17919 137 1 1 . 1 1 25 25 ASN C C 25 178.380 178.380 177.914 0.466 17919 138 1 1 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.323 -0.263 17919 139 1 1 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.263 0.187 17919 140 1 1 . 1 1 25 25 ASN H H 25 7.920 7.920 7.654 0.266 17919 141 1 1 . 1 1 26 26 VAL N N 26 121.710 121.710 119.045 2.665 17919 142 1 1 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.588 -0.191 17919 143 1 1 . 1 1 26 26 VAL C C 26 177.950 177.950 177.901 0.049 17919 144 1 1 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.791 0.869 17919 145 1 1 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.156 -0.316 17919 146 1 1 . 1 1 26 26 VAL H H 26 8.070 8.070 7.671 0.399 17919 147 1 1 . 1 1 27 27 LYS N N 27 118.860 118.860 119.929 -1.069 17919 148 1 1 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.163 0.417 17919 149 1 1 . 1 1 27 27 LYS C C 27 180.550 180.550 179.112 1.438 17919 150 1 1 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.473 -0.223 17919 151 1 1 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.203 1.528 17919 152 1 1 . 1 1 27 27 LYS H H 27 8.560 8.560 7.576 0.984 17919 153 1 1 . 1 1 28 28 ALA N N 28 123.440 123.440 123.063 0.377 17919 154 1 1 . 1 1 28 28 ALA HA H 28 4.160 4.160 3.985 0.175 17919 155 1 1 . 1 1 28 28 ALA C C 28 180.300 180.300 179.225 1.075 17919 156 1 1 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.254 0.116 17919 157 1 1 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.273 -0.563 17919 158 1 1 . 1 1 28 28 ALA H H 28 8.060 8.060 8.571 -0.511 17919 159 1 1 . 1 1 29 29 LYS N N 29 119.940 119.940 119.665 0.275 17919 160 1 1 . 1 1 29 29 LYS HA H 29 4.207 4.207 3.906 0.301 17919 161 1 1 . 1 1 29 29 LYS C C 29 180.320 180.320 179.089 1.231 17919 162 1 1 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.626 0.024 17919 163 1 1 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.263 1.027 17919 164 1 1 . 1 1 29 29 LYS H H 29 7.850 7.850 7.829 0.021 17919 165 1 1 . 1 1 30 30 ILE N N 30 121.080 121.080 119.694 1.386 17919 166 1 1 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.634 -0.127 17919 167 1 1 . 1 1 30 30 ILE C C 30 178.310 178.310 177.605 0.705 17919 168 1 1 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.436 0.714 17919 169 1 1 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.672 -0.872 17919 170 1 1 . 1 1 30 30 ILE H H 30 8.280 8.280 8.262 0.018 17919 171 1 1 . 1 1 31 31 GLN N N 31 123.490 123.490 119.972 3.518 17919 172 1 1 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.929 -0.100 17919 173 1 1 . 1 1 31 31 GLN C C 31 178.890 178.890 177.936 0.954 17919 174 1 1 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.123 0.877 17919 175 1 1 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.284 -0.564 17919 176 1 1 . 1 1 31 31 GLN H H 31 8.580 8.580 8.254 0.326 17919 177 1 1 . 1 1 32 32 ASP N N 32 119.360 119.360 120.111 -0.751 17919 178 1 1 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.388 -0.034 17919 179 1 1 . 1 1 32 32 ASP C C 32 177.250 177.250 178.430 -1.180 17919 180 1 1 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.998 0.192 17919 181 1 1 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.849 -0.269 17919 182 1 1 . 1 1 32 32 ASP H H 32 8.010 8.010 7.853 0.157 17919 183 1 1 . 1 1 33 33 LYS N N 33 115.130 115.130 118.434 -3.304 17919 184 1 1 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.201 0.136 17919 185 1 1 . 1 1 33 33 LYS C C 33 177.870 177.870 178.060 -0.190 17919 186 1 1 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.488 0.562 17919 187 1 1 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.362 0.808 17919 188 1 1 . 1 1 33 33 LYS H H 33 7.430 7.430 7.816 -0.386 17919 189 1 1 . 1 1 34 34 GLU N N 34 113.870 113.870 115.950 -2.080 17919 190 1 1 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.565 0.060 17919 191 1 1 . 1 1 34 34 GLU C C 34 177.840 177.840 176.092 1.748 17919 192 1 1 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.123 -0.953 17919 193 1 1 . 1 1 34 34 GLU CB C 34 32.660 32.660 30.872 1.788 17919 194 1 1 . 1 1 34 34 GLU H H 34 8.740 8.740 8.050 0.690 17919 195 1 1 . 1 1 35 35 GLY N N 35 108.650 108.650 108.914 -0.264 17919 196 1 1 . 1 1 35 35 GLY C C 35 173.960 173.960 174.543 -0.583 17919 197 1 1 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.803 0.277 17919 198 1 1 . 1 1 35 35 GLY H H 35 8.530 8.530 7.932 0.598 17919 199 1 1 . 1 1 36 36 ILE N N 36 119.880 119.880 122.490 -2.610 17919 200 1 1 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.318 0.127 17919 201 1 1 . 1 1 36 36 ILE C C 36 173.590 173.590 174.395 -0.805 17919 202 1 1 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.095 -0.345 17919 203 1 1 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.532 2.048 17919 204 1 1 . 1 1 36 36 ILE H H 36 6.150 6.150 7.756 -1.606 17919 205 1 1 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.770 -0.136 17919 206 1 1 . 1 1 37 37 PRO C C 37 176.940 176.940 176.092 0.848 17919 207 1 1 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.203 0.457 17919 208 1 1 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.588 0.262 17919 209 1 1 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.226 -0.109 17919 210 1 1 . 1 1 38 38 PRO C C 38 178.320 178.320 178.586 -0.266 17919 211 1 1 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.408 0.852 17919 212 1 1 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.846 1.044 17919 213 1 1 . 1 1 39 39 ASP N N 39 113.380 113.380 116.098 -2.718 17919 214 1 1 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.427 0.003 17919 215 1 1 . 1 1 39 39 ASP C C 39 177.090 177.090 178.114 -1.024 17919 216 1 1 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.487 -0.847 17919 217 1 1 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.255 -0.715 17919 218 1 1 . 1 1 39 39 ASP H H 39 8.550 8.550 8.656 -0.106 17919 219 1 1 . 1 1 40 40 GLN N N 40 116.780 116.780 117.626 -0.846 17919 220 1 1 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.267 0.197 17919 221 1 1 . 1 1 40 40 GLN C C 40 175.380 175.380 176.070 -0.690 17919 222 1 1 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.915 -1.275 17919 223 1 1 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.507 0.633 17919 224 1 1 . 1 1 40 40 GLN H H 40 7.820 7.820 8.188 -0.368 17919 225 1 1 . 1 1 41 41 GLN N N 41 117.720 117.720 118.981 -1.261 17919 226 1 1 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.805 -0.561 17919 227 1 1 . 1 1 41 41 GLN C C 41 176.300 176.300 175.524 0.776 17919 228 1 1 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.732 0.738 17919 229 1 1 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.522 2.128 17919 230 1 1 . 1 1 41 41 GLN H H 41 7.480 7.480 7.609 -0.129 17919 231 1 1 . 1 1 42 42 ARG N N 42 122.680 122.680 123.035 -0.355 17919 232 1 1 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.935 -0.435 17919 233 1 1 . 1 1 42 42 ARG C C 42 174.050 174.050 174.466 -0.416 17919 234 1 1 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.755 0.294 17919 235 1 1 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.785 -2.035 17919 236 1 1 . 1 1 42 42 ARG H H 42 8.530 8.530 8.654 -0.124 17919 237 1 1 . 1 1 43 43 LEU N N 43 124.040 124.040 123.513 0.527 17919 238 1 1 . 1 1 43 43 LEU C C 43 175.290 175.290 175.224 0.066 17919 239 1 1 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.723 -0.743 17919 240 1 1 . 1 1 43 43 LEU CB C 43 45.790 45.790 45.576 0.214 17919 241 1 1 . 1 1 43 43 LEU H H 43 8.820 8.820 8.696 0.124 17919 242 1 1 . 1 1 44 44 ILE N N 44 121.920 121.920 120.579 1.341 17919 243 1 1 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.095 -0.103 17919 244 1 1 . 1 1 44 44 ILE C C 44 176.060 176.060 174.231 1.829 17919 245 1 1 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.852 -0.872 17919 246 1 1 . 1 1 44 44 ILE CB C 44 41.420 41.420 42.079 -0.659 17919 247 1 1 . 1 1 44 44 ILE H H 44 9.030 9.030 8.421 0.609 17919 248 1 1 . 1 1 45 45 PHE N N 45 125.390 125.390 125.969 -0.579 17919 249 1 1 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.954 0.091 17919 250 1 1 . 1 1 45 45 PHE C C 45 174.470 174.470 174.130 0.340 17919 251 1 1 . 1 1 45 45 PHE CA C 45 57.020 57.020 57.039 -0.019 17919 252 1 1 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.239 0.521 17919 253 1 1 . 1 1 45 45 PHE H H 45 8.830 8.830 8.365 0.465 17919 254 1 1 . 1 1 46 46 ALA N N 46 132.200 132.200 127.767 4.433 17919 255 1 1 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.644 0.046 17919 256 1 1 . 1 1 46 46 ALA C C 46 177.290 177.290 177.927 -0.637 17919 257 1 1 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.471 0.069 17919 258 1 1 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.803 -0.233 17919 259 1 1 . 1 1 46 46 ALA H H 46 8.810 8.810 8.430 0.380 17919 260 1 1 . 1 1 47 47 GLY N N 47 102.340 102.340 104.637 -2.297 17919 261 1 1 . 1 1 47 47 GLY C C 47 173.810 173.810 174.130 -0.320 17919 262 1 1 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.053 0.297 17919 263 1 1 . 1 1 47 47 GLY H H 47 8.130 8.130 8.642 -0.512 17919 264 1 1 . 1 1 48 48 LYS N N 48 121.570 121.570 120.972 0.598 17919 265 1 1 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.599 0.023 17919 266 1 1 . 1 1 48 48 LYS C C 48 174.700 174.700 175.325 -0.625 17919 267 1 1 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.014 -0.464 17919 268 1 1 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.650 -0.120 17919 269 1 1 . 1 1 48 48 LYS H H 48 7.980 7.980 7.585 0.395 17919 270 1 1 . 1 1 49 49 GLN N N 49 122.410 122.410 122.330 0.080 17919 271 1 1 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.695 -0.135 17919 272 1 1 . 1 1 49 49 GLN C C 49 175.670 175.670 175.769 -0.099 17919 273 1 1 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.481 0.259 17919 274 1 1 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.761 -0.761 17919 275 1 1 . 1 1 49 49 GLN H H 49 8.600 8.600 8.574 0.026 17919 276 1 1 . 1 1 50 50 LEU N N 50 125.520 125.520 126.932 -1.412 17919 277 1 1 . 1 1 50 50 LEU HA H 50 4.090 4.090 3.646 0.444 17919 278 1 1 . 1 1 50 50 LEU C C 50 176.660 176.660 175.679 0.981 17919 279 1 1 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.829 0.411 17919 280 1 1 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.560 0.010 17919 281 1 1 . 1 1 50 50 LEU H H 50 8.530 8.530 8.353 0.177 17919 282 1 1 . 1 1 51 51 GLU N N 51 122.940 122.940 125.208 -2.268 17919 283 1 1 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.328 0.160 17919 284 1 1 . 1 1 51 51 GLU C C 51 175.870 175.870 177.021 -1.151 17919 285 1 1 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.781 0.179 17919 286 1 1 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.562 0.007 17919 287 1 1 . 1 1 51 51 GLU H H 51 8.400 8.400 8.460 -0.060 17919 288 1 1 . 1 1 52 52 ASP N N 52 120.030 120.030 124.529 -4.499 17919 289 1 1 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.579 -0.220 17919 290 1 1 . 1 1 52 52 ASP C C 52 177.330 177.330 177.220 0.110 17919 291 1 1 . 1 1 52 52 ASP CA C 52 56.960 56.960 56.836 0.124 17919 292 1 1 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.769 0.081 17919 293 1 1 . 1 1 52 52 ASP H H 52 8.160 8.160 8.843 -0.683 17919 294 1 1 . 1 1 53 53 GLY N N 53 106.660 106.660 105.623 1.037 17919 295 1 1 . 1 1 53 53 GLY C C 53 174.870 174.870 174.382 0.488 17919 296 1 1 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.736 0.434 17919 297 1 1 . 1 1 53 53 GLY H H 53 9.390 9.390 7.864 1.526 17919 298 1 1 . 1 1 54 54 ARG N N 54 119.050 119.050 119.759 -0.709 17919 299 1 1 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.592 0.103 17919 300 1 1 . 1 1 54 54 ARG C C 54 175.350 175.350 175.433 -0.083 17919 301 1 1 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.502 -0.112 17919 302 1 1 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.029 -0.379 17919 303 1 1 . 1 1 54 54 ARG H H 54 7.460 7.460 7.348 0.112 17919 304 1 1 . 1 1 55 55 THR N N 55 108.400 108.400 111.653 -3.253 17919 305 1 1 . 1 1 55 55 THR HA H 55 5.240 5.240 5.143 0.097 17919 306 1 1 . 1 1 55 55 THR C C 55 176.560 176.560 176.423 0.137 17919 307 1 1 . 1 1 55 55 THR CA C 55 59.690 59.690 60.145 -0.455 17919 308 1 1 . 1 1 55 55 THR CB C 55 72.260 72.260 71.278 0.982 17919 309 1 1 . 1 1 55 55 THR H H 55 8.730 8.730 8.824 -0.094 17919 310 1 1 . 1 1 56 56 LEU N N 56 117.920 117.920 122.093 -4.173 17919 311 1 1 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.850 0.210 17919 312 1 1 . 1 1 56 56 LEU C C 56 180.810 180.810 178.898 1.912 17919 313 1 1 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.512 0.198 17919 314 1 1 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.357 -0.987 17919 315 1 1 . 1 1 56 56 LEU H H 56 8.140 8.140 8.254 -0.114 17919 316 1 1 . 1 1 57 57 SER N N 57 113.330 113.330 114.825 -1.495 17919 317 1 1 . 1 1 57 57 SER HA H 57 4.370 4.370 4.060 0.310 17919 318 1 1 . 1 1 57 57 SER C C 57 178.310 178.310 176.860 1.450 17919 319 1 1 . 1 1 57 57 SER CA C 57 61.080 61.080 61.531 -0.451 17919 320 1 1 . 1 1 57 57 SER CB C 57 62.530 62.530 62.113 0.417 17919 321 1 1 . 1 1 57 57 SER H H 57 8.470 8.470 7.863 0.607 17919 322 1 1 . 1 1 58 58 ASP N N 58 124.190 124.190 122.845 1.345 17919 323 1 1 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.318 -0.022 17919 324 1 1 . 1 1 58 58 ASP C C 58 177.400 177.400 177.464 -0.064 17919 325 1 1 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.634 0.546 17919 326 1 1 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.531 -0.430 17919 327 1 1 . 1 1 58 58 ASP H H 58 7.930 7.930 7.638 0.292 17919 328 1 1 . 1 1 59 59 TYR N N 59 115.510 115.510 115.999 -0.489 17919 329 1 1 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.546 0.124 17919 330 1 1 . 1 1 59 59 TYR C C 59 174.700 174.700 174.966 -0.266 17919 331 1 1 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.666 0.584 17919 332 1 1 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.097 1.973 17919 333 1 1 . 1 1 59 59 TYR H H 59 7.250 7.250 7.458 -0.208 17919 334 1 1 . 1 1 60 60 ASN N N 60 115.900 115.900 118.247 -2.347 17919 335 1 1 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.424 -0.069 17919 336 1 1 . 1 1 60 60 ASN C C 60 174.340 174.340 174.171 0.169 17919 337 1 1 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.355 -0.235 17919 338 1 1 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.423 -0.014 17919 339 1 1 . 1 1 60 60 ASN H H 60 8.150 8.150 7.934 0.216 17919 340 1 1 . 1 1 61 61 ILE N N 61 118.600 118.600 120.799 -2.199 17919 341 1 1 . 1 1 61 61 ILE HA H 61 3.393 3.393 4.149 -0.756 17919 342 1 1 . 1 1 61 61 ILE C C 61 174.610 174.610 175.579 -0.969 17919 343 1 1 . 1 1 61 61 ILE CA C 61 62.420 62.420 60.937 1.483 17919 344 1 1 . 1 1 61 61 ILE CB C 61 36.740 36.740 38.186 -1.446 17919 345 1 1 . 1 1 61 61 ILE H H 61 7.250 7.250 8.030 -0.780 17919 346 1 1 . 1 1 62 62 GLN N N 62 124.740 124.740 128.038 -3.298 17919 347 1 1 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.399 0.107 17919 348 1 1 . 1 1 62 62 GLN C C 62 175.970 175.970 176.106 -0.136 17919 349 1 1 . 1 1 62 62 GLN CA C 62 53.660 53.660 54.852 -1.192 17919 350 1 1 . 1 1 62 62 GLN CB C 62 31.650 31.650 29.720 1.930 17919 351 1 1 . 1 1 62 62 GLN H H 62 7.610 7.610 8.399 -0.789 17919 352 1 1 . 1 1 63 63 LYS N N 63 120.300 120.300 123.011 -2.711 17919 353 1 1 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.992 0.009 17919 354 1 1 . 1 1 63 63 LYS C C 63 175.810 175.810 176.531 -0.721 17919 355 1 1 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.671 0.119 17919 356 1 1 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.858 0.792 17919 357 1 1 . 1 1 63 63 LYS H H 63 8.490 8.490 8.498 -0.008 17919 358 1 1 . 1 1 64 64 GLU N N 64 113.950 113.950 119.331 -5.381 17919 359 1 1 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.503 -0.038 17919 360 1 1 . 1 1 64 64 GLU C C 64 175.250 175.250 175.546 -0.296 17919 361 1 1 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.474 0.416 17919 362 1 1 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.315 -2.415 17919 363 1 1 . 1 1 64 64 GLU H H 64 9.280 9.280 8.814 0.466 17919 364 1 1 . 1 1 65 65 SER N N 65 114.730 114.730 115.412 -0.682 17919 365 1 1 . 1 1 65 65 SER HA H 65 4.640 4.640 4.309 0.331 17919 366 1 1 . 1 1 65 65 SER C C 65 172.160 172.160 174.292 -2.132 17919 367 1 1 . 1 1 65 65 SER CA C 65 60.890 60.890 59.607 1.283 17919 368 1 1 . 1 1 65 65 SER CB C 65 64.910 64.910 63.356 1.554 17919 369 1 1 . 1 1 65 65 SER H H 65 7.670 7.670 7.570 0.100 17919 370 1 1 . 1 1 66 66 THR N N 66 117.110 117.110 121.557 -4.447 17919 371 1 1 . 1 1 66 66 THR HA H 66 5.270 5.270 4.492 0.778 17919 372 1 1 . 1 1 66 66 THR C C 66 173.950 173.950 174.549 -0.599 17919 373 1 1 . 1 1 66 66 THR CA C 66 62.340 62.340 63.592 -1.252 17919 374 1 1 . 1 1 66 66 THR CB C 66 70.080 70.080 69.288 0.792 17919 375 1 1 . 1 1 66 66 THR H H 66 8.730 8.730 8.287 0.443 17919 376 1 1 . 1 1 67 67 LEU N N 67 127.110 127.110 126.139 0.971 17919 377 1 1 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.789 0.271 17919 378 1 1 . 1 1 67 67 LEU C C 67 175.770 175.770 175.241 0.529 17919 379 1 1 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.289 0.611 17919 380 1 1 . 1 1 67 67 LEU CB C 67 44.260 44.260 45.327 -1.067 17919 381 1 1 . 1 1 67 67 LEU H H 67 9.410 9.410 8.790 0.620 17919 382 1 1 . 1 1 68 68 HIS N N 68 118.380 118.380 122.918 -4.538 17919 383 1 1 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.059 0.181 17919 384 1 1 . 1 1 68 68 HIS C C 68 173.150 173.150 174.103 -0.953 17919 385 1 1 . 1 1 68 68 HIS CA C 68 55.000 55.000 53.811 1.189 17919 386 1 1 . 1 1 68 68 HIS CB C 68 30.530 30.530 30.699 -0.169 17919 387 1 1 . 1 1 68 68 HIS H H 68 9.230 9.230 8.444 0.786 17919 388 1 1 . 1 1 69 69 LEU N N 69 124.460 124.460 130.016 -5.556 17919 389 1 1 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.552 0.638 17919 390 1 1 . 1 1 69 69 LEU C C 69 175.270 175.270 174.656 0.614 17919 391 1 1 . 1 1 69 69 LEU CA C 69 53.890 53.890 55.039 -1.149 17919 392 1 1 . 1 1 69 69 LEU CB C 69 44.380 44.380 42.552 1.828 17919 393 1 1 . 1 1 69 69 LEU H H 69 8.340 8.340 8.371 -0.031 17919 394 1 1 . 1 1 70 70 VAL N N 70 126.940 126.940 127.186 -0.246 17919 395 1 1 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.151 0.199 17919 396 1 1 . 1 1 70 70 VAL C C 70 174.000 174.000 174.742 -0.742 17919 397 1 1 . 1 1 70 70 VAL CA C 70 60.800 60.800 61.386 -0.586 17919 398 1 1 . 1 1 70 70 VAL CB C 70 34.910 34.910 34.105 0.805 17919 399 1 1 . 1 1 70 70 VAL H H 70 9.200 9.200 9.070 0.130 17919 400 1 1 . 1 1 71 71 LEU N N 71 123.130 123.130 121.819 1.311 17919 401 1 1 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.056 0.004 17919 402 1 1 . 1 1 71 71 LEU C C 71 177.830 177.830 177.126 0.704 17919 403 1 1 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.169 0.770 17919 404 1 1 . 1 1 71 71 LEU CB C 71 42.850 42.850 44.396 -1.546 17919 405 1 1 . 1 1 71 71 LEU H H 71 8.120 8.120 8.267 -0.147 17919 406 1 1 . 1 1 72 72 ARG N N 72 123.490 123.490 124.701 -1.211 17919 407 1 1 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.069 0.232 17919 408 1 1 . 1 1 72 72 ARG C C 72 175.350 175.350 176.598 -1.248 17919 409 1 1 . 1 1 72 72 ARG CA C 72 55.610 55.610 57.309 -1.699 17919 410 1 1 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.434 0.916 17919 411 1 1 . 1 1 72 72 ARG H H 72 8.580 8.580 8.375 0.205 17919 412 1 2 . 1 1 2 2 GLN N N 2 123.220 123.220 123.349 -0.129 17919 413 1 2 . 1 1 2 2 GLN HA H 2 5.249 5.249 4.901 0.348 17919 414 1 2 . 1 1 2 2 GLN C C 2 175.920 175.920 176.083 -0.163 17919 415 1 2 . 1 1 2 2 GLN CA C 2 55.080 55.080 55.233 -0.153 17919 416 1 2 . 1 1 2 2 GLN CB C 2 30.760 30.760 29.013 1.747 17919 417 1 2 . 1 1 2 2 GLN H H 2 8.900 8.900 8.763 0.137 17919 418 1 2 . 1 1 3 3 ILE N N 3 115.340 115.340 118.261 -2.921 17919 419 1 2 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.152 0.061 17919 420 1 2 . 1 1 3 3 ILE C C 3 172.450 172.450 174.154 -1.704 17919 421 1 2 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.553 0.017 17919 422 1 2 . 1 1 3 3 ILE CB C 3 42.210 42.210 40.357 1.853 17919 423 1 2 . 1 1 3 3 ILE H H 3 8.320 8.320 7.629 0.691 17919 424 1 2 . 1 1 4 4 PHE N N 4 118.110 118.110 120.988 -2.878 17919 425 1 2 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.101 0.529 17919 426 1 2 . 1 1 4 4 PHE C C 4 175.320 175.320 175.522 -0.202 17919 427 1 2 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.662 -0.452 17919 428 1 2 . 1 1 4 4 PHE CB C 4 41.480 41.480 40.193 1.287 17919 429 1 2 . 1 1 4 4 PHE H H 4 8.610 8.610 8.065 0.545 17919 430 1 2 . 1 1 5 5 VAL N N 5 121.000 121.000 124.837 -3.837 17919 431 1 2 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.523 0.202 17919 432 1 2 . 1 1 5 5 VAL C C 5 174.870 174.870 175.133 -0.263 17919 433 1 2 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.619 -0.999 17919 434 1 2 . 1 1 5 5 VAL CB C 5 34.230 34.230 32.437 1.793 17919 435 1 2 . 1 1 5 5 VAL H H 5 9.300 9.300 8.568 0.732 17919 436 1 2 . 1 1 6 6 LYS N N 6 127.520 127.520 129.366 -1.846 17919 437 1 2 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.126 0.241 17919 438 1 2 . 1 1 6 6 LYS C C 6 177.140 177.140 176.656 0.484 17919 439 1 2 . 1 1 6 6 LYS CA C 6 54.520 54.520 55.002 -0.482 17919 440 1 2 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.706 0.344 17919 441 1 2 . 1 1 6 6 LYS H H 6 8.820 8.820 8.840 -0.020 17919 442 1 2 . 1 1 7 7 THR N N 7 115.400 115.400 117.213 -1.813 17919 443 1 2 . 1 1 7 7 THR HA H 7 4.970 4.970 4.438 0.532 17919 444 1 2 . 1 1 7 7 THR C C 7 176.910 176.910 175.989 0.921 17919 445 1 2 . 1 1 7 7 THR CA C 7 60.470 60.470 61.261 -0.791 17919 446 1 2 . 1 1 7 7 THR CB C 7 70.630 70.630 70.196 0.434 17919 447 1 2 . 1 1 7 7 THR H H 7 8.730 8.730 8.293 0.437 17919 448 1 2 . 1 1 8 8 LEU N N 8 121.330 121.330 121.138 0.192 17919 449 1 2 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.410 -0.100 17919 450 1 2 . 1 1 8 8 LEU C C 8 178.800 178.800 178.114 0.686 17919 451 1 2 . 1 1 8 8 LEU CA C 8 57.580 57.580 56.956 0.624 17919 452 1 2 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.149 -0.179 17919 453 1 2 . 1 1 8 8 LEU H H 8 9.100 9.100 8.710 0.390 17919 454 1 2 . 1 1 9 9 THR N N 9 105.590 105.590 110.544 -4.954 17919 455 1 2 . 1 1 9 9 THR HA H 9 4.428 4.428 4.336 0.092 17919 456 1 2 . 1 1 9 9 THR C C 9 175.520 175.520 175.614 -0.094 17919 457 1 2 . 1 1 9 9 THR CA C 9 61.400 61.400 62.101 -0.701 17919 458 1 2 . 1 1 9 9 THR CB C 9 69.140 69.140 69.337 -0.197 17919 459 1 2 . 1 1 9 9 THR H H 9 7.630 7.630 7.651 -0.021 17919 460 1 2 . 1 1 10 10 GLY N N 10 108.890 108.890 111.247 -2.357 17919 461 1 2 . 1 1 10 10 GLY C C 10 174.070 174.070 173.829 0.241 17919 462 1 2 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.788 0.672 17919 463 1 2 . 1 1 10 10 GLY H H 10 7.810 7.810 7.775 0.035 17919 464 1 2 . 1 1 11 11 LYS N N 11 121.600 121.600 121.509 0.091 17919 465 1 2 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.436 -0.075 17919 466 1 2 . 1 1 11 11 LYS C C 11 175.940 175.940 175.922 0.018 17919 467 1 2 . 1 1 11 11 LYS CA C 11 56.280 56.280 55.788 0.492 17919 468 1 2 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.593 -0.393 17919 469 1 2 . 1 1 11 11 LYS H H 11 7.280 7.280 7.648 -0.368 17919 470 1 2 . 1 1 12 12 THR N N 12 120.440 120.440 121.039 -0.599 17919 471 1 2 . 1 1 12 12 THR HA H 12 5.046 5.046 4.943 0.103 17919 472 1 2 . 1 1 12 12 THR C C 12 174.320 174.320 174.391 -0.071 17919 473 1 2 . 1 1 12 12 THR CA C 12 62.390 62.390 61.985 0.405 17919 474 1 2 . 1 1 12 12 THR CB C 12 69.910 69.910 69.765 0.145 17919 475 1 2 . 1 1 12 12 THR H H 12 8.650 8.650 8.437 0.213 17919 476 1 2 . 1 1 13 13 ILE N N 13 127.110 127.110 123.287 3.823 17919 477 1 2 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.771 -0.227 17919 478 1 2 . 1 1 13 13 ILE C C 13 175.220 175.220 173.605 1.615 17919 479 1 2 . 1 1 13 13 ILE CA C 13 59.980 59.980 58.976 1.004 17919 480 1 2 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.414 -0.464 17919 481 1 2 . 1 1 13 13 ILE H H 13 9.450 9.450 8.767 0.683 17919 482 1 2 . 1 1 14 14 THR N N 14 121.520 121.520 117.695 3.825 17919 483 1 2 . 1 1 14 14 THR HA H 14 4.964 4.964 4.839 0.125 17919 484 1 2 . 1 1 14 14 THR C C 14 173.790 173.790 173.652 0.138 17919 485 1 2 . 1 1 14 14 THR CA C 14 61.940 61.940 60.807 1.133 17919 486 1 2 . 1 1 14 14 THR CB C 14 69.650 69.650 70.996 -1.346 17919 487 1 2 . 1 1 14 14 THR H H 14 8.710 8.710 8.169 0.541 17919 488 1 2 . 1 1 15 15 LEU N N 15 124.800 124.800 126.342 -1.542 17919 489 1 2 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.646 0.134 17919 490 1 2 . 1 1 15 15 LEU C C 15 174.670 174.670 176.406 -1.736 17919 491 1 2 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.393 -0.563 17919 492 1 2 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.004 2.066 17919 493 1 2 . 1 1 15 15 LEU H H 15 8.710 8.710 8.152 0.558 17919 494 1 2 . 1 1 16 16 GLU N N 16 122.160 122.160 123.707 -1.547 17919 495 1 2 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.455 0.462 17919 496 1 2 . 1 1 16 16 GLU C C 16 175.860 175.860 175.604 0.256 17919 497 1 2 . 1 1 16 16 GLU CA C 16 54.820 54.820 54.302 0.518 17919 498 1 2 . 1 1 16 16 GLU CB C 16 29.450 29.450 28.154 1.296 17919 499 1 2 . 1 1 16 16 GLU H H 16 8.140 8.140 8.659 -0.519 17919 500 1 2 . 1 1 17 17 VAL N N 17 117.210 117.210 120.221 -3.011 17919 501 1 2 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.586 0.128 17919 502 1 2 . 1 1 17 17 VAL C C 17 174.160 174.160 174.768 -0.608 17919 503 1 2 . 1 1 17 17 VAL CA C 17 58.430 58.430 60.064 -1.634 17919 504 1 2 . 1 1 17 17 VAL CB C 17 36.400 36.400 34.511 1.889 17919 505 1 2 . 1 1 17 17 VAL H H 17 8.900 8.900 7.827 1.073 17919 506 1 2 . 1 1 18 18 GLU N N 18 118.990 118.990 119.720 -0.730 17919 507 1 2 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.749 0.330 17919 508 1 2 . 1 1 18 18 GLU C C 18 176.160 176.160 175.826 0.334 17919 509 1 2 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.579 -0.859 17919 510 1 2 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.424 -0.114 17919 511 1 2 . 1 1 18 18 GLU H H 18 8.640 8.640 8.595 0.045 17919 512 1 2 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.319 -0.178 17919 513 1 2 . 1 1 19 19 PRO C C 19 175.310 175.310 177.878 -2.568 17919 514 1 2 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.446 0.024 17919 515 1 2 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.092 -0.142 17919 516 1 2 . 1 1 20 20 SER N N 20 103.400 103.400 110.522 -7.122 17919 517 1 2 . 1 1 20 20 SER HA H 20 4.370 4.370 4.258 0.112 17919 518 1 2 . 1 1 20 20 SER C C 20 174.660 174.660 174.714 -0.054 17919 519 1 2 . 1 1 20 20 SER CA C 20 57.400 57.400 59.114 -1.714 17919 520 1 2 . 1 1 20 20 SER CB C 20 63.370 63.370 62.753 0.617 17919 521 1 2 . 1 1 20 20 SER H H 20 7.040 7.040 8.011 -0.971 17919 522 1 2 . 1 1 21 21 ASP N N 21 123.480 123.480 124.625 -1.145 17919 523 1 2 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.629 0.066 17919 524 1 2 . 1 1 21 21 ASP C C 21 176.360 176.360 175.657 0.703 17919 525 1 2 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.488 0.212 17919 526 1 2 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.609 -0.809 17919 527 1 2 . 1 1 21 21 ASP H H 21 8.030 8.030 7.739 0.291 17919 528 1 2 . 1 1 22 22 THR N N 22 108.800 108.800 113.644 -4.844 17919 529 1 2 . 1 1 22 22 THR HA H 22 4.920 4.920 4.719 0.201 17919 530 1 2 . 1 1 22 22 THR C C 22 176.750 176.750 176.020 0.730 17919 531 1 2 . 1 1 22 22 THR CA C 22 59.690 59.690 61.162 -1.472 17919 532 1 2 . 1 1 22 22 THR CB C 22 71.200 71.200 70.066 1.134 17919 533 1 2 . 1 1 22 22 THR H H 22 7.900 7.900 8.283 -0.383 17919 534 1 2 . 1 1 23 23 ILE N N 23 121.190 121.190 122.468 -1.278 17919 535 1 2 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.653 0.004 17919 536 1 2 . 1 1 23 23 ILE C C 23 179.040 179.040 177.573 1.467 17919 537 1 2 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.597 -0.337 17919 538 1 2 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.117 -1.767 17919 539 1 2 . 1 1 23 23 ILE H H 23 8.560 8.560 8.734 -0.174 17919 540 1 2 . 1 1 24 24 GLU N N 24 120.830 120.830 120.012 0.818 17919 541 1 2 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.980 -0.063 17919 542 1 2 . 1 1 24 24 GLU C C 24 178.640 178.640 178.776 -0.136 17919 543 1 2 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.709 0.511 17919 544 1 2 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.502 -1.222 17919 545 1 2 . 1 1 24 24 GLU H H 24 9.760 9.760 8.089 1.671 17919 546 1 2 . 1 1 25 25 ASN N N 25 120.570 120.570 118.237 2.333 17919 547 1 2 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.497 0.028 17919 548 1 2 . 1 1 25 25 ASN C C 25 178.380 178.380 178.047 0.333 17919 549 1 2 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.929 0.131 17919 550 1 2 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.036 0.414 17919 551 1 2 . 1 1 25 25 ASN H H 25 7.920 7.920 7.768 0.152 17919 552 1 2 . 1 1 26 26 VAL N N 26 121.710 121.710 119.726 1.984 17919 553 1 2 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.583 -0.186 17919 554 1 2 . 1 1 26 26 VAL C C 26 177.950 177.950 178.054 -0.104 17919 555 1 2 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.394 1.266 17919 556 1 2 . 1 1 26 26 VAL CB C 26 30.840 30.840 30.933 -0.093 17919 557 1 2 . 1 1 26 26 VAL H H 26 8.070 8.070 7.852 0.218 17919 558 1 2 . 1 1 27 27 LYS N N 27 118.860 118.860 120.088 -1.228 17919 559 1 2 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.201 0.379 17919 560 1 2 . 1 1 27 27 LYS C C 27 180.550 180.550 179.363 1.187 17919 561 1 2 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.604 -0.354 17919 562 1 2 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.092 1.638 17919 563 1 2 . 1 1 27 27 LYS H H 27 8.560 8.560 7.642 0.918 17919 564 1 2 . 1 1 28 28 ALA N N 28 123.440 123.440 121.367 2.073 17919 565 1 2 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.096 0.064 17919 566 1 2 . 1 1 28 28 ALA C C 28 180.300 180.300 179.430 0.870 17919 567 1 2 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.980 0.390 17919 568 1 2 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.386 -0.676 17919 569 1 2 . 1 1 28 28 ALA H H 28 8.060 8.060 8.389 -0.329 17919 570 1 2 . 1 1 29 29 LYS N N 29 119.940 119.940 119.099 0.841 17919 571 1 2 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.031 0.176 17919 572 1 2 . 1 1 29 29 LYS C C 29 180.320 180.320 179.078 1.242 17919 573 1 2 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.239 0.411 17919 574 1 2 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.280 1.010 17919 575 1 2 . 1 1 29 29 LYS H H 29 7.850 7.850 7.429 0.421 17919 576 1 2 . 1 1 30 30 ILE N N 30 121.080 121.080 120.332 0.748 17919 577 1 2 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.569 -0.062 17919 578 1 2 . 1 1 30 30 ILE C C 30 178.310 178.310 177.560 0.750 17919 579 1 2 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.352 0.798 17919 580 1 2 . 1 1 30 30 ILE CB C 30 36.800 36.800 36.976 -0.176 17919 581 1 2 . 1 1 30 30 ILE H H 30 8.280 8.280 8.231 0.049 17919 582 1 2 . 1 1 31 31 GLN N N 31 123.490 123.490 119.009 4.481 17919 583 1 2 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.960 -0.131 17919 584 1 2 . 1 1 31 31 GLN C C 31 178.890 178.890 178.372 0.518 17919 585 1 2 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.042 0.958 17919 586 1 2 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.431 -0.711 17919 587 1 2 . 1 1 31 31 GLN H H 31 8.580 8.580 8.187 0.393 17919 588 1 2 . 1 1 32 32 ASP N N 32 119.360 119.360 120.217 -0.857 17919 589 1 2 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.399 -0.045 17919 590 1 2 . 1 1 32 32 ASP C C 32 177.250 177.250 177.789 -0.539 17919 591 1 2 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.926 0.264 17919 592 1 2 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.890 -0.310 17919 593 1 2 . 1 1 32 32 ASP H H 32 8.010 8.010 7.846 0.164 17919 594 1 2 . 1 1 33 33 LYS N N 33 115.130 115.130 119.390 -4.260 17919 595 1 2 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.201 0.136 17919 596 1 2 . 1 1 33 33 LYS C C 33 177.870 177.870 178.693 -0.823 17919 597 1 2 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.201 -0.151 17919 598 1 2 . 1 1 33 33 LYS CB C 33 34.170 34.170 32.593 1.577 17919 599 1 2 . 1 1 33 33 LYS H H 33 7.430 7.430 7.731 -0.301 17919 600 1 2 . 1 1 34 34 GLU N N 34 113.870 113.870 115.029 -1.159 17919 601 1 2 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.484 0.141 17919 602 1 2 . 1 1 34 34 GLU C C 34 177.840 177.840 177.413 0.427 17919 603 1 2 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.204 -1.034 17919 604 1 2 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.871 0.789 17919 605 1 2 . 1 1 34 34 GLU H H 34 8.740 8.740 7.905 0.835 17919 606 1 2 . 1 1 35 35 GLY N N 35 108.650 108.650 109.893 -1.243 17919 607 1 2 . 1 1 35 35 GLY C C 35 173.960 173.960 174.272 -0.312 17919 608 1 2 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.905 0.175 17919 609 1 2 . 1 1 35 35 GLY H H 35 8.530 8.530 7.813 0.717 17919 610 1 2 . 1 1 36 36 ILE N N 36 119.880 119.880 121.578 -1.698 17919 611 1 2 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.246 0.199 17919 612 1 2 . 1 1 36 36 ILE C C 36 173.590 173.590 174.145 -0.555 17919 613 1 2 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.057 -0.307 17919 614 1 2 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.715 1.865 17919 615 1 2 . 1 1 36 36 ILE H H 36 6.150 6.150 7.780 -1.630 17919 616 1 2 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.566 0.068 17919 617 1 2 . 1 1 37 37 PRO C C 37 176.940 176.940 175.987 0.953 17919 618 1 2 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.729 -0.069 17919 619 1 2 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.337 0.513 17919 620 1 2 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.110 0.007 17919 621 1 2 . 1 1 38 38 PRO C C 38 178.320 178.320 178.798 -0.478 17919 622 1 2 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.807 0.453 17919 623 1 2 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.812 1.078 17919 624 1 2 . 1 1 39 39 ASP N N 39 113.380 113.380 116.892 -3.512 17919 625 1 2 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.266 0.164 17919 626 1 2 . 1 1 39 39 ASP C C 39 177.090 177.090 177.734 -0.644 17919 627 1 2 . 1 1 39 39 ASP CA C 39 55.640 55.640 57.198 -1.558 17919 628 1 2 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.434 -0.894 17919 629 1 2 . 1 1 39 39 ASP H H 39 8.550 8.550 8.613 -0.063 17919 630 1 2 . 1 1 40 40 GLN N N 40 116.780 116.780 116.376 0.404 17919 631 1 2 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.260 0.204 17919 632 1 2 . 1 1 40 40 GLN C C 40 175.380 175.380 176.391 -1.011 17919 633 1 2 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.002 -0.362 17919 634 1 2 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.083 1.057 17919 635 1 2 . 1 1 40 40 GLN H H 40 7.820 7.820 7.949 -0.129 17919 636 1 2 . 1 1 41 41 GLN N N 41 117.720 117.720 118.939 -1.219 17919 637 1 2 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.431 -0.187 17919 638 1 2 . 1 1 41 41 GLN C C 41 176.300 176.300 175.301 0.999 17919 639 1 2 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.862 0.608 17919 640 1 2 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.910 1.740 17919 641 1 2 . 1 1 41 41 GLN H H 41 7.480 7.480 7.350 0.130 17919 642 1 2 . 1 1 42 42 ARG N N 42 122.680 122.680 124.608 -1.928 17919 643 1 2 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.615 -0.115 17919 644 1 2 . 1 1 42 42 ARG C C 42 174.050 174.050 174.096 -0.046 17919 645 1 2 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.832 0.218 17919 646 1 2 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.505 -0.755 17919 647 1 2 . 1 1 42 42 ARG H H 42 8.530 8.530 7.981 0.549 17919 648 1 2 . 1 1 43 43 LEU N N 43 124.040 124.040 127.112 -3.072 17919 649 1 2 . 1 1 43 43 LEU C C 43 175.290 175.290 175.811 -0.521 17919 650 1 2 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.487 -0.507 17919 651 1 2 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.162 1.628 17919 652 1 2 . 1 1 43 43 LEU H H 43 8.820 8.820 8.703 0.117 17919 653 1 2 . 1 1 44 44 ILE N N 44 121.920 121.920 123.128 -1.208 17919 654 1 2 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.270 -0.278 17919 655 1 2 . 1 1 44 44 ILE C C 44 176.060 176.060 174.558 1.502 17919 656 1 2 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.222 -1.242 17919 657 1 2 . 1 1 44 44 ILE CB C 44 41.420 41.420 40.707 0.713 17919 658 1 2 . 1 1 44 44 ILE H H 44 9.030 9.030 8.443 0.587 17919 659 1 2 . 1 1 45 45 PHE N N 45 125.390 125.390 127.109 -1.719 17919 660 1 2 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.082 -0.037 17919 661 1 2 . 1 1 45 45 PHE C C 45 174.470 174.470 174.589 -0.119 17919 662 1 2 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.681 0.339 17919 663 1 2 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.311 0.449 17919 664 1 2 . 1 1 45 45 PHE H H 45 8.830 8.830 9.150 -0.320 17919 665 1 2 . 1 1 46 46 ALA N N 46 132.200 132.200 128.910 3.290 17919 666 1 2 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.725 -0.035 17919 667 1 2 . 1 1 46 46 ALA C C 46 177.290 177.290 177.707 -0.417 17919 668 1 2 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.693 -0.153 17919 669 1 2 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.623 -0.053 17919 670 1 2 . 1 1 46 46 ALA H H 46 8.810 8.810 8.731 0.079 17919 671 1 2 . 1 1 47 47 GLY N N 47 102.340 102.340 102.683 -0.343 17919 672 1 2 . 1 1 47 47 GLY C C 47 173.810 173.810 174.190 -0.380 17919 673 1 2 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.940 0.410 17919 674 1 2 . 1 1 47 47 GLY H H 47 8.130 8.130 8.343 -0.213 17919 675 1 2 . 1 1 48 48 LYS N N 48 121.570 121.570 119.809 1.761 17919 676 1 2 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.746 -0.124 17919 677 1 2 . 1 1 48 48 LYS C C 48 174.700 174.700 175.556 -0.856 17919 678 1 2 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.747 -0.197 17919 679 1 2 . 1 1 48 48 LYS CB C 48 34.530 34.530 35.443 -0.913 17919 680 1 2 . 1 1 48 48 LYS H H 48 7.980 7.980 7.883 0.097 17919 681 1 2 . 1 1 49 49 GLN N N 49 122.410 122.410 120.897 1.513 17919 682 1 2 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.877 -0.317 17919 683 1 2 . 1 1 49 49 GLN C C 49 175.670 175.670 175.965 -0.295 17919 684 1 2 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.547 0.193 17919 685 1 2 . 1 1 49 49 GLN CB C 49 29.000 29.000 30.048 -1.048 17919 686 1 2 . 1 1 49 49 GLN H H 49 8.600 8.600 8.492 0.108 17919 687 1 2 . 1 1 50 50 LEU N N 50 125.520 125.520 122.442 3.078 17919 688 1 2 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.314 -0.224 17919 689 1 2 . 1 1 50 50 LEU C C 50 176.660 176.660 176.533 0.127 17919 690 1 2 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.091 0.149 17919 691 1 2 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.827 -0.257 17919 692 1 2 . 1 1 50 50 LEU H H 50 8.530 8.530 8.602 -0.072 17919 693 1 2 . 1 1 51 51 GLU N N 51 122.940 122.940 123.281 -0.341 17919 694 1 2 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.617 -0.129 17919 695 1 2 . 1 1 51 51 GLU C C 51 175.870 175.870 175.889 -0.019 17919 696 1 2 . 1 1 51 51 GLU CA C 51 55.960 55.960 54.767 1.193 17919 697 1 2 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.989 -0.419 17919 698 1 2 . 1 1 51 51 GLU H H 51 8.400 8.400 8.640 -0.240 17919 699 1 2 . 1 1 52 52 ASP N N 52 120.030 120.030 122.872 -2.842 17919 700 1 2 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.512 -0.153 17919 701 1 2 . 1 1 52 52 ASP C C 52 177.330 177.330 177.878 -0.548 17919 702 1 2 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.346 -0.386 17919 703 1 2 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.952 -0.102 17919 704 1 2 . 1 1 52 52 ASP H H 52 8.160 8.160 8.918 -0.758 17919 705 1 2 . 1 1 53 53 GLY N N 53 106.660 106.660 106.400 0.260 17919 706 1 2 . 1 1 53 53 GLY C C 53 174.870 174.870 174.562 0.308 17919 707 1 2 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.755 0.415 17919 708 1 2 . 1 1 53 53 GLY H H 53 9.390 9.390 8.283 1.107 17919 709 1 2 . 1 1 54 54 ARG N N 54 119.050 119.050 121.709 -2.659 17919 710 1 2 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.492 0.203 17919 711 1 2 . 1 1 54 54 ARG C C 54 175.350 175.350 175.154 0.196 17919 712 1 2 . 1 1 54 54 ARG CA C 54 54.390 54.390 55.693 -1.303 17919 713 1 2 . 1 1 54 54 ARG CB C 54 32.650 32.650 31.686 0.964 17919 714 1 2 . 1 1 54 54 ARG H H 54 7.460 7.460 7.691 -0.231 17919 715 1 2 . 1 1 55 55 THR N N 55 108.400 108.400 111.109 -2.709 17919 716 1 2 . 1 1 55 55 THR HA H 55 5.240 5.240 4.986 0.254 17919 717 1 2 . 1 1 55 55 THR C C 55 176.560 176.560 176.300 0.260 17919 718 1 2 . 1 1 55 55 THR CA C 55 59.690 59.690 59.709 -0.019 17919 719 1 2 . 1 1 55 55 THR CB C 55 72.260 72.260 71.258 1.002 17919 720 1 2 . 1 1 55 55 THR H H 55 8.730 8.730 8.580 0.150 17919 721 1 2 . 1 1 56 56 LEU N N 56 117.920 117.920 121.083 -3.163 17919 722 1 2 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.090 -0.030 17919 723 1 2 . 1 1 56 56 LEU C C 56 180.810 180.810 178.709 2.101 17919 724 1 2 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.319 0.391 17919 725 1 2 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.205 -0.835 17919 726 1 2 . 1 1 56 56 LEU H H 56 8.140 8.140 8.268 -0.128 17919 727 1 2 . 1 1 57 57 SER N N 57 113.330 113.330 116.526 -3.196 17919 728 1 2 . 1 1 57 57 SER HA H 57 4.370 4.370 4.074 0.296 17919 729 1 2 . 1 1 57 57 SER C C 57 178.310 178.310 176.840 1.470 17919 730 1 2 . 1 1 57 57 SER CA C 57 61.080 61.080 61.928 -0.848 17919 731 1 2 . 1 1 57 57 SER CB C 57 62.530 62.530 62.756 -0.226 17919 732 1 2 . 1 1 57 57 SER H H 57 8.470 8.470 7.926 0.544 17919 733 1 2 . 1 1 58 58 ASP N N 58 124.190 124.190 120.781 3.409 17919 734 1 2 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.377 -0.081 17919 735 1 2 . 1 1 58 58 ASP C C 58 177.400 177.400 177.175 0.225 17919 736 1 2 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.745 0.435 17919 737 1 2 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.110 -0.010 17919 738 1 2 . 1 1 58 58 ASP H H 58 7.930 7.930 8.032 -0.102 17919 739 1 2 . 1 1 59 59 TYR N N 59 115.510 115.510 116.241 -0.731 17919 740 1 2 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.545 0.125 17919 741 1 2 . 1 1 59 59 TYR C C 59 174.700 174.700 176.061 -1.361 17919 742 1 2 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.950 0.300 17919 743 1 2 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.607 1.463 17919 744 1 2 . 1 1 59 59 TYR H H 59 7.250 7.250 7.125 0.125 17919 745 1 2 . 1 1 60 60 ASN N N 60 115.900 115.900 117.891 -1.991 17919 746 1 2 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.377 -0.022 17919 747 1 2 . 1 1 60 60 ASN C C 60 174.340 174.340 174.648 -0.308 17919 748 1 2 . 1 1 60 60 ASN CA C 60 54.120 54.120 53.983 0.137 17919 749 1 2 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.314 0.096 17919 750 1 2 . 1 1 60 60 ASN H H 60 8.150 8.150 7.902 0.248 17919 751 1 2 . 1 1 61 61 ILE N N 61 118.600 118.600 120.313 -1.713 17919 752 1 2 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.873 -0.480 17919 753 1 2 . 1 1 61 61 ILE C C 61 174.610 174.610 174.517 0.093 17919 754 1 2 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.390 0.030 17919 755 1 2 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.817 -1.077 17919 756 1 2 . 1 1 61 61 ILE H H 61 7.250 7.250 8.176 -0.926 17919 757 1 2 . 1 1 62 62 GLN N N 62 124.740 124.740 125.135 -0.395 17919 758 1 2 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.696 -0.190 17919 759 1 2 . 1 1 62 62 GLN C C 62 175.970 175.970 175.330 0.640 17919 760 1 2 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.277 0.383 17919 761 1 2 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.860 -0.210 17919 762 1 2 . 1 1 62 62 GLN H H 62 7.610 7.610 7.947 -0.337 17919 763 1 2 . 1 1 63 63 LYS N N 63 120.300 120.300 122.326 -2.026 17919 764 1 2 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.894 0.107 17919 765 1 2 . 1 1 63 63 LYS C C 63 175.810 175.810 176.367 -0.557 17919 766 1 2 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.429 -0.639 17919 767 1 2 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.102 0.548 17919 768 1 2 . 1 1 63 63 LYS H H 63 8.490 8.490 8.606 -0.116 17919 769 1 2 . 1 1 64 64 GLU N N 64 113.950 113.950 120.103 -6.153 17919 770 1 2 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.727 -0.262 17919 771 1 2 . 1 1 64 64 GLU C C 64 175.250 175.250 175.808 -0.558 17919 772 1 2 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.705 0.185 17919 773 1 2 . 1 1 64 64 GLU CB C 64 25.900 25.900 27.495 -1.595 17919 774 1 2 . 1 1 64 64 GLU H H 64 9.280 9.280 8.358 0.922 17919 775 1 2 . 1 1 65 65 SER N N 65 114.730 114.730 114.478 0.252 17919 776 1 2 . 1 1 65 65 SER HA H 65 4.640 4.640 4.563 0.077 17919 777 1 2 . 1 1 65 65 SER C C 65 172.160 172.160 174.513 -2.353 17919 778 1 2 . 1 1 65 65 SER CA C 65 60.890 60.890 59.966 0.924 17919 779 1 2 . 1 1 65 65 SER CB C 65 64.910 64.910 64.243 0.667 17919 780 1 2 . 1 1 65 65 SER H H 65 7.670 7.670 7.678 -0.008 17919 781 1 2 . 1 1 66 66 THR N N 66 117.110 117.110 121.608 -4.498 17919 782 1 2 . 1 1 66 66 THR HA H 66 5.270 5.270 4.928 0.342 17919 783 1 2 . 1 1 66 66 THR C C 66 173.950 173.950 173.679 0.271 17919 784 1 2 . 1 1 66 66 THR CA C 66 62.340 62.340 61.914 0.425 17919 785 1 2 . 1 1 66 66 THR CB C 66 70.080 70.080 70.347 -0.267 17919 786 1 2 . 1 1 66 66 THR H H 66 8.730 8.730 8.659 0.071 17919 787 1 2 . 1 1 67 67 LEU N N 67 127.110 127.110 127.128 -0.018 17919 788 1 2 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.681 0.379 17919 789 1 2 . 1 1 67 67 LEU C C 67 175.770 175.770 175.655 0.115 17919 790 1 2 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.208 -0.308 17919 791 1 2 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.004 1.256 17919 792 1 2 . 1 1 67 67 LEU H H 67 9.410 9.410 8.254 1.156 17919 793 1 2 . 1 1 68 68 HIS N N 68 118.380 118.380 123.164 -4.784 17919 794 1 2 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.540 -0.300 17919 795 1 2 . 1 1 68 68 HIS C C 68 173.150 173.150 174.010 -0.860 17919 796 1 2 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.637 0.363 17919 797 1 2 . 1 1 68 68 HIS CB C 68 30.530 30.530 33.075 -2.545 17919 798 1 2 . 1 1 68 68 HIS H H 68 9.230 9.230 9.270 -0.040 17919 799 1 2 . 1 1 69 69 LEU N N 69 124.460 124.460 123.237 1.223 17919 800 1 2 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.789 0.401 17919 801 1 2 . 1 1 69 69 LEU C C 69 175.270 175.270 173.911 1.359 17919 802 1 2 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.481 -0.591 17919 803 1 2 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.722 -0.342 17919 804 1 2 . 1 1 69 69 LEU H H 69 8.340 8.340 7.457 0.883 17919 805 1 2 . 1 1 70 70 VAL N N 70 126.940 126.940 125.455 1.485 17919 806 1 2 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.240 0.110 17919 807 1 2 . 1 1 70 70 VAL C C 70 174.000 174.000 174.870 -0.870 17919 808 1 2 . 1 1 70 70 VAL CA C 70 60.800 60.800 61.151 -0.351 17919 809 1 2 . 1 1 70 70 VAL CB C 70 34.910 34.910 32.440 2.470 17919 810 1 2 . 1 1 70 70 VAL H H 70 9.200 9.200 7.963 1.237 17919 811 1 2 . 1 1 71 71 LEU N N 71 123.130 123.130 125.088 -1.958 17919 812 1 2 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.899 0.161 17919 813 1 2 . 1 1 71 71 LEU C C 71 177.830 177.830 177.591 0.239 17919 814 1 2 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.598 0.342 17919 815 1 2 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.048 -0.198 17919 816 1 2 . 1 1 71 71 LEU H H 71 8.120 8.120 8.534 -0.414 17919 817 1 2 . 1 1 72 72 ARG N N 72 123.490 123.490 120.611 2.879 17919 818 1 2 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.343 -0.042 17919 819 1 2 . 1 1 72 72 ARG C C 72 175.350 175.350 175.904 -0.554 17919 820 1 2 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.617 -0.007 17919 821 1 2 . 1 1 72 72 ARG CB C 72 31.350 31.350 31.292 0.058 17919 822 1 2 . 1 1 72 72 ARG H H 72 8.580 8.580 8.345 0.235 17919 823 1 3 . 1 1 2 2 GLN N N 2 123.220 123.220 121.635 1.585 17919 824 1 3 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.375 -0.127 17919 825 1 3 . 1 1 2 2 GLN C C 2 175.920 175.920 175.423 0.497 17919 826 1 3 . 1 1 2 2 GLN CA C 2 55.080 55.080 55.430 -0.350 17919 827 1 3 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.215 0.545 17919 828 1 3 . 1 1 2 2 GLN H H 2 8.900 8.900 8.388 0.512 17919 829 1 3 . 1 1 3 3 ILE N N 3 115.340 115.340 116.595 -1.255 17919 830 1 3 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.272 -0.059 17919 831 1 3 . 1 1 3 3 ILE C C 3 172.450 172.450 173.536 -1.086 17919 832 1 3 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.276 0.294 17919 833 1 3 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.495 0.715 17919 834 1 3 . 1 1 3 3 ILE H H 3 8.320 8.320 8.430 -0.110 17919 835 1 3 . 1 1 4 4 PHE N N 4 118.110 118.110 121.363 -3.253 17919 836 1 3 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.126 0.504 17919 837 1 3 . 1 1 4 4 PHE C C 4 175.320 175.320 175.381 -0.061 17919 838 1 3 . 1 1 4 4 PHE CA C 4 55.210 55.210 56.641 -1.431 17919 839 1 3 . 1 1 4 4 PHE CB C 4 41.480 41.480 40.876 0.604 17919 840 1 3 . 1 1 4 4 PHE H H 4 8.610 8.610 7.944 0.666 17919 841 1 3 . 1 1 5 5 VAL N N 5 121.000 121.000 123.337 -2.337 17919 842 1 3 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.775 -0.050 17919 843 1 3 . 1 1 5 5 VAL C C 5 174.870 174.870 175.097 -0.227 17919 844 1 3 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.457 -0.837 17919 845 1 3 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.091 1.139 17919 846 1 3 . 1 1 5 5 VAL H H 5 9.300 9.300 9.085 0.215 17919 847 1 3 . 1 1 6 6 LYS N N 6 127.520 127.520 129.842 -2.322 17919 848 1 3 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.136 0.231 17919 849 1 3 . 1 1 6 6 LYS C C 6 177.140 177.140 176.745 0.395 17919 850 1 3 . 1 1 6 6 LYS CA C 6 54.520 54.520 55.559 -1.039 17919 851 1 3 . 1 1 6 6 LYS CB C 6 35.050 35.050 33.837 1.213 17919 852 1 3 . 1 1 6 6 LYS H H 6 8.820 8.820 8.722 0.098 17919 853 1 3 . 1 1 7 7 THR N N 7 115.400 115.400 116.737 -1.337 17919 854 1 3 . 1 1 7 7 THR HA H 7 4.970 4.970 4.918 0.052 17919 855 1 3 . 1 1 7 7 THR C C 7 176.910 176.910 176.158 0.752 17919 856 1 3 . 1 1 7 7 THR CA C 7 60.470 60.470 60.489 -0.019 17919 857 1 3 . 1 1 7 7 THR CB C 7 70.630 70.630 70.392 0.238 17919 858 1 3 . 1 1 7 7 THR H H 7 8.730 8.730 8.836 -0.106 17919 859 1 3 . 1 1 8 8 LEU N N 8 121.330 121.330 121.382 -0.052 17919 860 1 3 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.510 -0.200 17919 861 1 3 . 1 1 8 8 LEU C C 8 178.800 178.800 177.938 0.862 17919 862 1 3 . 1 1 8 8 LEU CA C 8 57.580 57.580 56.804 0.776 17919 863 1 3 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.136 -0.166 17919 864 1 3 . 1 1 8 8 LEU H H 8 9.100 9.100 8.796 0.304 17919 865 1 3 . 1 1 9 9 THR N N 9 105.590 105.590 109.403 -3.813 17919 866 1 3 . 1 1 9 9 THR HA H 9 4.428 4.428 4.305 0.123 17919 867 1 3 . 1 1 9 9 THR C C 9 175.520 175.520 175.539 -0.019 17919 868 1 3 . 1 1 9 9 THR CA C 9 61.400 61.400 62.282 -0.882 17919 869 1 3 . 1 1 9 9 THR CB C 9 69.140 69.140 69.532 -0.392 17919 870 1 3 . 1 1 9 9 THR H H 9 7.630 7.630 7.848 -0.218 17919 871 1 3 . 1 1 10 10 GLY N N 10 108.890 108.890 110.829 -1.939 17919 872 1 3 . 1 1 10 10 GLY C C 10 174.070 174.070 173.705 0.365 17919 873 1 3 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.629 0.831 17919 874 1 3 . 1 1 10 10 GLY H H 10 7.810 7.810 7.894 -0.084 17919 875 1 3 . 1 1 11 11 LYS N N 11 121.600 121.600 121.878 -0.278 17919 876 1 3 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.305 0.056 17919 877 1 3 . 1 1 11 11 LYS C C 11 175.940 175.940 175.454 0.486 17919 878 1 3 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.651 -0.371 17919 879 1 3 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.151 0.049 17919 880 1 3 . 1 1 11 11 LYS H H 11 7.280 7.280 7.934 -0.654 17919 881 1 3 . 1 1 12 12 THR N N 12 120.440 120.440 120.786 -0.346 17919 882 1 3 . 1 1 12 12 THR HA H 12 5.046 5.046 5.303 -0.257 17919 883 1 3 . 1 1 12 12 THR C C 12 174.320 174.320 174.659 -0.339 17919 884 1 3 . 1 1 12 12 THR CA C 12 62.390 62.390 62.103 0.287 17919 885 1 3 . 1 1 12 12 THR CB C 12 69.910 69.910 70.171 -0.261 17919 886 1 3 . 1 1 12 12 THR H H 12 8.650 8.650 8.330 0.320 17919 887 1 3 . 1 1 13 13 ILE N N 13 127.110 127.110 124.384 2.726 17919 888 1 3 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.561 -0.017 17919 889 1 3 . 1 1 13 13 ILE C C 13 175.220 175.220 174.314 0.906 17919 890 1 3 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.899 0.081 17919 891 1 3 . 1 1 13 13 ILE CB C 13 40.950 40.950 42.225 -1.275 17919 892 1 3 . 1 1 13 13 ILE H H 13 9.450 9.450 9.068 0.382 17919 893 1 3 . 1 1 14 14 THR N N 14 121.520 121.520 118.130 3.390 17919 894 1 3 . 1 1 14 14 THR HA H 14 4.964 4.964 5.256 -0.292 17919 895 1 3 . 1 1 14 14 THR C C 14 173.790 173.790 173.465 0.325 17919 896 1 3 . 1 1 14 14 THR CA C 14 61.940 61.940 60.742 1.198 17919 897 1 3 . 1 1 14 14 THR CB C 14 69.650 69.650 70.554 -0.904 17919 898 1 3 . 1 1 14 14 THR H H 14 8.710 8.710 8.364 0.346 17919 899 1 3 . 1 1 15 15 LEU N N 15 124.800 124.800 126.662 -1.862 17919 900 1 3 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.727 0.053 17919 901 1 3 . 1 1 15 15 LEU C C 15 174.670 174.670 174.520 0.150 17919 902 1 3 . 1 1 15 15 LEU CA C 15 52.830 52.830 54.014 -1.183 17919 903 1 3 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.901 1.169 17919 904 1 3 . 1 1 15 15 LEU H H 15 8.710 8.710 8.725 -0.015 17919 905 1 3 . 1 1 16 16 GLU N N 16 122.160 122.160 123.387 -1.227 17919 906 1 3 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.577 0.340 17919 907 1 3 . 1 1 16 16 GLU C C 16 175.860 175.860 175.781 0.079 17919 908 1 3 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.323 -0.503 17919 909 1 3 . 1 1 16 16 GLU CB C 16 29.450 29.450 29.082 0.367 17919 910 1 3 . 1 1 16 16 GLU H H 16 8.140 8.140 8.623 -0.483 17919 911 1 3 . 1 1 17 17 VAL N N 17 117.210 117.210 120.327 -3.117 17919 912 1 3 . 1 1 17 17 VAL HA H 17 4.714 4.714 5.146 -0.432 17919 913 1 3 . 1 1 17 17 VAL C C 17 174.160 174.160 174.933 -0.773 17919 914 1 3 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.191 -0.761 17919 915 1 3 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.287 1.113 17919 916 1 3 . 1 1 17 17 VAL H H 17 8.900 8.900 8.692 0.208 17919 917 1 3 . 1 1 18 18 GLU N N 18 118.990 118.990 121.551 -2.561 17919 918 1 3 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.862 0.217 17919 919 1 3 . 1 1 18 18 GLU C C 18 176.160 176.160 175.805 0.355 17919 920 1 3 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.026 -0.306 17919 921 1 3 . 1 1 18 18 GLU CB C 18 30.310 30.310 31.658 -1.348 17919 922 1 3 . 1 1 18 18 GLU H H 18 8.640 8.640 9.331 -0.691 17919 923 1 3 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.202 -0.061 17919 924 1 3 . 1 1 19 19 PRO C C 19 175.310 175.310 177.116 -1.806 17919 925 1 3 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.156 0.314 17919 926 1 3 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.081 -0.131 17919 927 1 3 . 1 1 20 20 SER N N 20 103.400 103.400 109.042 -5.642 17919 928 1 3 . 1 1 20 20 SER HA H 20 4.370 4.370 4.419 -0.049 17919 929 1 3 . 1 1 20 20 SER C C 20 174.660 174.660 173.896 0.764 17919 930 1 3 . 1 1 20 20 SER CA C 20 57.400 57.400 57.220 0.180 17919 931 1 3 . 1 1 20 20 SER CB C 20 63.370 63.370 63.184 0.186 17919 932 1 3 . 1 1 20 20 SER H H 20 7.040 7.040 7.898 -0.858 17919 933 1 3 . 1 1 21 21 ASP N N 21 123.480 123.480 124.939 -1.459 17919 934 1 3 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.765 -0.070 17919 935 1 3 . 1 1 21 21 ASP C C 21 176.360 176.360 175.767 0.593 17919 936 1 3 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.030 0.670 17919 937 1 3 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.991 -1.191 17919 938 1 3 . 1 1 21 21 ASP H H 21 8.030 8.030 7.970 0.060 17919 939 1 3 . 1 1 22 22 THR N N 22 108.800 108.800 114.636 -5.836 17919 940 1 3 . 1 1 22 22 THR HA H 22 4.920 4.920 4.658 0.262 17919 941 1 3 . 1 1 22 22 THR C C 22 176.750 176.750 176.028 0.722 17919 942 1 3 . 1 1 22 22 THR CA C 22 59.690 59.690 61.673 -1.983 17919 943 1 3 . 1 1 22 22 THR CB C 22 71.200 71.200 69.733 1.467 17919 944 1 3 . 1 1 22 22 THR H H 22 7.900 7.900 8.529 -0.629 17919 945 1 3 . 1 1 23 23 ILE N N 23 121.190 121.190 123.137 -1.947 17919 946 1 3 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.721 -0.064 17919 947 1 3 . 1 1 23 23 ILE C C 23 179.040 179.040 177.550 1.490 17919 948 1 3 . 1 1 23 23 ILE CA C 23 62.260 62.260 61.775 0.485 17919 949 1 3 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.020 -1.670 17919 950 1 3 . 1 1 23 23 ILE H H 23 8.560 8.560 9.018 -0.458 17919 951 1 3 . 1 1 24 24 GLU N N 24 120.830 120.830 120.319 0.511 17919 952 1 3 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.950 -0.033 17919 953 1 3 . 1 1 24 24 GLU C C 24 178.640 178.640 178.779 -0.139 17919 954 1 3 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.022 0.198 17919 955 1 3 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.505 -1.224 17919 956 1 3 . 1 1 24 24 GLU H H 24 9.760 9.760 8.658 1.102 17919 957 1 3 . 1 1 25 25 ASN N N 25 120.570 120.570 117.882 2.688 17919 958 1 3 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.421 0.104 17919 959 1 3 . 1 1 25 25 ASN C C 25 178.380 178.380 177.766 0.614 17919 960 1 3 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.008 0.053 17919 961 1 3 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.287 0.163 17919 962 1 3 . 1 1 25 25 ASN H H 25 7.920 7.920 7.647 0.273 17919 963 1 3 . 1 1 26 26 VAL N N 26 121.710 121.710 120.501 1.209 17919 964 1 3 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.772 -0.375 17919 965 1 3 . 1 1 26 26 VAL C C 26 177.950 177.950 177.338 0.612 17919 966 1 3 . 1 1 26 26 VAL CA C 26 67.660 67.660 65.002 2.658 17919 967 1 3 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.946 -1.106 17919 968 1 3 . 1 1 26 26 VAL H H 26 8.070 8.070 8.129 -0.059 17919 969 1 3 . 1 1 27 27 LYS N N 27 118.860 118.860 120.296 -1.436 17919 970 1 3 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.080 0.500 17919 971 1 3 . 1 1 27 27 LYS C C 27 180.550 180.550 178.874 1.676 17919 972 1 3 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.749 -0.499 17919 973 1 3 . 1 1 27 27 LYS CB C 27 33.730 33.730 31.886 1.844 17919 974 1 3 . 1 1 27 27 LYS H H 27 8.560 8.560 8.231 0.329 17919 975 1 3 . 1 1 28 28 ALA N N 28 123.440 123.440 121.846 1.594 17919 976 1 3 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.105 0.055 17919 977 1 3 . 1 1 28 28 ALA C C 28 180.300 180.300 179.148 1.152 17919 978 1 3 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.909 0.461 17919 979 1 3 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.287 -0.577 17919 980 1 3 . 1 1 28 28 ALA H H 28 8.060 8.060 7.717 0.343 17919 981 1 3 . 1 1 29 29 LYS N N 29 119.940 119.940 119.676 0.264 17919 982 1 3 . 1 1 29 29 LYS HA H 29 4.207 4.207 3.913 0.294 17919 983 1 3 . 1 1 29 29 LYS C C 29 180.320 180.320 179.014 1.306 17919 984 1 3 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.686 -0.036 17919 985 1 3 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.204 1.086 17919 986 1 3 . 1 1 29 29 LYS H H 29 7.850 7.850 7.654 0.196 17919 987 1 3 . 1 1 30 30 ILE N N 30 121.080 121.080 119.702 1.378 17919 988 1 3 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.628 -0.121 17919 989 1 3 . 1 1 30 30 ILE C C 30 178.310 178.310 177.523 0.787 17919 990 1 3 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.234 0.917 17919 991 1 3 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.362 -0.562 17919 992 1 3 . 1 1 30 30 ILE H H 30 8.280 8.280 8.008 0.272 17919 993 1 3 . 1 1 31 31 GLN N N 31 123.490 123.490 120.779 2.711 17919 994 1 3 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.844 -0.015 17919 995 1 3 . 1 1 31 31 GLN C C 31 178.890 178.890 178.063 0.827 17919 996 1 3 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.390 0.610 17919 997 1 3 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.312 -0.592 17919 998 1 3 . 1 1 31 31 GLN H H 31 8.580 8.580 8.075 0.505 17919 999 1 3 . 1 1 32 32 ASP N N 32 119.360 119.360 118.707 0.653 17919 1000 1 3 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.395 -0.041 17919 1001 1 3 . 1 1 32 32 ASP C C 32 177.250 177.250 178.203 -0.953 17919 1002 1 3 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.668 0.522 17919 1003 1 3 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.891 -0.311 17919 1004 1 3 . 1 1 32 32 ASP H H 32 8.010 8.010 7.844 0.166 17919 1005 1 3 . 1 1 33 33 LYS N N 33 115.130 115.130 118.466 -3.336 17919 1006 1 3 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.182 0.155 17919 1007 1 3 . 1 1 33 33 LYS C C 33 177.870 177.870 177.572 0.298 17919 1008 1 3 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.013 0.037 17919 1009 1 3 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.311 0.859 17919 1010 1 3 . 1 1 33 33 LYS H H 33 7.430 7.430 7.822 -0.392 17919 1011 1 3 . 1 1 34 34 GLU N N 34 113.870 113.870 114.510 -0.640 17919 1012 1 3 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.464 0.161 17919 1013 1 3 . 1 1 34 34 GLU C C 34 177.840 177.840 176.851 0.989 17919 1014 1 3 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.659 -0.489 17919 1015 1 3 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.717 0.943 17919 1016 1 3 . 1 1 34 34 GLU H H 34 8.740 8.740 8.261 0.479 17919 1017 1 3 . 1 1 35 35 GLY N N 35 108.650 108.650 107.543 1.107 17919 1018 1 3 . 1 1 35 35 GLY C C 35 173.960 173.960 174.796 -0.836 17919 1019 1 3 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.627 0.453 17919 1020 1 3 . 1 1 35 35 GLY H H 35 8.530 8.530 7.902 0.628 17919 1021 1 3 . 1 1 36 36 ILE N N 36 119.880 119.880 123.469 -3.589 17919 1022 1 3 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.278 0.167 17919 1023 1 3 . 1 1 36 36 ILE C C 36 173.590 173.590 173.989 -0.399 17919 1024 1 3 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.646 -0.896 17919 1025 1 3 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.638 1.942 17919 1026 1 3 . 1 1 36 36 ILE H H 36 6.150 6.150 7.772 -1.622 17919 1027 1 3 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.887 -0.253 17919 1028 1 3 . 1 1 37 37 PRO C C 37 176.940 176.940 176.013 0.927 17919 1029 1 3 . 1 1 37 37 PRO CA C 37 61.660 61.660 60.772 0.888 17919 1030 1 3 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.273 0.577 17919 1031 1 3 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.060 0.057 17919 1032 1 3 . 1 1 38 38 PRO C C 38 178.320 178.320 178.308 0.012 17919 1033 1 3 . 1 1 38 38 PRO CA C 38 66.260 66.260 66.379 -0.119 17919 1034 1 3 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.777 1.113 17919 1035 1 3 . 1 1 39 39 ASP N N 39 113.380 113.380 112.869 0.511 17919 1036 1 3 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.606 -0.176 17919 1037 1 3 . 1 1 39 39 ASP C C 39 177.090 177.090 176.807 0.283 17919 1038 1 3 . 1 1 39 39 ASP CA C 39 55.640 55.640 54.181 1.459 17919 1039 1 3 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.142 -0.601 17919 1040 1 3 . 1 1 39 39 ASP H H 39 8.550 8.550 8.557 -0.007 17919 1041 1 3 . 1 1 40 40 GLN N N 40 116.780 116.780 116.797 -0.017 17919 1042 1 3 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.470 -0.006 17919 1043 1 3 . 1 1 40 40 GLN C C 40 175.380 175.380 176.059 -0.679 17919 1044 1 3 . 1 1 40 40 GLN CA C 40 55.640 55.640 57.001 -1.361 17919 1045 1 3 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.933 0.207 17919 1046 1 3 . 1 1 40 40 GLN H H 40 7.820 7.820 7.765 0.055 17919 1047 1 3 . 1 1 41 41 GLN N N 41 117.720 117.720 118.426 -0.706 17919 1048 1 3 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.855 -0.611 17919 1049 1 3 . 1 1 41 41 GLN C C 41 176.300 176.300 174.871 1.429 17919 1050 1 3 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.330 1.141 17919 1051 1 3 . 1 1 41 41 GLN CB C 41 31.650 31.650 31.324 0.326 17919 1052 1 3 . 1 1 41 41 GLN H H 41 7.480 7.480 7.579 -0.099 17919 1053 1 3 . 1 1 42 42 ARG N N 42 122.680 122.680 120.931 1.749 17919 1054 1 3 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.697 -0.197 17919 1055 1 3 . 1 1 42 42 ARG C C 42 174.050 174.050 173.763 0.287 17919 1056 1 3 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.866 0.184 17919 1057 1 3 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.804 -1.054 17919 1058 1 3 . 1 1 42 42 ARG H H 42 8.530 8.530 8.285 0.245 17919 1059 1 3 . 1 1 43 43 LEU N N 43 124.040 124.040 125.486 -1.446 17919 1060 1 3 . 1 1 43 43 LEU C C 43 175.290 175.290 175.733 -0.443 17919 1061 1 3 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.637 -0.657 17919 1062 1 3 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.818 1.972 17919 1063 1 3 . 1 1 43 43 LEU H H 43 8.820 8.820 8.596 0.224 17919 1064 1 3 . 1 1 44 44 ILE N N 44 121.920 121.920 123.171 -1.251 17919 1065 1 3 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.418 0.574 17919 1066 1 3 . 1 1 44 44 ILE C C 44 176.060 176.060 174.271 1.789 17919 1067 1 3 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.294 -1.314 17919 1068 1 3 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.496 -0.076 17919 1069 1 3 . 1 1 44 44 ILE H H 44 9.030 9.030 8.213 0.817 17919 1070 1 3 . 1 1 45 45 PHE N N 45 125.390 125.390 128.074 -2.684 17919 1071 1 3 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.956 0.089 17919 1072 1 3 . 1 1 45 45 PHE C C 45 174.470 174.470 174.607 -0.137 17919 1073 1 3 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.914 0.106 17919 1074 1 3 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.540 1.220 17919 1075 1 3 . 1 1 45 45 PHE H H 45 8.830 8.830 8.210 0.620 17919 1076 1 3 . 1 1 46 46 ALA N N 46 132.200 132.200 130.596 1.604 17919 1077 1 3 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.709 -0.019 17919 1078 1 3 . 1 1 46 46 ALA C C 46 177.290 177.290 177.720 -0.430 17919 1079 1 3 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.584 -0.044 17919 1080 1 3 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.465 0.104 17919 1081 1 3 . 1 1 46 46 ALA H H 46 8.810 8.810 8.884 -0.074 17919 1082 1 3 . 1 1 47 47 GLY N N 47 102.340 102.340 104.856 -2.516 17919 1083 1 3 . 1 1 47 47 GLY C C 47 173.810 173.810 174.241 -0.431 17919 1084 1 3 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.075 0.275 17919 1085 1 3 . 1 1 47 47 GLY H H 47 8.130 8.130 8.547 -0.417 17919 1086 1 3 . 1 1 48 48 LYS N N 48 121.570 121.570 122.554 -0.984 17919 1087 1 3 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.546 0.076 17919 1088 1 3 . 1 1 48 48 LYS C C 48 174.700 174.700 175.526 -0.826 17919 1089 1 3 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.845 -0.295 17919 1090 1 3 . 1 1 48 48 LYS CB C 48 34.530 34.530 33.311 1.219 17919 1091 1 3 . 1 1 48 48 LYS H H 48 7.980 7.980 7.567 0.413 17919 1092 1 3 . 1 1 49 49 GLN N N 49 122.410 122.410 126.870 -4.460 17919 1093 1 3 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.391 0.169 17919 1094 1 3 . 1 1 49 49 GLN C C 49 175.670 175.670 175.947 -0.277 17919 1095 1 3 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.518 -0.778 17919 1096 1 3 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.161 -0.161 17919 1097 1 3 . 1 1 49 49 GLN H H 49 8.600 8.600 8.753 -0.153 17919 1098 1 3 . 1 1 50 50 LEU N N 50 125.520 125.520 127.283 -1.763 17919 1099 1 3 . 1 1 50 50 LEU HA H 50 4.090 4.090 3.926 0.164 17919 1100 1 3 . 1 1 50 50 LEU C C 50 176.660 176.660 176.465 0.195 17919 1101 1 3 . 1 1 50 50 LEU CA C 50 54.240 54.240 55.550 -1.310 17919 1102 1 3 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.026 -0.457 17919 1103 1 3 . 1 1 50 50 LEU H H 50 8.530 8.530 8.095 0.435 17919 1104 1 3 . 1 1 51 51 GLU N N 51 122.940 122.940 118.762 4.178 17919 1105 1 3 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.580 -0.092 17919 1106 1 3 . 1 1 51 51 GLU C C 51 175.870 175.870 176.123 -0.253 17919 1107 1 3 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.465 0.495 17919 1108 1 3 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.940 -1.370 17919 1109 1 3 . 1 1 51 51 GLU H H 51 8.400 8.400 8.384 0.016 17919 1110 1 3 . 1 1 52 52 ASP N N 52 120.030 120.030 124.922 -4.892 17919 1111 1 3 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.453 -0.094 17919 1112 1 3 . 1 1 52 52 ASP C C 52 177.330 177.330 178.033 -0.703 17919 1113 1 3 . 1 1 52 52 ASP CA C 52 56.960 56.960 58.120 -1.160 17919 1114 1 3 . 1 1 52 52 ASP CB C 52 40.850 40.850 41.020 -0.170 17919 1115 1 3 . 1 1 52 52 ASP H H 52 8.160 8.160 8.907 -0.747 17919 1116 1 3 . 1 1 53 53 GLY N N 53 106.660 106.660 106.261 0.399 17919 1117 1 3 . 1 1 53 53 GLY C C 53 174.870 174.870 174.291 0.579 17919 1118 1 3 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.231 -0.061 17919 1119 1 3 . 1 1 53 53 GLY H H 53 9.390 9.390 8.554 0.836 17919 1120 1 3 . 1 1 54 54 ARG N N 54 119.050 119.050 120.024 -0.974 17919 1121 1 3 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.641 0.054 17919 1122 1 3 . 1 1 54 54 ARG C C 54 175.350 175.350 174.963 0.387 17919 1123 1 3 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.017 0.374 17919 1124 1 3 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.505 0.145 17919 1125 1 3 . 1 1 54 54 ARG H H 54 7.460 7.460 7.423 0.037 17919 1126 1 3 . 1 1 55 55 THR N N 55 108.400 108.400 112.701 -4.301 17919 1127 1 3 . 1 1 55 55 THR HA H 55 5.240 5.240 4.965 0.275 17919 1128 1 3 . 1 1 55 55 THR C C 55 176.560 176.560 176.757 -0.197 17919 1129 1 3 . 1 1 55 55 THR CA C 55 59.690 59.690 60.287 -0.597 17919 1130 1 3 . 1 1 55 55 THR CB C 55 72.260 72.260 70.505 1.755 17919 1131 1 3 . 1 1 55 55 THR H H 55 8.730 8.730 9.098 -0.368 17919 1132 1 3 . 1 1 56 56 LEU N N 56 117.920 117.920 122.147 -4.227 17919 1133 1 3 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.033 0.027 17919 1134 1 3 . 1 1 56 56 LEU C C 56 180.810 180.810 178.583 2.227 17919 1135 1 3 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.486 0.224 17919 1136 1 3 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.024 -0.654 17919 1137 1 3 . 1 1 56 56 LEU H H 56 8.140 8.140 8.498 -0.358 17919 1138 1 3 . 1 1 57 57 SER N N 57 113.330 113.330 114.953 -1.623 17919 1139 1 3 . 1 1 57 57 SER HA H 57 4.370 4.370 4.153 0.217 17919 1140 1 3 . 1 1 57 57 SER C C 57 178.310 178.310 176.951 1.359 17919 1141 1 3 . 1 1 57 57 SER CA C 57 61.080 61.080 61.620 -0.540 17919 1142 1 3 . 1 1 57 57 SER CB C 57 62.530 62.530 62.580 -0.050 17919 1143 1 3 . 1 1 57 57 SER H H 57 8.470 8.470 7.835 0.635 17919 1144 1 3 . 1 1 58 58 ASP N N 58 124.190 124.190 122.920 1.270 17919 1145 1 3 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.210 0.086 17919 1146 1 3 . 1 1 58 58 ASP C C 58 177.400 177.400 177.447 -0.047 17919 1147 1 3 . 1 1 58 58 ASP CA C 58 57.180 57.180 57.348 -0.168 17919 1148 1 3 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.073 0.027 17919 1149 1 3 . 1 1 58 58 ASP H H 58 7.930 7.930 8.320 -0.390 17919 1150 1 3 . 1 1 59 59 TYR N N 59 115.510 115.510 115.223 0.287 17919 1151 1 3 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.623 0.047 17919 1152 1 3 . 1 1 59 59 TYR C C 59 174.700 174.700 175.468 -0.768 17919 1153 1 3 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.603 0.647 17919 1154 1 3 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.912 1.158 17919 1155 1 3 . 1 1 59 59 TYR H H 59 7.250 7.250 7.342 -0.092 17919 1156 1 3 . 1 1 60 60 ASN N N 60 115.900 115.900 117.501 -1.601 17919 1157 1 3 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.371 -0.016 17919 1158 1 3 . 1 1 60 60 ASN C C 60 174.340 174.340 174.605 -0.265 17919 1159 1 3 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.104 0.016 17919 1160 1 3 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.477 -0.068 17919 1161 1 3 . 1 1 60 60 ASN H H 60 8.150 8.150 7.806 0.344 17919 1162 1 3 . 1 1 61 61 ILE N N 61 118.600 118.600 120.769 -2.169 17919 1163 1 3 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.648 -0.255 17919 1164 1 3 . 1 1 61 61 ILE C C 61 174.610 174.610 174.956 -0.346 17919 1165 1 3 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.910 0.510 17919 1166 1 3 . 1 1 61 61 ILE CB C 61 36.740 36.740 36.438 0.302 17919 1167 1 3 . 1 1 61 61 ILE H H 61 7.250 7.250 7.524 -0.274 17919 1168 1 3 . 1 1 62 62 GLN N N 62 124.740 124.740 126.638 -1.898 17919 1169 1 3 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.585 -0.079 17919 1170 1 3 . 1 1 62 62 GLN C C 62 175.970 175.970 175.932 0.038 17919 1171 1 3 . 1 1 62 62 GLN CA C 62 53.660 53.660 54.251 -0.591 17919 1172 1 3 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.164 0.486 17919 1173 1 3 . 1 1 62 62 GLN H H 62 7.610 7.610 7.977 -0.367 17919 1174 1 3 . 1 1 63 63 LYS N N 63 120.300 120.300 119.979 0.321 17919 1175 1 3 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.023 -0.022 17919 1176 1 3 . 1 1 63 63 LYS C C 63 175.810 175.810 177.320 -1.510 17919 1177 1 3 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.650 0.140 17919 1178 1 3 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.197 0.453 17919 1179 1 3 . 1 1 63 63 LYS H H 63 8.490 8.490 8.605 -0.115 17919 1180 1 3 . 1 1 64 64 GLU N N 64 113.950 113.950 119.725 -5.775 17919 1181 1 3 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.797 -0.332 17919 1182 1 3 . 1 1 64 64 GLU C C 64 175.250 175.250 175.457 -0.207 17919 1183 1 3 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.496 0.394 17919 1184 1 3 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.533 -2.633 17919 1185 1 3 . 1 1 64 64 GLU H H 64 9.280 9.280 8.801 0.479 17919 1186 1 3 . 1 1 65 65 SER N N 65 114.730 114.730 115.279 -0.549 17919 1187 1 3 . 1 1 65 65 SER HA H 65 4.640 4.640 4.760 -0.120 17919 1188 1 3 . 1 1 65 65 SER C C 65 172.160 172.160 174.692 -2.532 17919 1189 1 3 . 1 1 65 65 SER CA C 65 60.890 60.890 58.928 1.962 17919 1190 1 3 . 1 1 65 65 SER CB C 65 64.910 64.910 63.579 1.331 17919 1191 1 3 . 1 1 65 65 SER H H 65 7.670 7.670 7.482 0.188 17919 1192 1 3 . 1 1 66 66 THR N N 66 117.110 117.110 123.580 -6.470 17919 1193 1 3 . 1 1 66 66 THR HA H 66 5.270 5.270 4.813 0.457 17919 1194 1 3 . 1 1 66 66 THR C C 66 173.950 173.950 174.717 -0.767 17919 1195 1 3 . 1 1 66 66 THR CA C 66 62.340 62.340 62.995 -0.655 17919 1196 1 3 . 1 1 66 66 THR CB C 66 70.080 70.080 69.502 0.578 17919 1197 1 3 . 1 1 66 66 THR H H 66 8.730 8.730 8.778 -0.048 17919 1198 1 3 . 1 1 67 67 LEU N N 67 127.110 127.110 127.284 -0.174 17919 1199 1 3 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.869 0.191 17919 1200 1 3 . 1 1 67 67 LEU C C 67 175.770 175.770 175.859 -0.089 17919 1201 1 3 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.331 -0.431 17919 1202 1 3 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.299 0.961 17919 1203 1 3 . 1 1 67 67 LEU H H 67 9.410 9.410 9.178 0.232 17919 1204 1 3 . 1 1 68 68 HIS N N 68 118.380 118.380 122.603 -4.223 17919 1205 1 3 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.324 -0.084 17919 1206 1 3 . 1 1 68 68 HIS C C 68 173.150 173.150 174.200 -1.050 17919 1207 1 3 . 1 1 68 68 HIS CA C 68 55.000 55.000 53.708 1.292 17919 1208 1 3 . 1 1 68 68 HIS CB C 68 30.530 30.530 31.899 -1.369 17919 1209 1 3 . 1 1 68 68 HIS H H 68 9.230 9.230 8.359 0.871 17919 1210 1 3 . 1 1 69 69 LEU N N 69 124.460 124.460 130.163 -5.703 17919 1211 1 3 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.634 0.556 17919 1212 1 3 . 1 1 69 69 LEU C C 69 175.270 175.270 174.672 0.598 17919 1213 1 3 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.647 -0.756 17919 1214 1 3 . 1 1 69 69 LEU CB C 69 44.380 44.380 42.943 1.437 17919 1215 1 3 . 1 1 69 69 LEU H H 69 8.340 8.340 7.846 0.494 17919 1216 1 3 . 1 1 70 70 VAL N N 70 126.940 126.940 126.193 0.747 17919 1217 1 3 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.193 0.157 17919 1218 1 3 . 1 1 70 70 VAL C C 70 174.000 174.000 174.200 -0.200 17919 1219 1 3 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.460 0.340 17919 1220 1 3 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.026 -0.116 17919 1221 1 3 . 1 1 70 70 VAL H H 70 9.200 9.200 8.132 1.068 17919 1222 1 3 . 1 1 71 71 LEU N N 71 123.130 123.130 125.471 -2.341 17919 1223 1 3 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.264 -0.204 17919 1224 1 3 . 1 1 71 71 LEU C C 71 177.830 177.830 176.283 1.547 17919 1225 1 3 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.826 0.114 17919 1226 1 3 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.104 -0.254 17919 1227 1 3 . 1 1 71 71 LEU H H 71 8.120 8.120 8.260 -0.140 17919 1228 1 3 . 1 1 72 72 ARG N N 72 123.490 123.490 124.511 -1.021 17919 1229 1 3 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.730 -0.429 17919 1230 1 3 . 1 1 72 72 ARG C C 72 175.350 175.350 174.450 0.900 17919 1231 1 3 . 1 1 72 72 ARG CA C 72 55.610 55.610 54.795 0.815 17919 1232 1 3 . 1 1 72 72 ARG CB C 72 31.350 31.350 33.374 -2.025 17919 1233 1 3 . 1 1 72 72 ARG H H 72 8.580 8.580 8.621 -0.041 17919 1234 1 4 . 1 1 2 2 GLN N N 2 123.220 123.220 120.287 2.933 17919 1235 1 4 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.274 -0.025 17919 1236 1 4 . 1 1 2 2 GLN C C 2 175.920 175.920 175.614 0.306 17919 1237 1 4 . 1 1 2 2 GLN CA C 2 55.080 55.080 55.243 -0.163 17919 1238 1 4 . 1 1 2 2 GLN CB C 2 30.760 30.760 29.896 0.864 17919 1239 1 4 . 1 1 2 2 GLN H H 2 8.900 8.900 8.550 0.350 17919 1240 1 4 . 1 1 3 3 ILE N N 3 115.340 115.340 115.960 -0.620 17919 1241 1 4 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.079 0.134 17919 1242 1 4 . 1 1 3 3 ILE C C 3 172.450 172.450 173.452 -1.002 17919 1243 1 4 . 1 1 3 3 ILE CA C 3 59.570 59.570 60.042 -0.472 17919 1244 1 4 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.626 0.584 17919 1245 1 4 . 1 1 3 3 ILE H H 3 8.320 8.320 8.275 0.045 17919 1246 1 4 . 1 1 4 4 PHE N N 4 118.110 118.110 120.003 -1.893 17919 1247 1 4 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.170 0.460 17919 1248 1 4 . 1 1 4 4 PHE C C 4 175.320 175.320 175.208 0.112 17919 1249 1 4 . 1 1 4 4 PHE CA C 4 55.210 55.210 54.905 0.305 17919 1250 1 4 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.850 -0.370 17919 1251 1 4 . 1 1 4 4 PHE H H 4 8.610 8.610 8.859 -0.249 17919 1252 1 4 . 1 1 5 5 VAL N N 5 121.000 121.000 120.577 0.423 17919 1253 1 4 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.865 -0.140 17919 1254 1 4 . 1 1 5 5 VAL C C 5 174.870 174.870 175.320 -0.450 17919 1255 1 4 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.444 -0.824 17919 1256 1 4 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.606 -0.376 17919 1257 1 4 . 1 1 5 5 VAL H H 5 9.300 9.300 8.425 0.875 17919 1258 1 4 . 1 1 6 6 LYS N N 6 127.520 127.520 128.093 -0.573 17919 1259 1 4 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.233 0.134 17919 1260 1 4 . 1 1 6 6 LYS C C 6 177.140 177.140 177.219 -0.079 17919 1261 1 4 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.395 0.125 17919 1262 1 4 . 1 1 6 6 LYS CB C 6 35.050 35.050 32.476 2.574 17919 1263 1 4 . 1 1 6 6 LYS H H 6 8.820 8.820 8.953 -0.133 17919 1264 1 4 . 1 1 7 7 THR N N 7 115.400 115.400 115.200 0.200 17919 1265 1 4 . 1 1 7 7 THR HA H 7 4.970 4.970 4.420 0.550 17919 1266 1 4 . 1 1 7 7 THR C C 7 176.910 176.910 175.775 1.135 17919 1267 1 4 . 1 1 7 7 THR CA C 7 60.470 60.470 61.269 -0.799 17919 1268 1 4 . 1 1 7 7 THR CB C 7 70.630 70.630 70.334 0.296 17919 1269 1 4 . 1 1 7 7 THR H H 7 8.730 8.730 8.415 0.315 17919 1270 1 4 . 1 1 8 8 LEU N N 8 121.330 121.330 118.295 3.035 17919 1271 1 4 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.239 0.071 17919 1272 1 4 . 1 1 8 8 LEU C C 8 178.800 178.800 178.207 0.593 17919 1273 1 4 . 1 1 8 8 LEU CA C 8 57.580 57.580 56.583 0.997 17919 1274 1 4 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.030 -0.060 17919 1275 1 4 . 1 1 8 8 LEU H H 8 9.100 9.100 8.983 0.117 17919 1276 1 4 . 1 1 9 9 THR N N 9 105.590 105.590 108.626 -3.036 17919 1277 1 4 . 1 1 9 9 THR HA H 9 4.428 4.428 4.366 0.062 17919 1278 1 4 . 1 1 9 9 THR C C 9 175.520 175.520 176.047 -0.527 17919 1279 1 4 . 1 1 9 9 THR CA C 9 61.400 61.400 61.646 -0.246 17919 1280 1 4 . 1 1 9 9 THR CB C 9 69.140 69.140 68.698 0.442 17919 1281 1 4 . 1 1 9 9 THR H H 9 7.630 7.630 7.741 -0.111 17919 1282 1 4 . 1 1 10 10 GLY N N 10 108.890 108.890 111.050 -2.160 17919 1283 1 4 . 1 1 10 10 GLY C C 10 174.070 174.070 173.779 0.291 17919 1284 1 4 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.862 -0.402 17919 1285 1 4 . 1 1 10 10 GLY H H 10 7.810 7.810 8.606 -0.796 17919 1286 1 4 . 1 1 11 11 LYS N N 11 121.600 121.600 121.611 -0.011 17919 1287 1 4 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.259 0.102 17919 1288 1 4 . 1 1 11 11 LYS C C 11 175.940 175.940 176.062 -0.122 17919 1289 1 4 . 1 1 11 11 LYS CA C 11 56.280 56.280 55.602 0.678 17919 1290 1 4 . 1 1 11 11 LYS CB C 11 33.200 33.200 32.544 0.657 17919 1291 1 4 . 1 1 11 11 LYS H H 11 7.280 7.280 7.661 -0.381 17919 1292 1 4 . 1 1 12 12 THR N N 12 120.440 120.440 117.631 2.809 17919 1293 1 4 . 1 1 12 12 THR HA H 12 5.046 5.046 4.444 0.602 17919 1294 1 4 . 1 1 12 12 THR C C 12 174.320 174.320 174.661 -0.341 17919 1295 1 4 . 1 1 12 12 THR CA C 12 62.390 62.390 62.904 -0.514 17919 1296 1 4 . 1 1 12 12 THR CB C 12 69.910 69.910 68.872 1.038 17919 1297 1 4 . 1 1 12 12 THR H H 12 8.650 8.650 8.272 0.378 17919 1298 1 4 . 1 1 13 13 ILE N N 13 127.110 127.110 128.986 -1.876 17919 1299 1 4 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.214 0.330 17919 1300 1 4 . 1 1 13 13 ILE C C 13 175.220 175.220 175.938 -0.718 17919 1301 1 4 . 1 1 13 13 ILE CA C 13 59.980 59.980 61.249 -1.269 17919 1302 1 4 . 1 1 13 13 ILE CB C 13 40.950 40.950 39.284 1.666 17919 1303 1 4 . 1 1 13 13 ILE H H 13 9.450 9.450 8.327 1.123 17919 1304 1 4 . 1 1 14 14 THR N N 14 121.520 121.520 122.829 -1.309 17919 1305 1 4 . 1 1 14 14 THR HA H 14 4.964 4.964 4.862 0.102 17919 1306 1 4 . 1 1 14 14 THR C C 14 173.790 173.790 173.922 -0.132 17919 1307 1 4 . 1 1 14 14 THR CA C 14 61.940 61.940 62.179 -0.239 17919 1308 1 4 . 1 1 14 14 THR CB C 14 69.650 69.650 69.307 0.343 17919 1309 1 4 . 1 1 14 14 THR H H 14 8.710 8.710 8.361 0.349 17919 1310 1 4 . 1 1 15 15 LEU N N 15 124.800 124.800 128.594 -3.794 17919 1311 1 4 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.669 0.111 17919 1312 1 4 . 1 1 15 15 LEU C C 15 174.670 174.670 175.653 -0.983 17919 1313 1 4 . 1 1 15 15 LEU CA C 15 52.830 52.830 54.078 -1.248 17919 1314 1 4 . 1 1 15 15 LEU CB C 15 47.070 47.070 43.749 3.321 17919 1315 1 4 . 1 1 15 15 LEU H H 15 8.710 8.710 8.649 0.061 17919 1316 1 4 . 1 1 16 16 GLU N N 16 122.160 122.160 121.958 0.202 17919 1317 1 4 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.040 -0.123 17919 1318 1 4 . 1 1 16 16 GLU C C 16 175.860 175.860 176.030 -0.170 17919 1319 1 4 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.481 -0.661 17919 1320 1 4 . 1 1 16 16 GLU CB C 16 29.450 29.450 31.508 -2.058 17919 1321 1 4 . 1 1 16 16 GLU H H 16 8.140 8.140 8.575 -0.435 17919 1322 1 4 . 1 1 17 17 VAL N N 17 117.210 117.210 119.995 -2.785 17919 1323 1 4 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.795 -0.081 17919 1324 1 4 . 1 1 17 17 VAL C C 17 174.160 174.160 174.188 -0.028 17919 1325 1 4 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.267 -0.837 17919 1326 1 4 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.088 1.312 17919 1327 1 4 . 1 1 17 17 VAL H H 17 8.900 8.900 8.610 0.290 17919 1328 1 4 . 1 1 18 18 GLU N N 18 118.990 118.990 118.587 0.403 17919 1329 1 4 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.983 0.096 17919 1330 1 4 . 1 1 18 18 GLU C C 18 176.160 176.160 175.370 0.790 17919 1331 1 4 . 1 1 18 18 GLU CA C 18 52.720 52.720 51.730 0.990 17919 1332 1 4 . 1 1 18 18 GLU CB C 18 30.310 30.310 32.400 -2.090 17919 1333 1 4 . 1 1 18 18 GLU H H 18 8.640 8.640 8.267 0.373 17919 1334 1 4 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.248 -0.107 17919 1335 1 4 . 1 1 19 19 PRO C C 19 175.310 175.310 178.243 -2.933 17919 1336 1 4 . 1 1 19 19 PRO CA C 19 65.470 65.470 64.704 0.766 17919 1337 1 4 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.903 0.047 17919 1338 1 4 . 1 1 20 20 SER N N 20 103.400 103.400 112.184 -8.784 17919 1339 1 4 . 1 1 20 20 SER HA H 20 4.370 4.370 4.116 0.254 17919 1340 1 4 . 1 1 20 20 SER C C 20 174.660 174.660 174.336 0.324 17919 1341 1 4 . 1 1 20 20 SER CA C 20 57.400 57.400 60.277 -2.877 17919 1342 1 4 . 1 1 20 20 SER CB C 20 63.370 63.370 62.823 0.547 17919 1343 1 4 . 1 1 20 20 SER H H 20 7.040 7.040 8.185 -1.145 17919 1344 1 4 . 1 1 21 21 ASP N N 21 123.480 123.480 122.675 0.805 17919 1345 1 4 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.563 0.132 17919 1346 1 4 . 1 1 21 21 ASP C C 21 176.360 176.360 175.650 0.710 17919 1347 1 4 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.802 -0.102 17919 1348 1 4 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.811 -1.011 17919 1349 1 4 . 1 1 21 21 ASP H H 21 8.030 8.030 7.787 0.243 17919 1350 1 4 . 1 1 22 22 THR N N 22 108.800 108.800 111.022 -2.222 17919 1351 1 4 . 1 1 22 22 THR HA H 22 4.920 4.920 4.859 0.061 17919 1352 1 4 . 1 1 22 22 THR C C 22 176.750 176.750 175.717 1.033 17919 1353 1 4 . 1 1 22 22 THR CA C 22 59.690 59.690 60.563 -0.873 17919 1354 1 4 . 1 1 22 22 THR CB C 22 71.200 71.200 71.133 0.067 17919 1355 1 4 . 1 1 22 22 THR H H 22 7.900 7.900 8.209 -0.309 17919 1356 1 4 . 1 1 23 23 ILE N N 23 121.190 121.190 122.748 -1.558 17919 1357 1 4 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.784 -0.127 17919 1358 1 4 . 1 1 23 23 ILE C C 23 179.040 179.040 177.496 1.544 17919 1359 1 4 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.353 -0.094 17919 1360 1 4 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.828 -2.478 17919 1361 1 4 . 1 1 23 23 ILE H H 23 8.560 8.560 9.152 -0.592 17919 1362 1 4 . 1 1 24 24 GLU N N 24 120.830 120.830 120.119 0.711 17919 1363 1 4 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.837 0.080 17919 1364 1 4 . 1 1 24 24 GLU C C 24 178.640 178.640 178.650 -0.010 17919 1365 1 4 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.910 0.310 17919 1366 1 4 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.414 -1.134 17919 1367 1 4 . 1 1 24 24 GLU H H 24 9.760 9.760 8.556 1.204 17919 1368 1 4 . 1 1 25 25 ASN N N 25 120.570 120.570 116.945 3.625 17919 1369 1 4 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.556 -0.031 17919 1370 1 4 . 1 1 25 25 ASN C C 25 178.380 178.380 177.471 0.909 17919 1371 1 4 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.838 0.222 17919 1372 1 4 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.869 -0.419 17919 1373 1 4 . 1 1 25 25 ASN H H 25 7.920 7.920 7.545 0.375 17919 1374 1 4 . 1 1 26 26 VAL N N 26 121.710 121.710 119.934 1.776 17919 1375 1 4 . 1 1 26 26 VAL HA H 26 3.397 3.397 4.059 -0.662 17919 1376 1 4 . 1 1 26 26 VAL C C 26 177.950 177.950 177.438 0.512 17919 1377 1 4 . 1 1 26 26 VAL CA C 26 67.660 67.660 62.276 5.384 17919 1378 1 4 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.385 -0.545 17919 1379 1 4 . 1 1 26 26 VAL H H 26 8.070 8.070 7.907 0.163 17919 1380 1 4 . 1 1 27 27 LYS N N 27 118.860 118.860 121.076 -2.216 17919 1381 1 4 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.178 0.402 17919 1382 1 4 . 1 1 27 27 LYS C C 27 180.550 180.550 178.415 2.135 17919 1383 1 4 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.899 -0.649 17919 1384 1 4 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.234 1.496 17919 1385 1 4 . 1 1 27 27 LYS H H 27 8.560 8.560 8.351 0.209 17919 1386 1 4 . 1 1 28 28 ALA N N 28 123.440 123.440 123.210 0.230 17919 1387 1 4 . 1 1 28 28 ALA HA H 28 4.160 4.160 3.930 0.230 17919 1388 1 4 . 1 1 28 28 ALA C C 28 180.300 180.300 179.132 1.168 17919 1389 1 4 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.300 0.070 17919 1390 1 4 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.220 -0.510 17919 1391 1 4 . 1 1 28 28 ALA H H 28 8.060 8.060 7.620 0.440 17919 1392 1 4 . 1 1 29 29 LYS N N 29 119.940 119.940 118.322 1.618 17919 1393 1 4 . 1 1 29 29 LYS HA H 29 4.207 4.207 3.849 0.358 17919 1394 1 4 . 1 1 29 29 LYS C C 29 180.320 180.320 178.975 1.345 17919 1395 1 4 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.475 0.175 17919 1396 1 4 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.222 1.067 17919 1397 1 4 . 1 1 29 29 LYS H H 29 7.850 7.850 7.658 0.192 17919 1398 1 4 . 1 1 30 30 ILE N N 30 121.080 121.080 117.908 3.172 17919 1399 1 4 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.793 -0.286 17919 1400 1 4 . 1 1 30 30 ILE C C 30 178.310 178.310 177.827 0.483 17919 1401 1 4 . 1 1 30 30 ILE CA C 30 66.150 66.150 64.177 1.973 17919 1402 1 4 . 1 1 30 30 ILE CB C 30 36.800 36.800 38.010 -1.210 17919 1403 1 4 . 1 1 30 30 ILE H H 30 8.280 8.280 7.352 0.928 17919 1404 1 4 . 1 1 31 31 GLN N N 31 123.490 123.490 122.260 1.230 17919 1405 1 4 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.003 -0.174 17919 1406 1 4 . 1 1 31 31 GLN C C 31 178.890 178.890 178.272 0.618 17919 1407 1 4 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.340 0.660 17919 1408 1 4 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.423 -0.703 17919 1409 1 4 . 1 1 31 31 GLN H H 31 8.580 8.580 8.771 -0.191 17919 1410 1 4 . 1 1 32 32 ASP N N 32 119.360 119.360 118.573 0.787 17919 1411 1 4 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.336 0.018 17919 1412 1 4 . 1 1 32 32 ASP C C 32 177.250 177.250 177.477 -0.227 17919 1413 1 4 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.613 0.577 17919 1414 1 4 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.806 -0.226 17919 1415 1 4 . 1 1 32 32 ASP H H 32 8.010 8.010 8.112 -0.102 17919 1416 1 4 . 1 1 33 33 LYS N N 33 115.130 115.130 115.780 -0.650 17919 1417 1 4 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.429 -0.092 17919 1418 1 4 . 1 1 33 33 LYS C C 33 177.870 177.870 178.432 -0.562 17919 1419 1 4 . 1 1 33 33 LYS CA C 33 58.050 58.050 56.631 1.419 17919 1420 1 4 . 1 1 33 33 LYS CB C 33 34.170 34.170 34.156 0.014 17919 1421 1 4 . 1 1 33 33 LYS H H 33 7.430 7.430 7.675 -0.245 17919 1422 1 4 . 1 1 34 34 GLU N N 34 113.870 113.870 118.882 -5.012 17919 1423 1 4 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.186 0.439 17919 1424 1 4 . 1 1 34 34 GLU C C 34 177.840 177.840 177.791 0.049 17919 1425 1 4 . 1 1 34 34 GLU CA C 34 55.170 55.170 57.700 -2.530 17919 1426 1 4 . 1 1 34 34 GLU CB C 34 32.660 32.660 30.177 2.483 17919 1427 1 4 . 1 1 34 34 GLU H H 34 8.740 8.740 7.920 0.820 17919 1428 1 4 . 1 1 35 35 GLY N N 35 108.650 108.650 108.196 0.454 17919 1429 1 4 . 1 1 35 35 GLY C C 35 173.960 173.960 174.203 -0.243 17919 1430 1 4 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.660 0.420 17919 1431 1 4 . 1 1 35 35 GLY H H 35 8.530 8.530 7.945 0.585 17919 1432 1 4 . 1 1 36 36 ILE N N 36 119.880 119.880 120.799 -0.919 17919 1433 1 4 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.355 0.090 17919 1434 1 4 . 1 1 36 36 ILE C C 36 173.590 173.590 174.215 -0.625 17919 1435 1 4 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.602 0.148 17919 1436 1 4 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.758 1.822 17919 1437 1 4 . 1 1 36 36 ILE H H 36 6.150 6.150 7.557 -1.407 17919 1438 1 4 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.413 0.221 17919 1439 1 4 . 1 1 37 37 PRO C C 37 176.940 176.940 176.235 0.705 17919 1440 1 4 . 1 1 37 37 PRO CA C 37 61.660 61.660 62.648 -0.988 17919 1441 1 4 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.339 0.511 17919 1442 1 4 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.200 -0.083 17919 1443 1 4 . 1 1 38 38 PRO C C 38 178.320 178.320 178.415 -0.095 17919 1444 1 4 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.591 0.669 17919 1445 1 4 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.931 0.959 17919 1446 1 4 . 1 1 39 39 ASP N N 39 113.380 113.380 115.533 -2.153 17919 1447 1 4 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.280 0.150 17919 1448 1 4 . 1 1 39 39 ASP C C 39 177.090 177.090 178.001 -0.911 17919 1449 1 4 . 1 1 39 39 ASP CA C 39 55.640 55.640 57.181 -1.541 17919 1450 1 4 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.399 -0.859 17919 1451 1 4 . 1 1 39 39 ASP H H 39 8.550 8.550 8.773 -0.223 17919 1452 1 4 . 1 1 40 40 GLN N N 40 116.780 116.780 116.394 0.386 17919 1453 1 4 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.250 0.214 17919 1454 1 4 . 1 1 40 40 GLN C C 40 175.380 175.380 176.640 -1.260 17919 1455 1 4 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.600 -0.960 17919 1456 1 4 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.268 0.872 17919 1457 1 4 . 1 1 40 40 GLN H H 40 7.820 7.820 7.632 0.188 17919 1458 1 4 . 1 1 41 41 GLN N N 41 117.720 117.720 119.802 -2.082 17919 1459 1 4 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.319 -0.075 17919 1460 1 4 . 1 1 41 41 GLN C C 41 176.300 176.300 175.017 1.283 17919 1461 1 4 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.325 0.145 17919 1462 1 4 . 1 1 41 41 GLN CB C 41 31.650 31.650 28.919 2.731 17919 1463 1 4 . 1 1 41 41 GLN H H 41 7.480 7.480 7.435 0.045 17919 1464 1 4 . 1 1 42 42 ARG N N 42 122.680 122.680 123.596 -0.916 17919 1465 1 4 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.592 -0.092 17919 1466 1 4 . 1 1 42 42 ARG C C 42 174.050 174.050 174.819 -0.769 17919 1467 1 4 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.573 0.477 17919 1468 1 4 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.028 -0.278 17919 1469 1 4 . 1 1 42 42 ARG H H 42 8.530 8.530 8.168 0.362 17919 1470 1 4 . 1 1 43 43 LEU N N 43 124.040 124.040 126.435 -2.395 17919 1471 1 4 . 1 1 43 43 LEU C C 43 175.290 175.290 175.822 -0.532 17919 1472 1 4 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.852 -0.872 17919 1473 1 4 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.401 2.389 17919 1474 1 4 . 1 1 43 43 LEU H H 43 8.820 8.820 8.775 0.045 17919 1475 1 4 . 1 1 44 44 ILE N N 44 121.920 121.920 123.302 -1.382 17919 1476 1 4 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.224 -0.232 17919 1477 1 4 . 1 1 44 44 ILE C C 44 176.060 176.060 174.614 1.446 17919 1478 1 4 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.700 -0.721 17919 1479 1 4 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.758 -0.338 17919 1480 1 4 . 1 1 44 44 ILE H H 44 9.030 9.030 8.773 0.257 17919 1481 1 4 . 1 1 45 45 PHE N N 45 125.390 125.390 127.710 -2.320 17919 1482 1 4 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.945 0.100 17919 1483 1 4 . 1 1 45 45 PHE C C 45 174.470 174.470 174.330 0.140 17919 1484 1 4 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.638 0.382 17919 1485 1 4 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.684 1.076 17919 1486 1 4 . 1 1 45 45 PHE H H 45 8.830 8.830 9.005 -0.175 17919 1487 1 4 . 1 1 46 46 ALA N N 46 132.200 132.200 130.496 1.704 17919 1488 1 4 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.702 -0.012 17919 1489 1 4 . 1 1 46 46 ALA C C 46 177.290 177.290 177.761 -0.471 17919 1490 1 4 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.670 -0.130 17919 1491 1 4 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.493 0.077 17919 1492 1 4 . 1 1 46 46 ALA H H 46 8.810 8.810 8.853 -0.043 17919 1493 1 4 . 1 1 47 47 GLY N N 47 102.340 102.340 104.625 -2.285 17919 1494 1 4 . 1 1 47 47 GLY C C 47 173.810 173.810 174.242 -0.432 17919 1495 1 4 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.106 0.244 17919 1496 1 4 . 1 1 47 47 GLY H H 47 8.130 8.130 8.544 -0.414 17919 1497 1 4 . 1 1 48 48 LYS N N 48 121.570 121.570 121.421 0.149 17919 1498 1 4 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.535 0.087 17919 1499 1 4 . 1 1 48 48 LYS C C 48 174.700 174.700 175.453 -0.753 17919 1500 1 4 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.748 -0.198 17919 1501 1 4 . 1 1 48 48 LYS CB C 48 34.530 34.530 33.963 0.567 17919 1502 1 4 . 1 1 48 48 LYS H H 48 7.980 7.980 7.816 0.164 17919 1503 1 4 . 1 1 49 49 GLN N N 49 122.410 122.410 125.298 -2.888 17919 1504 1 4 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.425 0.135 17919 1505 1 4 . 1 1 49 49 GLN C C 49 175.670 175.670 175.299 0.371 17919 1506 1 4 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.489 -0.749 17919 1507 1 4 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.380 -0.380 17919 1508 1 4 . 1 1 49 49 GLN H H 49 8.600 8.600 8.659 -0.059 17919 1509 1 4 . 1 1 50 50 LEU N N 50 125.520 125.520 127.233 -1.713 17919 1510 1 4 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.416 -0.326 17919 1511 1 4 . 1 1 50 50 LEU C C 50 176.660 176.660 176.228 0.432 17919 1512 1 4 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.578 0.662 17919 1513 1 4 . 1 1 50 50 LEU CB C 50 41.570 41.570 43.196 -1.626 17919 1514 1 4 . 1 1 50 50 LEU H H 50 8.530 8.530 8.763 -0.233 17919 1515 1 4 . 1 1 51 51 GLU N N 51 122.940 122.940 121.404 1.536 17919 1516 1 4 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.495 -0.007 17919 1517 1 4 . 1 1 51 51 GLU C C 51 175.870 175.870 176.532 -0.662 17919 1518 1 4 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.569 0.391 17919 1519 1 4 . 1 1 51 51 GLU CB C 51 31.570 31.570 30.963 0.607 17919 1520 1 4 . 1 1 51 51 GLU H H 51 8.400 8.400 8.243 0.157 17919 1521 1 4 . 1 1 52 52 ASP N N 52 120.030 120.030 122.185 -2.155 17919 1522 1 4 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.602 -0.243 17919 1523 1 4 . 1 1 52 52 ASP C C 52 177.330 177.330 177.906 -0.576 17919 1524 1 4 . 1 1 52 52 ASP CA C 52 56.960 56.960 56.448 0.512 17919 1525 1 4 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.738 0.112 17919 1526 1 4 . 1 1 52 52 ASP H H 52 8.160 8.160 8.801 -0.641 17919 1527 1 4 . 1 1 53 53 GLY N N 53 106.660 106.660 105.710 0.950 17919 1528 1 4 . 1 1 53 53 GLY C C 53 174.870 174.870 174.733 0.137 17919 1529 1 4 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.076 0.094 17919 1530 1 4 . 1 1 53 53 GLY H H 53 9.390 9.390 8.317 1.073 17919 1531 1 4 . 1 1 54 54 ARG N N 54 119.050 119.050 119.942 -0.892 17919 1532 1 4 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.572 0.123 17919 1533 1 4 . 1 1 54 54 ARG C C 54 175.350 175.350 175.555 -0.205 17919 1534 1 4 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.654 -0.264 17919 1535 1 4 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.506 0.144 17919 1536 1 4 . 1 1 54 54 ARG H H 54 7.460 7.460 7.307 0.153 17919 1537 1 4 . 1 1 55 55 THR N N 55 108.400 108.400 112.727 -4.327 17919 1538 1 4 . 1 1 55 55 THR HA H 55 5.240 5.240 5.025 0.215 17919 1539 1 4 . 1 1 55 55 THR C C 55 176.560 176.560 176.041 0.519 17919 1540 1 4 . 1 1 55 55 THR CA C 55 59.690 59.690 60.285 -0.595 17919 1541 1 4 . 1 1 55 55 THR CB C 55 72.260 72.260 70.931 1.329 17919 1542 1 4 . 1 1 55 55 THR H H 55 8.730 8.730 8.872 -0.142 17919 1543 1 4 . 1 1 56 56 LEU N N 56 117.920 117.920 120.092 -2.172 17919 1544 1 4 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.932 0.128 17919 1545 1 4 . 1 1 56 56 LEU C C 56 180.810 180.810 178.939 1.871 17919 1546 1 4 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.310 0.400 17919 1547 1 4 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.311 -0.941 17919 1548 1 4 . 1 1 56 56 LEU H H 56 8.140 8.140 8.217 -0.077 17919 1549 1 4 . 1 1 57 57 SER N N 57 113.330 113.330 113.091 0.239 17919 1550 1 4 . 1 1 57 57 SER HA H 57 4.370 4.370 4.270 0.100 17919 1551 1 4 . 1 1 57 57 SER C C 57 178.310 178.310 176.212 2.098 17919 1552 1 4 . 1 1 57 57 SER CA C 57 61.080 61.080 60.529 0.551 17919 1553 1 4 . 1 1 57 57 SER CB C 57 62.530 62.530 62.619 -0.089 17919 1554 1 4 . 1 1 57 57 SER H H 57 8.470 8.470 7.832 0.638 17919 1555 1 4 . 1 1 58 58 ASP N N 58 124.190 124.190 123.012 1.178 17919 1556 1 4 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.220 0.076 17919 1557 1 4 . 1 1 58 58 ASP C C 58 177.400 177.400 176.538 0.862 17919 1558 1 4 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.955 0.225 17919 1559 1 4 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.022 0.078 17919 1560 1 4 . 1 1 58 58 ASP H H 58 7.930 7.930 7.751 0.179 17919 1561 1 4 . 1 1 59 59 TYR N N 59 115.510 115.510 113.284 2.226 17919 1562 1 4 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.684 -0.014 17919 1563 1 4 . 1 1 59 59 TYR C C 59 174.700 174.700 175.238 -0.538 17919 1564 1 4 . 1 1 59 59 TYR CA C 59 58.250 58.250 55.987 2.263 17919 1565 1 4 . 1 1 59 59 TYR CB C 59 40.070 40.070 39.051 1.019 17919 1566 1 4 . 1 1 59 59 TYR H H 59 7.250 7.250 7.054 0.196 17919 1567 1 4 . 1 1 60 60 ASN N N 60 115.900 115.900 118.961 -3.061 17919 1568 1 4 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.384 -0.029 17919 1569 1 4 . 1 1 60 60 ASN C C 60 174.340 174.340 174.296 0.044 17919 1570 1 4 . 1 1 60 60 ASN CA C 60 54.120 54.120 53.759 0.361 17919 1571 1 4 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.416 -0.006 17919 1572 1 4 . 1 1 60 60 ASN H H 60 8.150 8.150 7.522 0.628 17919 1573 1 4 . 1 1 61 61 ILE N N 61 118.600 118.600 120.190 -1.590 17919 1574 1 4 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.772 -0.379 17919 1575 1 4 . 1 1 61 61 ILE C C 61 174.610 174.610 175.658 -1.048 17919 1576 1 4 . 1 1 61 61 ILE CA C 61 62.420 62.420 60.422 1.998 17919 1577 1 4 . 1 1 61 61 ILE CB C 61 36.740 36.740 35.998 0.743 17919 1578 1 4 . 1 1 61 61 ILE H H 61 7.250 7.250 8.107 -0.857 17919 1579 1 4 . 1 1 62 62 GLN N N 62 124.740 124.740 127.329 -2.589 17919 1580 1 4 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.534 -0.028 17919 1581 1 4 . 1 1 62 62 GLN C C 62 175.970 175.970 175.197 0.773 17919 1582 1 4 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.966 -0.306 17919 1583 1 4 . 1 1 62 62 GLN CB C 62 31.650 31.650 30.587 1.063 17919 1584 1 4 . 1 1 62 62 GLN H H 62 7.610 7.610 8.202 -0.592 17919 1585 1 4 . 1 1 63 63 LYS N N 63 120.300 120.300 119.955 0.345 17919 1586 1 4 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.104 -0.103 17919 1587 1 4 . 1 1 63 63 LYS C C 63 175.810 175.810 176.829 -1.019 17919 1588 1 4 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.470 0.320 17919 1589 1 4 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.977 0.673 17919 1590 1 4 . 1 1 63 63 LYS H H 63 8.490 8.490 8.344 0.146 17919 1591 1 4 . 1 1 64 64 GLU N N 64 113.950 113.950 118.418 -4.468 17919 1592 1 4 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.248 0.217 17919 1593 1 4 . 1 1 64 64 GLU C C 64 175.250 175.250 175.271 -0.021 17919 1594 1 4 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.733 0.157 17919 1595 1 4 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.327 -2.427 17919 1596 1 4 . 1 1 64 64 GLU H H 64 9.280 9.280 8.532 0.748 17919 1597 1 4 . 1 1 65 65 SER N N 65 114.730 114.730 112.830 1.900 17919 1598 1 4 . 1 1 65 65 SER HA H 65 4.640 4.640 4.780 -0.140 17919 1599 1 4 . 1 1 65 65 SER C C 65 172.160 172.160 173.099 -0.939 17919 1600 1 4 . 1 1 65 65 SER CA C 65 60.890 60.890 57.339 3.551 17919 1601 1 4 . 1 1 65 65 SER CB C 65 64.910 64.910 65.027 -0.117 17919 1602 1 4 . 1 1 65 65 SER H H 65 7.670 7.670 7.390 0.280 17919 1603 1 4 . 1 1 66 66 THR N N 66 117.110 117.110 117.388 -0.278 17919 1604 1 4 . 1 1 66 66 THR HA H 66 5.270 5.270 5.235 0.035 17919 1605 1 4 . 1 1 66 66 THR C C 66 173.950 173.950 173.736 0.214 17919 1606 1 4 . 1 1 66 66 THR CA C 66 62.340 62.340 61.955 0.385 17919 1607 1 4 . 1 1 66 66 THR CB C 66 70.080 70.080 70.911 -0.831 17919 1608 1 4 . 1 1 66 66 THR H H 66 8.730 8.730 8.550 0.180 17919 1609 1 4 . 1 1 67 67 LEU N N 67 127.110 127.110 126.486 0.624 17919 1610 1 4 . 1 1 67 67 LEU HA H 67 5.060 5.060 5.384 -0.324 17919 1611 1 4 . 1 1 67 67 LEU C C 67 175.770 175.770 175.663 0.107 17919 1612 1 4 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.640 0.260 17919 1613 1 4 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.435 -0.175 17919 1614 1 4 . 1 1 67 67 LEU H H 67 9.410 9.410 9.099 0.311 17919 1615 1 4 . 1 1 68 68 HIS N N 68 118.380 118.380 119.477 -1.097 17919 1616 1 4 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.342 -0.102 17919 1617 1 4 . 1 1 68 68 HIS C C 68 173.150 173.150 173.532 -0.382 17919 1618 1 4 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.358 0.643 17919 1619 1 4 . 1 1 68 68 HIS CB C 68 30.530 30.530 33.987 -3.457 17919 1620 1 4 . 1 1 68 68 HIS H H 68 9.230 9.230 8.702 0.528 17919 1621 1 4 . 1 1 69 69 LEU N N 69 124.460 124.460 123.810 0.650 17919 1622 1 4 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.355 -0.165 17919 1623 1 4 . 1 1 69 69 LEU C C 69 175.270 175.270 174.145 1.125 17919 1624 1 4 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.599 0.291 17919 1625 1 4 . 1 1 69 69 LEU CB C 69 44.380 44.380 45.917 -1.537 17919 1626 1 4 . 1 1 69 69 LEU H H 69 8.340 8.340 7.486 0.854 17919 1627 1 4 . 1 1 70 70 VAL N N 70 126.940 126.940 123.434 3.506 17919 1628 1 4 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.501 -0.151 17919 1629 1 4 . 1 1 70 70 VAL C C 70 174.000 174.000 173.437 0.563 17919 1630 1 4 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.459 1.341 17919 1631 1 4 . 1 1 70 70 VAL CB C 70 34.910 34.910 36.181 -1.271 17919 1632 1 4 . 1 1 70 70 VAL H H 70 9.200 9.200 8.337 0.863 17919 1633 1 4 . 1 1 71 71 LEU N N 71 123.130 123.130 124.021 -0.891 17919 1634 1 4 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.847 0.213 17919 1635 1 4 . 1 1 71 71 LEU C C 71 177.830 177.830 177.402 0.428 17919 1636 1 4 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.895 0.045 17919 1637 1 4 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.939 -0.089 17919 1638 1 4 . 1 1 71 71 LEU H H 71 8.120 8.120 8.402 -0.282 17919 1639 1 4 . 1 1 72 72 ARG N N 72 123.490 123.490 123.423 0.067 17919 1640 1 4 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.159 0.142 17919 1641 1 4 . 1 1 72 72 ARG C C 72 175.350 175.350 175.825 -0.475 17919 1642 1 4 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.179 -0.569 17919 1643 1 4 . 1 1 72 72 ARG CB C 72 31.350 31.350 31.268 0.082 17919 1644 1 4 . 1 1 72 72 ARG H H 72 8.580 8.580 7.969 0.611 17919 1645 1 5 . 1 1 2 2 GLN N N 2 123.220 123.220 120.348 2.872 17919 1646 1 5 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.249 0.000 17919 1647 1 5 . 1 1 2 2 GLN C C 2 175.920 175.920 174.250 1.670 17919 1648 1 5 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.354 0.726 17919 1649 1 5 . 1 1 2 2 GLN CB C 2 30.760 30.760 31.851 -1.091 17919 1650 1 5 . 1 1 2 2 GLN H H 2 8.900 8.900 8.294 0.606 17919 1651 1 5 . 1 1 3 3 ILE N N 3 115.340 115.340 118.914 -3.574 17919 1652 1 5 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.718 -0.505 17919 1653 1 5 . 1 1 3 3 ILE C C 3 172.450 172.450 173.405 -0.955 17919 1654 1 5 . 1 1 3 3 ILE CA C 3 59.570 59.570 58.923 0.647 17919 1655 1 5 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.044 1.167 17919 1656 1 5 . 1 1 3 3 ILE H H 3 8.320 8.320 7.773 0.547 17919 1657 1 5 . 1 1 4 4 PHE N N 4 118.110 118.110 119.001 -0.891 17919 1658 1 5 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.139 0.491 17919 1659 1 5 . 1 1 4 4 PHE C C 4 175.320 175.320 174.907 0.413 17919 1660 1 5 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.764 -0.554 17919 1661 1 5 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.358 0.122 17919 1662 1 5 . 1 1 4 4 PHE H H 4 8.610 8.610 7.822 0.788 17919 1663 1 5 . 1 1 5 5 VAL N N 5 121.000 121.000 124.754 -3.754 17919 1664 1 5 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.617 0.108 17919 1665 1 5 . 1 1 5 5 VAL C C 5 174.870 174.870 174.721 0.149 17919 1666 1 5 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.832 -1.212 17919 1667 1 5 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.065 1.165 17919 1668 1 5 . 1 1 5 5 VAL H H 5 9.300 9.300 8.740 0.560 17919 1669 1 5 . 1 1 6 6 LYS N N 6 127.520 127.520 129.256 -1.736 17919 1670 1 5 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.413 -0.046 17919 1671 1 5 . 1 1 6 6 LYS C C 6 177.140 177.140 176.131 1.009 17919 1672 1 5 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.220 0.300 17919 1673 1 5 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.138 -0.088 17919 1674 1 5 . 1 1 6 6 LYS H H 6 8.820 8.820 9.159 -0.339 17919 1675 1 5 . 1 1 7 7 THR N N 7 115.400 115.400 118.385 -2.985 17919 1676 1 5 . 1 1 7 7 THR HA H 7 4.970 4.970 4.620 0.350 17919 1677 1 5 . 1 1 7 7 THR C C 7 176.910 176.910 176.554 0.356 17919 1678 1 5 . 1 1 7 7 THR CA C 7 60.470 60.470 60.719 -0.249 17919 1679 1 5 . 1 1 7 7 THR CB C 7 70.630 70.630 70.517 0.113 17919 1680 1 5 . 1 1 7 7 THR H H 7 8.730 8.730 8.237 0.493 17919 1681 1 5 . 1 1 8 8 LEU N N 8 121.330 121.330 123.466 -2.136 17919 1682 1 5 . 1 1 8 8 LEU HA H 8 4.310 4.310 3.951 0.359 17919 1683 1 5 . 1 1 8 8 LEU C C 8 178.800 178.800 177.998 0.802 17919 1684 1 5 . 1 1 8 8 LEU CA C 8 57.580 57.580 58.002 -0.422 17919 1685 1 5 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.383 0.587 17919 1686 1 5 . 1 1 8 8 LEU H H 8 9.100 9.100 8.159 0.941 17919 1687 1 5 . 1 1 9 9 THR N N 9 105.590 105.590 105.822 -0.232 17919 1688 1 5 . 1 1 9 9 THR HA H 9 4.428 4.428 4.314 0.114 17919 1689 1 5 . 1 1 9 9 THR C C 9 175.520 175.520 175.621 -0.101 17919 1690 1 5 . 1 1 9 9 THR CA C 9 61.400 61.400 61.930 -0.530 17919 1691 1 5 . 1 1 9 9 THR CB C 9 69.140 69.140 68.583 0.557 17919 1692 1 5 . 1 1 9 9 THR H H 9 7.630 7.630 7.647 -0.017 17919 1693 1 5 . 1 1 10 10 GLY N N 10 108.890 108.890 111.306 -2.416 17919 1694 1 5 . 1 1 10 10 GLY C C 10 174.070 174.070 173.883 0.187 17919 1695 1 5 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.932 0.528 17919 1696 1 5 . 1 1 10 10 GLY H H 10 7.810 7.810 8.134 -0.324 17919 1697 1 5 . 1 1 11 11 LYS N N 11 121.600 121.600 123.065 -1.465 17919 1698 1 5 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.447 -0.086 17919 1699 1 5 . 1 1 11 11 LYS C C 11 175.940 175.940 175.185 0.755 17919 1700 1 5 . 1 1 11 11 LYS CA C 11 56.280 56.280 55.969 0.311 17919 1701 1 5 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.550 -0.350 17919 1702 1 5 . 1 1 11 11 LYS H H 11 7.280 7.280 7.658 -0.378 17919 1703 1 5 . 1 1 12 12 THR N N 12 120.440 120.440 120.906 -0.466 17919 1704 1 5 . 1 1 12 12 THR HA H 12 5.046 5.046 4.938 0.108 17919 1705 1 5 . 1 1 12 12 THR C C 12 174.320 174.320 174.546 -0.226 17919 1706 1 5 . 1 1 12 12 THR CA C 12 62.390 62.390 61.891 0.499 17919 1707 1 5 . 1 1 12 12 THR CB C 12 69.910 69.910 69.560 0.350 17919 1708 1 5 . 1 1 12 12 THR H H 12 8.650 8.650 8.406 0.244 17919 1709 1 5 . 1 1 13 13 ILE N N 13 127.110 127.110 129.391 -2.281 17919 1710 1 5 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.454 0.090 17919 1711 1 5 . 1 1 13 13 ILE C C 13 175.220 175.220 175.360 -0.140 17919 1712 1 5 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.569 -0.590 17919 1713 1 5 . 1 1 13 13 ILE CB C 13 40.950 40.950 38.676 2.274 17919 1714 1 5 . 1 1 13 13 ILE H H 13 9.450 9.450 9.050 0.400 17919 1715 1 5 . 1 1 14 14 THR N N 14 121.520 121.520 124.095 -2.575 17919 1716 1 5 . 1 1 14 14 THR HA H 14 4.964 4.964 4.467 0.497 17919 1717 1 5 . 1 1 14 14 THR C C 14 173.790 173.790 173.951 -0.161 17919 1718 1 5 . 1 1 14 14 THR CA C 14 61.940 61.940 62.804 -0.864 17919 1719 1 5 . 1 1 14 14 THR CB C 14 69.650 69.650 69.679 -0.029 17919 1720 1 5 . 1 1 14 14 THR H H 14 8.710 8.710 8.601 0.109 17919 1721 1 5 . 1 1 15 15 LEU N N 15 124.800 124.800 127.955 -3.155 17919 1722 1 5 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.765 0.015 17919 1723 1 5 . 1 1 15 15 LEU C C 15 174.670 174.670 174.857 -0.187 17919 1724 1 5 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.563 -0.733 17919 1725 1 5 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.430 1.640 17919 1726 1 5 . 1 1 15 15 LEU H H 15 8.710 8.710 8.003 0.707 17919 1727 1 5 . 1 1 16 16 GLU N N 16 122.160 122.160 124.743 -2.583 17919 1728 1 5 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.063 -0.146 17919 1729 1 5 . 1 1 16 16 GLU C C 16 175.860 175.860 175.801 0.059 17919 1730 1 5 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.401 -0.581 17919 1731 1 5 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.764 -1.314 17919 1732 1 5 . 1 1 16 16 GLU H H 16 8.140 8.140 8.605 -0.465 17919 1733 1 5 . 1 1 17 17 VAL N N 17 117.210 117.210 121.656 -4.446 17919 1734 1 5 . 1 1 17 17 VAL HA H 17 4.714 4.714 5.141 -0.427 17919 1735 1 5 . 1 1 17 17 VAL C C 17 174.160 174.160 174.711 -0.551 17919 1736 1 5 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.744 -0.314 17919 1737 1 5 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.797 0.603 17919 1738 1 5 . 1 1 17 17 VAL H H 17 8.900 8.900 8.908 -0.008 17919 1739 1 5 . 1 1 18 18 GLU N N 18 118.990 118.990 120.051 -1.061 17919 1740 1 5 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.922 0.157 17919 1741 1 5 . 1 1 18 18 GLU C C 18 176.160 176.160 175.119 1.041 17919 1742 1 5 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.101 -0.381 17919 1743 1 5 . 1 1 18 18 GLU CB C 18 30.310 30.310 32.998 -2.688 17919 1744 1 5 . 1 1 18 18 GLU H H 18 8.640 8.640 8.428 0.213 17919 1745 1 5 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.310 -0.169 17919 1746 1 5 . 1 1 19 19 PRO C C 19 175.310 175.310 177.969 -2.659 17919 1747 1 5 . 1 1 19 19 PRO CA C 19 65.470 65.470 64.921 0.549 17919 1748 1 5 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.896 0.054 17919 1749 1 5 . 1 1 20 20 SER N N 20 103.400 103.400 112.456 -9.056 17919 1750 1 5 . 1 1 20 20 SER HA H 20 4.370 4.370 4.231 0.139 17919 1751 1 5 . 1 1 20 20 SER C C 20 174.660 174.660 174.508 0.152 17919 1752 1 5 . 1 1 20 20 SER CA C 20 57.400 57.400 60.507 -3.107 17919 1753 1 5 . 1 1 20 20 SER CB C 20 63.370 63.370 63.000 0.370 17919 1754 1 5 . 1 1 20 20 SER H H 20 7.040 7.040 8.298 -1.258 17919 1755 1 5 . 1 1 21 21 ASP N N 21 123.480 123.480 122.544 0.936 17919 1756 1 5 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.629 0.066 17919 1757 1 5 . 1 1 21 21 ASP C C 21 176.360 176.360 176.050 0.310 17919 1758 1 5 . 1 1 21 21 ASP CA C 21 55.700 55.700 56.121 -0.421 17919 1759 1 5 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.628 -0.828 17919 1760 1 5 . 1 1 21 21 ASP H H 21 8.030 8.030 7.697 0.333 17919 1761 1 5 . 1 1 22 22 THR N N 22 108.800 108.800 114.027 -5.227 17919 1762 1 5 . 1 1 22 22 THR HA H 22 4.920 4.920 4.649 0.271 17919 1763 1 5 . 1 1 22 22 THR C C 22 176.750 176.750 176.308 0.442 17919 1764 1 5 . 1 1 22 22 THR CA C 22 59.690 59.690 61.626 -1.936 17919 1765 1 5 . 1 1 22 22 THR CB C 22 71.200 71.200 70.110 1.090 17919 1766 1 5 . 1 1 22 22 THR H H 22 7.900 7.900 8.619 -0.719 17919 1767 1 5 . 1 1 23 23 ILE N N 23 121.190 121.190 121.688 -0.498 17919 1768 1 5 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.765 -0.108 17919 1769 1 5 . 1 1 23 23 ILE C C 23 179.040 179.040 177.712 1.328 17919 1770 1 5 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.742 -1.482 17919 1771 1 5 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.883 -2.533 17919 1772 1 5 . 1 1 23 23 ILE H H 23 8.560 8.560 9.046 -0.486 17919 1773 1 5 . 1 1 24 24 GLU N N 24 120.830 120.830 119.357 1.473 17919 1774 1 5 . 1 1 24 24 GLU HA H 24 3.917 3.917 4.139 -0.222 17919 1775 1 5 . 1 1 24 24 GLU C C 24 178.640 178.640 177.903 0.737 17919 1776 1 5 . 1 1 24 24 GLU CA C 24 60.220 60.220 58.357 1.863 17919 1777 1 5 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.596 -1.316 17919 1778 1 5 . 1 1 24 24 GLU H H 24 9.760 9.760 8.025 1.735 17919 1779 1 5 . 1 1 25 25 ASN N N 25 120.570 120.570 118.231 2.339 17919 1780 1 5 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.559 -0.034 17919 1781 1 5 . 1 1 25 25 ASN C C 25 178.380 178.380 177.223 1.157 17919 1782 1 5 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.691 0.369 17919 1783 1 5 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.631 -0.181 17919 1784 1 5 . 1 1 25 25 ASN H H 25 7.920 7.920 7.707 0.213 17919 1785 1 5 . 1 1 26 26 VAL N N 26 121.710 121.710 120.019 1.691 17919 1786 1 5 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.529 -0.132 17919 1787 1 5 . 1 1 26 26 VAL C C 26 177.950 177.950 177.309 0.641 17919 1788 1 5 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.917 0.743 17919 1789 1 5 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.173 -0.333 17919 1790 1 5 . 1 1 26 26 VAL H H 26 8.070 8.070 8.123 -0.053 17919 1791 1 5 . 1 1 27 27 LYS N N 27 118.860 118.860 118.926 -0.066 17919 1792 1 5 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.079 0.501 17919 1793 1 5 . 1 1 27 27 LYS C C 27 180.550 180.550 178.724 1.826 17919 1794 1 5 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.112 0.138 17919 1795 1 5 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.230 1.500 17919 1796 1 5 . 1 1 27 27 LYS H H 27 8.560 8.560 7.399 1.161 17919 1797 1 5 . 1 1 28 28 ALA N N 28 123.440 123.440 121.477 1.963 17919 1798 1 5 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.092 0.068 17919 1799 1 5 . 1 1 28 28 ALA C C 28 180.300 180.300 179.008 1.292 17919 1800 1 5 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.768 0.602 17919 1801 1 5 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.295 -0.585 17919 1802 1 5 . 1 1 28 28 ALA H H 28 8.060 8.060 7.852 0.208 17919 1803 1 5 . 1 1 29 29 LYS N N 29 119.940 119.940 120.054 -0.114 17919 1804 1 5 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.014 0.193 17919 1805 1 5 . 1 1 29 29 LYS C C 29 180.320 180.320 178.751 1.569 17919 1806 1 5 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.258 0.392 17919 1807 1 5 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.312 0.978 17919 1808 1 5 . 1 1 29 29 LYS H H 29 7.850 7.850 7.581 0.269 17919 1809 1 5 . 1 1 30 30 ILE N N 30 121.080 121.080 120.198 0.882 17919 1810 1 5 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.495 0.012 17919 1811 1 5 . 1 1 30 30 ILE C C 30 178.310 178.310 177.600 0.710 17919 1812 1 5 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.639 0.511 17919 1813 1 5 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.412 -0.612 17919 1814 1 5 . 1 1 30 30 ILE H H 30 8.280 8.280 8.157 0.123 17919 1815 1 5 . 1 1 31 31 GLN N N 31 123.490 123.490 119.444 4.046 17919 1816 1 5 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.879 -0.050 17919 1817 1 5 . 1 1 31 31 GLN C C 31 178.890 178.890 178.095 0.795 17919 1818 1 5 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.377 0.623 17919 1819 1 5 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.229 -0.509 17919 1820 1 5 . 1 1 31 31 GLN H H 31 8.580 8.580 7.829 0.751 17919 1821 1 5 . 1 1 32 32 ASP N N 32 119.360 119.360 119.829 -0.469 17919 1822 1 5 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.380 -0.026 17919 1823 1 5 . 1 1 32 32 ASP C C 32 177.250 177.250 178.119 -0.869 17919 1824 1 5 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.942 0.248 17919 1825 1 5 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.623 -0.043 17919 1826 1 5 . 1 1 32 32 ASP H H 32 8.010 8.010 7.770 0.240 17919 1827 1 5 . 1 1 33 33 LYS N N 33 115.130 115.130 118.837 -3.707 17919 1828 1 5 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.238 0.099 17919 1829 1 5 . 1 1 33 33 LYS C C 33 177.870 177.870 178.460 -0.590 17919 1830 1 5 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.133 -0.083 17919 1831 1 5 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.141 1.029 17919 1832 1 5 . 1 1 33 33 LYS H H 33 7.430 7.430 7.791 -0.361 17919 1833 1 5 . 1 1 34 34 GLU N N 34 113.870 113.870 114.568 -0.698 17919 1834 1 5 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.480 0.145 17919 1835 1 5 . 1 1 34 34 GLU C C 34 177.840 177.840 177.371 0.469 17919 1836 1 5 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.746 -0.576 17919 1837 1 5 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.623 1.037 17919 1838 1 5 . 1 1 34 34 GLU H H 34 8.740 8.740 8.021 0.719 17919 1839 1 5 . 1 1 35 35 GLY N N 35 108.650 108.650 109.608 -0.958 17919 1840 1 5 . 1 1 35 35 GLY C C 35 173.960 173.960 174.178 -0.218 17919 1841 1 5 . 1 1 35 35 GLY CA C 35 46.080 46.080 46.285 -0.205 17919 1842 1 5 . 1 1 35 35 GLY H H 35 8.530 8.530 8.577 -0.047 17919 1843 1 5 . 1 1 36 36 ILE N N 36 119.880 119.880 122.310 -2.430 17919 1844 1 5 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.346 0.099 17919 1845 1 5 . 1 1 36 36 ILE C C 36 173.590 173.590 174.324 -0.734 17919 1846 1 5 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.875 -0.125 17919 1847 1 5 . 1 1 36 36 ILE CB C 36 40.580 40.580 39.145 1.435 17919 1848 1 5 . 1 1 36 36 ILE H H 36 6.150 6.150 7.651 -1.501 17919 1849 1 5 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.881 -0.247 17919 1850 1 5 . 1 1 37 37 PRO C C 37 176.940 176.940 175.932 1.008 17919 1851 1 5 . 1 1 37 37 PRO CA C 37 61.660 61.660 60.840 0.820 17919 1852 1 5 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.591 0.259 17919 1853 1 5 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.137 -0.020 17919 1854 1 5 . 1 1 38 38 PRO C C 38 178.320 178.320 178.715 -0.395 17919 1855 1 5 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.686 0.574 17919 1856 1 5 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.895 0.995 17919 1857 1 5 . 1 1 39 39 ASP N N 39 113.380 113.380 117.449 -4.069 17919 1858 1 5 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.232 0.198 17919 1859 1 5 . 1 1 39 39 ASP C C 39 177.090 177.090 178.338 -1.248 17919 1860 1 5 . 1 1 39 39 ASP CA C 39 55.640 55.640 57.174 -1.534 17919 1861 1 5 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.498 -0.958 17919 1862 1 5 . 1 1 39 39 ASP H H 39 8.550 8.550 8.711 -0.161 17919 1863 1 5 . 1 1 40 40 GLN N N 40 116.780 116.780 117.147 -0.367 17919 1864 1 5 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.119 0.345 17919 1865 1 5 . 1 1 40 40 GLN C C 40 175.380 175.380 176.875 -1.495 17919 1866 1 5 . 1 1 40 40 GLN CA C 40 55.640 55.640 57.091 -1.451 17919 1867 1 5 . 1 1 40 40 GLN CB C 40 30.140 30.140 28.984 1.156 17919 1868 1 5 . 1 1 40 40 GLN H H 40 7.820 7.820 8.113 -0.293 17919 1869 1 5 . 1 1 41 41 GLN N N 41 117.720 117.720 118.811 -1.091 17919 1870 1 5 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.266 -0.022 17919 1871 1 5 . 1 1 41 41 GLN C C 41 176.300 176.300 175.760 0.540 17919 1872 1 5 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.215 0.255 17919 1873 1 5 . 1 1 41 41 GLN CB C 41 31.650 31.650 28.560 3.090 17919 1874 1 5 . 1 1 41 41 GLN H H 41 7.480 7.480 7.475 0.005 17919 1875 1 5 . 1 1 42 42 ARG N N 42 122.680 122.680 125.497 -2.817 17919 1876 1 5 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.504 -0.004 17919 1877 1 5 . 1 1 42 42 ARG C C 42 174.050 174.050 174.698 -0.648 17919 1878 1 5 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.108 -0.058 17919 1879 1 5 . 1 1 42 42 ARG CB C 42 31.750 31.750 31.610 0.140 17919 1880 1 5 . 1 1 42 42 ARG H H 42 8.530 8.530 8.015 0.515 17919 1881 1 5 . 1 1 43 43 LEU N N 43 124.040 124.040 126.456 -2.416 17919 1882 1 5 . 1 1 43 43 LEU C C 43 175.290 175.290 175.743 -0.453 17919 1883 1 5 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.677 -0.697 17919 1884 1 5 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.934 1.856 17919 1885 1 5 . 1 1 43 43 LEU H H 43 8.820 8.820 8.691 0.129 17919 1886 1 5 . 1 1 44 44 ILE N N 44 121.920 121.920 123.812 -1.892 17919 1887 1 5 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.156 -0.164 17919 1888 1 5 . 1 1 44 44 ILE C C 44 176.060 176.060 174.867 1.193 17919 1889 1 5 . 1 1 44 44 ILE CA C 44 58.980 58.980 58.452 0.528 17919 1890 1 5 . 1 1 44 44 ILE CB C 44 41.420 41.420 39.167 2.253 17919 1891 1 5 . 1 1 44 44 ILE H H 44 9.030 9.030 8.490 0.540 17919 1892 1 5 . 1 1 45 45 PHE N N 45 125.390 125.390 127.908 -2.518 17919 1893 1 5 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.886 0.159 17919 1894 1 5 . 1 1 45 45 PHE C C 45 174.470 174.470 174.526 -0.056 17919 1895 1 5 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.365 0.654 17919 1896 1 5 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.200 0.560 17919 1897 1 5 . 1 1 45 45 PHE H H 45 8.830 8.830 8.348 0.482 17919 1898 1 5 . 1 1 46 46 ALA N N 46 132.200 132.200 126.197 6.003 17919 1899 1 5 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.504 0.186 17919 1900 1 5 . 1 1 46 46 ALA C C 46 177.290 177.290 177.836 -0.546 17919 1901 1 5 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.516 0.025 17919 1902 1 5 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.693 -0.123 17919 1903 1 5 . 1 1 46 46 ALA H H 46 8.810 8.810 7.679 1.131 17919 1904 1 5 . 1 1 47 47 GLY N N 47 102.340 102.340 104.149 -1.809 17919 1905 1 5 . 1 1 47 47 GLY C C 47 173.810 173.810 174.242 -0.432 17919 1906 1 5 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.971 0.379 17919 1907 1 5 . 1 1 47 47 GLY H H 47 8.130 8.130 8.265 -0.135 17919 1908 1 5 . 1 1 48 48 LYS N N 48 121.570 121.570 119.931 1.639 17919 1909 1 5 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.732 -0.110 17919 1910 1 5 . 1 1 48 48 LYS C C 48 174.700 174.700 174.640 0.060 17919 1911 1 5 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.205 -0.655 17919 1912 1 5 . 1 1 48 48 LYS CB C 48 34.530 34.530 35.490 -0.960 17919 1913 1 5 . 1 1 48 48 LYS H H 48 7.980 7.980 7.880 0.100 17919 1914 1 5 . 1 1 49 49 GLN N N 49 122.410 122.410 123.107 -0.697 17919 1915 1 5 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.852 -0.292 17919 1916 1 5 . 1 1 49 49 GLN C C 49 175.670 175.670 175.397 0.273 17919 1917 1 5 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.331 0.409 17919 1918 1 5 . 1 1 49 49 GLN CB C 49 29.000 29.000 30.061 -1.061 17919 1919 1 5 . 1 1 49 49 GLN H H 49 8.600 8.600 8.512 0.088 17919 1920 1 5 . 1 1 50 50 LEU N N 50 125.520 125.520 128.057 -2.537 17919 1921 1 5 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.491 -0.401 17919 1922 1 5 . 1 1 50 50 LEU C C 50 176.660 176.660 176.470 0.190 17919 1923 1 5 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.102 0.138 17919 1924 1 5 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.752 -1.182 17919 1925 1 5 . 1 1 50 50 LEU H H 50 8.530 8.530 8.123 0.407 17919 1926 1 5 . 1 1 51 51 GLU N N 51 122.940 122.940 124.406 -1.466 17919 1927 1 5 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.274 0.214 17919 1928 1 5 . 1 1 51 51 GLU C C 51 175.870 175.870 177.406 -1.536 17919 1929 1 5 . 1 1 51 51 GLU CA C 51 55.960 55.960 57.145 -1.185 17919 1930 1 5 . 1 1 51 51 GLU CB C 51 31.570 31.570 30.061 1.509 17919 1931 1 5 . 1 1 51 51 GLU H H 51 8.400 8.400 8.596 -0.196 17919 1932 1 5 . 1 1 52 52 ASP N N 52 120.030 120.030 125.997 -5.967 17919 1933 1 5 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.378 -0.019 17919 1934 1 5 . 1 1 52 52 ASP C C 52 177.330 177.330 178.374 -1.044 17919 1935 1 5 . 1 1 52 52 ASP CA C 52 56.960 56.960 58.134 -1.174 17919 1936 1 5 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.783 0.067 17919 1937 1 5 . 1 1 52 52 ASP H H 52 8.160 8.160 8.875 -0.715 17919 1938 1 5 . 1 1 53 53 GLY N N 53 106.660 106.660 104.844 1.816 17919 1939 1 5 . 1 1 53 53 GLY C C 53 174.870 174.870 174.451 0.419 17919 1940 1 5 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.056 0.114 17919 1941 1 5 . 1 1 53 53 GLY H H 53 9.390 9.390 8.302 1.088 17919 1942 1 5 . 1 1 54 54 ARG N N 54 119.050 119.050 121.388 -2.338 17919 1943 1 5 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.456 0.239 17919 1944 1 5 . 1 1 54 54 ARG C C 54 175.350 175.350 175.393 -0.043 17919 1945 1 5 . 1 1 54 54 ARG CA C 54 54.390 54.390 55.984 -1.595 17919 1946 1 5 . 1 1 54 54 ARG CB C 54 32.650 32.650 31.623 1.027 17919 1947 1 5 . 1 1 54 54 ARG H H 54 7.460 7.460 7.456 0.004 17919 1948 1 5 . 1 1 55 55 THR N N 55 108.400 108.400 114.238 -5.838 17919 1949 1 5 . 1 1 55 55 THR HA H 55 5.240 5.240 4.946 0.294 17919 1950 1 5 . 1 1 55 55 THR C C 55 176.560 176.560 175.206 1.354 17919 1951 1 5 . 1 1 55 55 THR CA C 55 59.690 59.690 60.260 -0.570 17919 1952 1 5 . 1 1 55 55 THR CB C 55 72.260 72.260 71.611 0.649 17919 1953 1 5 . 1 1 55 55 THR H H 55 8.730 8.730 8.129 0.601 17919 1954 1 5 . 1 1 56 56 LEU N N 56 117.920 117.920 122.879 -4.959 17919 1955 1 5 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.180 -0.120 17919 1956 1 5 . 1 1 56 56 LEU C C 56 180.810 180.810 178.842 1.968 17919 1957 1 5 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.414 0.296 17919 1958 1 5 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.449 -1.079 17919 1959 1 5 . 1 1 56 56 LEU H H 56 8.140 8.140 8.538 -0.398 17919 1960 1 5 . 1 1 57 57 SER N N 57 113.330 113.330 113.979 -0.649 17919 1961 1 5 . 1 1 57 57 SER HA H 57 4.370 4.370 4.067 0.303 17919 1962 1 5 . 1 1 57 57 SER C C 57 178.310 178.310 176.726 1.584 17919 1963 1 5 . 1 1 57 57 SER CA C 57 61.080 61.080 61.184 -0.104 17919 1964 1 5 . 1 1 57 57 SER CB C 57 62.530 62.530 62.548 -0.018 17919 1965 1 5 . 1 1 57 57 SER H H 57 8.470 8.470 7.738 0.732 17919 1966 1 5 . 1 1 58 58 ASP N N 58 124.190 124.190 122.412 1.778 17919 1967 1 5 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.340 -0.044 17919 1968 1 5 . 1 1 58 58 ASP C C 58 177.400 177.400 177.148 0.252 17919 1969 1 5 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.585 0.595 17919 1970 1 5 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.787 -0.687 17919 1971 1 5 . 1 1 58 58 ASP H H 58 7.930 7.930 8.179 -0.249 17919 1972 1 5 . 1 1 59 59 TYR N N 59 115.510 115.510 115.855 -0.345 17919 1973 1 5 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.604 0.066 17919 1974 1 5 . 1 1 59 59 TYR C C 59 174.700 174.700 175.252 -0.552 17919 1975 1 5 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.655 0.595 17919 1976 1 5 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.073 1.997 17919 1977 1 5 . 1 1 59 59 TYR H H 59 7.250 7.250 7.367 -0.117 17919 1978 1 5 . 1 1 60 60 ASN N N 60 115.900 115.900 115.651 0.249 17919 1979 1 5 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.385 -0.030 17919 1980 1 5 . 1 1 60 60 ASN C C 60 174.340 174.340 174.597 -0.257 17919 1981 1 5 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.404 -0.284 17919 1982 1 5 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.978 -0.568 17919 1983 1 5 . 1 1 60 60 ASN H H 60 8.150 8.150 7.989 0.161 17919 1984 1 5 . 1 1 61 61 ILE N N 61 118.600 118.600 120.541 -1.941 17919 1985 1 5 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.747 -0.354 17919 1986 1 5 . 1 1 61 61 ILE C C 61 174.610 174.610 175.250 -0.640 17919 1987 1 5 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.965 -0.545 17919 1988 1 5 . 1 1 61 61 ILE CB C 61 36.740 36.740 36.696 0.044 17919 1989 1 5 . 1 1 61 61 ILE H H 61 7.250 7.250 8.191 -0.941 17919 1990 1 5 . 1 1 62 62 GLN N N 62 124.740 124.740 126.297 -1.557 17919 1991 1 5 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.620 -0.114 17919 1992 1 5 . 1 1 62 62 GLN C C 62 175.970 175.970 175.703 0.267 17919 1993 1 5 . 1 1 62 62 GLN CA C 62 53.660 53.660 54.148 -0.488 17919 1994 1 5 . 1 1 62 62 GLN CB C 62 31.650 31.650 32.185 -0.535 17919 1995 1 5 . 1 1 62 62 GLN H H 62 7.610 7.610 8.058 -0.448 17919 1996 1 5 . 1 1 63 63 LYS N N 63 120.300 120.300 119.689 0.611 17919 1997 1 5 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.980 0.021 17919 1998 1 5 . 1 1 63 63 LYS C C 63 175.810 175.810 176.514 -0.704 17919 1999 1 5 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.020 -0.230 17919 2000 1 5 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.238 0.412 17919 2001 1 5 . 1 1 63 63 LYS H H 63 8.490 8.490 8.438 0.052 17919 2002 1 5 . 1 1 64 64 GLU N N 64 113.950 113.950 118.824 -4.874 17919 2003 1 5 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.979 -0.514 17919 2004 1 5 . 1 1 64 64 GLU C C 64 175.250 175.250 175.614 -0.364 17919 2005 1 5 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.781 0.109 17919 2006 1 5 . 1 1 64 64 GLU CB C 64 25.900 25.900 27.971 -2.071 17919 2007 1 5 . 1 1 64 64 GLU H H 64 9.280 9.280 8.652 0.628 17919 2008 1 5 . 1 1 65 65 SER N N 65 114.730 114.730 114.460 0.270 17919 2009 1 5 . 1 1 65 65 SER HA H 65 4.640 4.640 4.393 0.247 17919 2010 1 5 . 1 1 65 65 SER C C 65 172.160 172.160 173.745 -1.585 17919 2011 1 5 . 1 1 65 65 SER CA C 65 60.890 60.890 59.957 0.933 17919 2012 1 5 . 1 1 65 65 SER CB C 65 64.910 64.910 64.025 0.885 17919 2013 1 5 . 1 1 65 65 SER H H 65 7.670 7.670 7.518 0.152 17919 2014 1 5 . 1 1 66 66 THR N N 66 117.110 117.110 118.215 -1.105 17919 2015 1 5 . 1 1 66 66 THR HA H 66 5.270 5.270 5.051 0.219 17919 2016 1 5 . 1 1 66 66 THR C C 66 173.950 173.950 174.174 -0.224 17919 2017 1 5 . 1 1 66 66 THR CA C 66 62.340 62.340 61.753 0.587 17919 2018 1 5 . 1 1 66 66 THR CB C 66 70.080 70.080 70.099 -0.019 17919 2019 1 5 . 1 1 66 66 THR H H 66 8.730 8.730 8.193 0.537 17919 2020 1 5 . 1 1 67 67 LEU N N 67 127.110 127.110 127.182 -0.072 17919 2021 1 5 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.724 0.336 17919 2022 1 5 . 1 1 67 67 LEU C C 67 175.770 175.770 176.003 -0.233 17919 2023 1 5 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.707 0.193 17919 2024 1 5 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.941 0.319 17919 2025 1 5 . 1 1 67 67 LEU H H 67 9.410 9.410 8.964 0.446 17919 2026 1 5 . 1 1 68 68 HIS N N 68 118.380 118.380 120.304 -1.924 17919 2027 1 5 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.154 0.086 17919 2028 1 5 . 1 1 68 68 HIS C C 68 173.150 173.150 174.247 -1.097 17919 2029 1 5 . 1 1 68 68 HIS CA C 68 55.000 55.000 55.208 -0.208 17919 2030 1 5 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.623 -2.093 17919 2031 1 5 . 1 1 68 68 HIS H H 68 9.230 9.230 8.028 1.202 17919 2032 1 5 . 1 1 69 69 LEU N N 69 124.460 124.460 120.894 3.566 17919 2033 1 5 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.775 0.415 17919 2034 1 5 . 1 1 69 69 LEU C C 69 175.270 175.270 174.019 1.251 17919 2035 1 5 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.814 -0.924 17919 2036 1 5 . 1 1 69 69 LEU CB C 69 44.380 44.380 45.921 -1.541 17919 2037 1 5 . 1 1 69 69 LEU H H 69 8.340 8.340 7.665 0.675 17919 2038 1 5 . 1 1 70 70 VAL N N 70 126.940 126.940 126.232 0.708 17919 2039 1 5 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.323 0.027 17919 2040 1 5 . 1 1 70 70 VAL C C 70 174.000 174.000 174.537 -0.537 17919 2041 1 5 . 1 1 70 70 VAL CA C 70 60.800 60.800 61.007 -0.207 17919 2042 1 5 . 1 1 70 70 VAL CB C 70 34.910 34.910 32.884 2.026 17919 2043 1 5 . 1 1 70 70 VAL H H 70 9.200 9.200 7.957 1.243 17919 2044 1 5 . 1 1 71 71 LEU N N 71 123.130 123.130 129.082 -5.952 17919 2045 1 5 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.337 0.723 17919 2046 1 5 . 1 1 71 71 LEU C C 71 177.830 177.830 176.687 1.143 17919 2047 1 5 . 1 1 71 71 LEU CA C 71 53.940 53.940 54.186 -0.246 17919 2048 1 5 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.609 0.241 17919 2049 1 5 . 1 1 71 71 LEU H H 71 8.120 8.120 8.511 -0.391 17919 2050 1 5 . 1 1 72 72 ARG N N 72 123.490 123.490 126.542 -3.052 17919 2051 1 5 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.218 0.083 17919 2052 1 5 . 1 1 72 72 ARG C C 72 175.350 175.350 174.981 0.369 17919 2053 1 5 . 1 1 72 72 ARG CA C 72 55.610 55.610 57.106 -1.496 17919 2054 1 5 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.782 0.568 17919 2055 1 5 . 1 1 72 72 ARG H H 72 8.580 8.580 8.052 0.528 17919 2056 1 6 . 1 1 2 2 GLN N N 2 123.220 123.220 120.041 3.179 17919 2057 1 6 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.052 0.197 17919 2058 1 6 . 1 1 2 2 GLN C C 2 175.920 175.920 175.041 0.879 17919 2059 1 6 . 1 1 2 2 GLN CA C 2 55.080 55.080 55.113 -0.033 17919 2060 1 6 . 1 1 2 2 GLN CB C 2 30.760 30.760 29.869 0.891 17919 2061 1 6 . 1 1 2 2 GLN H H 2 8.900 8.900 8.493 0.407 17919 2062 1 6 . 1 1 3 3 ILE N N 3 115.340 115.340 115.394 -0.054 17919 2063 1 6 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.257 -0.044 17919 2064 1 6 . 1 1 3 3 ILE C C 3 172.450 172.450 173.776 -1.326 17919 2065 1 6 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.449 0.121 17919 2066 1 6 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.250 0.960 17919 2067 1 6 . 1 1 3 3 ILE H H 3 8.320 8.320 8.084 0.236 17919 2068 1 6 . 1 1 4 4 PHE N N 4 118.110 118.110 121.462 -3.352 17919 2069 1 6 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.198 0.432 17919 2070 1 6 . 1 1 4 4 PHE C C 4 175.320 175.320 175.677 -0.357 17919 2071 1 6 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.908 -0.698 17919 2072 1 6 . 1 1 4 4 PHE CB C 4 41.480 41.480 40.976 0.504 17919 2073 1 6 . 1 1 4 4 PHE H H 4 8.610 8.610 8.134 0.476 17919 2074 1 6 . 1 1 5 5 VAL N N 5 121.000 121.000 120.670 0.330 17919 2075 1 6 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.909 -0.184 17919 2076 1 6 . 1 1 5 5 VAL C C 5 174.870 174.870 175.135 -0.265 17919 2077 1 6 . 1 1 5 5 VAL CA C 5 60.620 60.620 60.722 -0.102 17919 2078 1 6 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.667 0.563 17919 2079 1 6 . 1 1 5 5 VAL H H 5 9.300 9.300 8.974 0.326 17919 2080 1 6 . 1 1 6 6 LYS N N 6 127.520 127.520 129.110 -1.590 17919 2081 1 6 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.193 0.174 17919 2082 1 6 . 1 1 6 6 LYS C C 6 177.140 177.140 176.723 0.417 17919 2083 1 6 . 1 1 6 6 LYS CA C 6 54.520 54.520 55.037 -0.517 17919 2084 1 6 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.282 0.768 17919 2085 1 6 . 1 1 6 6 LYS H H 6 8.820 8.820 8.713 0.107 17919 2086 1 6 . 1 1 7 7 THR N N 7 115.400 115.400 118.335 -2.935 17919 2087 1 6 . 1 1 7 7 THR HA H 7 4.970 4.970 4.242 0.728 17919 2088 1 6 . 1 1 7 7 THR C C 7 176.910 176.910 176.263 0.647 17919 2089 1 6 . 1 1 7 7 THR CA C 7 60.470 60.470 61.437 -0.967 17919 2090 1 6 . 1 1 7 7 THR CB C 7 70.630 70.630 69.676 0.954 17919 2091 1 6 . 1 1 7 7 THR H H 7 8.730 8.730 8.190 0.540 17919 2092 1 6 . 1 1 8 8 LEU N N 8 121.330 121.330 121.736 -0.406 17919 2093 1 6 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.313 -0.003 17919 2094 1 6 . 1 1 8 8 LEU C C 8 178.800 178.800 178.199 0.601 17919 2095 1 6 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.490 0.090 17919 2096 1 6 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.084 -0.114 17919 2097 1 6 . 1 1 8 8 LEU H H 8 9.100 9.100 8.564 0.536 17919 2098 1 6 . 1 1 9 9 THR N N 9 105.590 105.590 106.096 -0.506 17919 2099 1 6 . 1 1 9 9 THR HA H 9 4.428 4.428 4.319 0.109 17919 2100 1 6 . 1 1 9 9 THR C C 9 175.520 175.520 175.449 0.071 17919 2101 1 6 . 1 1 9 9 THR CA C 9 61.400 61.400 61.973 -0.573 17919 2102 1 6 . 1 1 9 9 THR CB C 9 69.140 69.140 69.334 -0.194 17919 2103 1 6 . 1 1 9 9 THR H H 9 7.630 7.630 7.755 -0.125 17919 2104 1 6 . 1 1 10 10 GLY N N 10 108.890 108.890 110.878 -1.988 17919 2105 1 6 . 1 1 10 10 GLY C C 10 174.070 174.070 173.958 0.112 17919 2106 1 6 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.552 0.908 17919 2107 1 6 . 1 1 10 10 GLY H H 10 7.810 7.810 7.581 0.229 17919 2108 1 6 . 1 1 11 11 LYS N N 11 121.600 121.600 121.477 0.123 17919 2109 1 6 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.293 0.068 17919 2110 1 6 . 1 1 11 11 LYS C C 11 175.940 175.940 175.700 0.240 17919 2111 1 6 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.820 -0.540 17919 2112 1 6 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.516 -0.316 17919 2113 1 6 . 1 1 11 11 LYS H H 11 7.280 7.280 7.894 -0.614 17919 2114 1 6 . 1 1 12 12 THR N N 12 120.440 120.440 119.220 1.220 17919 2115 1 6 . 1 1 12 12 THR HA H 12 5.046 5.046 4.737 0.309 17919 2116 1 6 . 1 1 12 12 THR C C 12 174.320 174.320 174.311 0.009 17919 2117 1 6 . 1 1 12 12 THR CA C 12 62.390 62.390 62.004 0.386 17919 2118 1 6 . 1 1 12 12 THR CB C 12 69.910 69.910 69.799 0.111 17919 2119 1 6 . 1 1 12 12 THR H H 12 8.650 8.650 8.445 0.205 17919 2120 1 6 . 1 1 13 13 ILE N N 13 127.110 127.110 127.306 -0.196 17919 2121 1 6 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.443 0.101 17919 2122 1 6 . 1 1 13 13 ILE C C 13 175.220 175.220 175.093 0.127 17919 2123 1 6 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.298 -0.318 17919 2124 1 6 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.069 0.881 17919 2125 1 6 . 1 1 13 13 ILE H H 13 9.450 9.450 9.018 0.432 17919 2126 1 6 . 1 1 14 14 THR N N 14 121.520 121.520 123.475 -1.955 17919 2127 1 6 . 1 1 14 14 THR HA H 14 4.964 4.964 4.847 0.117 17919 2128 1 6 . 1 1 14 14 THR C C 14 173.790 173.790 174.054 -0.264 17919 2129 1 6 . 1 1 14 14 THR CA C 14 61.940 61.940 62.035 -0.095 17919 2130 1 6 . 1 1 14 14 THR CB C 14 69.650 69.650 69.508 0.142 17919 2131 1 6 . 1 1 14 14 THR H H 14 8.710 8.710 8.534 0.176 17919 2132 1 6 . 1 1 15 15 LEU N N 15 124.800 124.800 127.930 -3.130 17919 2133 1 6 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.750 0.030 17919 2134 1 6 . 1 1 15 15 LEU C C 15 174.670 174.670 175.514 -0.844 17919 2135 1 6 . 1 1 15 15 LEU CA C 15 52.830 52.830 54.088 -1.258 17919 2136 1 6 . 1 1 15 15 LEU CB C 15 47.070 47.070 44.801 2.269 17919 2137 1 6 . 1 1 15 15 LEU H H 15 8.710 8.710 8.255 0.455 17919 2138 1 6 . 1 1 16 16 GLU N N 16 122.160 122.160 122.670 -0.510 17919 2139 1 6 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.142 -0.225 17919 2140 1 6 . 1 1 16 16 GLU C C 16 175.860 175.860 176.310 -0.450 17919 2141 1 6 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.108 -0.289 17919 2142 1 6 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.604 -1.154 17919 2143 1 6 . 1 1 16 16 GLU H H 16 8.140 8.140 8.426 -0.286 17919 2144 1 6 . 1 1 17 17 VAL N N 17 117.210 117.210 119.473 -2.263 17919 2145 1 6 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.540 0.174 17919 2146 1 6 . 1 1 17 17 VAL C C 17 174.160 174.160 174.319 -0.159 17919 2147 1 6 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.416 -0.986 17919 2148 1 6 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.561 0.839 17919 2149 1 6 . 1 1 17 17 VAL H H 17 8.900 8.900 8.728 0.172 17919 2150 1 6 . 1 1 18 18 GLU N N 18 118.990 118.990 119.387 -0.397 17919 2151 1 6 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.803 0.276 17919 2152 1 6 . 1 1 18 18 GLU C C 18 176.160 176.160 174.914 1.246 17919 2153 1 6 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.475 -0.755 17919 2154 1 6 . 1 1 18 18 GLU CB C 18 30.310 30.310 31.042 -0.732 17919 2155 1 6 . 1 1 18 18 GLU H H 18 8.640 8.640 8.600 0.040 17919 2156 1 6 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.239 -0.098 17919 2157 1 6 . 1 1 19 19 PRO C C 19 175.310 175.310 177.518 -2.208 17919 2158 1 6 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.555 -0.085 17919 2159 1 6 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.124 -0.174 17919 2160 1 6 . 1 1 20 20 SER N N 20 103.400 103.400 108.783 -5.383 17919 2161 1 6 . 1 1 20 20 SER HA H 20 4.370 4.370 4.376 -0.006 17919 2162 1 6 . 1 1 20 20 SER C C 20 174.660 174.660 174.621 0.039 17919 2163 1 6 . 1 1 20 20 SER CA C 20 57.400 57.400 58.787 -1.387 17919 2164 1 6 . 1 1 20 20 SER CB C 20 63.370 63.370 62.856 0.514 17919 2165 1 6 . 1 1 20 20 SER H H 20 7.040 7.040 7.890 -0.850 17919 2166 1 6 . 1 1 21 21 ASP N N 21 123.480 123.480 125.138 -1.658 17919 2167 1 6 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.643 0.052 17919 2168 1 6 . 1 1 21 21 ASP C C 21 176.360 176.360 175.698 0.662 17919 2169 1 6 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.361 0.339 17919 2170 1 6 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.456 -0.656 17919 2171 1 6 . 1 1 21 21 ASP H H 21 8.030 8.030 7.842 0.188 17919 2172 1 6 . 1 1 22 22 THR N N 22 108.800 108.800 112.718 -3.918 17919 2173 1 6 . 1 1 22 22 THR HA H 22 4.920 4.920 4.796 0.124 17919 2174 1 6 . 1 1 22 22 THR C C 22 176.750 176.750 176.252 0.498 17919 2175 1 6 . 1 1 22 22 THR CA C 22 59.690 59.690 61.006 -1.316 17919 2176 1 6 . 1 1 22 22 THR CB C 22 71.200 71.200 71.007 0.193 17919 2177 1 6 . 1 1 22 22 THR H H 22 7.900 7.900 8.139 -0.239 17919 2178 1 6 . 1 1 23 23 ILE N N 23 121.190 121.190 122.954 -1.764 17919 2179 1 6 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.754 -0.097 17919 2180 1 6 . 1 1 23 23 ILE C C 23 179.040 179.040 177.845 1.195 17919 2181 1 6 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.246 0.014 17919 2182 1 6 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.215 -1.865 17919 2183 1 6 . 1 1 23 23 ILE H H 23 8.560 8.560 9.007 -0.447 17919 2184 1 6 . 1 1 24 24 GLU N N 24 120.830 120.830 120.782 0.048 17919 2185 1 6 . 1 1 24 24 GLU HA H 24 3.917 3.917 4.013 -0.096 17919 2186 1 6 . 1 1 24 24 GLU C C 24 178.640 178.640 179.157 -0.517 17919 2187 1 6 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.951 0.269 17919 2188 1 6 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.499 -1.219 17919 2189 1 6 . 1 1 24 24 GLU H H 24 9.760 9.760 8.562 1.198 17919 2190 1 6 . 1 1 25 25 ASN N N 25 120.570 120.570 117.442 3.128 17919 2191 1 6 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.574 -0.049 17919 2192 1 6 . 1 1 25 25 ASN C C 25 178.380 178.380 177.862 0.518 17919 2193 1 6 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.821 0.239 17919 2194 1 6 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.809 -0.358 17919 2195 1 6 . 1 1 25 25 ASN H H 25 7.920 7.920 7.528 0.392 17919 2196 1 6 . 1 1 26 26 VAL N N 26 121.710 121.710 121.419 0.291 17919 2197 1 6 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.802 -0.405 17919 2198 1 6 . 1 1 26 26 VAL C C 26 177.950 177.950 177.033 0.917 17919 2199 1 6 . 1 1 26 26 VAL CA C 26 67.660 67.660 64.552 3.108 17919 2200 1 6 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.902 -1.062 17919 2201 1 6 . 1 1 26 26 VAL H H 26 8.070 8.070 8.402 -0.332 17919 2202 1 6 . 1 1 27 27 LYS N N 27 118.860 118.860 120.756 -1.896 17919 2203 1 6 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.125 0.455 17919 2204 1 6 . 1 1 27 27 LYS C C 27 180.550 180.550 178.848 1.702 17919 2205 1 6 . 1 1 27 27 LYS CA C 27 59.250 59.250 60.032 -0.782 17919 2206 1 6 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.098 1.632 17919 2207 1 6 . 1 1 27 27 LYS H H 27 8.560 8.560 8.464 0.096 17919 2208 1 6 . 1 1 28 28 ALA N N 28 123.440 123.440 121.070 2.370 17919 2209 1 6 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.084 0.076 17919 2210 1 6 . 1 1 28 28 ALA C C 28 180.300 180.300 179.158 1.142 17919 2211 1 6 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.567 0.803 17919 2212 1 6 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.344 -0.634 17919 2213 1 6 . 1 1 28 28 ALA H H 28 8.060 8.060 8.109 -0.049 17919 2214 1 6 . 1 1 29 29 LYS N N 29 119.940 119.940 120.324 -0.384 17919 2215 1 6 . 1 1 29 29 LYS HA H 29 4.207 4.207 3.987 0.220 17919 2216 1 6 . 1 1 29 29 LYS C C 29 180.320 180.320 178.885 1.435 17919 2217 1 6 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.425 0.226 17919 2218 1 6 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.285 1.005 17919 2219 1 6 . 1 1 29 29 LYS H H 29 7.850 7.850 7.861 -0.011 17919 2220 1 6 . 1 1 30 30 ILE N N 30 121.080 121.080 120.066 1.014 17919 2221 1 6 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.559 -0.052 17919 2222 1 6 . 1 1 30 30 ILE C C 30 178.310 178.310 177.407 0.903 17919 2223 1 6 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.392 0.758 17919 2224 1 6 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.517 -0.717 17919 2225 1 6 . 1 1 30 30 ILE H H 30 8.280 8.280 8.281 -0.001 17919 2226 1 6 . 1 1 31 31 GLN N N 31 123.490 123.490 119.005 4.485 17919 2227 1 6 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.062 -0.233 17919 2228 1 6 . 1 1 31 31 GLN C C 31 178.890 178.890 177.964 0.926 17919 2229 1 6 . 1 1 31 31 GLN CA C 31 60.000 60.000 58.651 1.349 17919 2230 1 6 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.398 -0.679 17919 2231 1 6 . 1 1 31 31 GLN H H 31 8.580 8.580 7.793 0.787 17919 2232 1 6 . 1 1 32 32 ASP N N 32 119.360 119.360 120.146 -0.786 17919 2233 1 6 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.407 -0.053 17919 2234 1 6 . 1 1 32 32 ASP C C 32 177.250 177.250 177.865 -0.615 17919 2235 1 6 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.799 0.391 17919 2236 1 6 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.923 -0.343 17919 2237 1 6 . 1 1 32 32 ASP H H 32 8.010 8.010 7.621 0.389 17919 2238 1 6 . 1 1 33 33 LYS N N 33 115.130 115.130 118.706 -3.576 17919 2239 1 6 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.250 0.087 17919 2240 1 6 . 1 1 33 33 LYS C C 33 177.870 177.870 178.052 -0.182 17919 2241 1 6 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.894 0.156 17919 2242 1 6 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.064 1.106 17919 2243 1 6 . 1 1 33 33 LYS H H 33 7.430 7.430 7.485 -0.055 17919 2244 1 6 . 1 1 34 34 GLU N N 34 113.870 113.870 115.054 -1.184 17919 2245 1 6 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.482 0.143 17919 2246 1 6 . 1 1 34 34 GLU C C 34 177.840 177.840 176.653 1.187 17919 2247 1 6 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.190 -1.020 17919 2248 1 6 . 1 1 34 34 GLU CB C 34 32.660 32.660 32.305 0.355 17919 2249 1 6 . 1 1 34 34 GLU H H 34 8.740 8.740 8.062 0.678 17919 2250 1 6 . 1 1 35 35 GLY N N 35 108.650 108.650 109.100 -0.450 17919 2251 1 6 . 1 1 35 35 GLY C C 35 173.960 173.960 174.537 -0.577 17919 2252 1 6 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.957 0.123 17919 2253 1 6 . 1 1 35 35 GLY H H 35 8.530 8.530 7.809 0.721 17919 2254 1 6 . 1 1 36 36 ILE N N 36 119.880 119.880 117.319 2.561 17919 2255 1 6 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.400 0.045 17919 2256 1 6 . 1 1 36 36 ILE C C 36 173.590 173.590 174.157 -0.567 17919 2257 1 6 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.259 -0.509 17919 2258 1 6 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.056 2.524 17919 2259 1 6 . 1 1 36 36 ILE H H 36 6.150 6.150 7.544 -1.394 17919 2260 1 6 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.770 -0.136 17919 2261 1 6 . 1 1 37 37 PRO C C 37 176.940 176.940 176.249 0.691 17919 2262 1 6 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.112 0.548 17919 2263 1 6 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.203 0.648 17919 2264 1 6 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.235 -0.118 17919 2265 1 6 . 1 1 38 38 PRO C C 38 178.320 178.320 177.771 0.549 17919 2266 1 6 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.269 0.991 17919 2267 1 6 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.670 1.220 17919 2268 1 6 . 1 1 39 39 ASP N N 39 113.380 113.380 116.066 -2.686 17919 2269 1 6 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.389 0.041 17919 2270 1 6 . 1 1 39 39 ASP C C 39 177.090 177.090 177.016 0.074 17919 2271 1 6 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.333 -0.693 17919 2272 1 6 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.510 -0.970 17919 2273 1 6 . 1 1 39 39 ASP H H 39 8.550 8.550 8.599 -0.049 17919 2274 1 6 . 1 1 40 40 GLN N N 40 116.780 116.780 116.799 -0.019 17919 2275 1 6 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.317 0.147 17919 2276 1 6 . 1 1 40 40 GLN C C 40 175.380 175.380 176.667 -1.287 17919 2277 1 6 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.756 -1.116 17919 2278 1 6 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.885 0.255 17919 2279 1 6 . 1 1 40 40 GLN H H 40 7.820 7.820 7.529 0.291 17919 2280 1 6 . 1 1 41 41 GLN N N 41 117.720 117.720 119.470 -1.750 17919 2281 1 6 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.182 0.062 17919 2282 1 6 . 1 1 41 41 GLN C C 41 176.300 176.300 175.900 0.400 17919 2283 1 6 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.601 -0.131 17919 2284 1 6 . 1 1 41 41 GLN CB C 41 31.650 31.650 28.812 2.838 17919 2285 1 6 . 1 1 41 41 GLN H H 41 7.480 7.480 7.365 0.115 17919 2286 1 6 . 1 1 42 42 ARG N N 42 122.680 122.680 126.516 -3.836 17919 2287 1 6 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.537 -0.037 17919 2288 1 6 . 1 1 42 42 ARG C C 42 174.050 174.050 174.494 -0.444 17919 2289 1 6 . 1 1 42 42 ARG CA C 42 55.050 55.050 53.984 1.066 17919 2290 1 6 . 1 1 42 42 ARG CB C 42 31.750 31.750 30.364 1.386 17919 2291 1 6 . 1 1 42 42 ARG H H 42 8.530 8.530 8.513 0.017 17919 2292 1 6 . 1 1 43 43 LEU N N 43 124.040 124.040 128.658 -4.618 17919 2293 1 6 . 1 1 43 43 LEU C C 43 175.290 175.290 174.968 0.322 17919 2294 1 6 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.754 -0.774 17919 2295 1 6 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.335 1.455 17919 2296 1 6 . 1 1 43 43 LEU H H 43 8.820 8.820 8.703 0.117 17919 2297 1 6 . 1 1 44 44 ILE N N 44 121.920 121.920 122.198 -0.278 17919 2298 1 6 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.284 -0.292 17919 2299 1 6 . 1 1 44 44 ILE C C 44 176.060 176.060 173.662 2.398 17919 2300 1 6 . 1 1 44 44 ILE CA C 44 58.980 58.980 58.506 0.474 17919 2301 1 6 . 1 1 44 44 ILE CB C 44 41.420 41.420 40.875 0.545 17919 2302 1 6 . 1 1 44 44 ILE H H 44 9.030 9.030 8.079 0.951 17919 2303 1 6 . 1 1 45 45 PHE N N 45 125.390 125.390 127.564 -2.174 17919 2304 1 6 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.978 0.067 17919 2305 1 6 . 1 1 45 45 PHE C C 45 174.470 174.470 174.614 -0.144 17919 2306 1 6 . 1 1 45 45 PHE CA C 45 57.020 57.020 57.243 -0.223 17919 2307 1 6 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.610 1.150 17919 2308 1 6 . 1 1 45 45 PHE H H 45 8.830 8.830 8.270 0.560 17919 2309 1 6 . 1 1 46 46 ALA N N 46 132.200 132.200 130.381 1.819 17919 2310 1 6 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.695 -0.005 17919 2311 1 6 . 1 1 46 46 ALA C C 46 177.290 177.290 177.202 0.088 17919 2312 1 6 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.775 -0.235 17919 2313 1 6 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.528 0.042 17919 2314 1 6 . 1 1 46 46 ALA H H 46 8.810 8.810 8.692 0.118 17919 2315 1 6 . 1 1 47 47 GLY N N 47 102.340 102.340 102.763 -0.423 17919 2316 1 6 . 1 1 47 47 GLY C C 47 173.810 173.810 174.360 -0.550 17919 2317 1 6 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.330 0.020 17919 2318 1 6 . 1 1 47 47 GLY H H 47 8.130 8.130 8.457 -0.327 17919 2319 1 6 . 1 1 48 48 LYS N N 48 121.570 121.570 120.341 1.229 17919 2320 1 6 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.570 0.052 17919 2321 1 6 . 1 1 48 48 LYS C C 48 174.700 174.700 175.530 -0.830 17919 2322 1 6 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.828 -0.278 17919 2323 1 6 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.551 -0.021 17919 2324 1 6 . 1 1 48 48 LYS H H 48 7.980 7.980 7.588 0.392 17919 2325 1 6 . 1 1 49 49 GLN N N 49 122.410 122.410 122.524 -0.114 17919 2326 1 6 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.207 0.353 17919 2327 1 6 . 1 1 49 49 GLN C C 49 175.670 175.670 175.900 -0.230 17919 2328 1 6 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.298 -0.558 17919 2329 1 6 . 1 1 49 49 GLN CB C 49 29.000 29.000 28.549 0.451 17919 2330 1 6 . 1 1 49 49 GLN H H 49 8.600 8.600 8.606 -0.006 17919 2331 1 6 . 1 1 50 50 LEU N N 50 125.520 125.520 128.214 -2.694 17919 2332 1 6 . 1 1 50 50 LEU HA H 50 4.090 4.090 3.838 0.252 17919 2333 1 6 . 1 1 50 50 LEU C C 50 176.660 176.660 176.139 0.521 17919 2334 1 6 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.390 -0.150 17919 2335 1 6 . 1 1 50 50 LEU CB C 50 41.570 41.570 40.829 0.741 17919 2336 1 6 . 1 1 50 50 LEU H H 50 8.530 8.530 7.835 0.695 17919 2337 1 6 . 1 1 51 51 GLU N N 51 122.940 122.940 125.606 -2.666 17919 2338 1 6 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.339 0.149 17919 2339 1 6 . 1 1 51 51 GLU C C 51 175.870 175.870 177.076 -1.206 17919 2340 1 6 . 1 1 51 51 GLU CA C 51 55.960 55.960 56.325 -0.365 17919 2341 1 6 . 1 1 51 51 GLU CB C 51 31.570 31.570 30.785 0.785 17919 2342 1 6 . 1 1 51 51 GLU H H 51 8.400 8.400 7.965 0.435 17919 2343 1 6 . 1 1 52 52 ASP N N 52 120.030 120.030 124.893 -4.863 17919 2344 1 6 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.434 -0.075 17919 2345 1 6 . 1 1 52 52 ASP C C 52 177.330 177.330 178.324 -0.994 17919 2346 1 6 . 1 1 52 52 ASP CA C 52 56.960 56.960 58.276 -1.315 17919 2347 1 6 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.970 -0.120 17919 2348 1 6 . 1 1 52 52 ASP H H 52 8.160 8.160 8.856 -0.696 17919 2349 1 6 . 1 1 53 53 GLY N N 53 106.660 106.660 106.050 0.610 17919 2350 1 6 . 1 1 53 53 GLY C C 53 174.870 174.870 174.825 0.045 17919 2351 1 6 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.178 -0.008 17919 2352 1 6 . 1 1 53 53 GLY H H 53 9.390 9.390 8.247 1.143 17919 2353 1 6 . 1 1 54 54 ARG N N 54 119.050 119.050 120.486 -1.436 17919 2354 1 6 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.407 0.287 17919 2355 1 6 . 1 1 54 54 ARG C C 54 175.350 175.350 175.777 -0.427 17919 2356 1 6 . 1 1 54 54 ARG CA C 54 54.390 54.390 55.624 -1.234 17919 2357 1 6 . 1 1 54 54 ARG CB C 54 32.650 32.650 31.421 1.230 17919 2358 1 6 . 1 1 54 54 ARG H H 54 7.460 7.460 7.685 -0.225 17919 2359 1 6 . 1 1 55 55 THR N N 55 108.400 108.400 112.702 -4.302 17919 2360 1 6 . 1 1 55 55 THR HA H 55 5.240 5.240 4.774 0.466 17919 2361 1 6 . 1 1 55 55 THR C C 55 176.560 176.560 176.664 -0.104 17919 2362 1 6 . 1 1 55 55 THR CA C 55 59.690 59.690 60.934 -1.244 17919 2363 1 6 . 1 1 55 55 THR CB C 55 72.260 72.260 70.305 1.955 17919 2364 1 6 . 1 1 55 55 THR H H 55 8.730 8.730 8.357 0.373 17919 2365 1 6 . 1 1 56 56 LEU N N 56 117.920 117.920 120.383 -2.463 17919 2366 1 6 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.976 0.084 17919 2367 1 6 . 1 1 56 56 LEU C C 56 180.810 180.810 178.882 1.928 17919 2368 1 6 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.359 0.351 17919 2369 1 6 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.032 -0.662 17919 2370 1 6 . 1 1 56 56 LEU H H 56 8.140 8.140 8.310 -0.170 17919 2371 1 6 . 1 1 57 57 SER N N 57 113.330 113.330 113.681 -0.351 17919 2372 1 6 . 1 1 57 57 SER HA H 57 4.370 4.370 4.267 0.103 17919 2373 1 6 . 1 1 57 57 SER C C 57 178.310 178.310 176.878 1.432 17919 2374 1 6 . 1 1 57 57 SER CA C 57 61.080 61.080 61.147 -0.067 17919 2375 1 6 . 1 1 57 57 SER CB C 57 62.530 62.530 62.536 -0.006 17919 2376 1 6 . 1 1 57 57 SER H H 57 8.470 8.470 7.988 0.482 17919 2377 1 6 . 1 1 58 58 ASP N N 58 124.190 124.190 124.253 -0.063 17919 2378 1 6 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.330 -0.034 17919 2379 1 6 . 1 1 58 58 ASP C C 58 177.400 177.400 177.413 -0.013 17919 2380 1 6 . 1 1 58 58 ASP CA C 58 57.180 57.180 57.022 0.158 17919 2381 1 6 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.347 -0.247 17919 2382 1 6 . 1 1 58 58 ASP H H 58 7.930 7.930 7.916 0.014 17919 2383 1 6 . 1 1 59 59 TYR N N 59 115.510 115.510 114.674 0.836 17919 2384 1 6 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.667 0.003 17919 2385 1 6 . 1 1 59 59 TYR C C 59 174.700 174.700 175.236 -0.536 17919 2386 1 6 . 1 1 59 59 TYR CA C 59 58.250 58.250 58.187 0.063 17919 2387 1 6 . 1 1 59 59 TYR CB C 59 40.070 40.070 39.078 0.992 17919 2388 1 6 . 1 1 59 59 TYR H H 59 7.250 7.250 7.525 -0.275 17919 2389 1 6 . 1 1 60 60 ASN N N 60 115.900 115.900 118.069 -2.169 17919 2390 1 6 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.449 -0.094 17919 2391 1 6 . 1 1 60 60 ASN C C 60 174.340 174.340 174.893 -0.553 17919 2392 1 6 . 1 1 60 60 ASN CA C 60 54.120 54.120 53.921 0.199 17919 2393 1 6 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.404 0.006 17919 2394 1 6 . 1 1 60 60 ASN H H 60 8.150 8.150 7.766 0.384 17919 2395 1 6 . 1 1 61 61 ILE N N 61 118.600 118.600 121.123 -2.523 17919 2396 1 6 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.734 -0.341 17919 2397 1 6 . 1 1 61 61 ILE C C 61 174.610 174.610 175.002 -0.392 17919 2398 1 6 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.431 0.989 17919 2399 1 6 . 1 1 61 61 ILE CB C 61 36.740 36.740 35.968 0.772 17919 2400 1 6 . 1 1 61 61 ILE H H 61 7.250 7.250 7.693 -0.443 17919 2401 1 6 . 1 1 62 62 GLN N N 62 124.740 124.740 125.942 -1.202 17919 2402 1 6 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.538 -0.032 17919 2403 1 6 . 1 1 62 62 GLN C C 62 175.970 175.970 175.901 0.069 17919 2404 1 6 . 1 1 62 62 GLN CA C 62 53.660 53.660 54.167 -0.507 17919 2405 1 6 . 1 1 62 62 GLN CB C 62 31.650 31.650 30.239 1.411 17919 2406 1 6 . 1 1 62 62 GLN H H 62 7.610 7.610 7.795 -0.185 17919 2407 1 6 . 1 1 63 63 LYS N N 63 120.300 120.300 119.945 0.355 17919 2408 1 6 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.970 0.031 17919 2409 1 6 . 1 1 63 63 LYS C C 63 175.810 175.810 176.824 -1.014 17919 2410 1 6 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.400 0.390 17919 2411 1 6 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.989 0.661 17919 2412 1 6 . 1 1 63 63 LYS H H 63 8.490 8.490 8.424 0.066 17919 2413 1 6 . 1 1 64 64 GLU N N 64 113.950 113.950 120.066 -6.116 17919 2414 1 6 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.693 -0.228 17919 2415 1 6 . 1 1 64 64 GLU C C 64 175.250 175.250 175.874 -0.624 17919 2416 1 6 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.461 0.429 17919 2417 1 6 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.292 -2.392 17919 2418 1 6 . 1 1 64 64 GLU H H 64 9.280 9.280 8.455 0.825 17919 2419 1 6 . 1 1 65 65 SER N N 65 114.730 114.730 115.737 -1.007 17919 2420 1 6 . 1 1 65 65 SER HA H 65 4.640 4.640 4.393 0.247 17919 2421 1 6 . 1 1 65 65 SER C C 65 172.160 172.160 174.635 -2.475 17919 2422 1 6 . 1 1 65 65 SER CA C 65 60.890 60.890 59.843 1.047 17919 2423 1 6 . 1 1 65 65 SER CB C 65 64.910 64.910 63.315 1.595 17919 2424 1 6 . 1 1 65 65 SER H H 65 7.670 7.670 7.608 0.062 17919 2425 1 6 . 1 1 66 66 THR N N 66 117.110 117.110 122.590 -5.480 17919 2426 1 6 . 1 1 66 66 THR HA H 66 5.270 5.270 4.485 0.785 17919 2427 1 6 . 1 1 66 66 THR C C 66 173.950 173.950 174.554 -0.604 17919 2428 1 6 . 1 1 66 66 THR CA C 66 62.340 62.340 63.262 -0.922 17919 2429 1 6 . 1 1 66 66 THR CB C 66 70.080 70.080 68.650 1.430 17919 2430 1 6 . 1 1 66 66 THR H H 66 8.730 8.730 8.610 0.120 17919 2431 1 6 . 1 1 67 67 LEU N N 67 127.110 127.110 127.824 -0.714 17919 2432 1 6 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.623 0.437 17919 2433 1 6 . 1 1 67 67 LEU C C 67 175.770 175.770 175.734 0.036 17919 2434 1 6 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.263 -0.363 17919 2435 1 6 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.625 0.635 17919 2436 1 6 . 1 1 67 67 LEU H H 67 9.410 9.410 8.677 0.733 17919 2437 1 6 . 1 1 68 68 HIS N N 68 118.380 118.380 120.581 -2.201 17919 2438 1 6 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.612 -0.372 17919 2439 1 6 . 1 1 68 68 HIS C C 68 173.150 173.150 173.733 -0.583 17919 2440 1 6 . 1 1 68 68 HIS CA C 68 55.000 55.000 53.972 1.028 17919 2441 1 6 . 1 1 68 68 HIS CB C 68 30.530 30.530 33.826 -3.296 17919 2442 1 6 . 1 1 68 68 HIS H H 68 9.230 9.230 8.527 0.703 17919 2443 1 6 . 1 1 69 69 LEU N N 69 124.460 124.460 120.412 4.048 17919 2444 1 6 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.992 0.198 17919 2445 1 6 . 1 1 69 69 LEU C C 69 175.270 175.270 173.958 1.312 17919 2446 1 6 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.811 -0.921 17919 2447 1 6 . 1 1 69 69 LEU CB C 69 44.380 44.380 45.789 -1.409 17919 2448 1 6 . 1 1 69 69 LEU H H 69 8.340 8.340 7.038 1.302 17919 2449 1 6 . 1 1 70 70 VAL N N 70 126.940 126.940 123.098 3.842 17919 2450 1 6 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.431 -0.081 17919 2451 1 6 . 1 1 70 70 VAL C C 70 174.000 174.000 174.831 -0.831 17919 2452 1 6 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.463 0.337 17919 2453 1 6 . 1 1 70 70 VAL CB C 70 34.910 34.910 34.901 0.009 17919 2454 1 6 . 1 1 70 70 VAL H H 70 9.200 9.200 8.361 0.839 17919 2455 1 6 . 1 1 71 71 LEU N N 71 123.130 123.130 123.599 -0.469 17919 2456 1 6 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.131 -0.071 17919 2457 1 6 . 1 1 71 71 LEU C C 71 177.830 177.830 177.301 0.529 17919 2458 1 6 . 1 1 71 71 LEU CA C 71 53.940 53.940 52.926 1.014 17919 2459 1 6 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.004 -0.154 17919 2460 1 6 . 1 1 71 71 LEU H H 71 8.120 8.120 8.310 -0.190 17919 2461 1 6 . 1 1 72 72 ARG N N 72 123.490 123.490 124.057 -0.567 17919 2462 1 6 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.301 0.000 17919 2463 1 6 . 1 1 72 72 ARG C C 72 175.350 175.350 175.268 0.082 17919 2464 1 6 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.755 -1.145 17919 2465 1 6 . 1 1 72 72 ARG CB C 72 31.350 31.350 29.954 1.396 17919 2466 1 6 . 1 1 72 72 ARG H H 72 8.580 8.580 8.115 0.465 17919 2467 1 7 . 1 1 2 2 GLN N N 2 123.220 123.220 119.420 3.800 17919 2468 1 7 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.243 0.006 17919 2469 1 7 . 1 1 2 2 GLN C C 2 175.920 175.920 176.262 -0.342 17919 2470 1 7 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.709 0.371 17919 2471 1 7 . 1 1 2 2 GLN CB C 2 30.760 30.760 29.704 1.056 17919 2472 1 7 . 1 1 2 2 GLN H H 2 8.900 8.900 8.317 0.583 17919 2473 1 7 . 1 1 3 3 ILE N N 3 115.340 115.340 116.757 -1.417 17919 2474 1 7 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.239 -0.026 17919 2475 1 7 . 1 1 3 3 ILE C C 3 172.450 172.450 173.869 -1.419 17919 2476 1 7 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.466 0.104 17919 2477 1 7 . 1 1 3 3 ILE CB C 3 42.210 42.210 40.594 1.616 17919 2478 1 7 . 1 1 3 3 ILE H H 3 8.320 8.320 7.816 0.504 17919 2479 1 7 . 1 1 4 4 PHE N N 4 118.110 118.110 118.349 -0.239 17919 2480 1 7 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.391 0.239 17919 2481 1 7 . 1 1 4 4 PHE C C 4 175.320 175.320 175.274 0.046 17919 2482 1 7 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.937 -0.727 17919 2483 1 7 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.137 -0.657 17919 2484 1 7 . 1 1 4 4 PHE H H 4 8.610 8.610 7.666 0.944 17919 2485 1 7 . 1 1 5 5 VAL N N 5 121.000 121.000 121.819 -0.819 17919 2486 1 7 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.972 -0.247 17919 2487 1 7 . 1 1 5 5 VAL C C 5 174.870 174.870 174.822 0.048 17919 2488 1 7 . 1 1 5 5 VAL CA C 5 60.620 60.620 60.912 -0.292 17919 2489 1 7 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.367 -0.137 17919 2490 1 7 . 1 1 5 5 VAL H H 5 9.300 9.300 9.105 0.195 17919 2491 1 7 . 1 1 6 6 LYS N N 6 127.520 127.520 129.117 -1.597 17919 2492 1 7 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.187 0.180 17919 2493 1 7 . 1 1 6 6 LYS C C 6 177.140 177.140 176.608 0.532 17919 2494 1 7 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.762 -0.242 17919 2495 1 7 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.172 -0.122 17919 2496 1 7 . 1 1 6 6 LYS H H 6 8.820 8.820 8.254 0.567 17919 2497 1 7 . 1 1 7 7 THR N N 7 115.400 115.400 116.829 -1.429 17919 2498 1 7 . 1 1 7 7 THR HA H 7 4.970 4.970 4.569 0.401 17919 2499 1 7 . 1 1 7 7 THR C C 7 176.910 176.910 176.483 0.427 17919 2500 1 7 . 1 1 7 7 THR CA C 7 60.470 60.470 61.082 -0.612 17919 2501 1 7 . 1 1 7 7 THR CB C 7 70.630 70.630 70.374 0.256 17919 2502 1 7 . 1 1 7 7 THR H H 7 8.730 8.730 8.757 -0.027 17919 2503 1 7 . 1 1 8 8 LEU N N 8 121.330 121.330 121.826 -0.496 17919 2504 1 7 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.385 -0.075 17919 2505 1 7 . 1 1 8 8 LEU C C 8 178.800 178.800 178.053 0.747 17919 2506 1 7 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.436 0.144 17919 2507 1 7 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.017 -0.047 17919 2508 1 7 . 1 1 8 8 LEU H H 8 9.100 9.100 8.700 0.401 17919 2509 1 7 . 1 1 9 9 THR N N 9 105.590 105.590 108.360 -2.770 17919 2510 1 7 . 1 1 9 9 THR HA H 9 4.428 4.428 4.269 0.159 17919 2511 1 7 . 1 1 9 9 THR C C 9 175.520 175.520 175.467 0.053 17919 2512 1 7 . 1 1 9 9 THR CA C 9 61.400 61.400 62.568 -1.167 17919 2513 1 7 . 1 1 9 9 THR CB C 9 69.140 69.140 68.443 0.697 17919 2514 1 7 . 1 1 9 9 THR H H 9 7.630 7.630 7.958 -0.328 17919 2515 1 7 . 1 1 10 10 GLY N N 10 108.890 108.890 111.035 -2.145 17919 2516 1 7 . 1 1 10 10 GLY C C 10 174.070 174.070 173.929 0.141 17919 2517 1 7 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.017 0.443 17919 2518 1 7 . 1 1 10 10 GLY H H 10 7.810 7.810 7.783 0.027 17919 2519 1 7 . 1 1 11 11 LYS N N 11 121.600 121.600 121.405 0.195 17919 2520 1 7 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.222 0.139 17919 2521 1 7 . 1 1 11 11 LYS C C 11 175.940 175.940 175.297 0.643 17919 2522 1 7 . 1 1 11 11 LYS CA C 11 56.280 56.280 57.229 -0.949 17919 2523 1 7 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.598 -0.398 17919 2524 1 7 . 1 1 11 11 LYS H H 11 7.280 7.280 7.619 -0.339 17919 2525 1 7 . 1 1 12 12 THR N N 12 120.440 120.440 115.285 5.155 17919 2526 1 7 . 1 1 12 12 THR HA H 12 5.046 5.046 5.316 -0.270 17919 2527 1 7 . 1 1 12 12 THR C C 12 174.320 174.320 173.994 0.326 17919 2528 1 7 . 1 1 12 12 THR CA C 12 62.390 62.390 60.990 1.400 17919 2529 1 7 . 1 1 12 12 THR CB C 12 69.910 69.910 71.838 -1.929 17919 2530 1 7 . 1 1 12 12 THR H H 12 8.650 8.650 8.146 0.504 17919 2531 1 7 . 1 1 13 13 ILE N N 13 127.110 127.110 126.480 0.630 17919 2532 1 7 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.492 0.052 17919 2533 1 7 . 1 1 13 13 ILE C C 13 175.220 175.220 174.702 0.518 17919 2534 1 7 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.745 -0.765 17919 2535 1 7 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.088 -0.138 17919 2536 1 7 . 1 1 13 13 ILE H H 13 9.450 9.450 9.360 0.090 17919 2537 1 7 . 1 1 14 14 THR N N 14 121.520 121.520 124.418 -2.898 17919 2538 1 7 . 1 1 14 14 THR HA H 14 4.964 4.964 4.594 0.370 17919 2539 1 7 . 1 1 14 14 THR C C 14 173.790 173.790 173.994 -0.204 17919 2540 1 7 . 1 1 14 14 THR CA C 14 61.940 61.940 62.919 -0.979 17919 2541 1 7 . 1 1 14 14 THR CB C 14 69.650 69.650 69.417 0.233 17919 2542 1 7 . 1 1 14 14 THR H H 14 8.710 8.710 8.774 -0.064 17919 2543 1 7 . 1 1 15 15 LEU N N 15 124.800 124.800 124.827 -0.027 17919 2544 1 7 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.726 0.054 17919 2545 1 7 . 1 1 15 15 LEU C C 15 174.670 174.670 175.450 -0.780 17919 2546 1 7 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.528 -0.698 17919 2547 1 7 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.205 1.865 17919 2548 1 7 . 1 1 15 15 LEU H H 15 8.710 8.710 7.932 0.778 17919 2549 1 7 . 1 1 16 16 GLU N N 16 122.160 122.160 124.151 -1.991 17919 2550 1 7 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.799 0.118 17919 2551 1 7 . 1 1 16 16 GLU C C 16 175.860 175.860 175.449 0.411 17919 2552 1 7 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.091 -0.271 17919 2553 1 7 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.286 -0.836 17919 2554 1 7 . 1 1 16 16 GLU H H 16 8.140 8.140 8.413 -0.273 17919 2555 1 7 . 1 1 17 17 VAL N N 17 117.210 117.210 120.062 -2.852 17919 2556 1 7 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.951 -0.237 17919 2557 1 7 . 1 1 17 17 VAL C C 17 174.160 174.160 175.145 -0.985 17919 2558 1 7 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.302 -0.872 17919 2559 1 7 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.724 0.676 17919 2560 1 7 . 1 1 17 17 VAL H H 17 8.900 8.900 8.748 0.152 17919 2561 1 7 . 1 1 18 18 GLU N N 18 118.990 118.990 120.229 -1.239 17919 2562 1 7 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.860 0.219 17919 2563 1 7 . 1 1 18 18 GLU C C 18 176.160 176.160 175.034 1.126 17919 2564 1 7 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.558 0.162 17919 2565 1 7 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.654 -0.344 17919 2566 1 7 . 1 1 18 18 GLU H H 18 8.640 8.640 8.876 -0.236 17919 2567 1 7 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.152 -0.011 17919 2568 1 7 . 1 1 19 19 PRO C C 19 175.310 175.310 178.248 -2.938 17919 2569 1 7 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.967 -0.497 17919 2570 1 7 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.950 -0.000 17919 2571 1 7 . 1 1 20 20 SER N N 20 103.400 103.400 110.102 -6.702 17919 2572 1 7 . 1 1 20 20 SER HA H 20 4.370 4.370 4.158 0.212 17919 2573 1 7 . 1 1 20 20 SER C C 20 174.660 174.660 174.307 0.353 17919 2574 1 7 . 1 1 20 20 SER CA C 20 57.400 57.400 59.514 -2.114 17919 2575 1 7 . 1 1 20 20 SER CB C 20 63.370 63.370 62.779 0.591 17919 2576 1 7 . 1 1 20 20 SER H H 20 7.040 7.040 8.008 -0.968 17919 2577 1 7 . 1 1 21 21 ASP N N 21 123.480 123.480 122.286 1.194 17919 2578 1 7 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.688 0.007 17919 2579 1 7 . 1 1 21 21 ASP C C 21 176.360 176.360 175.564 0.796 17919 2580 1 7 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.431 0.269 17919 2581 1 7 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.847 -1.047 17919 2582 1 7 . 1 1 21 21 ASP H H 21 8.030 8.030 7.964 0.066 17919 2583 1 7 . 1 1 22 22 THR N N 22 108.800 108.800 111.258 -2.458 17919 2584 1 7 . 1 1 22 22 THR HA H 22 4.920 4.920 4.582 0.338 17919 2585 1 7 . 1 1 22 22 THR C C 22 176.750 176.750 175.422 1.328 17919 2586 1 7 . 1 1 22 22 THR CA C 22 59.690 59.690 60.764 -1.074 17919 2587 1 7 . 1 1 22 22 THR CB C 22 71.200 71.200 70.669 0.531 17919 2588 1 7 . 1 1 22 22 THR H H 22 7.900 7.900 8.226 -0.326 17919 2589 1 7 . 1 1 23 23 ILE N N 23 121.190 121.190 120.818 0.372 17919 2590 1 7 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.970 -0.313 17919 2591 1 7 . 1 1 23 23 ILE C C 23 179.040 179.040 177.615 1.425 17919 2592 1 7 . 1 1 23 23 ILE CA C 23 62.260 62.260 61.946 0.314 17919 2593 1 7 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.609 -2.259 17919 2594 1 7 . 1 1 23 23 ILE H H 23 8.560 8.560 8.768 -0.208 17919 2595 1 7 . 1 1 24 24 GLU N N 24 120.830 120.830 119.913 0.917 17919 2596 1 7 . 1 1 24 24 GLU HA H 24 3.917 3.917 4.027 -0.110 17919 2597 1 7 . 1 1 24 24 GLU C C 24 178.640 178.640 178.538 0.102 17919 2598 1 7 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.584 0.636 17919 2599 1 7 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.134 -0.854 17919 2600 1 7 . 1 1 24 24 GLU H H 24 9.760 9.760 7.760 2.000 17919 2601 1 7 . 1 1 25 25 ASN N N 25 120.570 120.570 118.846 1.724 17919 2602 1 7 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.468 0.057 17919 2603 1 7 . 1 1 25 25 ASN C C 25 178.380 178.380 177.836 0.544 17919 2604 1 7 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.315 -0.255 17919 2605 1 7 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.210 0.240 17919 2606 1 7 . 1 1 25 25 ASN H H 25 7.920 7.920 7.565 0.355 17919 2607 1 7 . 1 1 26 26 VAL N N 26 121.710 121.710 117.924 3.786 17919 2608 1 7 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.542 -0.145 17919 2609 1 7 . 1 1 26 26 VAL C C 26 177.950 177.950 177.705 0.245 17919 2610 1 7 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.972 0.688 17919 2611 1 7 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.067 -0.227 17919 2612 1 7 . 1 1 26 26 VAL H H 26 8.070 8.070 7.730 0.340 17919 2613 1 7 . 1 1 27 27 LYS N N 27 118.860 118.860 119.794 -0.934 17919 2614 1 7 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.206 0.374 17919 2615 1 7 . 1 1 27 27 LYS C C 27 180.550 180.550 178.948 1.602 17919 2616 1 7 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.189 0.061 17919 2617 1 7 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.183 1.547 17919 2618 1 7 . 1 1 27 27 LYS H H 27 8.560 8.560 7.434 1.126 17919 2619 1 7 . 1 1 28 28 ALA N N 28 123.440 123.440 123.402 0.038 17919 2620 1 7 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.026 0.134 17919 2621 1 7 . 1 1 28 28 ALA C C 28 180.300 180.300 178.811 1.489 17919 2622 1 7 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.136 0.234 17919 2623 1 7 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.384 -0.674 17919 2624 1 7 . 1 1 28 28 ALA H H 28 8.060 8.060 8.600 -0.540 17919 2625 1 7 . 1 1 29 29 LYS N N 29 119.940 119.940 119.787 0.153 17919 2626 1 7 . 1 1 29 29 LYS HA H 29 4.207 4.207 3.854 0.353 17919 2627 1 7 . 1 1 29 29 LYS C C 29 180.320 180.320 179.023 1.297 17919 2628 1 7 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.577 0.073 17919 2629 1 7 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.308 0.982 17919 2630 1 7 . 1 1 29 29 LYS H H 29 7.850 7.850 7.687 0.163 17919 2631 1 7 . 1 1 30 30 ILE N N 30 121.080 121.080 119.080 2.000 17919 2632 1 7 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.573 -0.066 17919 2633 1 7 . 1 1 30 30 ILE C C 30 178.310 178.310 177.762 0.548 17919 2634 1 7 . 1 1 30 30 ILE CA C 30 66.150 66.150 64.898 1.252 17919 2635 1 7 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.613 -0.813 17919 2636 1 7 . 1 1 30 30 ILE H H 30 8.280 8.280 8.458 -0.178 17919 2637 1 7 . 1 1 31 31 GLN N N 31 123.490 123.490 120.147 3.343 17919 2638 1 7 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.039 -0.210 17919 2639 1 7 . 1 1 31 31 GLN C C 31 178.890 178.890 178.255 0.635 17919 2640 1 7 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.175 0.825 17919 2641 1 7 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.346 -0.626 17919 2642 1 7 . 1 1 31 31 GLN H H 31 8.580 8.580 8.310 0.270 17919 2643 1 7 . 1 1 32 32 ASP N N 32 119.360 119.360 117.881 1.479 17919 2644 1 7 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.442 -0.088 17919 2645 1 7 . 1 1 32 32 ASP C C 32 177.250 177.250 177.943 -0.693 17919 2646 1 7 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.678 0.512 17919 2647 1 7 . 1 1 32 32 ASP CB C 32 40.580 40.580 41.010 -0.430 17919 2648 1 7 . 1 1 32 32 ASP H H 32 8.010 8.010 7.943 0.067 17919 2649 1 7 . 1 1 33 33 LYS N N 33 115.130 115.130 117.233 -2.103 17919 2650 1 7 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.368 -0.031 17919 2651 1 7 . 1 1 33 33 LYS C C 33 177.870 177.870 178.118 -0.248 17919 2652 1 7 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.575 0.475 17919 2653 1 7 . 1 1 33 33 LYS CB C 33 34.170 34.170 34.171 -0.001 17919 2654 1 7 . 1 1 33 33 LYS H H 33 7.430 7.430 7.582 -0.152 17919 2655 1 7 . 1 1 34 34 GLU N N 34 113.870 113.870 117.205 -3.335 17919 2656 1 7 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.427 0.198 17919 2657 1 7 . 1 1 34 34 GLU C C 34 177.840 177.840 176.710 1.130 17919 2658 1 7 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.230 -1.060 17919 2659 1 7 . 1 1 34 34 GLU CB C 34 32.660 32.660 30.704 1.956 17919 2660 1 7 . 1 1 34 34 GLU H H 34 8.740 8.740 8.287 0.453 17919 2661 1 7 . 1 1 35 35 GLY N N 35 108.650 108.650 107.746 0.904 17919 2662 1 7 . 1 1 35 35 GLY C C 35 173.960 173.960 174.118 -0.158 17919 2663 1 7 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.140 0.940 17919 2664 1 7 . 1 1 35 35 GLY H H 35 8.530 8.530 7.784 0.746 17919 2665 1 7 . 1 1 36 36 ILE N N 36 119.880 119.880 121.411 -1.531 17919 2666 1 7 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.412 0.033 17919 2667 1 7 . 1 1 36 36 ILE C C 36 173.590 173.590 173.875 -0.285 17919 2668 1 7 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.539 0.211 17919 2669 1 7 . 1 1 36 36 ILE CB C 36 40.580 40.580 39.618 0.962 17919 2670 1 7 . 1 1 36 36 ILE H H 36 6.150 6.150 7.580 -1.430 17919 2671 1 7 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.609 0.025 17919 2672 1 7 . 1 1 37 37 PRO C C 37 176.940 176.940 175.614 1.326 17919 2673 1 7 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.664 -0.004 17919 2674 1 7 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.146 0.704 17919 2675 1 7 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.103 0.014 17919 2676 1 7 . 1 1 38 38 PRO C C 38 178.320 178.320 178.701 -0.381 17919 2677 1 7 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.878 0.382 17919 2678 1 7 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.981 0.909 17919 2679 1 7 . 1 1 39 39 ASP N N 39 113.380 113.380 116.417 -3.037 17919 2680 1 7 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.207 0.223 17919 2681 1 7 . 1 1 39 39 ASP C C 39 177.090 177.090 177.959 -0.869 17919 2682 1 7 . 1 1 39 39 ASP CA C 39 55.640 55.640 57.517 -1.877 17919 2683 1 7 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.639 -1.099 17919 2684 1 7 . 1 1 39 39 ASP H H 39 8.550 8.550 8.796 -0.246 17919 2685 1 7 . 1 1 40 40 GLN N N 40 116.780 116.780 116.479 0.301 17919 2686 1 7 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.170 0.294 17919 2687 1 7 . 1 1 40 40 GLN C C 40 175.380 175.380 177.192 -1.812 17919 2688 1 7 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.835 -1.195 17919 2689 1 7 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.055 1.085 17919 2690 1 7 . 1 1 40 40 GLN H H 40 7.820 7.820 7.707 0.113 17919 2691 1 7 . 1 1 41 41 GLN N N 41 117.720 117.720 119.015 -1.295 17919 2692 1 7 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.354 -0.110 17919 2693 1 7 . 1 1 41 41 GLN C C 41 176.300 176.300 175.845 0.455 17919 2694 1 7 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.531 -0.061 17919 2695 1 7 . 1 1 41 41 GLN CB C 41 31.650 31.650 28.680 2.970 17919 2696 1 7 . 1 1 41 41 GLN H H 41 7.480 7.480 7.326 0.154 17919 2697 1 7 . 1 1 42 42 ARG N N 42 122.680 122.680 126.586 -3.906 17919 2698 1 7 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.504 -0.004 17919 2699 1 7 . 1 1 42 42 ARG C C 42 174.050 174.050 173.813 0.237 17919 2700 1 7 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.384 -0.334 17919 2701 1 7 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.141 -0.391 17919 2702 1 7 . 1 1 42 42 ARG H H 42 8.530 8.530 8.660 -0.130 17919 2703 1 7 . 1 1 43 43 LEU N N 43 124.040 124.040 127.601 -3.561 17919 2704 1 7 . 1 1 43 43 LEU C C 43 175.290 175.290 175.024 0.266 17919 2705 1 7 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.855 -0.875 17919 2706 1 7 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.966 1.824 17919 2707 1 7 . 1 1 43 43 LEU H H 43 8.820 8.820 8.775 0.045 17919 2708 1 7 . 1 1 44 44 ILE N N 44 121.920 121.920 124.699 -2.779 17919 2709 1 7 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.885 0.107 17919 2710 1 7 . 1 1 44 44 ILE C C 44 176.060 176.060 174.264 1.796 17919 2711 1 7 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.490 -0.510 17919 2712 1 7 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.260 0.161 17919 2713 1 7 . 1 1 44 44 ILE H H 44 9.030 9.030 8.625 0.405 17919 2714 1 7 . 1 1 45 45 PHE N N 45 125.390 125.390 126.834 -1.444 17919 2715 1 7 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.867 0.178 17919 2716 1 7 . 1 1 45 45 PHE C C 45 174.470 174.470 174.004 0.466 17919 2717 1 7 . 1 1 45 45 PHE CA C 45 57.020 57.020 57.269 -0.249 17919 2718 1 7 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.962 0.797 17919 2719 1 7 . 1 1 45 45 PHE H H 45 8.830 8.830 8.427 0.403 17919 2720 1 7 . 1 1 46 46 ALA N N 46 132.200 132.200 129.031 3.169 17919 2721 1 7 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.605 0.085 17919 2722 1 7 . 1 1 46 46 ALA C C 46 177.290 177.290 177.809 -0.519 17919 2723 1 7 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.816 -0.276 17919 2724 1 7 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.546 0.024 17919 2725 1 7 . 1 1 46 46 ALA H H 46 8.810 8.810 8.614 0.196 17919 2726 1 7 . 1 1 47 47 GLY N N 47 102.340 102.340 103.662 -1.322 17919 2727 1 7 . 1 1 47 47 GLY C C 47 173.810 173.810 174.252 -0.442 17919 2728 1 7 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.852 0.498 17919 2729 1 7 . 1 1 47 47 GLY H H 47 8.130 8.130 8.305 -0.175 17919 2730 1 7 . 1 1 48 48 LYS N N 48 121.570 121.570 122.471 -0.901 17919 2731 1 7 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.585 0.037 17919 2732 1 7 . 1 1 48 48 LYS C C 48 174.700 174.700 175.348 -0.648 17919 2733 1 7 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.797 -0.248 17919 2734 1 7 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.081 0.449 17919 2735 1 7 . 1 1 48 48 LYS H H 48 7.980 7.980 7.837 0.143 17919 2736 1 7 . 1 1 49 49 GLN N N 49 122.410 122.410 124.217 -1.807 17919 2737 1 7 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.531 0.029 17919 2738 1 7 . 1 1 49 49 GLN C C 49 175.670 175.670 175.339 0.331 17919 2739 1 7 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.665 0.075 17919 2740 1 7 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.151 -0.151 17919 2741 1 7 . 1 1 49 49 GLN H H 49 8.600 8.600 8.554 0.046 17919 2742 1 7 . 1 1 50 50 LEU N N 50 125.520 125.520 123.490 2.030 17919 2743 1 7 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.434 -0.344 17919 2744 1 7 . 1 1 50 50 LEU C C 50 176.660 176.660 176.716 -0.056 17919 2745 1 7 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.986 0.254 17919 2746 1 7 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.385 0.185 17919 2747 1 7 . 1 1 50 50 LEU H H 50 8.530 8.530 8.453 0.077 17919 2748 1 7 . 1 1 51 51 GLU N N 51 122.940 122.940 126.079 -3.139 17919 2749 1 7 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.243 0.245 17919 2750 1 7 . 1 1 51 51 GLU C C 51 175.870 175.870 177.018 -1.148 17919 2751 1 7 . 1 1 51 51 GLU CA C 51 55.960 55.960 56.496 -0.536 17919 2752 1 7 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.185 0.385 17919 2753 1 7 . 1 1 51 51 GLU H H 51 8.400 8.400 8.188 0.212 17919 2754 1 7 . 1 1 52 52 ASP N N 52 120.030 120.030 124.979 -4.949 17919 2755 1 7 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.536 -0.177 17919 2756 1 7 . 1 1 52 52 ASP C C 52 177.330 177.330 176.678 0.652 17919 2757 1 7 . 1 1 52 52 ASP CA C 52 56.960 56.960 56.210 0.750 17919 2758 1 7 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.807 0.042 17919 2759 1 7 . 1 1 52 52 ASP H H 52 8.160 8.160 8.657 -0.497 17919 2760 1 7 . 1 1 53 53 GLY N N 53 106.660 106.660 105.665 0.995 17919 2761 1 7 . 1 1 53 53 GLY C C 53 174.870 174.870 174.323 0.547 17919 2762 1 7 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.614 0.556 17919 2763 1 7 . 1 1 53 53 GLY H H 53 9.390 9.390 8.231 1.159 17919 2764 1 7 . 1 1 54 54 ARG N N 54 119.050 119.050 119.760 -0.710 17919 2765 1 7 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.602 0.093 17919 2766 1 7 . 1 1 54 54 ARG C C 54 175.350 175.350 175.075 0.275 17919 2767 1 7 . 1 1 54 54 ARG CA C 54 54.390 54.390 52.958 1.432 17919 2768 1 7 . 1 1 54 54 ARG CB C 54 32.650 32.650 31.974 0.676 17919 2769 1 7 . 1 1 54 54 ARG H H 54 7.460 7.460 7.820 -0.360 17919 2770 1 7 . 1 1 55 55 THR N N 55 108.400 108.400 110.055 -1.655 17919 2771 1 7 . 1 1 55 55 THR HA H 55 5.240 5.240 4.821 0.419 17919 2772 1 7 . 1 1 55 55 THR C C 55 176.560 176.560 176.143 0.417 17919 2773 1 7 . 1 1 55 55 THR CA C 55 59.690 59.690 59.553 0.137 17919 2774 1 7 . 1 1 55 55 THR CB C 55 72.260 72.260 71.592 0.668 17919 2775 1 7 . 1 1 55 55 THR H H 55 8.730 8.730 7.974 0.756 17919 2776 1 7 . 1 1 56 56 LEU N N 56 117.920 117.920 120.408 -2.488 17919 2777 1 7 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.948 0.112 17919 2778 1 7 . 1 1 56 56 LEU C C 56 180.810 180.810 178.747 2.063 17919 2779 1 7 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.395 0.315 17919 2780 1 7 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.346 -0.976 17919 2781 1 7 . 1 1 56 56 LEU H H 56 8.140 8.140 8.313 -0.173 17919 2782 1 7 . 1 1 57 57 SER N N 57 113.330 113.330 114.017 -0.687 17919 2783 1 7 . 1 1 57 57 SER HA H 57 4.370 4.370 4.090 0.280 17919 2784 1 7 . 1 1 57 57 SER C C 57 178.310 178.310 177.027 1.283 17919 2785 1 7 . 1 1 57 57 SER CA C 57 61.080 61.080 61.501 -0.421 17919 2786 1 7 . 1 1 57 57 SER CB C 57 62.530 62.530 62.564 -0.034 17919 2787 1 7 . 1 1 57 57 SER H H 57 8.470 8.470 8.086 0.384 17919 2788 1 7 . 1 1 58 58 ASP N N 58 124.190 124.190 122.943 1.247 17919 2789 1 7 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.358 -0.062 17919 2790 1 7 . 1 1 58 58 ASP C C 58 177.400 177.400 177.436 -0.036 17919 2791 1 7 . 1 1 58 58 ASP CA C 58 57.180 57.180 57.133 0.047 17919 2792 1 7 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.519 -0.419 17919 2793 1 7 . 1 1 58 58 ASP H H 58 7.930 7.930 7.592 0.338 17919 2794 1 7 . 1 1 59 59 TYR N N 59 115.510 115.510 115.317 0.193 17919 2795 1 7 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.768 -0.098 17919 2796 1 7 . 1 1 59 59 TYR C C 59 174.700 174.700 175.133 -0.433 17919 2797 1 7 . 1 1 59 59 TYR CA C 59 58.250 58.250 55.686 2.564 17919 2798 1 7 . 1 1 59 59 TYR CB C 59 40.070 40.070 37.030 3.040 17919 2799 1 7 . 1 1 59 59 TYR H H 59 7.250 7.250 7.285 -0.035 17919 2800 1 7 . 1 1 60 60 ASN N N 60 115.900 115.900 115.381 0.519 17919 2801 1 7 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.365 -0.010 17919 2802 1 7 . 1 1 60 60 ASN C C 60 174.340 174.340 174.862 -0.522 17919 2803 1 7 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.844 -0.724 17919 2804 1 7 . 1 1 60 60 ASN CB C 60 37.410 37.410 38.080 -0.670 17919 2805 1 7 . 1 1 60 60 ASN H H 60 8.150 8.150 7.696 0.454 17919 2806 1 7 . 1 1 61 61 ILE N N 61 118.600 118.600 121.195 -2.595 17919 2807 1 7 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.550 -0.157 17919 2808 1 7 . 1 1 61 61 ILE C C 61 174.610 174.610 175.020 -0.410 17919 2809 1 7 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.483 -0.064 17919 2810 1 7 . 1 1 61 61 ILE CB C 61 36.740 36.740 36.941 -0.202 17919 2811 1 7 . 1 1 61 61 ILE H H 61 7.250 7.250 7.537 -0.287 17919 2812 1 7 . 1 1 62 62 GLN N N 62 124.740 124.740 126.327 -1.587 17919 2813 1 7 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.672 -0.166 17919 2814 1 7 . 1 1 62 62 GLN C C 62 175.970 175.970 175.957 0.013 17919 2815 1 7 . 1 1 62 62 GLN CA C 62 53.660 53.660 52.791 0.869 17919 2816 1 7 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.669 -0.019 17919 2817 1 7 . 1 1 62 62 GLN H H 62 7.610 7.610 8.221 -0.611 17919 2818 1 7 . 1 1 63 63 LYS N N 63 120.300 120.300 124.397 -4.097 17919 2819 1 7 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.940 0.061 17919 2820 1 7 . 1 1 63 63 LYS C C 63 175.810 175.810 176.743 -0.933 17919 2821 1 7 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.103 -0.313 17919 2822 1 7 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.714 0.936 17919 2823 1 7 . 1 1 63 63 LYS H H 63 8.490 8.490 8.790 -0.300 17919 2824 1 7 . 1 1 64 64 GLU N N 64 113.950 113.950 118.700 -4.750 17919 2825 1 7 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.829 -0.364 17919 2826 1 7 . 1 1 64 64 GLU C C 64 175.250 175.250 175.137 0.113 17919 2827 1 7 . 1 1 64 64 GLU CA C 64 57.890 57.890 58.012 -0.122 17919 2828 1 7 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.832 -2.932 17919 2829 1 7 . 1 1 64 64 GLU H H 64 9.280 9.280 8.820 0.460 17919 2830 1 7 . 1 1 65 65 SER N N 65 114.730 114.730 116.717 -1.987 17919 2831 1 7 . 1 1 65 65 SER HA H 65 4.640 4.640 4.654 -0.014 17919 2832 1 7 . 1 1 65 65 SER C C 65 172.160 172.160 173.961 -1.801 17919 2833 1 7 . 1 1 65 65 SER CA C 65 60.890 60.890 59.667 1.222 17919 2834 1 7 . 1 1 65 65 SER CB C 65 64.910 64.910 63.801 1.109 17919 2835 1 7 . 1 1 65 65 SER H H 65 7.670 7.670 8.203 -0.533 17919 2836 1 7 . 1 1 66 66 THR N N 66 117.110 117.110 123.184 -6.074 17919 2837 1 7 . 1 1 66 66 THR HA H 66 5.270 5.270 4.925 0.345 17919 2838 1 7 . 1 1 66 66 THR C C 66 173.950 173.950 175.097 -1.147 17919 2839 1 7 . 1 1 66 66 THR CA C 66 62.340 62.340 63.173 -0.833 17919 2840 1 7 . 1 1 66 66 THR CB C 66 70.080 70.080 69.405 0.675 17919 2841 1 7 . 1 1 66 66 THR H H 66 8.730 8.730 8.543 0.187 17919 2842 1 7 . 1 1 67 67 LEU N N 67 127.110 127.110 127.665 -0.555 17919 2843 1 7 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.896 0.164 17919 2844 1 7 . 1 1 67 67 LEU C C 67 175.770 175.770 175.579 0.191 17919 2845 1 7 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.955 -0.055 17919 2846 1 7 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.623 0.636 17919 2847 1 7 . 1 1 67 67 LEU H H 67 9.410 9.410 8.648 0.762 17919 2848 1 7 . 1 1 68 68 HIS N N 68 118.380 118.380 122.049 -3.669 17919 2849 1 7 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.227 0.013 17919 2850 1 7 . 1 1 68 68 HIS C C 68 173.150 173.150 173.981 -0.831 17919 2851 1 7 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.313 0.687 17919 2852 1 7 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.159 -1.629 17919 2853 1 7 . 1 1 68 68 HIS H H 68 9.230 9.230 8.352 0.878 17919 2854 1 7 . 1 1 69 69 LEU N N 69 124.460 124.460 129.491 -5.031 17919 2855 1 7 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.830 0.360 17919 2856 1 7 . 1 1 69 69 LEU C C 69 175.270 175.270 174.181 1.089 17919 2857 1 7 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.911 -0.021 17919 2858 1 7 . 1 1 69 69 LEU CB C 69 44.380 44.380 43.734 0.645 17919 2859 1 7 . 1 1 69 69 LEU H H 69 8.340 8.340 7.755 0.585 17919 2860 1 7 . 1 1 70 70 VAL N N 70 126.940 126.940 125.211 1.729 17919 2861 1 7 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.281 0.069 17919 2862 1 7 . 1 1 70 70 VAL C C 70 174.000 174.000 174.830 -0.830 17919 2863 1 7 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.199 0.601 17919 2864 1 7 . 1 1 70 70 VAL CB C 70 34.910 34.910 34.369 0.541 17919 2865 1 7 . 1 1 70 70 VAL H H 70 9.200 9.200 8.916 0.284 17919 2866 1 7 . 1 1 71 71 LEU N N 71 123.130 123.130 122.245 0.885 17919 2867 1 7 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.795 0.265 17919 2868 1 7 . 1 1 71 71 LEU C C 71 177.830 177.830 177.751 0.079 17919 2869 1 7 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.920 0.020 17919 2870 1 7 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.275 -0.425 17919 2871 1 7 . 1 1 71 71 LEU H H 71 8.120 8.120 8.534 -0.414 17919 2872 1 7 . 1 1 72 72 ARG N N 72 123.490 123.490 123.311 0.179 17919 2873 1 7 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.344 -0.043 17919 2874 1 7 . 1 1 72 72 ARG C C 72 175.350 175.350 175.508 -0.158 17919 2875 1 7 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.615 -0.005 17919 2876 1 7 . 1 1 72 72 ARG CB C 72 31.350 31.350 28.319 3.031 17919 2877 1 7 . 1 1 72 72 ARG H H 72 8.580 8.580 8.269 0.311 17919 2878 1 8 . 1 1 2 2 GLN N N 2 123.220 123.220 122.836 0.384 17919 2879 1 8 . 1 1 2 2 GLN HA H 2 5.249 5.249 4.614 0.635 17919 2880 1 8 . 1 1 2 2 GLN C C 2 175.920 175.920 174.517 1.403 17919 2881 1 8 . 1 1 2 2 GLN CA C 2 55.080 55.080 55.889 -0.809 17919 2882 1 8 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.137 0.624 17919 2883 1 8 . 1 1 2 2 GLN H H 2 8.900 8.900 8.394 0.506 17919 2884 1 8 . 1 1 3 3 ILE N N 3 115.340 115.340 117.111 -1.771 17919 2885 1 8 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.017 0.196 17919 2886 1 8 . 1 1 3 3 ILE C C 3 172.450 172.450 173.615 -1.165 17919 2887 1 8 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.499 0.071 17919 2888 1 8 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.439 0.771 17919 2889 1 8 . 1 1 3 3 ILE H H 3 8.320 8.320 7.828 0.492 17919 2890 1 8 . 1 1 4 4 PHE N N 4 118.110 118.110 119.240 -1.130 17919 2891 1 8 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.242 0.388 17919 2892 1 8 . 1 1 4 4 PHE C C 4 175.320 175.320 175.340 -0.020 17919 2893 1 8 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.053 0.157 17919 2894 1 8 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.534 -0.054 17919 2895 1 8 . 1 1 4 4 PHE H H 4 8.610 8.610 7.901 0.709 17919 2896 1 8 . 1 1 5 5 VAL N N 5 121.000 121.000 122.301 -1.301 17919 2897 1 8 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.865 -0.140 17919 2898 1 8 . 1 1 5 5 VAL C C 5 174.870 174.870 174.891 -0.021 17919 2899 1 8 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.084 -0.464 17919 2900 1 8 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.773 0.457 17919 2901 1 8 . 1 1 5 5 VAL H H 5 9.300 9.300 8.602 0.698 17919 2902 1 8 . 1 1 6 6 LYS N N 6 127.520 127.520 129.956 -2.436 17919 2903 1 8 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.364 0.003 17919 2904 1 8 . 1 1 6 6 LYS C C 6 177.140 177.140 177.231 -0.091 17919 2905 1 8 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.701 -0.181 17919 2906 1 8 . 1 1 6 6 LYS CB C 6 35.050 35.050 33.614 1.436 17919 2907 1 8 . 1 1 6 6 LYS H H 6 8.820 8.820 8.754 0.066 17919 2908 1 8 . 1 1 7 7 THR N N 7 115.400 115.400 120.004 -4.604 17919 2909 1 8 . 1 1 7 7 THR HA H 7 4.970 4.970 4.493 0.477 17919 2910 1 8 . 1 1 7 7 THR C C 7 176.910 176.910 176.247 0.663 17919 2911 1 8 . 1 1 7 7 THR CA C 7 60.470 60.470 61.704 -1.234 17919 2912 1 8 . 1 1 7 7 THR CB C 7 70.630 70.630 69.953 0.677 17919 2913 1 8 . 1 1 7 7 THR H H 7 8.730 8.730 8.864 -0.134 17919 2914 1 8 . 1 1 8 8 LEU N N 8 121.330 121.330 121.477 -0.147 17919 2915 1 8 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.211 0.099 17919 2916 1 8 . 1 1 8 8 LEU C C 8 178.800 178.800 177.467 1.333 17919 2917 1 8 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.766 -0.186 17919 2918 1 8 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.752 0.218 17919 2919 1 8 . 1 1 8 8 LEU H H 8 9.100 9.100 8.770 0.330 17919 2920 1 8 . 1 1 9 9 THR N N 9 105.590 105.590 108.487 -2.897 17919 2921 1 8 . 1 1 9 9 THR HA H 9 4.428 4.428 4.465 -0.037 17919 2922 1 8 . 1 1 9 9 THR C C 9 175.520 175.520 175.222 0.298 17919 2923 1 8 . 1 1 9 9 THR CA C 9 61.400 61.400 60.959 0.441 17919 2924 1 8 . 1 1 9 9 THR CB C 9 69.140 69.140 68.829 0.311 17919 2925 1 8 . 1 1 9 9 THR H H 9 7.630 7.630 7.797 -0.167 17919 2926 1 8 . 1 1 10 10 GLY N N 10 108.890 108.890 111.089 -2.199 17919 2927 1 8 . 1 1 10 10 GLY C C 10 174.070 174.070 174.549 -0.479 17919 2928 1 8 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.325 0.135 17919 2929 1 8 . 1 1 10 10 GLY H H 10 7.810 7.810 8.267 -0.457 17919 2930 1 8 . 1 1 11 11 LYS N N 11 121.600 121.600 120.327 1.273 17919 2931 1 8 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.455 -0.094 17919 2932 1 8 . 1 1 11 11 LYS C C 11 175.940 175.940 175.191 0.749 17919 2933 1 8 . 1 1 11 11 LYS CA C 11 56.280 56.280 55.985 0.295 17919 2934 1 8 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.340 -0.140 17919 2935 1 8 . 1 1 11 11 LYS H H 11 7.280 7.280 7.800 -0.520 17919 2936 1 8 . 1 1 12 12 THR N N 12 120.440 120.440 115.884 4.556 17919 2937 1 8 . 1 1 12 12 THR HA H 12 5.046 5.046 5.178 -0.132 17919 2938 1 8 . 1 1 12 12 THR C C 12 174.320 174.320 174.394 -0.074 17919 2939 1 8 . 1 1 12 12 THR CA C 12 62.390 62.390 61.628 0.762 17919 2940 1 8 . 1 1 12 12 THR CB C 12 69.910 69.910 69.744 0.166 17919 2941 1 8 . 1 1 12 12 THR H H 12 8.650 8.650 8.370 0.280 17919 2942 1 8 . 1 1 13 13 ILE N N 13 127.110 127.110 123.682 3.428 17919 2943 1 8 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.726 -0.182 17919 2944 1 8 . 1 1 13 13 ILE C C 13 175.220 175.220 175.552 -0.332 17919 2945 1 8 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.332 0.648 17919 2946 1 8 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.142 0.808 17919 2947 1 8 . 1 1 13 13 ILE H H 13 9.450 9.450 9.034 0.416 17919 2948 1 8 . 1 1 14 14 THR N N 14 121.520 121.520 122.488 -0.968 17919 2949 1 8 . 1 1 14 14 THR HA H 14 4.964 4.964 4.662 0.302 17919 2950 1 8 . 1 1 14 14 THR C C 14 173.790 173.790 173.996 -0.206 17919 2951 1 8 . 1 1 14 14 THR CA C 14 61.940 61.940 62.980 -1.040 17919 2952 1 8 . 1 1 14 14 THR CB C 14 69.650 69.650 69.176 0.474 17919 2953 1 8 . 1 1 14 14 THR H H 14 8.710 8.710 8.488 0.222 17919 2954 1 8 . 1 1 15 15 LEU N N 15 124.800 124.800 127.702 -2.902 17919 2955 1 8 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.715 0.065 17919 2956 1 8 . 1 1 15 15 LEU C C 15 174.670 174.670 175.179 -0.509 17919 2957 1 8 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.843 -1.013 17919 2958 1 8 . 1 1 15 15 LEU CB C 15 47.070 47.070 44.704 2.366 17919 2959 1 8 . 1 1 15 15 LEU H H 15 8.710 8.710 8.074 0.636 17919 2960 1 8 . 1 1 16 16 GLU N N 16 122.160 122.160 122.472 -0.312 17919 2961 1 8 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.537 0.380 17919 2962 1 8 . 1 1 16 16 GLU C C 16 175.860 175.860 175.627 0.233 17919 2963 1 8 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.123 -0.303 17919 2964 1 8 . 1 1 16 16 GLU CB C 16 29.450 29.450 31.534 -2.083 17919 2965 1 8 . 1 1 16 16 GLU H H 16 8.140 8.140 8.671 -0.531 17919 2966 1 8 . 1 1 17 17 VAL N N 17 117.210 117.210 121.401 -4.191 17919 2967 1 8 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.610 0.104 17919 2968 1 8 . 1 1 17 17 VAL C C 17 174.160 174.160 174.868 -0.708 17919 2969 1 8 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.617 -1.187 17919 2970 1 8 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.607 0.793 17919 2971 1 8 . 1 1 17 17 VAL H H 17 8.900 8.900 8.128 0.772 17919 2972 1 8 . 1 1 18 18 GLU N N 18 118.990 118.990 120.618 -1.628 17919 2973 1 8 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.750 0.329 17919 2974 1 8 . 1 1 18 18 GLU C C 18 176.160 176.160 175.714 0.446 17919 2975 1 8 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.019 -0.298 17919 2976 1 8 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.303 0.007 17919 2977 1 8 . 1 1 18 18 GLU H H 18 8.640 8.640 8.673 -0.033 17919 2978 1 8 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.322 -0.181 17919 2979 1 8 . 1 1 19 19 PRO C C 19 175.310 175.310 177.387 -2.077 17919 2980 1 8 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.386 0.084 17919 2981 1 8 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.028 -0.078 17919 2982 1 8 . 1 1 20 20 SER N N 20 103.400 103.400 108.868 -5.468 17919 2983 1 8 . 1 1 20 20 SER HA H 20 4.370 4.370 4.362 0.008 17919 2984 1 8 . 1 1 20 20 SER C C 20 174.660 174.660 174.180 0.480 17919 2985 1 8 . 1 1 20 20 SER CA C 20 57.400 57.400 57.901 -0.501 17919 2986 1 8 . 1 1 20 20 SER CB C 20 63.370 63.370 62.822 0.548 17919 2987 1 8 . 1 1 20 20 SER H H 20 7.040 7.040 7.873 -0.833 17919 2988 1 8 . 1 1 21 21 ASP N N 21 123.480 123.480 125.235 -1.755 17919 2989 1 8 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.608 0.087 17919 2990 1 8 . 1 1 21 21 ASP C C 21 176.360 176.360 176.264 0.096 17919 2991 1 8 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.523 0.177 17919 2992 1 8 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.228 -0.428 17919 2993 1 8 . 1 1 21 21 ASP H H 21 8.030 8.030 7.874 0.156 17919 2994 1 8 . 1 1 22 22 THR N N 22 108.800 108.800 112.754 -3.954 17919 2995 1 8 . 1 1 22 22 THR HA H 22 4.920 4.920 4.613 0.307 17919 2996 1 8 . 1 1 22 22 THR C C 22 176.750 176.750 176.013 0.737 17919 2997 1 8 . 1 1 22 22 THR CA C 22 59.690 59.690 61.796 -2.106 17919 2998 1 8 . 1 1 22 22 THR CB C 22 71.200 71.200 70.378 0.822 17919 2999 1 8 . 1 1 22 22 THR H H 22 7.900 7.900 8.194 -0.294 17919 3000 1 8 . 1 1 23 23 ILE N N 23 121.190 121.190 122.457 -1.267 17919 3001 1 8 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.840 -0.183 17919 3002 1 8 . 1 1 23 23 ILE C C 23 179.040 179.040 177.728 1.312 17919 3003 1 8 . 1 1 23 23 ILE CA C 23 62.260 62.260 61.828 0.432 17919 3004 1 8 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.370 -2.020 17919 3005 1 8 . 1 1 23 23 ILE H H 23 8.560 8.560 8.779 -0.219 17919 3006 1 8 . 1 1 24 24 GLU N N 24 120.830 120.830 121.062 -0.232 17919 3007 1 8 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.907 0.010 17919 3008 1 8 . 1 1 24 24 GLU C C 24 178.640 178.640 178.631 0.009 17919 3009 1 8 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.833 0.387 17919 3010 1 8 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.643 -1.363 17919 3011 1 8 . 1 1 24 24 GLU H H 24 9.760 9.760 8.535 1.225 17919 3012 1 8 . 1 1 25 25 ASN N N 25 120.570 120.570 118.384 2.186 17919 3013 1 8 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.472 0.053 17919 3014 1 8 . 1 1 25 25 ASN C C 25 178.380 178.380 177.942 0.438 17919 3015 1 8 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.978 0.082 17919 3016 1 8 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.380 0.070 17919 3017 1 8 . 1 1 25 25 ASN H H 25 7.920 7.920 7.668 0.252 17919 3018 1 8 . 1 1 26 26 VAL N N 26 121.710 121.710 117.713 3.997 17919 3019 1 8 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.466 -0.069 17919 3020 1 8 . 1 1 26 26 VAL C C 26 177.950 177.950 178.192 -0.242 17919 3021 1 8 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.269 1.391 17919 3022 1 8 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.026 -0.186 17919 3023 1 8 . 1 1 26 26 VAL H H 26 8.070 8.070 7.954 0.116 17919 3024 1 8 . 1 1 27 27 LYS N N 27 118.860 118.860 120.014 -1.154 17919 3025 1 8 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.253 0.327 17919 3026 1 8 . 1 1 27 27 LYS C C 27 180.550 180.550 179.159 1.391 17919 3027 1 8 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.329 -0.079 17919 3028 1 8 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.237 1.493 17919 3029 1 8 . 1 1 27 27 LYS H H 27 8.560 8.560 7.670 0.890 17919 3030 1 8 . 1 1 28 28 ALA N N 28 123.440 123.440 120.671 2.769 17919 3031 1 8 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.066 0.094 17919 3032 1 8 . 1 1 28 28 ALA C C 28 180.300 180.300 179.060 1.240 17919 3033 1 8 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.040 0.330 17919 3034 1 8 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.379 -0.669 17919 3035 1 8 . 1 1 28 28 ALA H H 28 8.060 8.060 8.461 -0.401 17919 3036 1 8 . 1 1 29 29 LYS N N 29 119.940 119.940 119.459 0.481 17919 3037 1 8 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.051 0.156 17919 3038 1 8 . 1 1 29 29 LYS C C 29 180.320 180.320 179.168 1.152 17919 3039 1 8 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.231 0.419 17919 3040 1 8 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.345 0.945 17919 3041 1 8 . 1 1 29 29 LYS H H 29 7.850 7.850 7.470 0.380 17919 3042 1 8 . 1 1 30 30 ILE N N 30 121.080 121.080 120.225 0.855 17919 3043 1 8 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.669 -0.162 17919 3044 1 8 . 1 1 30 30 ILE C C 30 178.310 178.310 177.483 0.827 17919 3045 1 8 . 1 1 30 30 ILE CA C 30 66.150 66.150 64.778 1.373 17919 3046 1 8 . 1 1 30 30 ILE CB C 30 36.800 36.800 36.903 -0.103 17919 3047 1 8 . 1 1 30 30 ILE H H 30 8.280 8.280 8.329 -0.049 17919 3048 1 8 . 1 1 31 31 GLN N N 31 123.490 123.490 120.598 2.892 17919 3049 1 8 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.012 -0.183 17919 3050 1 8 . 1 1 31 31 GLN C C 31 178.890 178.890 177.996 0.894 17919 3051 1 8 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.337 0.663 17919 3052 1 8 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.330 -0.610 17919 3053 1 8 . 1 1 31 31 GLN H H 31 8.580 8.580 8.406 0.174 17919 3054 1 8 . 1 1 32 32 ASP N N 32 119.360 119.360 117.874 1.486 17919 3055 1 8 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.395 -0.041 17919 3056 1 8 . 1 1 32 32 ASP C C 32 177.250 177.250 177.719 -0.469 17919 3057 1 8 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.867 0.323 17919 3058 1 8 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.806 -0.226 17919 3059 1 8 . 1 1 32 32 ASP H H 32 8.010 8.010 7.777 0.233 17919 3060 1 8 . 1 1 33 33 LYS N N 33 115.130 115.130 118.763 -3.633 17919 3061 1 8 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.225 0.112 17919 3062 1 8 . 1 1 33 33 LYS C C 33 177.870 177.870 178.346 -0.476 17919 3063 1 8 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.999 0.051 17919 3064 1 8 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.727 0.443 17919 3065 1 8 . 1 1 33 33 LYS H H 33 7.430 7.430 7.474 -0.044 17919 3066 1 8 . 1 1 34 34 GLU N N 34 113.870 113.870 115.589 -1.719 17919 3067 1 8 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.461 0.164 17919 3068 1 8 . 1 1 34 34 GLU C C 34 177.840 177.840 176.348 1.492 17919 3069 1 8 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.068 -0.898 17919 3070 1 8 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.419 1.241 17919 3071 1 8 . 1 1 34 34 GLU H H 34 8.740 8.740 8.104 0.636 17919 3072 1 8 . 1 1 35 35 GLY N N 35 108.650 108.650 108.371 0.279 17919 3073 1 8 . 1 1 35 35 GLY C C 35 173.960 173.960 174.338 -0.378 17919 3074 1 8 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.514 0.566 17919 3075 1 8 . 1 1 35 35 GLY H H 35 8.530 8.530 7.871 0.659 17919 3076 1 8 . 1 1 36 36 ILE N N 36 119.880 119.880 120.142 -0.262 17919 3077 1 8 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.391 0.054 17919 3078 1 8 . 1 1 36 36 ILE C C 36 173.590 173.590 174.280 -0.690 17919 3079 1 8 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.806 -0.056 17919 3080 1 8 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.245 2.335 17919 3081 1 8 . 1 1 36 36 ILE H H 36 6.150 6.150 7.615 -1.465 17919 3082 1 8 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.449 0.185 17919 3083 1 8 . 1 1 37 37 PRO C C 37 176.940 176.940 176.167 0.773 17919 3084 1 8 . 1 1 37 37 PRO CA C 37 61.660 61.660 62.649 -0.989 17919 3085 1 8 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.499 0.351 17919 3086 1 8 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.147 -0.030 17919 3087 1 8 . 1 1 38 38 PRO C C 38 178.320 178.320 178.352 -0.032 17919 3088 1 8 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.348 0.912 17919 3089 1 8 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.898 0.992 17919 3090 1 8 . 1 1 39 39 ASP N N 39 113.380 113.380 117.901 -4.521 17919 3091 1 8 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.289 0.141 17919 3092 1 8 . 1 1 39 39 ASP C C 39 177.090 177.090 178.049 -0.959 17919 3093 1 8 . 1 1 39 39 ASP CA C 39 55.640 55.640 57.292 -1.652 17919 3094 1 8 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.426 -0.886 17919 3095 1 8 . 1 1 39 39 ASP H H 39 8.550 8.550 8.665 -0.115 17919 3096 1 8 . 1 1 40 40 GLN N N 40 116.780 116.780 117.972 -1.192 17919 3097 1 8 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.092 0.372 17919 3098 1 8 . 1 1 40 40 GLN C C 40 175.380 175.380 175.741 -0.361 17919 3099 1 8 . 1 1 40 40 GLN CA C 40 55.640 55.640 57.179 -1.539 17919 3100 1 8 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.115 1.025 17919 3101 1 8 . 1 1 40 40 GLN H H 40 7.820 7.820 7.641 0.179 17919 3102 1 8 . 1 1 41 41 GLN N N 41 117.720 117.720 118.679 -0.959 17919 3103 1 8 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.467 -0.223 17919 3104 1 8 . 1 1 41 41 GLN C C 41 176.300 176.300 174.447 1.853 17919 3105 1 8 . 1 1 41 41 GLN CA C 41 56.470 56.470 54.889 1.581 17919 3106 1 8 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.147 2.503 17919 3107 1 8 . 1 1 41 41 GLN H H 41 7.480 7.480 7.354 0.126 17919 3108 1 8 . 1 1 42 42 ARG N N 42 122.680 122.680 125.778 -3.098 17919 3109 1 8 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.467 0.033 17919 3110 1 8 . 1 1 42 42 ARG C C 42 174.050 174.050 174.125 -0.075 17919 3111 1 8 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.404 -0.354 17919 3112 1 8 . 1 1 42 42 ARG CB C 42 31.750 31.750 31.822 -0.072 17919 3113 1 8 . 1 1 42 42 ARG H H 42 8.530 8.530 7.818 0.712 17919 3114 1 8 . 1 1 43 43 LEU N N 43 124.040 124.040 127.316 -3.276 17919 3115 1 8 . 1 1 43 43 LEU C C 43 175.290 175.290 175.365 -0.075 17919 3116 1 8 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.451 -0.471 17919 3117 1 8 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.339 1.451 17919 3118 1 8 . 1 1 43 43 LEU H H 43 8.820 8.820 8.753 0.067 17919 3119 1 8 . 1 1 44 44 ILE N N 44 121.920 121.920 121.675 0.245 17919 3120 1 8 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.264 -0.272 17919 3121 1 8 . 1 1 44 44 ILE C C 44 176.060 176.060 173.442 2.618 17919 3122 1 8 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.143 -0.163 17919 3123 1 8 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.165 0.255 17919 3124 1 8 . 1 1 44 44 ILE H H 44 9.030 9.030 8.057 0.973 17919 3125 1 8 . 1 1 45 45 PHE N N 45 125.390 125.390 128.999 -3.609 17919 3126 1 8 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.107 -0.062 17919 3127 1 8 . 1 1 45 45 PHE C C 45 174.470 174.470 174.424 0.046 17919 3128 1 8 . 1 1 45 45 PHE CA C 45 57.020 57.020 57.149 -0.129 17919 3129 1 8 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.240 1.520 17919 3130 1 8 . 1 1 45 45 PHE H H 45 8.830 8.830 8.144 0.686 17919 3131 1 8 . 1 1 46 46 ALA N N 46 132.200 132.200 129.359 2.841 17919 3132 1 8 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.701 -0.011 17919 3133 1 8 . 1 1 46 46 ALA C C 46 177.290 177.290 177.241 0.049 17919 3134 1 8 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.822 -0.282 17919 3135 1 8 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.762 -0.192 17919 3136 1 8 . 1 1 46 46 ALA H H 46 8.810 8.810 8.725 0.085 17919 3137 1 8 . 1 1 47 47 GLY N N 47 102.340 102.340 104.568 -2.228 17919 3138 1 8 . 1 1 47 47 GLY C C 47 173.810 173.810 174.725 -0.915 17919 3139 1 8 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.475 -0.125 17919 3140 1 8 . 1 1 47 47 GLY H H 47 8.130 8.130 8.440 -0.310 17919 3141 1 8 . 1 1 48 48 LYS N N 48 121.570 121.570 121.251 0.319 17919 3142 1 8 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.348 0.274 17919 3143 1 8 . 1 1 48 48 LYS C C 48 174.700 174.700 175.804 -1.104 17919 3144 1 8 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.477 -0.927 17919 3145 1 8 . 1 1 48 48 LYS CB C 48 34.530 34.530 33.246 1.284 17919 3146 1 8 . 1 1 48 48 LYS H H 48 7.980 7.980 7.621 0.359 17919 3147 1 8 . 1 1 49 49 GLN N N 49 122.410 122.410 125.796 -3.386 17919 3148 1 8 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.242 0.318 17919 3149 1 8 . 1 1 49 49 GLN C C 49 175.670 175.670 175.629 0.041 17919 3150 1 8 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.720 0.020 17919 3151 1 8 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.082 -0.082 17919 3152 1 8 . 1 1 49 49 GLN H H 49 8.600 8.600 8.607 -0.007 17919 3153 1 8 . 1 1 50 50 LEU N N 50 125.520 125.520 128.145 -2.625 17919 3154 1 8 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.122 -0.032 17919 3155 1 8 . 1 1 50 50 LEU C C 50 176.660 176.660 176.285 0.375 17919 3156 1 8 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.850 -0.610 17919 3157 1 8 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.316 -0.746 17919 3158 1 8 . 1 1 50 50 LEU H H 50 8.530 8.530 8.448 0.082 17919 3159 1 8 . 1 1 51 51 GLU N N 51 122.940 122.940 122.996 -0.056 17919 3160 1 8 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.607 -0.119 17919 3161 1 8 . 1 1 51 51 GLU C C 51 175.870 175.870 176.799 -0.929 17919 3162 1 8 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.015 0.945 17919 3163 1 8 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.995 -0.425 17919 3164 1 8 . 1 1 51 51 GLU H H 51 8.400 8.400 8.977 -0.577 17919 3165 1 8 . 1 1 52 52 ASP N N 52 120.030 120.030 127.191 -7.161 17919 3166 1 8 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.311 0.048 17919 3167 1 8 . 1 1 52 52 ASP C C 52 177.330 177.330 178.014 -0.684 17919 3168 1 8 . 1 1 52 52 ASP CA C 52 56.960 56.960 58.543 -1.583 17919 3169 1 8 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.582 0.268 17919 3170 1 8 . 1 1 52 52 ASP H H 52 8.160 8.160 8.928 -0.768 17919 3171 1 8 . 1 1 53 53 GLY N N 53 106.660 106.660 104.903 1.757 17919 3172 1 8 . 1 1 53 53 GLY C C 53 174.870 174.870 174.444 0.426 17919 3173 1 8 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.972 0.198 17919 3174 1 8 . 1 1 53 53 GLY H H 53 9.390 9.390 8.393 0.997 17919 3175 1 8 . 1 1 54 54 ARG N N 54 119.050 119.050 121.492 -2.442 17919 3176 1 8 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.633 0.062 17919 3177 1 8 . 1 1 54 54 ARG C C 54 175.350 175.350 175.015 0.335 17919 3178 1 8 . 1 1 54 54 ARG CA C 54 54.390 54.390 55.002 -0.612 17919 3179 1 8 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.531 0.119 17919 3180 1 8 . 1 1 54 54 ARG H H 54 7.460 7.460 7.845 -0.385 17919 3181 1 8 . 1 1 55 55 THR N N 55 108.400 108.400 111.405 -3.005 17919 3182 1 8 . 1 1 55 55 THR HA H 55 5.240 5.240 5.119 0.121 17919 3183 1 8 . 1 1 55 55 THR C C 55 176.560 176.560 176.538 0.022 17919 3184 1 8 . 1 1 55 55 THR CA C 55 59.690 59.690 59.838 -0.148 17919 3185 1 8 . 1 1 55 55 THR CB C 55 72.260 72.260 71.707 0.553 17919 3186 1 8 . 1 1 55 55 THR H H 55 8.730 8.730 8.717 0.013 17919 3187 1 8 . 1 1 56 56 LEU N N 56 117.920 117.920 121.004 -3.084 17919 3188 1 8 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.933 0.127 17919 3189 1 8 . 1 1 56 56 LEU C C 56 180.810 180.810 179.045 1.765 17919 3190 1 8 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.516 0.194 17919 3191 1 8 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.290 -0.920 17919 3192 1 8 . 1 1 56 56 LEU H H 56 8.140 8.140 8.367 -0.227 17919 3193 1 8 . 1 1 57 57 SER N N 57 113.330 113.330 113.697 -0.367 17919 3194 1 8 . 1 1 57 57 SER HA H 57 4.370 4.370 4.311 0.059 17919 3195 1 8 . 1 1 57 57 SER C C 57 178.310 178.310 177.235 1.075 17919 3196 1 8 . 1 1 57 57 SER CA C 57 61.080 61.080 60.560 0.520 17919 3197 1 8 . 1 1 57 57 SER CB C 57 62.530 62.530 62.212 0.318 17919 3198 1 8 . 1 1 57 57 SER H H 57 8.470 8.470 7.906 0.564 17919 3199 1 8 . 1 1 58 58 ASP N N 58 124.190 124.190 125.048 -0.858 17919 3200 1 8 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.233 0.063 17919 3201 1 8 . 1 1 58 58 ASP C C 58 177.400 177.400 177.381 0.019 17919 3202 1 8 . 1 1 58 58 ASP CA C 58 57.180 57.180 57.149 0.031 17919 3203 1 8 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.122 -0.022 17919 3204 1 8 . 1 1 58 58 ASP H H 58 7.930 7.930 7.750 0.180 17919 3205 1 8 . 1 1 59 59 TYR N N 59 115.510 115.510 115.157 0.353 17919 3206 1 8 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.612 0.058 17919 3207 1 8 . 1 1 59 59 TYR C C 59 174.700 174.700 175.629 -0.929 17919 3208 1 8 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.845 0.405 17919 3209 1 8 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.404 1.666 17919 3210 1 8 . 1 1 59 59 TYR H H 59 7.250 7.250 7.303 -0.053 17919 3211 1 8 . 1 1 60 60 ASN N N 60 115.900 115.900 116.228 -0.328 17919 3212 1 8 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.361 -0.006 17919 3213 1 8 . 1 1 60 60 ASN C C 60 174.340 174.340 174.445 -0.105 17919 3214 1 8 . 1 1 60 60 ASN CA C 60 54.120 54.120 53.951 0.169 17919 3215 1 8 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.348 0.062 17919 3216 1 8 . 1 1 60 60 ASN H H 60 8.150 8.150 7.813 0.337 17919 3217 1 8 . 1 1 61 61 ILE N N 61 118.600 118.600 119.121 -0.521 17919 3218 1 8 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.884 -0.491 17919 3219 1 8 . 1 1 61 61 ILE C C 61 174.610 174.610 174.984 -0.374 17919 3220 1 8 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.506 -0.086 17919 3221 1 8 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.856 -1.116 17919 3222 1 8 . 1 1 61 61 ILE H H 61 7.250 7.250 7.987 -0.737 17919 3223 1 8 . 1 1 62 62 GLN N N 62 124.740 124.740 124.531 0.209 17919 3224 1 8 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.831 -0.325 17919 3225 1 8 . 1 1 62 62 GLN C C 62 175.970 175.970 175.267 0.703 17919 3226 1 8 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.367 0.293 17919 3227 1 8 . 1 1 62 62 GLN CB C 62 31.650 31.650 32.059 -0.409 17919 3228 1 8 . 1 1 62 62 GLN H H 62 7.610 7.610 7.888 -0.278 17919 3229 1 8 . 1 1 63 63 LYS N N 63 120.300 120.300 121.596 -1.296 17919 3230 1 8 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.856 0.145 17919 3231 1 8 . 1 1 63 63 LYS C C 63 175.810 175.810 176.620 -0.810 17919 3232 1 8 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.935 -0.145 17919 3233 1 8 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.786 0.864 17919 3234 1 8 . 1 1 63 63 LYS H H 63 8.490 8.490 8.631 -0.141 17919 3235 1 8 . 1 1 64 64 GLU N N 64 113.950 113.950 119.594 -5.644 17919 3236 1 8 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.538 -0.073 17919 3237 1 8 . 1 1 64 64 GLU C C 64 175.250 175.250 175.178 0.072 17919 3238 1 8 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.556 0.334 17919 3239 1 8 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.264 -2.364 17919 3240 1 8 . 1 1 64 64 GLU H H 64 9.280 9.280 8.641 0.639 17919 3241 1 8 . 1 1 65 65 SER N N 65 114.730 114.730 114.040 0.690 17919 3242 1 8 . 1 1 65 65 SER HA H 65 4.640 4.640 4.618 0.022 17919 3243 1 8 . 1 1 65 65 SER C C 65 172.160 172.160 173.384 -1.224 17919 3244 1 8 . 1 1 65 65 SER CA C 65 60.890 60.890 58.750 2.140 17919 3245 1 8 . 1 1 65 65 SER CB C 65 64.910 64.910 65.332 -0.422 17919 3246 1 8 . 1 1 65 65 SER H H 65 7.670 7.670 7.391 0.279 17919 3247 1 8 . 1 1 66 66 THR N N 66 117.110 117.110 117.440 -0.330 17919 3248 1 8 . 1 1 66 66 THR HA H 66 5.270 5.270 5.090 0.180 17919 3249 1 8 . 1 1 66 66 THR C C 66 173.950 173.950 173.094 0.856 17919 3250 1 8 . 1 1 66 66 THR CA C 66 62.340 62.340 61.287 1.053 17919 3251 1 8 . 1 1 66 66 THR CB C 66 70.080 70.080 70.922 -0.842 17919 3252 1 8 . 1 1 66 66 THR H H 66 8.730 8.730 8.296 0.434 17919 3253 1 8 . 1 1 67 67 LEU N N 67 127.110 127.110 125.187 1.923 17919 3254 1 8 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.470 0.590 17919 3255 1 8 . 1 1 67 67 LEU C C 67 175.770 175.770 175.580 0.190 17919 3256 1 8 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.130 0.770 17919 3257 1 8 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.590 0.670 17919 3258 1 8 . 1 1 67 67 LEU H H 67 9.410 9.410 7.989 1.421 17919 3259 1 8 . 1 1 68 68 HIS N N 68 118.380 118.380 120.635 -2.255 17919 3260 1 8 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.031 0.209 17919 3261 1 8 . 1 1 68 68 HIS C C 68 173.150 173.150 174.586 -1.436 17919 3262 1 8 . 1 1 68 68 HIS CA C 68 55.000 55.000 55.103 -0.103 17919 3263 1 8 . 1 1 68 68 HIS CB C 68 30.530 30.530 29.503 1.027 17919 3264 1 8 . 1 1 68 68 HIS H H 68 9.230 9.230 8.103 1.127 17919 3265 1 8 . 1 1 69 69 LEU N N 69 124.460 124.460 128.129 -3.669 17919 3266 1 8 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.821 0.369 17919 3267 1 8 . 1 1 69 69 LEU C C 69 175.270 175.270 175.470 -0.200 17919 3268 1 8 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.904 -0.014 17919 3269 1 8 . 1 1 69 69 LEU CB C 69 44.380 44.380 43.426 0.954 17919 3270 1 8 . 1 1 69 69 LEU H H 69 8.340 8.340 7.962 0.378 17919 3271 1 8 . 1 1 70 70 VAL N N 70 126.940 126.940 124.767 2.173 17919 3272 1 8 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.527 -0.177 17919 3273 1 8 . 1 1 70 70 VAL C C 70 174.000 174.000 174.029 -0.029 17919 3274 1 8 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.322 0.478 17919 3275 1 8 . 1 1 70 70 VAL CB C 70 34.910 34.910 34.216 0.694 17919 3276 1 8 . 1 1 70 70 VAL H H 70 9.200 9.200 7.880 1.320 17919 3277 1 8 . 1 1 71 71 LEU N N 71 123.130 123.130 127.460 -4.330 17919 3278 1 8 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.712 0.348 17919 3279 1 8 . 1 1 71 71 LEU C C 71 177.830 177.830 177.461 0.369 17919 3280 1 8 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.650 0.290 17919 3281 1 8 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.906 -0.056 17919 3282 1 8 . 1 1 71 71 LEU H H 71 8.120 8.120 8.574 -0.454 17919 3283 1 8 . 1 1 72 72 ARG N N 72 123.490 123.490 124.398 -0.908 17919 3284 1 8 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.289 0.012 17919 3285 1 8 . 1 1 72 72 ARG C C 72 175.350 175.350 175.706 -0.356 17919 3286 1 8 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.926 -1.316 17919 3287 1 8 . 1 1 72 72 ARG CB C 72 31.350 31.350 28.978 2.372 17919 3288 1 8 . 1 1 72 72 ARG H H 72 8.580 8.580 8.251 0.329 17919 3289 1 9 . 1 1 2 2 GLN N N 2 123.220 123.220 119.147 4.073 17919 3290 1 9 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.197 0.052 17919 3291 1 9 . 1 1 2 2 GLN C C 2 175.920 175.920 174.168 1.752 17919 3292 1 9 . 1 1 2 2 GLN CA C 2 55.080 55.080 55.189 -0.109 17919 3293 1 9 . 1 1 2 2 GLN CB C 2 30.760 30.760 32.586 -1.826 17919 3294 1 9 . 1 1 2 2 GLN H H 2 8.900 8.900 8.338 0.562 17919 3295 1 9 . 1 1 3 3 ILE N N 3 115.340 115.340 117.315 -1.975 17919 3296 1 9 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.326 -0.113 17919 3297 1 9 . 1 1 3 3 ILE C C 3 172.450 172.450 173.058 -0.608 17919 3298 1 9 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.681 -0.111 17919 3299 1 9 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.699 0.511 17919 3300 1 9 . 1 1 3 3 ILE H H 3 8.320 8.320 8.174 0.146 17919 3301 1 9 . 1 1 4 4 PHE N N 4 118.110 118.110 120.100 -1.990 17919 3302 1 9 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.087 0.543 17919 3303 1 9 . 1 1 4 4 PHE C C 4 175.320 175.320 175.375 -0.055 17919 3304 1 9 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.239 -0.029 17919 3305 1 9 . 1 1 4 4 PHE CB C 4 41.480 41.480 40.948 0.532 17919 3306 1 9 . 1 1 4 4 PHE H H 4 8.610 8.610 8.170 0.440 17919 3307 1 9 . 1 1 5 5 VAL N N 5 121.000 121.000 122.652 -1.652 17919 3308 1 9 . 1 1 5 5 VAL HA H 5 4.725 4.725 5.068 -0.343 17919 3309 1 9 . 1 1 5 5 VAL C C 5 174.870 174.870 174.798 0.072 17919 3310 1 9 . 1 1 5 5 VAL CA C 5 60.620 60.620 60.903 -0.283 17919 3311 1 9 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.580 -0.350 17919 3312 1 9 . 1 1 5 5 VAL H H 5 9.300 9.300 8.620 0.680 17919 3313 1 9 . 1 1 6 6 LYS N N 6 127.520 127.520 127.570 -0.050 17919 3314 1 9 . 1 1 6 6 LYS HA H 6 5.367 5.367 4.978 0.389 17919 3315 1 9 . 1 1 6 6 LYS C C 6 177.140 177.140 176.135 1.005 17919 3316 1 9 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.664 -0.144 17919 3317 1 9 . 1 1 6 6 LYS CB C 6 35.050 35.050 33.934 1.116 17919 3318 1 9 . 1 1 6 6 LYS H H 6 8.820 8.820 9.064 -0.244 17919 3319 1 9 . 1 1 7 7 THR N N 7 115.400 115.400 114.643 0.757 17919 3320 1 9 . 1 1 7 7 THR HA H 7 4.970 4.970 4.460 0.510 17919 3321 1 9 . 1 1 7 7 THR C C 7 176.910 176.910 176.846 0.064 17919 3322 1 9 . 1 1 7 7 THR CA C 7 60.470 60.470 59.809 0.661 17919 3323 1 9 . 1 1 7 7 THR CB C 7 70.630 70.630 70.498 0.132 17919 3324 1 9 . 1 1 7 7 THR H H 7 8.730 8.730 8.040 0.690 17919 3325 1 9 . 1 1 8 8 LEU N N 8 121.330 121.330 120.762 0.568 17919 3326 1 9 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.050 0.260 17919 3327 1 9 . 1 1 8 8 LEU C C 8 178.800 178.800 177.800 1.000 17919 3328 1 9 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.347 0.233 17919 3329 1 9 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.070 0.900 17919 3330 1 9 . 1 1 8 8 LEU H H 8 9.100 9.100 8.832 0.268 17919 3331 1 9 . 1 1 9 9 THR N N 9 105.590 105.590 107.807 -2.217 17919 3332 1 9 . 1 1 9 9 THR HA H 9 4.428 4.428 4.433 -0.005 17919 3333 1 9 . 1 1 9 9 THR C C 9 175.520 175.520 175.396 0.124 17919 3334 1 9 . 1 1 9 9 THR CA C 9 61.400 61.400 60.956 0.444 17919 3335 1 9 . 1 1 9 9 THR CB C 9 69.140 69.140 68.833 0.307 17919 3336 1 9 . 1 1 9 9 THR H H 9 7.630 7.630 7.434 0.196 17919 3337 1 9 . 1 1 10 10 GLY N N 10 108.890 108.890 110.335 -1.445 17919 3338 1 9 . 1 1 10 10 GLY C C 10 174.070 174.070 174.584 -0.514 17919 3339 1 9 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.771 -0.311 17919 3340 1 9 . 1 1 10 10 GLY H H 10 7.810 7.810 8.049 -0.239 17919 3341 1 9 . 1 1 11 11 LYS N N 11 121.600 121.600 120.598 1.002 17919 3342 1 9 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.433 -0.072 17919 3343 1 9 . 1 1 11 11 LYS C C 11 175.940 175.940 175.319 0.621 17919 3344 1 9 . 1 1 11 11 LYS CA C 11 56.280 56.280 55.621 0.659 17919 3345 1 9 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.464 -0.264 17919 3346 1 9 . 1 1 11 11 LYS H H 11 7.280 7.280 7.658 -0.378 17919 3347 1 9 . 1 1 12 12 THR N N 12 120.440 120.440 120.394 0.046 17919 3348 1 9 . 1 1 12 12 THR HA H 12 5.046 5.046 5.067 -0.021 17919 3349 1 9 . 1 1 12 12 THR C C 12 174.320 174.320 174.415 -0.095 17919 3350 1 9 . 1 1 12 12 THR CA C 12 62.390 62.390 61.497 0.893 17919 3351 1 9 . 1 1 12 12 THR CB C 12 69.910 69.910 69.053 0.857 17919 3352 1 9 . 1 1 12 12 THR H H 12 8.650 8.650 8.308 0.342 17919 3353 1 9 . 1 1 13 13 ILE N N 13 127.110 127.110 124.313 2.797 17919 3354 1 9 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.620 -0.076 17919 3355 1 9 . 1 1 13 13 ILE C C 13 175.220 175.220 174.721 0.499 17919 3356 1 9 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.367 0.613 17919 3357 1 9 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.624 0.326 17919 3358 1 9 . 1 1 13 13 ILE H H 13 9.450 9.450 8.847 0.603 17919 3359 1 9 . 1 1 14 14 THR N N 14 121.520 121.520 119.541 1.979 17919 3360 1 9 . 1 1 14 14 THR HA H 14 4.964 4.964 4.882 0.082 17919 3361 1 9 . 1 1 14 14 THR C C 14 173.790 173.790 173.708 0.082 17919 3362 1 9 . 1 1 14 14 THR CA C 14 61.940 61.940 61.966 -0.026 17919 3363 1 9 . 1 1 14 14 THR CB C 14 69.650 69.650 70.272 -0.622 17919 3364 1 9 . 1 1 14 14 THR H H 14 8.710 8.710 8.453 0.257 17919 3365 1 9 . 1 1 15 15 LEU N N 15 124.800 124.800 125.610 -0.810 17919 3366 1 9 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.818 -0.038 17919 3367 1 9 . 1 1 15 15 LEU C C 15 174.670 174.670 175.015 -0.345 17919 3368 1 9 . 1 1 15 15 LEU CA C 15 52.830 52.830 54.012 -1.182 17919 3369 1 9 . 1 1 15 15 LEU CB C 15 47.070 47.070 44.454 2.616 17919 3370 1 9 . 1 1 15 15 LEU H H 15 8.710 8.710 8.440 0.270 17919 3371 1 9 . 1 1 16 16 GLU N N 16 122.160 122.160 124.200 -2.040 17919 3372 1 9 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.824 0.093 17919 3373 1 9 . 1 1 16 16 GLU C C 16 175.860 175.860 176.049 -0.189 17919 3374 1 9 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.460 -0.640 17919 3375 1 9 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.153 -0.703 17919 3376 1 9 . 1 1 16 16 GLU H H 16 8.140 8.140 8.523 -0.383 17919 3377 1 9 . 1 1 17 17 VAL N N 17 117.210 117.210 119.570 -2.360 17919 3378 1 9 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.466 0.248 17919 3379 1 9 . 1 1 17 17 VAL C C 17 174.160 174.160 174.727 -0.567 17919 3380 1 9 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.334 -0.904 17919 3381 1 9 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.045 1.355 17919 3382 1 9 . 1 1 17 17 VAL H H 17 8.900 8.900 7.934 0.966 17919 3383 1 9 . 1 1 18 18 GLU N N 18 118.990 118.990 120.887 -1.897 17919 3384 1 9 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.888 0.191 17919 3385 1 9 . 1 1 18 18 GLU C C 18 176.160 176.160 175.471 0.689 17919 3386 1 9 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.715 0.005 17919 3387 1 9 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.732 -0.422 17919 3388 1 9 . 1 1 18 18 GLU H H 18 8.640 8.640 8.267 0.373 17919 3389 1 9 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.404 -0.263 17919 3390 1 9 . 1 1 19 19 PRO C C 19 175.310 175.310 177.513 -2.203 17919 3391 1 9 . 1 1 19 19 PRO CA C 19 65.470 65.470 64.939 0.531 17919 3392 1 9 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.968 -0.018 17919 3393 1 9 . 1 1 20 20 SER N N 20 103.400 103.400 110.204 -6.804 17919 3394 1 9 . 1 1 20 20 SER HA H 20 4.370 4.370 4.346 0.024 17919 3395 1 9 . 1 1 20 20 SER C C 20 174.660 174.660 174.286 0.374 17919 3396 1 9 . 1 1 20 20 SER CA C 20 57.400 57.400 58.593 -1.193 17919 3397 1 9 . 1 1 20 20 SER CB C 20 63.370 63.370 62.553 0.816 17919 3398 1 9 . 1 1 20 20 SER H H 20 7.040 7.040 7.938 -0.898 17919 3399 1 9 . 1 1 21 21 ASP N N 21 123.480 123.480 124.304 -0.824 17919 3400 1 9 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.798 -0.103 17919 3401 1 9 . 1 1 21 21 ASP C C 21 176.360 176.360 175.671 0.689 17919 3402 1 9 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.875 0.825 17919 3403 1 9 . 1 1 21 21 ASP CB C 21 40.800 40.800 42.318 -1.518 17919 3404 1 9 . 1 1 21 21 ASP H H 21 8.030 8.030 7.697 0.333 17919 3405 1 9 . 1 1 22 22 THR N N 22 108.800 108.800 112.888 -4.088 17919 3406 1 9 . 1 1 22 22 THR HA H 22 4.920 4.920 4.692 0.228 17919 3407 1 9 . 1 1 22 22 THR C C 22 176.750 176.750 176.036 0.714 17919 3408 1 9 . 1 1 22 22 THR CA C 22 59.690 59.690 61.160 -1.470 17919 3409 1 9 . 1 1 22 22 THR CB C 22 71.200 71.200 70.193 1.007 17919 3410 1 9 . 1 1 22 22 THR H H 22 7.900 7.900 8.361 -0.461 17919 3411 1 9 . 1 1 23 23 ILE N N 23 121.190 121.190 122.833 -1.643 17919 3412 1 9 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.685 -0.028 17919 3413 1 9 . 1 1 23 23 ILE C C 23 179.040 179.040 177.557 1.483 17919 3414 1 9 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.507 -1.247 17919 3415 1 9 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.537 -2.187 17919 3416 1 9 . 1 1 23 23 ILE H H 23 8.560 8.560 9.047 -0.487 17919 3417 1 9 . 1 1 24 24 GLU N N 24 120.830 120.830 119.807 1.023 17919 3418 1 9 . 1 1 24 24 GLU HA H 24 3.917 3.917 4.029 -0.112 17919 3419 1 9 . 1 1 24 24 GLU C C 24 178.640 178.640 178.749 -0.109 17919 3420 1 9 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.827 0.393 17919 3421 1 9 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.436 -1.156 17919 3422 1 9 . 1 1 24 24 GLU H H 24 9.760 9.760 7.881 1.879 17919 3423 1 9 . 1 1 25 25 ASN N N 25 120.570 120.570 117.581 2.989 17919 3424 1 9 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.568 -0.043 17919 3425 1 9 . 1 1 25 25 ASN C C 25 178.380 178.380 178.025 0.355 17919 3426 1 9 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.541 0.519 17919 3427 1 9 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.317 0.133 17919 3428 1 9 . 1 1 25 25 ASN H H 25 7.920 7.920 7.555 0.365 17919 3429 1 9 . 1 1 26 26 VAL N N 26 121.710 121.710 120.373 1.337 17919 3430 1 9 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.673 -0.276 17919 3431 1 9 . 1 1 26 26 VAL C C 26 177.950 177.950 177.745 0.205 17919 3432 1 9 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.301 1.359 17919 3433 1 9 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.115 -0.275 17919 3434 1 9 . 1 1 26 26 VAL H H 26 8.070 8.070 8.383 -0.313 17919 3435 1 9 . 1 1 27 27 LYS N N 27 118.860 118.860 119.565 -0.705 17919 3436 1 9 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.286 0.294 17919 3437 1 9 . 1 1 27 27 LYS C C 27 180.550 180.550 179.026 1.524 17919 3438 1 9 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.295 -0.045 17919 3439 1 9 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.118 1.612 17919 3440 1 9 . 1 1 27 27 LYS H H 27 8.560 8.560 7.938 0.622 17919 3441 1 9 . 1 1 28 28 ALA N N 28 123.440 123.440 122.259 1.181 17919 3442 1 9 . 1 1 28 28 ALA HA H 28 4.160 4.160 3.956 0.204 17919 3443 1 9 . 1 1 28 28 ALA C C 28 180.300 180.300 179.040 1.260 17919 3444 1 9 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.763 -0.393 17919 3445 1 9 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.465 -0.755 17919 3446 1 9 . 1 1 28 28 ALA H H 28 8.060 8.060 7.932 0.128 17919 3447 1 9 . 1 1 29 29 LYS N N 29 119.940 119.940 117.774 2.166 17919 3448 1 9 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.146 0.061 17919 3449 1 9 . 1 1 29 29 LYS C C 29 180.320 180.320 178.819 1.501 17919 3450 1 9 . 1 1 29 29 LYS CA C 29 59.650 59.650 58.888 0.762 17919 3451 1 9 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.306 0.984 17919 3452 1 9 . 1 1 29 29 LYS H H 29 7.850 7.850 7.283 0.567 17919 3453 1 9 . 1 1 30 30 ILE N N 30 121.080 121.080 120.736 0.344 17919 3454 1 9 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.647 -0.140 17919 3455 1 9 . 1 1 30 30 ILE C C 30 178.310 178.310 177.382 0.928 17919 3456 1 9 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.233 0.917 17919 3457 1 9 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.648 -0.848 17919 3458 1 9 . 1 1 30 30 ILE H H 30 8.280 8.280 8.017 0.263 17919 3459 1 9 . 1 1 31 31 GLN N N 31 123.490 123.490 120.056 3.434 17919 3460 1 9 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.075 -0.246 17919 3461 1 9 . 1 1 31 31 GLN C C 31 178.890 178.890 178.407 0.483 17919 3462 1 9 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.036 0.964 17919 3463 1 9 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.489 -0.769 17919 3464 1 9 . 1 1 31 31 GLN H H 31 8.580 8.580 8.034 0.546 17919 3465 1 9 . 1 1 32 32 ASP N N 32 119.360 119.360 119.446 -0.086 17919 3466 1 9 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.414 -0.060 17919 3467 1 9 . 1 1 32 32 ASP C C 32 177.250 177.250 177.809 -0.559 17919 3468 1 9 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.762 0.428 17919 3469 1 9 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.781 -0.201 17919 3470 1 9 . 1 1 32 32 ASP H H 32 8.010 8.010 7.843 0.167 17919 3471 1 9 . 1 1 33 33 LYS N N 33 115.130 115.130 117.823 -2.693 17919 3472 1 9 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.377 -0.040 17919 3473 1 9 . 1 1 33 33 LYS C C 33 177.870 177.870 178.348 -0.478 17919 3474 1 9 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.761 0.289 17919 3475 1 9 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.876 0.294 17919 3476 1 9 . 1 1 33 33 LYS H H 33 7.430 7.430 7.536 -0.106 17919 3477 1 9 . 1 1 34 34 GLU N N 34 113.870 113.870 117.290 -3.420 17919 3478 1 9 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.421 0.204 17919 3479 1 9 . 1 1 34 34 GLU C C 34 177.840 177.840 177.309 0.531 17919 3480 1 9 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.376 -1.206 17919 3481 1 9 . 1 1 34 34 GLU CB C 34 32.660 32.660 30.813 1.847 17919 3482 1 9 . 1 1 34 34 GLU H H 34 8.740 8.740 7.846 0.894 17919 3483 1 9 . 1 1 35 35 GLY N N 35 108.650 108.650 109.068 -0.418 17919 3484 1 9 . 1 1 35 35 GLY C C 35 173.960 173.960 174.454 -0.494 17919 3485 1 9 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.642 0.438 17919 3486 1 9 . 1 1 35 35 GLY H H 35 8.530 8.530 8.346 0.184 17919 3487 1 9 . 1 1 36 36 ILE N N 36 119.880 119.880 117.578 2.302 17919 3488 1 9 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.510 -0.065 17919 3489 1 9 . 1 1 36 36 ILE C C 36 173.590 173.590 173.966 -0.376 17919 3490 1 9 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.608 0.143 17919 3491 1 9 . 1 1 36 36 ILE CB C 36 40.580 40.580 37.947 2.632 17919 3492 1 9 . 1 1 36 36 ILE H H 36 6.150 6.150 7.455 -1.305 17919 3493 1 9 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.863 -0.229 17919 3494 1 9 . 1 1 37 37 PRO C C 37 176.940 176.940 176.999 -0.059 17919 3495 1 9 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.445 0.215 17919 3496 1 9 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.012 0.838 17919 3497 1 9 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.199 -0.082 17919 3498 1 9 . 1 1 38 38 PRO C C 38 178.320 178.320 177.261 1.059 17919 3499 1 9 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.499 0.761 17919 3500 1 9 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.757 1.133 17919 3501 1 9 . 1 1 39 39 ASP N N 39 113.380 113.380 114.839 -1.459 17919 3502 1 9 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.488 -0.058 17919 3503 1 9 . 1 1 39 39 ASP C C 39 177.090 177.090 178.327 -1.237 17919 3504 1 9 . 1 1 39 39 ASP CA C 39 55.640 55.640 55.352 0.288 17919 3505 1 9 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.386 -0.846 17919 3506 1 9 . 1 1 39 39 ASP H H 39 8.550 8.550 8.460 0.090 17919 3507 1 9 . 1 1 40 40 GLN N N 40 116.780 116.780 118.005 -1.225 17919 3508 1 9 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.236 0.228 17919 3509 1 9 . 1 1 40 40 GLN C C 40 175.380 175.380 175.926 -0.546 17919 3510 1 9 . 1 1 40 40 GLN CA C 40 55.640 55.640 57.809 -2.169 17919 3511 1 9 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.675 0.465 17919 3512 1 9 . 1 1 40 40 GLN H H 40 7.820 7.820 7.634 0.186 17919 3513 1 9 . 1 1 41 41 GLN N N 41 117.720 117.720 117.943 -0.223 17919 3514 1 9 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.714 -0.470 17919 3515 1 9 . 1 1 41 41 GLN C C 41 176.300 176.300 175.542 0.758 17919 3516 1 9 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.932 0.538 17919 3517 1 9 . 1 1 41 41 GLN CB C 41 31.650 31.650 30.344 1.306 17919 3518 1 9 . 1 1 41 41 GLN H H 41 7.480 7.480 7.185 0.295 17919 3519 1 9 . 1 1 42 42 ARG N N 42 122.680 122.680 120.513 2.167 17919 3520 1 9 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.715 -0.215 17919 3521 1 9 . 1 1 42 42 ARG C C 42 174.050 174.050 174.395 -0.345 17919 3522 1 9 . 1 1 42 42 ARG CA C 42 55.050 55.050 53.363 1.687 17919 3523 1 9 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.571 -1.821 17919 3524 1 9 . 1 1 42 42 ARG H H 42 8.530 8.530 8.567 -0.037 17919 3525 1 9 . 1 1 43 43 LEU N N 43 124.040 124.040 124.388 -0.348 17919 3526 1 9 . 1 1 43 43 LEU C C 43 175.290 175.290 174.711 0.579 17919 3527 1 9 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.171 -1.191 17919 3528 1 9 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.190 2.600 17919 3529 1 9 . 1 1 43 43 LEU H H 43 8.820 8.820 8.870 -0.050 17919 3530 1 9 . 1 1 44 44 ILE N N 44 121.920 121.920 122.229 -0.309 17919 3531 1 9 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.986 0.006 17919 3532 1 9 . 1 1 44 44 ILE C C 44 176.060 176.060 174.639 1.421 17919 3533 1 9 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.231 -1.251 17919 3534 1 9 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.817 -0.397 17919 3535 1 9 . 1 1 44 44 ILE H H 44 9.030 9.030 7.938 1.092 17919 3536 1 9 . 1 1 45 45 PHE N N 45 125.390 125.390 127.092 -1.702 17919 3537 1 9 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.963 0.082 17919 3538 1 9 . 1 1 45 45 PHE C C 45 174.470 174.470 174.074 0.396 17919 3539 1 9 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.654 0.366 17919 3540 1 9 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.762 0.998 17919 3541 1 9 . 1 1 45 45 PHE H H 45 8.830 8.830 9.155 -0.325 17919 3542 1 9 . 1 1 46 46 ALA N N 46 132.200 132.200 130.954 1.246 17919 3543 1 9 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.701 -0.011 17919 3544 1 9 . 1 1 46 46 ALA C C 46 177.290 177.290 177.513 -0.223 17919 3545 1 9 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.513 0.027 17919 3546 1 9 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.472 0.098 17919 3547 1 9 . 1 1 46 46 ALA H H 46 8.810 8.810 8.732 0.078 17919 3548 1 9 . 1 1 47 47 GLY N N 47 102.340 102.340 105.140 -2.800 17919 3549 1 9 . 1 1 47 47 GLY C C 47 173.810 173.810 174.277 -0.467 17919 3550 1 9 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.293 0.057 17919 3551 1 9 . 1 1 47 47 GLY H H 47 8.130 8.130 8.552 -0.422 17919 3552 1 9 . 1 1 48 48 LYS N N 48 121.570 121.570 120.287 1.283 17919 3553 1 9 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.591 0.031 17919 3554 1 9 . 1 1 48 48 LYS C C 48 174.700 174.700 175.219 -0.519 17919 3555 1 9 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.020 -0.470 17919 3556 1 9 . 1 1 48 48 LYS CB C 48 34.530 34.530 35.158 -0.628 17919 3557 1 9 . 1 1 48 48 LYS H H 48 7.980 7.980 7.817 0.163 17919 3558 1 9 . 1 1 49 49 GLN N N 49 122.410 122.410 122.824 -0.414 17919 3559 1 9 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.596 -0.036 17919 3560 1 9 . 1 1 49 49 GLN C C 49 175.670 175.670 175.775 -0.105 17919 3561 1 9 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.894 -0.154 17919 3562 1 9 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.967 -0.967 17919 3563 1 9 . 1 1 49 49 GLN H H 49 8.600 8.600 8.602 -0.002 17919 3564 1 9 . 1 1 50 50 LEU N N 50 125.520 125.520 126.690 -1.170 17919 3565 1 9 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.081 0.009 17919 3566 1 9 . 1 1 50 50 LEU C C 50 176.660 176.660 175.938 0.722 17919 3567 1 9 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.784 0.456 17919 3568 1 9 . 1 1 50 50 LEU CB C 50 41.570 41.570 40.736 0.834 17919 3569 1 9 . 1 1 50 50 LEU H H 50 8.530 8.530 8.868 -0.338 17919 3570 1 9 . 1 1 51 51 GLU N N 51 122.940 122.940 124.595 -1.655 17919 3571 1 9 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.303 0.185 17919 3572 1 9 . 1 1 51 51 GLU C C 51 175.870 175.870 177.075 -1.205 17919 3573 1 9 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.385 0.575 17919 3574 1 9 . 1 1 51 51 GLU CB C 51 31.570 31.570 30.782 0.788 17919 3575 1 9 . 1 1 51 51 GLU H H 51 8.400 8.400 8.408 -0.008 17919 3576 1 9 . 1 1 52 52 ASP N N 52 120.030 120.030 121.484 -1.454 17919 3577 1 9 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.624 -0.265 17919 3578 1 9 . 1 1 52 52 ASP C C 52 177.330 177.330 177.146 0.184 17919 3579 1 9 . 1 1 52 52 ASP CA C 52 56.960 56.960 56.224 0.736 17919 3580 1 9 . 1 1 52 52 ASP CB C 52 40.850 40.850 41.007 -0.157 17919 3581 1 9 . 1 1 52 52 ASP H H 52 8.160 8.160 8.820 -0.660 17919 3582 1 9 . 1 1 53 53 GLY N N 53 106.660 106.660 106.295 0.365 17919 3583 1 9 . 1 1 53 53 GLY C C 53 174.870 174.870 174.170 0.700 17919 3584 1 9 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.240 -0.070 17919 3585 1 9 . 1 1 53 53 GLY H H 53 9.390 9.390 8.694 0.696 17919 3586 1 9 . 1 1 54 54 ARG N N 54 119.050 119.050 119.432 -0.382 17919 3587 1 9 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.521 0.174 17919 3588 1 9 . 1 1 54 54 ARG C C 54 175.350 175.350 175.121 0.229 17919 3589 1 9 . 1 1 54 54 ARG CA C 54 54.390 54.390 53.995 0.395 17919 3590 1 9 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.941 -0.291 17919 3591 1 9 . 1 1 54 54 ARG H H 54 7.460 7.460 7.214 0.246 17919 3592 1 9 . 1 1 55 55 THR N N 55 108.400 108.400 111.824 -3.424 17919 3593 1 9 . 1 1 55 55 THR HA H 55 5.240 5.240 5.210 0.030 17919 3594 1 9 . 1 1 55 55 THR C C 55 176.560 176.560 176.169 0.391 17919 3595 1 9 . 1 1 55 55 THR CA C 55 59.690 59.690 59.852 -0.162 17919 3596 1 9 . 1 1 55 55 THR CB C 55 72.260 72.260 71.761 0.499 17919 3597 1 9 . 1 1 55 55 THR H H 55 8.730 8.730 8.445 0.285 17919 3598 1 9 . 1 1 56 56 LEU N N 56 117.920 117.920 121.052 -3.132 17919 3599 1 9 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.941 0.119 17919 3600 1 9 . 1 1 56 56 LEU C C 56 180.810 180.810 178.818 1.992 17919 3601 1 9 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.505 0.205 17919 3602 1 9 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.383 -1.013 17919 3603 1 9 . 1 1 56 56 LEU H H 56 8.140 8.140 8.215 -0.075 17919 3604 1 9 . 1 1 57 57 SER N N 57 113.330 113.330 113.961 -0.631 17919 3605 1 9 . 1 1 57 57 SER HA H 57 4.370 4.370 4.240 0.130 17919 3606 1 9 . 1 1 57 57 SER C C 57 178.310 178.310 176.676 1.634 17919 3607 1 9 . 1 1 57 57 SER CA C 57 61.080 61.080 61.716 -0.636 17919 3608 1 9 . 1 1 57 57 SER CB C 57 62.530 62.530 62.874 -0.345 17919 3609 1 9 . 1 1 57 57 SER H H 57 8.470 8.470 7.957 0.513 17919 3610 1 9 . 1 1 58 58 ASP N N 58 124.190 124.190 122.878 1.312 17919 3611 1 9 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.371 -0.075 17919 3612 1 9 . 1 1 58 58 ASP C C 58 177.400 177.400 177.334 0.066 17919 3613 1 9 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.607 0.573 17919 3614 1 9 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.541 -0.442 17919 3615 1 9 . 1 1 58 58 ASP H H 58 7.930 7.930 7.728 0.202 17919 3616 1 9 . 1 1 59 59 TYR N N 59 115.510 115.510 115.818 -0.308 17919 3617 1 9 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.631 0.039 17919 3618 1 9 . 1 1 59 59 TYR C C 59 174.700 174.700 174.737 -0.037 17919 3619 1 9 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.215 1.035 17919 3620 1 9 . 1 1 59 59 TYR CB C 59 40.070 40.070 39.009 1.061 17919 3621 1 9 . 1 1 59 59 TYR H H 59 7.250 7.250 7.382 -0.132 17919 3622 1 9 . 1 1 60 60 ASN N N 60 115.900 115.900 119.241 -3.341 17919 3623 1 9 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.373 -0.018 17919 3624 1 9 . 1 1 60 60 ASN C C 60 174.340 174.340 174.631 -0.291 17919 3625 1 9 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.121 -0.001 17919 3626 1 9 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.180 0.230 17919 3627 1 9 . 1 1 60 60 ASN H H 60 8.150 8.150 7.651 0.499 17919 3628 1 9 . 1 1 61 61 ILE N N 61 118.600 118.600 120.585 -1.985 17919 3629 1 9 . 1 1 61 61 ILE HA H 61 3.393 3.393 4.033 -0.640 17919 3630 1 9 . 1 1 61 61 ILE C C 61 174.610 174.610 174.591 0.019 17919 3631 1 9 . 1 1 61 61 ILE CA C 61 62.420 62.420 60.973 1.447 17919 3632 1 9 . 1 1 61 61 ILE CB C 61 36.740 36.740 38.734 -1.994 17919 3633 1 9 . 1 1 61 61 ILE H H 61 7.250 7.250 8.189 -0.939 17919 3634 1 9 . 1 1 62 62 GLN N N 62 124.740 124.740 123.859 0.881 17919 3635 1 9 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.661 -0.155 17919 3636 1 9 . 1 1 62 62 GLN C C 62 175.970 175.970 175.093 0.877 17919 3637 1 9 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.414 0.246 17919 3638 1 9 . 1 1 62 62 GLN CB C 62 31.650 31.650 30.932 0.718 17919 3639 1 9 . 1 1 62 62 GLN H H 62 7.610 7.610 8.136 -0.526 17919 3640 1 9 . 1 1 63 63 LYS N N 63 120.300 120.300 120.376 -0.076 17919 3641 1 9 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.074 -0.073 17919 3642 1 9 . 1 1 63 63 LYS C C 63 175.810 175.810 176.913 -1.103 17919 3643 1 9 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.627 0.163 17919 3644 1 9 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.090 1.560 17919 3645 1 9 . 1 1 63 63 LYS H H 63 8.490 8.490 8.604 -0.114 17919 3646 1 9 . 1 1 64 64 GLU N N 64 113.950 113.950 118.516 -4.566 17919 3647 1 9 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.105 0.360 17919 3648 1 9 . 1 1 64 64 GLU C C 64 175.250 175.250 175.829 -0.579 17919 3649 1 9 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.818 0.072 17919 3650 1 9 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.300 -2.400 17919 3651 1 9 . 1 1 64 64 GLU H H 64 9.280 9.280 8.810 0.470 17919 3652 1 9 . 1 1 65 65 SER N N 65 114.730 114.730 114.692 0.038 17919 3653 1 9 . 1 1 65 65 SER HA H 65 4.640 4.640 4.430 0.210 17919 3654 1 9 . 1 1 65 65 SER C C 65 172.160 172.160 174.243 -2.083 17919 3655 1 9 . 1 1 65 65 SER CA C 65 60.890 60.890 60.315 0.575 17919 3656 1 9 . 1 1 65 65 SER CB C 65 64.910 64.910 64.113 0.797 17919 3657 1 9 . 1 1 65 65 SER H H 65 7.670 7.670 7.843 -0.173 17919 3658 1 9 . 1 1 66 66 THR N N 66 117.110 117.110 122.712 -5.602 17919 3659 1 9 . 1 1 66 66 THR HA H 66 5.270 5.270 4.884 0.386 17919 3660 1 9 . 1 1 66 66 THR C C 66 173.950 173.950 174.501 -0.551 17919 3661 1 9 . 1 1 66 66 THR CA C 66 62.340 62.340 62.864 -0.524 17919 3662 1 9 . 1 1 66 66 THR CB C 66 70.080 70.080 69.345 0.735 17919 3663 1 9 . 1 1 66 66 THR H H 66 8.730 8.730 8.385 0.345 17919 3664 1 9 . 1 1 67 67 LEU N N 67 127.110 127.110 127.307 -0.197 17919 3665 1 9 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.945 0.115 17919 3666 1 9 . 1 1 67 67 LEU C C 67 175.770 175.770 175.452 0.318 17919 3667 1 9 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.008 -0.108 17919 3668 1 9 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.534 -0.274 17919 3669 1 9 . 1 1 67 67 LEU H H 67 9.410 9.410 9.098 0.312 17919 3670 1 9 . 1 1 68 68 HIS N N 68 118.380 118.380 121.813 -3.433 17919 3671 1 9 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.336 -0.096 17919 3672 1 9 . 1 1 68 68 HIS C C 68 173.150 173.150 175.669 -2.519 17919 3673 1 9 . 1 1 68 68 HIS CA C 68 55.000 55.000 53.527 1.473 17919 3674 1 9 . 1 1 68 68 HIS CB C 68 30.530 30.530 30.341 0.189 17919 3675 1 9 . 1 1 68 68 HIS H H 68 9.230 9.230 8.386 0.844 17919 3676 1 9 . 1 1 69 69 LEU N N 69 124.460 124.460 125.824 -1.364 17919 3677 1 9 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.792 0.398 17919 3678 1 9 . 1 1 69 69 LEU C C 69 175.270 175.270 175.043 0.227 17919 3679 1 9 . 1 1 69 69 LEU CA C 69 53.890 53.890 55.618 -1.728 17919 3680 1 9 . 1 1 69 69 LEU CB C 69 44.380 44.380 42.778 1.602 17919 3681 1 9 . 1 1 69 69 LEU H H 69 8.340 8.340 7.943 0.397 17919 3682 1 9 . 1 1 70 70 VAL N N 70 126.940 126.940 113.613 13.327 17919 3683 1 9 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.493 -0.143 17919 3684 1 9 . 1 1 70 70 VAL C C 70 174.000 174.000 174.317 -0.317 17919 3685 1 9 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.491 1.309 17919 3686 1 9 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.314 -0.404 17919 3687 1 9 . 1 1 70 70 VAL H H 70 9.200 9.200 8.893 0.307 17919 3688 1 9 . 1 1 71 71 LEU N N 71 123.130 123.130 121.728 1.402 17919 3689 1 9 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.020 0.040 17919 3690 1 9 . 1 1 71 71 LEU C C 71 177.830 177.830 177.471 0.359 17919 3691 1 9 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.210 0.730 17919 3692 1 9 . 1 1 71 71 LEU CB C 71 42.850 42.850 41.887 0.963 17919 3693 1 9 . 1 1 71 71 LEU H H 71 8.120 8.120 8.207 -0.087 17919 3694 1 9 . 1 1 72 72 ARG N N 72 123.490 123.490 125.658 -2.168 17919 3695 1 9 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.205 0.096 17919 3696 1 9 . 1 1 72 72 ARG C C 72 175.350 175.350 175.509 -0.159 17919 3697 1 9 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.847 -1.237 17919 3698 1 9 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.918 0.432 17919 3699 1 9 . 1 1 72 72 ARG H H 72 8.580 8.580 8.163 0.417 17919 3700 1 10 . 1 1 2 2 GLN N N 2 123.220 123.220 121.192 2.028 17919 3701 1 10 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.186 0.063 17919 3702 1 10 . 1 1 2 2 GLN C C 2 175.920 175.920 175.865 0.055 17919 3703 1 10 . 1 1 2 2 GLN CA C 2 55.080 55.080 55.201 -0.121 17919 3704 1 10 . 1 1 2 2 GLN CB C 2 30.760 30.760 29.483 1.277 17919 3705 1 10 . 1 1 2 2 GLN H H 2 8.900 8.900 8.462 0.438 17919 3706 1 10 . 1 1 3 3 ILE N N 3 115.340 115.340 117.833 -2.493 17919 3707 1 10 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.535 -0.322 17919 3708 1 10 . 1 1 3 3 ILE C C 3 172.450 172.450 174.098 -1.648 17919 3709 1 10 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.283 0.287 17919 3710 1 10 . 1 1 3 3 ILE CB C 3 42.210 42.210 40.566 1.644 17919 3711 1 10 . 1 1 3 3 ILE H H 3 8.320 8.320 8.330 -0.010 17919 3712 1 10 . 1 1 4 4 PHE N N 4 118.110 118.110 119.260 -1.150 17919 3713 1 10 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.061 0.569 17919 3714 1 10 . 1 1 4 4 PHE C C 4 175.320 175.320 175.406 -0.086 17919 3715 1 10 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.837 -0.627 17919 3716 1 10 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.604 -0.124 17919 3717 1 10 . 1 1 4 4 PHE H H 4 8.610 8.610 8.743 -0.133 17919 3718 1 10 . 1 1 5 5 VAL N N 5 121.000 121.000 120.236 0.764 17919 3719 1 10 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.837 -0.112 17919 3720 1 10 . 1 1 5 5 VAL C C 5 174.870 174.870 174.797 0.073 17919 3721 1 10 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.164 -0.544 17919 3722 1 10 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.703 -0.473 17919 3723 1 10 . 1 1 5 5 VAL H H 5 9.300 9.300 8.589 0.711 17919 3724 1 10 . 1 1 6 6 LYS N N 6 127.520 127.520 128.997 -1.477 17919 3725 1 10 . 1 1 6 6 LYS HA H 6 5.367 5.367 4.644 0.723 17919 3726 1 10 . 1 1 6 6 LYS C C 6 177.140 177.140 175.951 1.189 17919 3727 1 10 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.945 -0.425 17919 3728 1 10 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.097 0.953 17919 3729 1 10 . 1 1 6 6 LYS H H 6 8.820 8.820 8.824 -0.004 17919 3730 1 10 . 1 1 7 7 THR N N 7 115.400 115.400 117.263 -1.863 17919 3731 1 10 . 1 1 7 7 THR HA H 7 4.970 4.970 4.577 0.393 17919 3732 1 10 . 1 1 7 7 THR C C 7 176.910 176.910 176.207 0.703 17919 3733 1 10 . 1 1 7 7 THR CA C 7 60.470 60.470 59.805 0.665 17919 3734 1 10 . 1 1 7 7 THR CB C 7 70.630 70.630 71.041 -0.411 17919 3735 1 10 . 1 1 7 7 THR H H 7 8.730 8.730 7.902 0.828 17919 3736 1 10 . 1 1 8 8 LEU N N 8 121.330 121.330 121.900 -0.570 17919 3737 1 10 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.155 0.155 17919 3738 1 10 . 1 1 8 8 LEU C C 8 178.800 178.800 177.214 1.586 17919 3739 1 10 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.987 -0.407 17919 3740 1 10 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.177 -0.207 17919 3741 1 10 . 1 1 8 8 LEU H H 8 9.100 9.100 8.647 0.453 17919 3742 1 10 . 1 1 9 9 THR N N 9 105.590 105.590 107.562 -1.972 17919 3743 1 10 . 1 1 9 9 THR HA H 9 4.428 4.428 4.264 0.164 17919 3744 1 10 . 1 1 9 9 THR C C 9 175.520 175.520 175.574 -0.054 17919 3745 1 10 . 1 1 9 9 THR CA C 9 61.400 61.400 61.993 -0.593 17919 3746 1 10 . 1 1 9 9 THR CB C 9 69.140 69.140 68.038 1.102 17919 3747 1 10 . 1 1 9 9 THR H H 9 7.630 7.630 7.680 -0.050 17919 3748 1 10 . 1 1 10 10 GLY N N 10 108.890 108.890 110.396 -1.506 17919 3749 1 10 . 1 1 10 10 GLY C C 10 174.070 174.070 173.895 0.175 17919 3750 1 10 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.349 0.111 17919 3751 1 10 . 1 1 10 10 GLY H H 10 7.810 7.810 7.939 -0.129 17919 3752 1 10 . 1 1 11 11 LYS N N 11 121.600 121.600 122.822 -1.222 17919 3753 1 10 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.382 -0.021 17919 3754 1 10 . 1 1 11 11 LYS C C 11 175.940 175.940 175.653 0.287 17919 3755 1 10 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.417 -0.137 17919 3756 1 10 . 1 1 11 11 LYS CB C 11 33.200 33.200 32.500 0.700 17919 3757 1 10 . 1 1 11 11 LYS H H 11 7.280 7.280 7.646 -0.366 17919 3758 1 10 . 1 1 12 12 THR N N 12 120.440 120.440 119.697 0.743 17919 3759 1 10 . 1 1 12 12 THR HA H 12 5.046 5.046 5.187 -0.141 17919 3760 1 10 . 1 1 12 12 THR C C 12 174.320 174.320 174.451 -0.131 17919 3761 1 10 . 1 1 12 12 THR CA C 12 62.390 62.390 61.067 1.323 17919 3762 1 10 . 1 1 12 12 THR CB C 12 69.910 69.910 70.022 -0.112 17919 3763 1 10 . 1 1 12 12 THR H H 12 8.650 8.650 8.270 0.380 17919 3764 1 10 . 1 1 13 13 ILE N N 13 127.110 127.110 124.075 3.035 17919 3765 1 10 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.679 -0.135 17919 3766 1 10 . 1 1 13 13 ILE C C 13 175.220 175.220 174.830 0.390 17919 3767 1 10 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.823 0.157 17919 3768 1 10 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.076 0.874 17919 3769 1 10 . 1 1 13 13 ILE H H 13 9.450 9.450 8.293 1.157 17919 3770 1 10 . 1 1 14 14 THR N N 14 121.520 121.520 119.761 1.759 17919 3771 1 10 . 1 1 14 14 THR HA H 14 4.964 4.964 5.196 -0.232 17919 3772 1 10 . 1 1 14 14 THR C C 14 173.790 173.790 173.776 0.014 17919 3773 1 10 . 1 1 14 14 THR CA C 14 61.940 61.940 61.976 -0.036 17919 3774 1 10 . 1 1 14 14 THR CB C 14 69.650 69.650 70.418 -0.768 17919 3775 1 10 . 1 1 14 14 THR H H 14 8.710 8.710 8.302 0.408 17919 3776 1 10 . 1 1 15 15 LEU N N 15 124.800 124.800 125.711 -0.911 17919 3777 1 10 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.777 0.003 17919 3778 1 10 . 1 1 15 15 LEU C C 15 174.670 174.670 175.173 -0.503 17919 3779 1 10 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.767 -0.937 17919 3780 1 10 . 1 1 15 15 LEU CB C 15 47.070 47.070 44.737 2.333 17919 3781 1 10 . 1 1 15 15 LEU H H 15 8.710 8.710 8.523 0.187 17919 3782 1 10 . 1 1 16 16 GLU N N 16 122.160 122.160 123.598 -1.438 17919 3783 1 10 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.469 0.448 17919 3784 1 10 . 1 1 16 16 GLU C C 16 175.860 175.860 175.418 0.442 17919 3785 1 10 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.246 -0.426 17919 3786 1 10 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.375 -0.925 17919 3787 1 10 . 1 1 16 16 GLU H H 16 8.140 8.140 8.727 -0.587 17919 3788 1 10 . 1 1 17 17 VAL N N 17 117.210 117.210 122.800 -5.590 17919 3789 1 10 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.580 0.134 17919 3790 1 10 . 1 1 17 17 VAL C C 17 174.160 174.160 174.570 -0.410 17919 3791 1 10 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.788 -1.358 17919 3792 1 10 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.599 0.801 17919 3793 1 10 . 1 1 17 17 VAL H H 17 8.900 8.900 7.900 1.000 17919 3794 1 10 . 1 1 18 18 GLU N N 18 118.990 118.990 120.877 -1.887 17919 3795 1 10 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.696 0.383 17919 3796 1 10 . 1 1 18 18 GLU C C 18 176.160 176.160 175.910 0.250 17919 3797 1 10 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.483 -0.763 17919 3798 1 10 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.243 0.067 17919 3799 1 10 . 1 1 18 18 GLU H H 18 8.640 8.640 8.106 0.534 17919 3800 1 10 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.248 -0.107 17919 3801 1 10 . 1 1 19 19 PRO C C 19 175.310 175.310 178.048 -2.738 17919 3802 1 10 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.737 -0.267 17919 3803 1 10 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.869 0.081 17919 3804 1 10 . 1 1 20 20 SER N N 20 103.400 103.400 110.361 -6.961 17919 3805 1 10 . 1 1 20 20 SER HA H 20 4.370 4.370 4.392 -0.022 17919 3806 1 10 . 1 1 20 20 SER C C 20 174.660 174.660 174.138 0.522 17919 3807 1 10 . 1 1 20 20 SER CA C 20 57.400 57.400 58.837 -1.437 17919 3808 1 10 . 1 1 20 20 SER CB C 20 63.370 63.370 62.723 0.647 17919 3809 1 10 . 1 1 20 20 SER H H 20 7.040 7.040 8.111 -1.071 17919 3810 1 10 . 1 1 21 21 ASP N N 21 123.480 123.480 122.810 0.670 17919 3811 1 10 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.736 -0.041 17919 3812 1 10 . 1 1 21 21 ASP C C 21 176.360 176.360 175.309 1.051 17919 3813 1 10 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.636 1.064 17919 3814 1 10 . 1 1 21 21 ASP CB C 21 40.800 40.800 42.268 -1.468 17919 3815 1 10 . 1 1 21 21 ASP H H 21 8.030 8.030 7.437 0.593 17919 3816 1 10 . 1 1 22 22 THR N N 22 108.800 108.800 115.130 -6.330 17919 3817 1 10 . 1 1 22 22 THR HA H 22 4.920 4.920 4.425 0.495 17919 3818 1 10 . 1 1 22 22 THR C C 22 176.750 176.750 175.939 0.811 17919 3819 1 10 . 1 1 22 22 THR CA C 22 59.690 59.690 62.278 -2.588 17919 3820 1 10 . 1 1 22 22 THR CB C 22 71.200 71.200 69.990 1.210 17919 3821 1 10 . 1 1 22 22 THR H H 22 7.900 7.900 8.091 -0.191 17919 3822 1 10 . 1 1 23 23 ILE N N 23 121.190 121.190 123.404 -2.214 17919 3823 1 10 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.654 0.003 17919 3824 1 10 . 1 1 23 23 ILE C C 23 179.040 179.040 177.680 1.360 17919 3825 1 10 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.248 -0.988 17919 3826 1 10 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.691 -2.341 17919 3827 1 10 . 1 1 23 23 ILE H H 23 8.560 8.560 9.184 -0.624 17919 3828 1 10 . 1 1 24 24 GLU N N 24 120.830 120.830 119.010 1.820 17919 3829 1 10 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.906 0.011 17919 3830 1 10 . 1 1 24 24 GLU C C 24 178.640 178.640 178.242 0.398 17919 3831 1 10 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.523 0.698 17919 3832 1 10 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.312 -1.032 17919 3833 1 10 . 1 1 24 24 GLU H H 24 9.760 9.760 8.370 1.390 17919 3834 1 10 . 1 1 25 25 ASN N N 25 120.570 120.570 117.112 3.458 17919 3835 1 10 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.638 -0.113 17919 3836 1 10 . 1 1 25 25 ASN C C 25 178.380 178.380 177.614 0.766 17919 3837 1 10 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.264 0.797 17919 3838 1 10 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.284 0.166 17919 3839 1 10 . 1 1 25 25 ASN H H 25 7.920 7.920 7.747 0.173 17919 3840 1 10 . 1 1 26 26 VAL N N 26 121.710 121.710 120.689 1.021 17919 3841 1 10 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.485 -0.088 17919 3842 1 10 . 1 1 26 26 VAL C C 26 177.950 177.950 177.716 0.234 17919 3843 1 10 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.887 0.773 17919 3844 1 10 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.191 -0.351 17919 3845 1 10 . 1 1 26 26 VAL H H 26 8.070 8.070 7.838 0.232 17919 3846 1 10 . 1 1 27 27 LYS N N 27 118.860 118.860 119.440 -0.580 17919 3847 1 10 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.178 0.402 17919 3848 1 10 . 1 1 27 27 LYS C C 27 180.550 180.550 178.918 1.632 17919 3849 1 10 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.357 -0.107 17919 3850 1 10 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.019 1.711 17919 3851 1 10 . 1 1 27 27 LYS H H 27 8.560 8.560 7.441 1.119 17919 3852 1 10 . 1 1 28 28 ALA N N 28 123.440 123.440 122.418 1.022 17919 3853 1 10 . 1 1 28 28 ALA HA H 28 4.160 4.160 3.980 0.180 17919 3854 1 10 . 1 1 28 28 ALA C C 28 180.300 180.300 179.143 1.157 17919 3855 1 10 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.389 -0.019 17919 3856 1 10 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.354 -0.644 17919 3857 1 10 . 1 1 28 28 ALA H H 28 8.060 8.060 7.860 0.200 17919 3858 1 10 . 1 1 29 29 LYS N N 29 119.940 119.940 119.219 0.721 17919 3859 1 10 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.034 0.173 17919 3860 1 10 . 1 1 29 29 LYS C C 29 180.320 180.320 179.320 1.000 17919 3861 1 10 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.425 0.225 17919 3862 1 10 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.358 0.932 17919 3863 1 10 . 1 1 29 29 LYS H H 29 7.850 7.850 7.370 0.480 17919 3864 1 10 . 1 1 30 30 ILE N N 30 121.080 121.080 120.929 0.151 17919 3865 1 10 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.573 -0.066 17919 3866 1 10 . 1 1 30 30 ILE C C 30 178.310 178.310 177.527 0.783 17919 3867 1 10 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.662 0.488 17919 3868 1 10 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.567 -0.767 17919 3869 1 10 . 1 1 30 30 ILE H H 30 8.280 8.280 8.360 -0.080 17919 3870 1 10 . 1 1 31 31 GLN N N 31 123.490 123.490 120.110 3.380 17919 3871 1 10 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.047 -0.218 17919 3872 1 10 . 1 1 31 31 GLN C C 31 178.890 178.890 178.550 0.340 17919 3873 1 10 . 1 1 31 31 GLN CA C 31 60.000 60.000 58.932 1.068 17919 3874 1 10 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.573 -0.853 17919 3875 1 10 . 1 1 31 31 GLN H H 31 8.580 8.580 8.322 0.258 17919 3876 1 10 . 1 1 32 32 ASP N N 32 119.360 119.360 119.309 0.051 17919 3877 1 10 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.416 -0.062 17919 3878 1 10 . 1 1 32 32 ASP C C 32 177.250 177.250 177.768 -0.518 17919 3879 1 10 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.805 0.385 17919 3880 1 10 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.763 -0.183 17919 3881 1 10 . 1 1 32 32 ASP H H 32 8.010 8.010 8.218 -0.208 17919 3882 1 10 . 1 1 33 33 LYS N N 33 115.130 115.130 119.120 -3.990 17919 3883 1 10 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.249 0.088 17919 3884 1 10 . 1 1 33 33 LYS C C 33 177.870 177.870 178.141 -0.271 17919 3885 1 10 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.433 -0.383 17919 3886 1 10 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.633 0.537 17919 3887 1 10 . 1 1 33 33 LYS H H 33 7.430 7.430 7.580 -0.150 17919 3888 1 10 . 1 1 34 34 GLU N N 34 113.870 113.870 115.185 -1.315 17919 3889 1 10 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.481 0.144 17919 3890 1 10 . 1 1 34 34 GLU C C 34 177.840 177.840 177.053 0.787 17919 3891 1 10 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.146 -0.976 17919 3892 1 10 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.603 1.057 17919 3893 1 10 . 1 1 34 34 GLU H H 34 8.740 8.740 7.927 0.813 17919 3894 1 10 . 1 1 35 35 GLY N N 35 108.650 108.650 110.284 -1.634 17919 3895 1 10 . 1 1 35 35 GLY C C 35 173.960 173.960 174.624 -0.664 17919 3896 1 10 . 1 1 35 35 GLY CA C 35 46.080 46.080 46.346 -0.266 17919 3897 1 10 . 1 1 35 35 GLY H H 35 8.530 8.530 8.095 0.435 17919 3898 1 10 . 1 1 36 36 ILE N N 36 119.880 119.880 117.375 2.505 17919 3899 1 10 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.486 -0.041 17919 3900 1 10 . 1 1 36 36 ILE C C 36 173.590 173.590 174.154 -0.564 17919 3901 1 10 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.834 -0.083 17919 3902 1 10 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.430 2.150 17919 3903 1 10 . 1 1 36 36 ILE H H 36 6.150 6.150 7.452 -1.302 17919 3904 1 10 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.904 -0.270 17919 3905 1 10 . 1 1 37 37 PRO C C 37 176.940 176.940 176.670 0.270 17919 3906 1 10 . 1 1 37 37 PRO CA C 37 61.660 61.660 60.495 1.165 17919 3907 1 10 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.374 0.476 17919 3908 1 10 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.091 0.026 17919 3909 1 10 . 1 1 38 38 PRO C C 38 178.320 178.320 178.637 -0.317 17919 3910 1 10 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.998 0.262 17919 3911 1 10 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.617 1.273 17919 3912 1 10 . 1 1 39 39 ASP N N 39 113.380 113.380 115.506 -2.126 17919 3913 1 10 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.342 0.088 17919 3914 1 10 . 1 1 39 39 ASP C C 39 177.090 177.090 177.087 0.003 17919 3915 1 10 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.467 -0.827 17919 3916 1 10 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.429 -0.889 17919 3917 1 10 . 1 1 39 39 ASP H H 39 8.550 8.550 8.638 -0.088 17919 3918 1 10 . 1 1 40 40 GLN N N 40 116.780 116.780 115.169 1.611 17919 3919 1 10 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.512 -0.048 17919 3920 1 10 . 1 1 40 40 GLN C C 40 175.380 175.380 175.717 -0.337 17919 3921 1 10 . 1 1 40 40 GLN CA C 40 55.640 55.640 54.635 1.006 17919 3922 1 10 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.458 0.682 17919 3923 1 10 . 1 1 40 40 GLN H H 40 7.820 7.820 8.273 -0.453 17919 3924 1 10 . 1 1 41 41 GLN N N 41 117.720 117.720 120.026 -2.306 17919 3925 1 10 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.457 -0.213 17919 3926 1 10 . 1 1 41 41 GLN C C 41 176.300 176.300 175.918 0.382 17919 3927 1 10 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.317 0.153 17919 3928 1 10 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.613 2.037 17919 3929 1 10 . 1 1 41 41 GLN H H 41 7.480 7.480 7.352 0.128 17919 3930 1 10 . 1 1 42 42 ARG N N 42 122.680 122.680 123.646 -0.966 17919 3931 1 10 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.594 -0.094 17919 3932 1 10 . 1 1 42 42 ARG C C 42 174.050 174.050 174.980 -0.930 17919 3933 1 10 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.212 0.838 17919 3934 1 10 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.619 -0.869 17919 3935 1 10 . 1 1 42 42 ARG H H 42 8.530 8.530 7.890 0.640 17919 3936 1 10 . 1 1 43 43 LEU N N 43 124.040 124.040 123.505 0.535 17919 3937 1 10 . 1 1 43 43 LEU C C 43 175.290 175.290 176.335 -1.045 17919 3938 1 10 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.937 -0.957 17919 3939 1 10 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.262 2.528 17919 3940 1 10 . 1 1 43 43 LEU H H 43 8.820 8.820 8.561 0.259 17919 3941 1 10 . 1 1 44 44 ILE N N 44 121.920 121.920 121.664 0.256 17919 3942 1 10 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.870 0.122 17919 3943 1 10 . 1 1 44 44 ILE C C 44 176.060 176.060 174.356 1.704 17919 3944 1 10 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.768 -1.788 17919 3945 1 10 . 1 1 44 44 ILE CB C 44 41.420 41.420 42.330 -0.910 17919 3946 1 10 . 1 1 44 44 ILE H H 44 9.030 9.030 8.715 0.315 17919 3947 1 10 . 1 1 45 45 PHE N N 45 125.390 125.390 126.336 -0.946 17919 3948 1 10 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.965 0.080 17919 3949 1 10 . 1 1 45 45 PHE C C 45 174.470 174.470 174.430 0.040 17919 3950 1 10 . 1 1 45 45 PHE CA C 45 57.020 57.020 57.525 -0.505 17919 3951 1 10 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.183 0.577 17919 3952 1 10 . 1 1 45 45 PHE H H 45 8.830 8.830 8.826 0.004 17919 3953 1 10 . 1 1 46 46 ALA N N 46 132.200 132.200 129.649 2.551 17919 3954 1 10 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.604 0.086 17919 3955 1 10 . 1 1 46 46 ALA C C 46 177.290 177.290 177.515 -0.225 17919 3956 1 10 . 1 1 46 46 ALA CA C 46 52.540 52.540 53.256 -0.716 17919 3957 1 10 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.848 -0.278 17919 3958 1 10 . 1 1 46 46 ALA H H 46 8.810 8.810 8.732 0.078 17919 3959 1 10 . 1 1 47 47 GLY N N 47 102.340 102.340 103.695 -1.355 17919 3960 1 10 . 1 1 47 47 GLY C C 47 173.810 173.810 174.359 -0.549 17919 3961 1 10 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.421 -0.071 17919 3962 1 10 . 1 1 47 47 GLY H H 47 8.130 8.130 8.625 -0.495 17919 3963 1 10 . 1 1 48 48 LYS N N 48 121.570 121.570 121.745 -0.175 17919 3964 1 10 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.662 -0.040 17919 3965 1 10 . 1 1 48 48 LYS C C 48 174.700 174.700 175.910 -1.210 17919 3966 1 10 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.810 -0.260 17919 3967 1 10 . 1 1 48 48 LYS CB C 48 34.530 34.530 33.812 0.718 17919 3968 1 10 . 1 1 48 48 LYS H H 48 7.980 7.980 8.117 -0.137 17919 3969 1 10 . 1 1 49 49 GLN N N 49 122.410 122.410 124.011 -1.601 17919 3970 1 10 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.405 0.155 17919 3971 1 10 . 1 1 49 49 GLN C C 49 175.670 175.670 175.971 -0.301 17919 3972 1 10 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.142 -0.402 17919 3973 1 10 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.046 -0.045 17919 3974 1 10 . 1 1 49 49 GLN H H 49 8.600 8.600 8.583 0.017 17919 3975 1 10 . 1 1 50 50 LEU N N 50 125.520 125.520 126.504 -0.984 17919 3976 1 10 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.106 -0.016 17919 3977 1 10 . 1 1 50 50 LEU C C 50 176.660 176.660 176.338 0.322 17919 3978 1 10 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.924 -0.684 17919 3979 1 10 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.930 -0.360 17919 3980 1 10 . 1 1 50 50 LEU H H 50 8.530 8.530 8.043 0.487 17919 3981 1 10 . 1 1 51 51 GLU N N 51 122.940 122.940 122.774 0.166 17919 3982 1 10 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.526 -0.038 17919 3983 1 10 . 1 1 51 51 GLU C C 51 175.870 175.870 176.743 -0.873 17919 3984 1 10 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.236 0.724 17919 3985 1 10 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.947 -0.377 17919 3986 1 10 . 1 1 51 51 GLU H H 51 8.400 8.400 8.666 -0.266 17919 3987 1 10 . 1 1 52 52 ASP N N 52 120.030 120.030 125.173 -5.143 17919 3988 1 10 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.559 -0.201 17919 3989 1 10 . 1 1 52 52 ASP C C 52 177.330 177.330 176.924 0.406 17919 3990 1 10 . 1 1 52 52 ASP CA C 52 56.960 56.960 55.883 1.077 17919 3991 1 10 . 1 1 52 52 ASP CB C 52 40.850 40.850 41.021 -0.171 17919 3992 1 10 . 1 1 52 52 ASP H H 52 8.160 8.160 8.767 -0.607 17919 3993 1 10 . 1 1 53 53 GLY N N 53 106.660 106.660 105.852 0.808 17919 3994 1 10 . 1 1 53 53 GLY C C 53 174.870 174.870 174.396 0.474 17919 3995 1 10 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.549 0.621 17919 3996 1 10 . 1 1 53 53 GLY H H 53 9.390 9.390 8.332 1.058 17919 3997 1 10 . 1 1 54 54 ARG N N 54 119.050 119.050 120.577 -1.527 17919 3998 1 10 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.761 -0.066 17919 3999 1 10 . 1 1 54 54 ARG C C 54 175.350 175.350 175.845 -0.495 17919 4000 1 10 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.639 -0.249 17919 4001 1 10 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.518 0.132 17919 4002 1 10 . 1 1 54 54 ARG H H 54 7.460 7.460 7.582 -0.122 17919 4003 1 10 . 1 1 55 55 THR N N 55 108.400 108.400 113.459 -5.059 17919 4004 1 10 . 1 1 55 55 THR HA H 55 5.240 5.240 4.846 0.394 17919 4005 1 10 . 1 1 55 55 THR C C 55 176.560 176.560 176.073 0.487 17919 4006 1 10 . 1 1 55 55 THR CA C 55 59.690 59.690 61.369 -1.679 17919 4007 1 10 . 1 1 55 55 THR CB C 55 72.260 72.260 71.032 1.228 17919 4008 1 10 . 1 1 55 55 THR H H 55 8.730 8.730 8.870 -0.140 17919 4009 1 10 . 1 1 56 56 LEU N N 56 117.920 117.920 122.618 -4.698 17919 4010 1 10 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.049 0.011 17919 4011 1 10 . 1 1 56 56 LEU C C 56 180.810 180.810 178.610 2.200 17919 4012 1 10 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.504 0.206 17919 4013 1 10 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.904 -1.534 17919 4014 1 10 . 1 1 56 56 LEU H H 56 8.140 8.140 8.387 -0.247 17919 4015 1 10 . 1 1 57 57 SER N N 57 113.330 113.330 114.362 -1.032 17919 4016 1 10 . 1 1 57 57 SER HA H 57 4.370 4.370 4.056 0.314 17919 4017 1 10 . 1 1 57 57 SER C C 57 178.310 178.310 176.437 1.873 17919 4018 1 10 . 1 1 57 57 SER CA C 57 61.080 61.080 62.232 -1.152 17919 4019 1 10 . 1 1 57 57 SER CB C 57 62.530 62.530 62.816 -0.286 17919 4020 1 10 . 1 1 57 57 SER H H 57 8.470 8.470 7.986 0.484 17919 4021 1 10 . 1 1 58 58 ASP N N 58 124.190 124.190 121.029 3.161 17919 4022 1 10 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.314 -0.018 17919 4023 1 10 . 1 1 58 58 ASP C C 58 177.400 177.400 177.024 0.376 17919 4024 1 10 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.229 0.951 17919 4025 1 10 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.323 -0.223 17919 4026 1 10 . 1 1 58 58 ASP H H 58 7.930 7.930 7.779 0.151 17919 4027 1 10 . 1 1 59 59 TYR N N 59 115.510 115.510 116.245 -0.735 17919 4028 1 10 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.505 0.165 17919 4029 1 10 . 1 1 59 59 TYR C C 59 174.700 174.700 175.526 -0.826 17919 4030 1 10 . 1 1 59 59 TYR CA C 59 58.250 58.250 58.034 0.216 17919 4031 1 10 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.614 1.456 17919 4032 1 10 . 1 1 59 59 TYR H H 59 7.250 7.250 7.302 -0.052 17919 4033 1 10 . 1 1 60 60 ASN N N 60 115.900 115.900 117.756 -1.856 17919 4034 1 10 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.357 -0.002 17919 4035 1 10 . 1 1 60 60 ASN C C 60 174.340 174.340 174.901 -0.561 17919 4036 1 10 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.276 -0.156 17919 4037 1 10 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.047 0.363 17919 4038 1 10 . 1 1 60 60 ASN H H 60 8.150 8.150 7.821 0.329 17919 4039 1 10 . 1 1 61 61 ILE N N 61 118.600 118.600 119.784 -1.184 17919 4040 1 10 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.666 -0.273 17919 4041 1 10 . 1 1 61 61 ILE C C 61 174.610 174.610 174.884 -0.274 17919 4042 1 10 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.888 0.532 17919 4043 1 10 . 1 1 61 61 ILE CB C 61 36.740 36.740 38.630 -1.890 17919 4044 1 10 . 1 1 61 61 ILE H H 61 7.250 7.250 7.375 -0.125 17919 4045 1 10 . 1 1 62 62 GLN N N 62 124.740 124.740 121.760 2.980 17919 4046 1 10 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.679 -0.173 17919 4047 1 10 . 1 1 62 62 GLN C C 62 175.970 175.970 175.059 0.911 17919 4048 1 10 . 1 1 62 62 GLN CA C 62 53.660 53.660 54.206 -0.546 17919 4049 1 10 . 1 1 62 62 GLN CB C 62 31.650 31.650 33.326 -1.676 17919 4050 1 10 . 1 1 62 62 GLN H H 62 7.610 7.610 8.032 -0.422 17919 4051 1 10 . 1 1 63 63 LYS N N 63 120.300 120.300 124.389 -4.089 17919 4052 1 10 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.897 0.104 17919 4053 1 10 . 1 1 63 63 LYS C C 63 175.810 175.810 177.048 -1.238 17919 4054 1 10 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.967 -0.176 17919 4055 1 10 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.458 0.192 17919 4056 1 10 . 1 1 63 63 LYS H H 63 8.490 8.490 8.858 -0.368 17919 4057 1 10 . 1 1 64 64 GLU N N 64 113.950 113.950 121.787 -7.837 17919 4058 1 10 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.272 0.193 17919 4059 1 10 . 1 1 64 64 GLU C C 64 175.250 175.250 176.000 -0.750 17919 4060 1 10 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.799 0.091 17919 4061 1 10 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.209 -2.308 17919 4062 1 10 . 1 1 64 64 GLU H H 64 9.280 9.280 8.521 0.759 17919 4063 1 10 . 1 1 65 65 SER N N 65 114.730 114.730 114.062 0.668 17919 4064 1 10 . 1 1 65 65 SER HA H 65 4.640 4.640 4.568 0.072 17919 4065 1 10 . 1 1 65 65 SER C C 65 172.160 172.160 174.126 -1.966 17919 4066 1 10 . 1 1 65 65 SER CA C 65 60.890 60.890 59.559 1.331 17919 4067 1 10 . 1 1 65 65 SER CB C 65 64.910 64.910 64.837 0.074 17919 4068 1 10 . 1 1 65 65 SER H H 65 7.670 7.670 7.760 -0.090 17919 4069 1 10 . 1 1 66 66 THR N N 66 117.110 117.110 115.804 1.306 17919 4070 1 10 . 1 1 66 66 THR HA H 66 5.270 5.270 5.200 0.070 17919 4071 1 10 . 1 1 66 66 THR C C 66 173.950 173.950 173.737 0.213 17919 4072 1 10 . 1 1 66 66 THR CA C 66 62.340 62.340 62.574 -0.234 17919 4073 1 10 . 1 1 66 66 THR CB C 66 70.080 70.080 70.950 -0.870 17919 4074 1 10 . 1 1 66 66 THR H H 66 8.730 8.730 8.335 0.395 17919 4075 1 10 . 1 1 67 67 LEU N N 67 127.110 127.110 127.019 0.091 17919 4076 1 10 . 1 1 67 67 LEU HA H 67 5.060 5.060 5.299 -0.239 17919 4077 1 10 . 1 1 67 67 LEU C C 67 175.770 175.770 175.925 -0.155 17919 4078 1 10 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.040 -0.140 17919 4079 1 10 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.206 1.054 17919 4080 1 10 . 1 1 67 67 LEU H H 67 9.410 9.410 8.491 0.919 17919 4081 1 10 . 1 1 68 68 HIS N N 68 118.380 118.380 121.960 -3.580 17919 4082 1 10 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.383 -0.143 17919 4083 1 10 . 1 1 68 68 HIS C C 68 173.150 173.150 173.957 -0.807 17919 4084 1 10 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.740 0.260 17919 4085 1 10 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.763 -2.232 17919 4086 1 10 . 1 1 68 68 HIS H H 68 9.230 9.230 9.188 0.042 17919 4087 1 10 . 1 1 69 69 LEU N N 69 124.460 124.460 126.890 -2.430 17919 4088 1 10 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.919 0.271 17919 4089 1 10 . 1 1 69 69 LEU C C 69 175.270 175.270 175.120 0.150 17919 4090 1 10 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.713 0.177 17919 4091 1 10 . 1 1 69 69 LEU CB C 69 44.380 44.380 43.918 0.462 17919 4092 1 10 . 1 1 69 69 LEU H H 69 8.340 8.340 8.329 0.011 17919 4093 1 10 . 1 1 70 70 VAL N N 70 126.940 126.940 127.946 -1.006 17919 4094 1 10 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.181 0.169 17919 4095 1 10 . 1 1 70 70 VAL C C 70 174.000 174.000 174.307 -0.307 17919 4096 1 10 . 1 1 70 70 VAL CA C 70 60.800 60.800 61.413 -0.613 17919 4097 1 10 . 1 1 70 70 VAL CB C 70 34.910 34.910 34.012 0.898 17919 4098 1 10 . 1 1 70 70 VAL H H 70 9.200 9.200 7.911 1.289 17919 4099 1 10 . 1 1 71 71 LEU N N 71 123.130 123.130 128.428 -5.298 17919 4100 1 10 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.798 0.262 17919 4101 1 10 . 1 1 71 71 LEU C C 71 177.830 177.830 176.964 0.866 17919 4102 1 10 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.751 0.189 17919 4103 1 10 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.402 0.448 17919 4104 1 10 . 1 1 71 71 LEU H H 71 8.120 8.120 8.457 -0.337 17919 4105 1 10 . 1 1 72 72 ARG N N 72 123.490 123.490 126.897 -3.407 17919 4106 1 10 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.245 0.056 17919 4107 1 10 . 1 1 72 72 ARG C C 72 175.350 175.350 175.371 -0.021 17919 4108 1 10 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.551 -0.941 17919 4109 1 10 . 1 1 72 72 ARG CB C 72 31.350 31.350 31.043 0.307 17919 4110 1 10 . 1 1 72 72 ARG H H 72 8.580 8.580 8.406 0.174 17919 4111 1 11 . 1 1 2 2 GLN N N 2 123.220 123.220 118.461 4.759 17919 4112 1 11 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.311 -0.062 17919 4113 1 11 . 1 1 2 2 GLN C C 2 175.920 175.920 175.009 0.911 17919 4114 1 11 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.444 0.636 17919 4115 1 11 . 1 1 2 2 GLN CB C 2 30.760 30.760 31.809 -1.049 17919 4116 1 11 . 1 1 2 2 GLN H H 2 8.900 8.900 8.207 0.693 17919 4117 1 11 . 1 1 3 3 ILE N N 3 115.340 115.340 117.183 -1.843 17919 4118 1 11 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.233 -0.020 17919 4119 1 11 . 1 1 3 3 ILE C C 3 172.450 172.450 173.471 -1.021 17919 4120 1 11 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.468 0.102 17919 4121 1 11 . 1 1 3 3 ILE CB C 3 42.210 42.210 40.734 1.476 17919 4122 1 11 . 1 1 3 3 ILE H H 3 8.320 8.320 8.099 0.221 17919 4123 1 11 . 1 1 4 4 PHE N N 4 118.110 118.110 118.909 -0.799 17919 4124 1 11 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.575 0.055 17919 4125 1 11 . 1 1 4 4 PHE C C 4 175.320 175.320 175.632 -0.312 17919 4126 1 11 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.449 -0.239 17919 4127 1 11 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.036 -0.556 17919 4128 1 11 . 1 1 4 4 PHE H H 4 8.610 8.610 8.517 0.093 17919 4129 1 11 . 1 1 5 5 VAL N N 5 121.000 121.000 118.761 2.239 17919 4130 1 11 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.783 -0.058 17919 4131 1 11 . 1 1 5 5 VAL C C 5 174.870 174.870 174.649 0.221 17919 4132 1 11 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.139 -0.519 17919 4133 1 11 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.772 -0.542 17919 4134 1 11 . 1 1 5 5 VAL H H 5 9.300 9.300 8.432 0.868 17919 4135 1 11 . 1 1 6 6 LYS N N 6 127.520 127.520 128.605 -1.085 17919 4136 1 11 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.079 0.288 17919 4137 1 11 . 1 1 6 6 LYS C C 6 177.140 177.140 177.113 0.027 17919 4138 1 11 . 1 1 6 6 LYS CA C 6 54.520 54.520 55.458 -0.938 17919 4139 1 11 . 1 1 6 6 LYS CB C 6 35.050 35.050 33.877 1.173 17919 4140 1 11 . 1 1 6 6 LYS H H 6 8.820 8.820 9.063 -0.243 17919 4141 1 11 . 1 1 7 7 THR N N 7 115.400 115.400 119.811 -4.411 17919 4142 1 11 . 1 1 7 7 THR HA H 7 4.970 4.970 4.404 0.566 17919 4143 1 11 . 1 1 7 7 THR C C 7 176.910 176.910 176.550 0.360 17919 4144 1 11 . 1 1 7 7 THR CA C 7 60.470 60.470 61.028 -0.558 17919 4145 1 11 . 1 1 7 7 THR CB C 7 70.630 70.630 69.467 1.163 17919 4146 1 11 . 1 1 7 7 THR H H 7 8.730 8.730 8.710 0.020 17919 4147 1 11 . 1 1 8 8 LEU N N 8 121.330 121.330 120.989 0.341 17919 4148 1 11 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.145 0.165 17919 4149 1 11 . 1 1 8 8 LEU C C 8 178.800 178.800 178.320 0.480 17919 4150 1 11 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.672 -0.092 17919 4151 1 11 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.789 0.181 17919 4152 1 11 . 1 1 8 8 LEU H H 8 9.100 9.100 8.548 0.552 17919 4153 1 11 . 1 1 9 9 THR N N 9 105.590 105.590 106.811 -1.221 17919 4154 1 11 . 1 1 9 9 THR HA H 9 4.428 4.428 4.297 0.131 17919 4155 1 11 . 1 1 9 9 THR C C 9 175.520 175.520 176.196 -0.676 17919 4156 1 11 . 1 1 9 9 THR CA C 9 61.400 61.400 61.546 -0.146 17919 4157 1 11 . 1 1 9 9 THR CB C 9 69.140 69.140 68.274 0.866 17919 4158 1 11 . 1 1 9 9 THR H H 9 7.630 7.630 7.810 -0.180 17919 4159 1 11 . 1 1 10 10 GLY N N 10 108.890 108.890 110.371 -1.481 17919 4160 1 11 . 1 1 10 10 GLY C C 10 174.070 174.070 174.381 -0.311 17919 4161 1 11 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.032 0.428 17919 4162 1 11 . 1 1 10 10 GLY H H 10 7.810 7.810 7.834 -0.024 17919 4163 1 11 . 1 1 11 11 LYS N N 11 121.600 121.600 121.061 0.539 17919 4164 1 11 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.154 0.207 17919 4165 1 11 . 1 1 11 11 LYS C C 11 175.940 175.940 175.466 0.474 17919 4166 1 11 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.966 -0.686 17919 4167 1 11 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.097 0.103 17919 4168 1 11 . 1 1 11 11 LYS H H 11 7.280 7.280 7.940 -0.660 17919 4169 1 11 . 1 1 12 12 THR N N 12 120.440 120.440 119.894 0.546 17919 4170 1 11 . 1 1 12 12 THR HA H 12 5.046 5.046 4.849 0.197 17919 4171 1 11 . 1 1 12 12 THR C C 12 174.320 174.320 174.442 -0.122 17919 4172 1 11 . 1 1 12 12 THR CA C 12 62.390 62.390 61.501 0.889 17919 4173 1 11 . 1 1 12 12 THR CB C 12 69.910 69.910 69.499 0.411 17919 4174 1 11 . 1 1 12 12 THR H H 12 8.650 8.650 8.235 0.415 17919 4175 1 11 . 1 1 13 13 ILE N N 13 127.110 127.110 123.655 3.455 17919 4176 1 11 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.667 -0.123 17919 4177 1 11 . 1 1 13 13 ILE C C 13 175.220 175.220 174.986 0.234 17919 4178 1 11 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.628 0.352 17919 4179 1 11 . 1 1 13 13 ILE CB C 13 40.950 40.950 39.924 1.026 17919 4180 1 11 . 1 1 13 13 ILE H H 13 9.450 9.450 8.513 0.937 17919 4181 1 11 . 1 1 14 14 THR N N 14 121.520 121.520 119.822 1.698 17919 4182 1 11 . 1 1 14 14 THR HA H 14 4.964 4.964 4.779 0.185 17919 4183 1 11 . 1 1 14 14 THR C C 14 173.790 173.790 173.870 -0.080 17919 4184 1 11 . 1 1 14 14 THR CA C 14 61.940 61.940 62.331 -0.391 17919 4185 1 11 . 1 1 14 14 THR CB C 14 69.650 69.650 69.400 0.251 17919 4186 1 11 . 1 1 14 14 THR H H 14 8.710 8.710 8.361 0.349 17919 4187 1 11 . 1 1 15 15 LEU N N 15 124.800 124.800 127.334 -2.534 17919 4188 1 11 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.637 0.143 17919 4189 1 11 . 1 1 15 15 LEU C C 15 174.670 174.670 175.423 -0.753 17919 4190 1 11 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.567 -0.737 17919 4191 1 11 . 1 1 15 15 LEU CB C 15 47.070 47.070 43.496 3.574 17919 4192 1 11 . 1 1 15 15 LEU H H 15 8.710 8.710 8.529 0.181 17919 4193 1 11 . 1 1 16 16 GLU N N 16 122.160 122.160 124.634 -2.474 17919 4194 1 11 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.693 0.224 17919 4195 1 11 . 1 1 16 16 GLU C C 16 175.860 175.860 175.501 0.359 17919 4196 1 11 . 1 1 16 16 GLU CA C 16 54.820 54.820 54.121 0.699 17919 4197 1 11 . 1 1 16 16 GLU CB C 16 29.450 29.450 28.845 0.605 17919 4198 1 11 . 1 1 16 16 GLU H H 16 8.140 8.140 8.611 -0.471 17919 4199 1 11 . 1 1 17 17 VAL N N 17 117.210 117.210 118.197 -0.987 17919 4200 1 11 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.971 -0.257 17919 4201 1 11 . 1 1 17 17 VAL C C 17 174.160 174.160 174.717 -0.557 17919 4202 1 11 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.773 -0.343 17919 4203 1 11 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.340 1.060 17919 4204 1 11 . 1 1 17 17 VAL H H 17 8.900 8.900 8.347 0.553 17919 4205 1 11 . 1 1 18 18 GLU N N 18 118.990 118.990 118.225 0.765 17919 4206 1 11 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.806 0.273 17919 4207 1 11 . 1 1 18 18 GLU C C 18 176.160 176.160 174.356 1.804 17919 4208 1 11 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.606 -0.886 17919 4209 1 11 . 1 1 18 18 GLU CB C 18 30.310 30.310 32.852 -2.542 17919 4210 1 11 . 1 1 18 18 GLU H H 18 8.640 8.640 8.476 0.164 17919 4211 1 11 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.337 -0.196 17919 4212 1 11 . 1 1 19 19 PRO C C 19 175.310 175.310 177.957 -2.647 17919 4213 1 11 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.193 0.277 17919 4214 1 11 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.012 -0.062 17919 4215 1 11 . 1 1 20 20 SER N N 20 103.400 103.400 111.587 -8.187 17919 4216 1 11 . 1 1 20 20 SER HA H 20 4.370 4.370 4.183 0.187 17919 4217 1 11 . 1 1 20 20 SER C C 20 174.660 174.660 174.652 0.008 17919 4218 1 11 . 1 1 20 20 SER CA C 20 57.400 57.400 60.145 -2.745 17919 4219 1 11 . 1 1 20 20 SER CB C 20 63.370 63.370 62.878 0.492 17919 4220 1 11 . 1 1 20 20 SER H H 20 7.040 7.040 7.983 -0.943 17919 4221 1 11 . 1 1 21 21 ASP N N 21 123.480 123.480 122.345 1.135 17919 4222 1 11 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.710 -0.015 17919 4223 1 11 . 1 1 21 21 ASP C C 21 176.360 176.360 175.970 0.390 17919 4224 1 11 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.024 0.676 17919 4225 1 11 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.346 -0.546 17919 4226 1 11 . 1 1 21 21 ASP H H 21 8.030 8.030 7.960 0.070 17919 4227 1 11 . 1 1 22 22 THR N N 22 108.800 108.800 113.603 -4.803 17919 4228 1 11 . 1 1 22 22 THR HA H 22 4.920 4.920 4.601 0.319 17919 4229 1 11 . 1 1 22 22 THR C C 22 176.750 176.750 175.945 0.805 17919 4230 1 11 . 1 1 22 22 THR CA C 22 59.690 59.690 61.762 -2.072 17919 4231 1 11 . 1 1 22 22 THR CB C 22 71.200 71.200 69.737 1.463 17919 4232 1 11 . 1 1 22 22 THR H H 22 7.900 7.900 8.391 -0.491 17919 4233 1 11 . 1 1 23 23 ILE N N 23 121.190 121.190 122.130 -0.940 17919 4234 1 11 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.838 -0.181 17919 4235 1 11 . 1 1 23 23 ILE C C 23 179.040 179.040 177.585 1.455 17919 4236 1 11 . 1 1 23 23 ILE CA C 23 62.260 62.260 61.696 0.564 17919 4237 1 11 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.265 -1.915 17919 4238 1 11 . 1 1 23 23 ILE H H 23 8.560 8.560 8.270 0.290 17919 4239 1 11 . 1 1 24 24 GLU N N 24 120.830 120.830 121.257 -0.427 17919 4240 1 11 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.942 -0.025 17919 4241 1 11 . 1 1 24 24 GLU C C 24 178.640 178.640 178.811 -0.171 17919 4242 1 11 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.030 0.190 17919 4243 1 11 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.345 -1.065 17919 4244 1 11 . 1 1 24 24 GLU H H 24 9.760 9.760 8.292 1.468 17919 4245 1 11 . 1 1 25 25 ASN N N 25 120.570 120.570 117.363 3.207 17919 4246 1 11 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.536 -0.011 17919 4247 1 11 . 1 1 25 25 ASN C C 25 178.380 178.380 177.793 0.587 17919 4248 1 11 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.699 0.361 17919 4249 1 11 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.050 0.400 17919 4250 1 11 . 1 1 25 25 ASN H H 25 7.920 7.920 8.146 -0.226 17919 4251 1 11 . 1 1 26 26 VAL N N 26 121.710 121.710 120.478 1.232 17919 4252 1 11 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.486 -0.089 17919 4253 1 11 . 1 1 26 26 VAL C C 26 177.950 177.950 177.950 0.000 17919 4254 1 11 . 1 1 26 26 VAL CA C 26 67.660 67.660 67.020 0.640 17919 4255 1 11 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.671 -0.831 17919 4256 1 11 . 1 1 26 26 VAL H H 26 8.070 8.070 7.941 0.129 17919 4257 1 11 . 1 1 27 27 LYS N N 27 118.860 118.860 118.926 -0.066 17919 4258 1 11 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.040 0.540 17919 4259 1 11 . 1 1 27 27 LYS C C 27 180.550 180.550 178.947 1.603 17919 4260 1 11 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.531 -0.281 17919 4261 1 11 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.152 1.578 17919 4262 1 11 . 1 1 27 27 LYS H H 27 8.560 8.560 7.807 0.753 17919 4263 1 11 . 1 1 28 28 ALA N N 28 123.440 123.440 121.110 2.330 17919 4264 1 11 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.028 0.132 17919 4265 1 11 . 1 1 28 28 ALA C C 28 180.300 180.300 179.101 1.199 17919 4266 1 11 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.042 0.328 17919 4267 1 11 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.294 -0.584 17919 4268 1 11 . 1 1 28 28 ALA H H 28 8.060 8.060 8.121 -0.061 17919 4269 1 11 . 1 1 29 29 LYS N N 29 119.940 119.940 118.964 0.976 17919 4270 1 11 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.104 0.103 17919 4271 1 11 . 1 1 29 29 LYS C C 29 180.320 180.320 178.890 1.430 17919 4272 1 11 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.272 0.378 17919 4273 1 11 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.520 0.770 17919 4274 1 11 . 1 1 29 29 LYS H H 29 7.850 7.850 7.651 0.199 17919 4275 1 11 . 1 1 30 30 ILE N N 30 121.080 121.080 121.315 -0.235 17919 4276 1 11 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.536 -0.029 17919 4277 1 11 . 1 1 30 30 ILE C C 30 178.310 178.310 177.623 0.687 17919 4278 1 11 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.773 0.377 17919 4279 1 11 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.557 -0.757 17919 4280 1 11 . 1 1 30 30 ILE H H 30 8.280 8.280 8.142 0.138 17919 4281 1 11 . 1 1 31 31 GLN N N 31 123.490 123.490 119.499 3.991 17919 4282 1 11 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.976 -0.147 17919 4283 1 11 . 1 1 31 31 GLN C C 31 178.890 178.890 178.342 0.548 17919 4284 1 11 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.197 0.803 17919 4285 1 11 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.431 -0.711 17919 4286 1 11 . 1 1 31 31 GLN H H 31 8.580 8.580 8.430 0.150 17919 4287 1 11 . 1 1 32 32 ASP N N 32 119.360 119.360 118.946 0.414 17919 4288 1 11 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.417 -0.063 17919 4289 1 11 . 1 1 32 32 ASP C C 32 177.250 177.250 177.960 -0.710 17919 4290 1 11 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.805 0.385 17919 4291 1 11 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.795 -0.215 17919 4292 1 11 . 1 1 32 32 ASP H H 32 8.010 8.010 7.723 0.287 17919 4293 1 11 . 1 1 33 33 LYS N N 33 115.130 115.130 118.302 -3.172 17919 4294 1 11 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.339 -0.002 17919 4295 1 11 . 1 1 33 33 LYS C C 33 177.870 177.870 178.294 -0.424 17919 4296 1 11 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.957 0.093 17919 4297 1 11 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.760 0.410 17919 4298 1 11 . 1 1 33 33 LYS H H 33 7.430 7.430 7.599 -0.169 17919 4299 1 11 . 1 1 34 34 GLU N N 34 113.870 113.870 115.577 -1.707 17919 4300 1 11 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.394 0.231 17919 4301 1 11 . 1 1 34 34 GLU C C 34 177.840 177.840 177.444 0.396 17919 4302 1 11 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.212 -1.042 17919 4303 1 11 . 1 1 34 34 GLU CB C 34 32.660 32.660 30.894 1.766 17919 4304 1 11 . 1 1 34 34 GLU H H 34 8.740 8.740 8.200 0.540 17919 4305 1 11 . 1 1 35 35 GLY N N 35 108.650 108.650 108.649 0.001 17919 4306 1 11 . 1 1 35 35 GLY C C 35 173.960 173.960 174.423 -0.463 17919 4307 1 11 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.573 0.507 17919 4308 1 11 . 1 1 35 35 GLY H H 35 8.530 8.530 8.011 0.519 17919 4309 1 11 . 1 1 36 36 ILE N N 36 119.880 119.880 121.084 -1.204 17919 4310 1 11 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.369 0.076 17919 4311 1 11 . 1 1 36 36 ILE C C 36 173.590 173.590 174.069 -0.479 17919 4312 1 11 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.963 -0.213 17919 4313 1 11 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.278 2.302 17919 4314 1 11 . 1 1 36 36 ILE H H 36 6.150 6.150 7.630 -1.480 17919 4315 1 11 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.715 -0.081 17919 4316 1 11 . 1 1 37 37 PRO C C 37 176.940 176.940 175.607 1.333 17919 4317 1 11 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.527 0.133 17919 4318 1 11 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.175 0.675 17919 4319 1 11 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.162 -0.045 17919 4320 1 11 . 1 1 38 38 PRO C C 38 178.320 178.320 178.377 -0.057 17919 4321 1 11 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.383 0.877 17919 4322 1 11 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.851 1.039 17919 4323 1 11 . 1 1 39 39 ASP N N 39 113.380 113.380 117.630 -4.250 17919 4324 1 11 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.158 0.272 17919 4325 1 11 . 1 1 39 39 ASP C C 39 177.090 177.090 177.583 -0.493 17919 4326 1 11 . 1 1 39 39 ASP CA C 39 55.640 55.640 57.282 -1.642 17919 4327 1 11 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.460 -0.920 17919 4328 1 11 . 1 1 39 39 ASP H H 39 8.550 8.550 8.847 -0.297 17919 4329 1 11 . 1 1 40 40 GLN N N 40 116.780 116.780 116.593 0.187 17919 4330 1 11 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.193 0.271 17919 4331 1 11 . 1 1 40 40 GLN C C 40 175.380 175.380 176.918 -1.538 17919 4332 1 11 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.638 -0.998 17919 4333 1 11 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.216 0.924 17919 4334 1 11 . 1 1 40 40 GLN H H 40 7.820 7.820 8.112 -0.292 17919 4335 1 11 . 1 1 41 41 GLN N N 41 117.720 117.720 119.044 -1.324 17919 4336 1 11 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.519 -0.275 17919 4337 1 11 . 1 1 41 41 GLN C C 41 176.300 176.300 175.706 0.594 17919 4338 1 11 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.414 0.056 17919 4339 1 11 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.546 2.104 17919 4340 1 11 . 1 1 41 41 GLN H H 41 7.480 7.480 7.319 0.161 17919 4341 1 11 . 1 1 42 42 ARG N N 42 122.680 122.680 122.255 0.425 17919 4342 1 11 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.614 -0.114 17919 4343 1 11 . 1 1 42 42 ARG C C 42 174.050 174.050 174.861 -0.811 17919 4344 1 11 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.834 0.216 17919 4345 1 11 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.686 -1.936 17919 4346 1 11 . 1 1 42 42 ARG H H 42 8.530 8.530 7.874 0.656 17919 4347 1 11 . 1 1 43 43 LEU N N 43 124.040 124.040 125.295 -1.255 17919 4348 1 11 . 1 1 43 43 LEU C C 43 175.290 175.290 176.236 -0.946 17919 4349 1 11 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.902 -0.922 17919 4350 1 11 . 1 1 43 43 LEU CB C 43 45.790 45.790 42.749 3.041 17919 4351 1 11 . 1 1 43 43 LEU H H 43 8.820 8.820 8.416 0.404 17919 4352 1 11 . 1 1 44 44 ILE N N 44 121.920 121.920 122.413 -0.493 17919 4353 1 11 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.971 0.021 17919 4354 1 11 . 1 1 44 44 ILE C C 44 176.060 176.060 175.173 0.887 17919 4355 1 11 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.428 -0.449 17919 4356 1 11 . 1 1 44 44 ILE CB C 44 41.420 41.420 38.614 2.806 17919 4357 1 11 . 1 1 44 44 ILE H H 44 9.030 9.030 8.453 0.577 17919 4358 1 11 . 1 1 45 45 PHE N N 45 125.390 125.390 127.813 -2.423 17919 4359 1 11 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.688 0.357 17919 4360 1 11 . 1 1 45 45 PHE C C 45 174.470 174.470 174.126 0.344 17919 4361 1 11 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.288 0.732 17919 4362 1 11 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.640 1.120 17919 4363 1 11 . 1 1 45 45 PHE H H 45 8.830 8.830 8.600 0.230 17919 4364 1 11 . 1 1 46 46 ALA N N 46 132.200 132.200 129.079 3.121 17919 4365 1 11 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.645 0.045 17919 4366 1 11 . 1 1 46 46 ALA C C 46 177.290 177.290 177.315 -0.025 17919 4367 1 11 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.511 0.029 17919 4368 1 11 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.133 0.437 17919 4369 1 11 . 1 1 46 46 ALA H H 46 8.810 8.810 9.053 -0.243 17919 4370 1 11 . 1 1 47 47 GLY N N 47 102.340 102.340 103.463 -1.123 17919 4371 1 11 . 1 1 47 47 GLY C C 47 173.810 173.810 174.209 -0.399 17919 4372 1 11 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.846 0.503 17919 4373 1 11 . 1 1 47 47 GLY H H 47 8.130 8.130 8.438 -0.308 17919 4374 1 11 . 1 1 48 48 LYS N N 48 121.570 121.570 122.099 -0.529 17919 4375 1 11 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.584 0.038 17919 4376 1 11 . 1 1 48 48 LYS C C 48 174.700 174.700 175.589 -0.889 17919 4377 1 11 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.890 -0.340 17919 4378 1 11 . 1 1 48 48 LYS CB C 48 34.530 34.530 33.886 0.644 17919 4379 1 11 . 1 1 48 48 LYS H H 48 7.980 7.980 7.978 0.002 17919 4380 1 11 . 1 1 49 49 GLN N N 49 122.410 122.410 123.469 -1.059 17919 4381 1 11 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.766 -0.206 17919 4382 1 11 . 1 1 49 49 GLN C C 49 175.670 175.670 175.873 -0.203 17919 4383 1 11 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.829 -0.089 17919 4384 1 11 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.682 -0.682 17919 4385 1 11 . 1 1 49 49 GLN H H 49 8.600 8.600 8.515 0.085 17919 4386 1 11 . 1 1 50 50 LEU N N 50 125.520 125.520 125.595 -0.075 17919 4387 1 11 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.226 -0.136 17919 4388 1 11 . 1 1 50 50 LEU C C 50 176.660 176.660 175.445 1.215 17919 4389 1 11 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.482 0.758 17919 4390 1 11 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.901 -1.331 17919 4391 1 11 . 1 1 50 50 LEU H H 50 8.530 8.530 8.682 -0.152 17919 4392 1 11 . 1 1 51 51 GLU N N 51 122.940 122.940 122.900 0.040 17919 4393 1 11 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.488 0.000 17919 4394 1 11 . 1 1 51 51 GLU C C 51 175.870 175.870 175.987 -0.117 17919 4395 1 11 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.045 0.915 17919 4396 1 11 . 1 1 51 51 GLU CB C 51 31.570 31.570 33.044 -1.474 17919 4397 1 11 . 1 1 51 51 GLU H H 51 8.400 8.400 8.015 0.385 17919 4398 1 11 . 1 1 52 52 ASP N N 52 120.030 120.030 123.749 -3.719 17919 4399 1 11 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.659 -0.300 17919 4400 1 11 . 1 1 52 52 ASP C C 52 177.330 177.330 176.599 0.731 17919 4401 1 11 . 1 1 52 52 ASP CA C 52 56.960 56.960 55.676 1.284 17919 4402 1 11 . 1 1 52 52 ASP CB C 52 40.850 40.850 41.072 -0.222 17919 4403 1 11 . 1 1 52 52 ASP H H 52 8.160 8.160 8.791 -0.631 17919 4404 1 11 . 1 1 53 53 GLY N N 53 106.660 106.660 105.804 0.856 17919 4405 1 11 . 1 1 53 53 GLY C C 53 174.870 174.870 174.348 0.522 17919 4406 1 11 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.802 0.368 17919 4407 1 11 . 1 1 53 53 GLY H H 53 9.390 9.390 8.492 0.898 17919 4408 1 11 . 1 1 54 54 ARG N N 54 119.050 119.050 120.248 -1.198 17919 4409 1 11 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.682 0.013 17919 4410 1 11 . 1 1 54 54 ARG C C 54 175.350 175.350 175.131 0.219 17919 4411 1 11 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.425 -0.035 17919 4412 1 11 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.844 -0.194 17919 4413 1 11 . 1 1 54 54 ARG H H 54 7.460 7.460 7.369 0.091 17919 4414 1 11 . 1 1 55 55 THR N N 55 108.400 108.400 112.844 -4.444 17919 4415 1 11 . 1 1 55 55 THR HA H 55 5.240 5.240 4.840 0.400 17919 4416 1 11 . 1 1 55 55 THR C C 55 176.560 176.560 176.821 -0.261 17919 4417 1 11 . 1 1 55 55 THR CA C 55 59.690 59.690 60.322 -0.632 17919 4418 1 11 . 1 1 55 55 THR CB C 55 72.260 72.260 70.478 1.782 17919 4419 1 11 . 1 1 55 55 THR H H 55 8.730 8.730 8.849 -0.119 17919 4420 1 11 . 1 1 56 56 LEU N N 56 117.920 117.920 121.148 -3.228 17919 4421 1 11 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.018 0.042 17919 4422 1 11 . 1 1 56 56 LEU C C 56 180.810 180.810 178.482 2.328 17919 4423 1 11 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.196 0.514 17919 4424 1 11 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.279 -0.909 17919 4425 1 11 . 1 1 56 56 LEU H H 56 8.140 8.140 8.395 -0.255 17919 4426 1 11 . 1 1 57 57 SER N N 57 113.330 113.330 114.666 -1.336 17919 4427 1 11 . 1 1 57 57 SER HA H 57 4.370 4.370 4.223 0.147 17919 4428 1 11 . 1 1 57 57 SER C C 57 178.310 178.310 176.819 1.491 17919 4429 1 11 . 1 1 57 57 SER CA C 57 61.080 61.080 61.857 -0.777 17919 4430 1 11 . 1 1 57 57 SER CB C 57 62.530 62.530 62.620 -0.090 17919 4431 1 11 . 1 1 57 57 SER H H 57 8.470 8.470 8.084 0.386 17919 4432 1 11 . 1 1 58 58 ASP N N 58 124.190 124.190 122.819 1.371 17919 4433 1 11 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.273 0.023 17919 4434 1 11 . 1 1 58 58 ASP C C 58 177.400 177.400 176.661 0.739 17919 4435 1 11 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.699 0.481 17919 4436 1 11 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.424 -0.324 17919 4437 1 11 . 1 1 58 58 ASP H H 58 7.930 7.930 7.872 0.058 17919 4438 1 11 . 1 1 59 59 TYR N N 59 115.510 115.510 114.727 0.783 17919 4439 1 11 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.623 0.047 17919 4440 1 11 . 1 1 59 59 TYR C C 59 174.700 174.700 175.305 -0.605 17919 4441 1 11 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.375 0.875 17919 4442 1 11 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.165 1.905 17919 4443 1 11 . 1 1 59 59 TYR H H 59 7.250 7.250 7.389 -0.139 17919 4444 1 11 . 1 1 60 60 ASN N N 60 115.900 115.900 117.520 -1.620 17919 4445 1 11 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.389 -0.034 17919 4446 1 11 . 1 1 60 60 ASN C C 60 174.340 174.340 174.519 -0.179 17919 4447 1 11 . 1 1 60 60 ASN CA C 60 54.120 54.120 53.812 0.307 17919 4448 1 11 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.898 -0.488 17919 4449 1 11 . 1 1 60 60 ASN H H 60 8.150 8.150 7.689 0.461 17919 4450 1 11 . 1 1 61 61 ILE N N 61 118.600 118.600 119.335 -0.735 17919 4451 1 11 . 1 1 61 61 ILE HA H 61 3.393 3.393 4.026 -0.633 17919 4452 1 11 . 1 1 61 61 ILE C C 61 174.610 174.610 175.310 -0.700 17919 4453 1 11 . 1 1 61 61 ILE CA C 61 62.420 62.420 60.660 1.760 17919 4454 1 11 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.187 -0.447 17919 4455 1 11 . 1 1 61 61 ILE H H 61 7.250 7.250 7.813 -0.563 17919 4456 1 11 . 1 1 62 62 GLN N N 62 124.740 124.740 124.960 -0.220 17919 4457 1 11 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.706 -0.200 17919 4458 1 11 . 1 1 62 62 GLN C C 62 175.970 175.970 175.427 0.543 17919 4459 1 11 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.563 0.097 17919 4460 1 11 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.164 0.486 17919 4461 1 11 . 1 1 62 62 GLN H H 62 7.610 7.610 8.240 -0.630 17919 4462 1 11 . 1 1 63 63 LYS N N 63 120.300 120.300 123.245 -2.945 17919 4463 1 11 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.957 0.044 17919 4464 1 11 . 1 1 63 63 LYS C C 63 175.810 175.810 176.510 -0.700 17919 4465 1 11 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.841 -0.051 17919 4466 1 11 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.326 1.324 17919 4467 1 11 . 1 1 63 63 LYS H H 63 8.490 8.490 8.651 -0.161 17919 4468 1 11 . 1 1 64 64 GLU N N 64 113.950 113.950 116.743 -2.793 17919 4469 1 11 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.660 -0.195 17919 4470 1 11 . 1 1 64 64 GLU C C 64 175.250 175.250 175.638 -0.388 17919 4471 1 11 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.729 0.161 17919 4472 1 11 . 1 1 64 64 GLU CB C 64 25.900 25.900 27.983 -2.083 17919 4473 1 11 . 1 1 64 64 GLU H H 64 9.280 9.280 8.851 0.429 17919 4474 1 11 . 1 1 65 65 SER N N 65 114.730 114.730 114.998 -0.268 17919 4475 1 11 . 1 1 65 65 SER HA H 65 4.640 4.640 4.555 0.085 17919 4476 1 11 . 1 1 65 65 SER C C 65 172.160 172.160 173.357 -1.197 17919 4477 1 11 . 1 1 65 65 SER CA C 65 60.890 60.890 58.227 2.663 17919 4478 1 11 . 1 1 65 65 SER CB C 65 64.910 64.910 63.977 0.933 17919 4479 1 11 . 1 1 65 65 SER H H 65 7.670 7.670 7.635 0.035 17919 4480 1 11 . 1 1 66 66 THR N N 66 117.110 117.110 119.960 -2.850 17919 4481 1 11 . 1 1 66 66 THR HA H 66 5.270 5.270 5.030 0.240 17919 4482 1 11 . 1 1 66 66 THR C C 66 173.950 173.950 173.562 0.388 17919 4483 1 11 . 1 1 66 66 THR CA C 66 62.340 62.340 62.112 0.228 17919 4484 1 11 . 1 1 66 66 THR CB C 66 70.080 70.080 70.054 0.026 17919 4485 1 11 . 1 1 66 66 THR H H 66 8.730 8.730 8.467 0.263 17919 4486 1 11 . 1 1 67 67 LEU N N 67 127.110 127.110 127.417 -0.307 17919 4487 1 11 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.686 0.374 17919 4488 1 11 . 1 1 67 67 LEU C C 67 175.770 175.770 175.946 -0.176 17919 4489 1 11 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.907 -0.007 17919 4490 1 11 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.010 0.251 17919 4491 1 11 . 1 1 67 67 LEU H H 67 9.410 9.410 8.864 0.546 17919 4492 1 11 . 1 1 68 68 HIS N N 68 118.380 118.380 116.671 1.709 17919 4493 1 11 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.478 -0.238 17919 4494 1 11 . 1 1 68 68 HIS C C 68 173.150 173.150 174.620 -1.470 17919 4495 1 11 . 1 1 68 68 HIS CA C 68 55.000 55.000 53.827 1.173 17919 4496 1 11 . 1 1 68 68 HIS CB C 68 30.530 30.530 33.193 -2.663 17919 4497 1 11 . 1 1 68 68 HIS H H 68 9.230 9.230 8.430 0.800 17919 4498 1 11 . 1 1 69 69 LEU N N 69 124.460 124.460 121.453 3.007 17919 4499 1 11 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.149 0.041 17919 4500 1 11 . 1 1 69 69 LEU C C 69 175.270 175.270 174.407 0.863 17919 4501 1 11 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.928 -1.038 17919 4502 1 11 . 1 1 69 69 LEU CB C 69 44.380 44.380 45.193 -0.813 17919 4503 1 11 . 1 1 69 69 LEU H H 69 8.340 8.340 8.662 -0.322 17919 4504 1 11 . 1 1 70 70 VAL N N 70 126.940 126.940 124.082 2.858 17919 4505 1 11 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.685 -0.335 17919 4506 1 11 . 1 1 70 70 VAL C C 70 174.000 174.000 173.421 0.579 17919 4507 1 11 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.818 0.982 17919 4508 1 11 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.511 -0.601 17919 4509 1 11 . 1 1 70 70 VAL H H 70 9.200 9.200 8.171 1.029 17919 4510 1 11 . 1 1 71 71 LEU N N 71 123.130 123.130 125.017 -1.887 17919 4511 1 11 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.096 -0.036 17919 4512 1 11 . 1 1 71 71 LEU C C 71 177.830 177.830 175.531 2.299 17919 4513 1 11 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.798 0.142 17919 4514 1 11 . 1 1 71 71 LEU CB C 71 42.850 42.850 44.926 -2.076 17919 4515 1 11 . 1 1 71 71 LEU H H 71 8.120 8.120 8.310 -0.190 17919 4516 1 11 . 1 1 72 72 ARG N N 72 123.490 123.490 126.098 -2.608 17919 4517 1 11 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.677 -0.376 17919 4518 1 11 . 1 1 72 72 ARG C C 72 175.350 175.350 175.428 -0.078 17919 4519 1 11 . 1 1 72 72 ARG CA C 72 55.610 55.610 54.269 1.341 17919 4520 1 11 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.280 1.070 17919 4521 1 11 . 1 1 72 72 ARG H H 72 8.580 8.580 9.014 -0.434 17919 4522 1 12 . 1 1 2 2 GLN N N 2 123.220 123.220 122.597 0.623 17919 4523 1 12 . 1 1 2 2 GLN HA H 2 5.249 5.249 4.470 0.779 17919 4524 1 12 . 1 1 2 2 GLN C C 2 175.920 175.920 174.375 1.545 17919 4525 1 12 . 1 1 2 2 GLN CA C 2 55.080 55.080 56.133 -1.054 17919 4526 1 12 . 1 1 2 2 GLN CB C 2 30.760 30.760 29.264 1.496 17919 4527 1 12 . 1 1 2 2 GLN H H 2 8.900 8.900 8.370 0.530 17919 4528 1 12 . 1 1 3 3 ILE N N 3 115.340 115.340 116.012 -0.672 17919 4529 1 12 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.202 0.011 17919 4530 1 12 . 1 1 3 3 ILE C C 3 172.450 172.450 173.463 -1.013 17919 4531 1 12 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.572 -0.002 17919 4532 1 12 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.729 0.481 17919 4533 1 12 . 1 1 3 3 ILE H H 3 8.320 8.320 7.850 0.470 17919 4534 1 12 . 1 1 4 4 PHE N N 4 118.110 118.110 120.753 -2.643 17919 4535 1 12 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.358 0.272 17919 4536 1 12 . 1 1 4 4 PHE C C 4 175.320 175.320 175.411 -0.091 17919 4537 1 12 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.328 -0.118 17919 4538 1 12 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.188 -0.708 17919 4539 1 12 . 1 1 4 4 PHE H H 4 8.610 8.610 9.062 -0.452 17919 4540 1 12 . 1 1 5 5 VAL N N 5 121.000 121.000 121.034 -0.034 17919 4541 1 12 . 1 1 5 5 VAL HA H 5 4.725 4.725 5.012 -0.287 17919 4542 1 12 . 1 1 5 5 VAL C C 5 174.870 174.870 174.676 0.194 17919 4543 1 12 . 1 1 5 5 VAL CA C 5 60.620 60.620 60.975 -0.355 17919 4544 1 12 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.592 -0.362 17919 4545 1 12 . 1 1 5 5 VAL H H 5 9.300 9.300 8.921 0.379 17919 4546 1 12 . 1 1 6 6 LYS N N 6 127.520 127.520 129.203 -1.683 17919 4547 1 12 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.299 0.068 17919 4548 1 12 . 1 1 6 6 LYS C C 6 177.140 177.140 176.416 0.724 17919 4549 1 12 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.556 -0.035 17919 4550 1 12 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.835 0.215 17919 4551 1 12 . 1 1 6 6 LYS H H 6 8.820 8.820 8.788 0.032 17919 4552 1 12 . 1 1 7 7 THR N N 7 115.400 115.400 118.254 -2.854 17919 4553 1 12 . 1 1 7 7 THR HA H 7 4.970 4.970 4.523 0.447 17919 4554 1 12 . 1 1 7 7 THR C C 7 176.910 176.910 175.693 1.217 17919 4555 1 12 . 1 1 7 7 THR CA C 7 60.470 60.470 60.293 0.177 17919 4556 1 12 . 1 1 7 7 THR CB C 7 70.630 70.630 70.295 0.335 17919 4557 1 12 . 1 1 7 7 THR H H 7 8.730 8.730 8.372 0.358 17919 4558 1 12 . 1 1 8 8 LEU N N 8 121.330 121.330 120.186 1.144 17919 4559 1 12 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.390 -0.080 17919 4560 1 12 . 1 1 8 8 LEU C C 8 178.800 178.800 177.457 1.343 17919 4561 1 12 . 1 1 8 8 LEU CA C 8 57.580 57.580 56.824 0.756 17919 4562 1 12 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.151 -0.181 17919 4563 1 12 . 1 1 8 8 LEU H H 8 9.100 9.100 8.797 0.303 17919 4564 1 12 . 1 1 9 9 THR N N 9 105.590 105.590 109.334 -3.744 17919 4565 1 12 . 1 1 9 9 THR HA H 9 4.428 4.428 4.400 0.028 17919 4566 1 12 . 1 1 9 9 THR C C 9 175.520 175.520 175.586 -0.066 17919 4567 1 12 . 1 1 9 9 THR CA C 9 61.400 61.400 61.299 0.101 17919 4568 1 12 . 1 1 9 9 THR CB C 9 69.140 69.140 69.094 0.046 17919 4569 1 12 . 1 1 9 9 THR H H 9 7.630 7.630 7.663 -0.033 17919 4570 1 12 . 1 1 10 10 GLY N N 10 108.890 108.890 111.685 -2.795 17919 4571 1 12 . 1 1 10 10 GLY C C 10 174.070 174.070 174.290 -0.220 17919 4572 1 12 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.032 0.428 17919 4573 1 12 . 1 1 10 10 GLY H H 10 7.810 7.810 7.856 -0.046 17919 4574 1 12 . 1 1 11 11 LYS N N 11 121.600 121.600 121.905 -0.305 17919 4575 1 12 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.474 -0.113 17919 4576 1 12 . 1 1 11 11 LYS C C 11 175.940 175.940 175.523 0.417 17919 4577 1 12 . 1 1 11 11 LYS CA C 11 56.280 56.280 55.607 0.673 17919 4578 1 12 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.394 -0.194 17919 4579 1 12 . 1 1 11 11 LYS H H 11 7.280 7.280 7.735 -0.455 17919 4580 1 12 . 1 1 12 12 THR N N 12 120.440 120.440 119.166 1.274 17919 4581 1 12 . 1 1 12 12 THR HA H 12 5.046 5.046 5.124 -0.078 17919 4582 1 12 . 1 1 12 12 THR C C 12 174.320 174.320 174.172 0.148 17919 4583 1 12 . 1 1 12 12 THR CA C 12 62.390 62.390 61.278 1.113 17919 4584 1 12 . 1 1 12 12 THR CB C 12 69.910 69.910 70.149 -0.239 17919 4585 1 12 . 1 1 12 12 THR H H 12 8.650 8.650 8.358 0.292 17919 4586 1 12 . 1 1 13 13 ILE N N 13 127.110 127.110 128.058 -0.948 17919 4587 1 12 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.495 0.049 17919 4588 1 12 . 1 1 13 13 ILE C C 13 175.220 175.220 175.220 0.000 17919 4589 1 12 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.608 -0.629 17919 4590 1 12 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.562 -0.612 17919 4591 1 12 . 1 1 13 13 ILE H H 13 9.450 9.450 9.066 0.384 17919 4592 1 12 . 1 1 14 14 THR N N 14 121.520 121.520 124.233 -2.713 17919 4593 1 12 . 1 1 14 14 THR HA H 14 4.964 4.964 4.592 0.372 17919 4594 1 12 . 1 1 14 14 THR C C 14 173.790 173.790 174.223 -0.433 17919 4595 1 12 . 1 1 14 14 THR CA C 14 61.940 61.940 62.875 -0.935 17919 4596 1 12 . 1 1 14 14 THR CB C 14 69.650 69.650 69.064 0.586 17919 4597 1 12 . 1 1 14 14 THR H H 14 8.710 8.710 8.608 0.102 17919 4598 1 12 . 1 1 15 15 LEU N N 15 124.800 124.800 128.032 -3.232 17919 4599 1 12 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.550 0.230 17919 4600 1 12 . 1 1 15 15 LEU C C 15 174.670 174.670 176.089 -1.419 17919 4601 1 12 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.901 -1.071 17919 4602 1 12 . 1 1 15 15 LEU CB C 15 47.070 47.070 43.187 3.883 17919 4603 1 12 . 1 1 15 15 LEU H H 15 8.710 8.710 8.637 0.073 17919 4604 1 12 . 1 1 16 16 GLU N N 16 122.160 122.160 122.165 -0.005 17919 4605 1 12 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.640 0.277 17919 4606 1 12 . 1 1 16 16 GLU C C 16 175.860 175.860 175.148 0.712 17919 4607 1 12 . 1 1 16 16 GLU CA C 16 54.820 54.820 54.856 -0.036 17919 4608 1 12 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.233 -0.783 17919 4609 1 12 . 1 1 16 16 GLU H H 16 8.140 8.140 8.639 -0.499 17919 4610 1 12 . 1 1 17 17 VAL N N 17 117.210 117.210 118.912 -1.702 17919 4611 1 12 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.493 0.221 17919 4612 1 12 . 1 1 17 17 VAL C C 17 174.160 174.160 174.116 0.044 17919 4613 1 12 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.142 -0.712 17919 4614 1 12 . 1 1 17 17 VAL CB C 17 36.400 36.400 34.609 1.791 17919 4615 1 12 . 1 1 17 17 VAL H H 17 8.900 8.900 7.762 1.138 17919 4616 1 12 . 1 1 18 18 GLU N N 18 118.990 118.990 121.324 -2.334 17919 4617 1 12 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.614 0.465 17919 4618 1 12 . 1 1 18 18 GLU C C 18 176.160 176.160 175.499 0.661 17919 4619 1 12 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.390 -0.670 17919 4620 1 12 . 1 1 18 18 GLU CB C 18 30.310 30.310 29.874 0.436 17919 4621 1 12 . 1 1 18 18 GLU H H 18 8.640 8.640 8.485 0.155 17919 4622 1 12 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.418 -0.277 17919 4623 1 12 . 1 1 19 19 PRO C C 19 175.310 175.310 177.963 -2.653 17919 4624 1 12 . 1 1 19 19 PRO CA C 19 65.470 65.470 64.689 0.781 17919 4625 1 12 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.442 -0.492 17919 4626 1 12 . 1 1 20 20 SER N N 20 103.400 103.400 113.921 -10.521 17919 4627 1 12 . 1 1 20 20 SER HA H 20 4.370 4.370 4.175 0.195 17919 4628 1 12 . 1 1 20 20 SER C C 20 174.660 174.660 174.464 0.196 17919 4629 1 12 . 1 1 20 20 SER CA C 20 57.400 57.400 60.035 -2.635 17919 4630 1 12 . 1 1 20 20 SER CB C 20 63.370 63.370 62.926 0.444 17919 4631 1 12 . 1 1 20 20 SER H H 20 7.040 7.040 7.896 -0.856 17919 4632 1 12 . 1 1 21 21 ASP N N 21 123.480 123.480 121.895 1.585 17919 4633 1 12 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.449 0.246 17919 4634 1 12 . 1 1 21 21 ASP C C 21 176.360 176.360 176.660 -0.300 17919 4635 1 12 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.701 -0.001 17919 4636 1 12 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.297 -0.497 17919 4637 1 12 . 1 1 21 21 ASP H H 21 8.030 8.030 7.813 0.217 17919 4638 1 12 . 1 1 22 22 THR N N 22 108.800 108.800 113.890 -5.090 17919 4639 1 12 . 1 1 22 22 THR HA H 22 4.920 4.920 4.745 0.175 17919 4640 1 12 . 1 1 22 22 THR C C 22 176.750 176.750 175.570 1.180 17919 4641 1 12 . 1 1 22 22 THR CA C 22 59.690 59.690 60.577 -0.887 17919 4642 1 12 . 1 1 22 22 THR CB C 22 71.200 71.200 71.250 -0.050 17919 4643 1 12 . 1 1 22 22 THR H H 22 7.900 7.900 8.155 -0.255 17919 4644 1 12 . 1 1 23 23 ILE N N 23 121.190 121.190 120.929 0.261 17919 4645 1 12 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.846 -0.189 17919 4646 1 12 . 1 1 23 23 ILE C C 23 179.040 179.040 177.317 1.723 17919 4647 1 12 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.942 -1.682 17919 4648 1 12 . 1 1 23 23 ILE CB C 23 34.350 34.350 37.982 -3.632 17919 4649 1 12 . 1 1 23 23 ILE H H 23 8.560 8.560 8.935 -0.375 17919 4650 1 12 . 1 1 24 24 GLU N N 24 120.830 120.830 121.062 -0.232 17919 4651 1 12 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.948 -0.031 17919 4652 1 12 . 1 1 24 24 GLU C C 24 178.640 178.640 178.410 0.230 17919 4653 1 12 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.160 0.060 17919 4654 1 12 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.333 -1.053 17919 4655 1 12 . 1 1 24 24 GLU H H 24 9.760 9.760 8.136 1.624 17919 4656 1 12 . 1 1 25 25 ASN N N 25 120.570 120.570 118.150 2.420 17919 4657 1 12 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.513 0.012 17919 4658 1 12 . 1 1 25 25 ASN C C 25 178.380 178.380 178.170 0.210 17919 4659 1 12 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.062 -0.002 17919 4660 1 12 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.443 0.007 17919 4661 1 12 . 1 1 25 25 ASN H H 25 7.920 7.920 7.687 0.233 17919 4662 1 12 . 1 1 26 26 VAL N N 26 121.710 121.710 121.880 -0.170 17919 4663 1 12 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.550 -0.153 17919 4664 1 12 . 1 1 26 26 VAL C C 26 177.950 177.950 177.226 0.724 17919 4665 1 12 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.805 0.856 17919 4666 1 12 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.696 -0.856 17919 4667 1 12 . 1 1 26 26 VAL H H 26 8.070 8.070 7.561 0.509 17919 4668 1 12 . 1 1 27 27 LYS N N 27 118.860 118.860 120.296 -1.436 17919 4669 1 12 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.229 0.351 17919 4670 1 12 . 1 1 27 27 LYS C C 27 180.550 180.550 179.177 1.373 17919 4671 1 12 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.782 -0.532 17919 4672 1 12 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.337 1.393 17919 4673 1 12 . 1 1 27 27 LYS H H 27 8.560 8.560 8.486 0.074 17919 4674 1 12 . 1 1 28 28 ALA N N 28 123.440 123.440 120.074 3.366 17919 4675 1 12 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.103 0.057 17919 4676 1 12 . 1 1 28 28 ALA C C 28 180.300 180.300 179.113 1.187 17919 4677 1 12 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.885 0.485 17919 4678 1 12 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.470 -0.760 17919 4679 1 12 . 1 1 28 28 ALA H H 28 8.060 8.060 8.587 -0.527 17919 4680 1 12 . 1 1 29 29 LYS N N 29 119.940 119.940 118.789 1.151 17919 4681 1 12 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.164 0.043 17919 4682 1 12 . 1 1 29 29 LYS C C 29 180.320 180.320 178.865 1.455 17919 4683 1 12 . 1 1 29 29 LYS CA C 29 59.650 59.650 58.627 1.023 17919 4684 1 12 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.546 0.744 17919 4685 1 12 . 1 1 29 29 LYS H H 29 7.850 7.850 7.385 0.465 17919 4686 1 12 . 1 1 30 30 ILE N N 30 121.080 121.080 121.289 -0.209 17919 4687 1 12 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.542 -0.035 17919 4688 1 12 . 1 1 30 30 ILE C C 30 178.310 178.310 177.406 0.904 17919 4689 1 12 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.421 0.729 17919 4690 1 12 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.574 -0.774 17919 4691 1 12 . 1 1 30 30 ILE H H 30 8.280 8.280 8.573 -0.293 17919 4692 1 12 . 1 1 31 31 GLN N N 31 123.490 123.490 118.913 4.577 17919 4693 1 12 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.876 -0.047 17919 4694 1 12 . 1 1 31 31 GLN C C 31 178.890 178.890 177.808 1.082 17919 4695 1 12 . 1 1 31 31 GLN CA C 31 60.000 60.000 58.850 1.150 17919 4696 1 12 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.511 -0.791 17919 4697 1 12 . 1 1 31 31 GLN H H 31 8.580 8.580 7.762 0.818 17919 4698 1 12 . 1 1 32 32 ASP N N 32 119.360 119.360 118.493 0.867 17919 4699 1 12 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.399 -0.045 17919 4700 1 12 . 1 1 32 32 ASP C C 32 177.250 177.250 178.096 -0.846 17919 4701 1 12 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.813 0.377 17919 4702 1 12 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.543 0.037 17919 4703 1 12 . 1 1 32 32 ASP H H 32 8.010 8.010 7.725 0.285 17919 4704 1 12 . 1 1 33 33 LYS N N 33 115.130 115.130 118.148 -3.018 17919 4705 1 12 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.227 0.110 17919 4706 1 12 . 1 1 33 33 LYS C C 33 177.870 177.870 178.169 -0.299 17919 4707 1 12 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.082 -0.032 17919 4708 1 12 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.037 1.133 17919 4709 1 12 . 1 1 33 33 LYS H H 33 7.430 7.430 7.760 -0.330 17919 4710 1 12 . 1 1 34 34 GLU N N 34 113.870 113.870 115.076 -1.206 17919 4711 1 12 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.508 0.117 17919 4712 1 12 . 1 1 34 34 GLU C C 34 177.840 177.840 177.027 0.813 17919 4713 1 12 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.278 -1.108 17919 4714 1 12 . 1 1 34 34 GLU CB C 34 32.660 32.660 32.514 0.146 17919 4715 1 12 . 1 1 34 34 GLU H H 34 8.740 8.740 7.774 0.966 17919 4716 1 12 . 1 1 35 35 GLY N N 35 108.650 108.650 108.550 0.100 17919 4717 1 12 . 1 1 35 35 GLY C C 35 173.960 173.960 174.393 -0.433 17919 4718 1 12 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.181 0.899 17919 4719 1 12 . 1 1 35 35 GLY H H 35 8.530 8.530 7.958 0.572 17919 4720 1 12 . 1 1 36 36 ILE N N 36 119.880 119.880 123.197 -3.317 17919 4721 1 12 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.330 0.115 17919 4722 1 12 . 1 1 36 36 ILE C C 36 173.590 173.590 174.673 -1.083 17919 4723 1 12 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.830 -0.080 17919 4724 1 12 . 1 1 36 36 ILE CB C 36 40.580 40.580 39.003 1.577 17919 4725 1 12 . 1 1 36 36 ILE H H 36 6.150 6.150 7.820 -1.670 17919 4726 1 12 . 1 1 37 37 PRO HA H 37 4.634 4.634 5.078 -0.444 17919 4727 1 12 . 1 1 37 37 PRO C C 37 176.940 176.940 176.129 0.811 17919 4728 1 12 . 1 1 37 37 PRO CA C 37 61.660 61.660 60.811 0.849 17919 4729 1 12 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.218 0.632 17919 4730 1 12 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.164 -0.047 17919 4731 1 12 . 1 1 38 38 PRO C C 38 178.320 178.320 178.426 -0.106 17919 4732 1 12 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.351 0.909 17919 4733 1 12 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.669 1.220 17919 4734 1 12 . 1 1 39 39 ASP N N 39 113.380 113.380 118.507 -5.127 17919 4735 1 12 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.228 0.202 17919 4736 1 12 . 1 1 39 39 ASP C C 39 177.090 177.090 176.950 0.140 17919 4737 1 12 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.806 -1.166 17919 4738 1 12 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.167 -0.627 17919 4739 1 12 . 1 1 39 39 ASP H H 39 8.550 8.550 8.676 -0.126 17919 4740 1 12 . 1 1 40 40 GLN N N 40 116.780 116.780 115.580 1.200 17919 4741 1 12 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.390 0.074 17919 4742 1 12 . 1 1 40 40 GLN C C 40 175.380 175.380 176.048 -0.668 17919 4743 1 12 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.673 -0.033 17919 4744 1 12 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.092 1.048 17919 4745 1 12 . 1 1 40 40 GLN H H 40 7.820 7.820 8.012 -0.192 17919 4746 1 12 . 1 1 41 41 GLN N N 41 117.720 117.720 119.207 -1.487 17919 4747 1 12 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.617 -0.373 17919 4748 1 12 . 1 1 41 41 GLN C C 41 176.300 176.300 174.983 1.317 17919 4749 1 12 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.477 0.993 17919 4750 1 12 . 1 1 41 41 GLN CB C 41 31.650 31.650 30.272 1.378 17919 4751 1 12 . 1 1 41 41 GLN H H 41 7.480 7.480 7.330 0.150 17919 4752 1 12 . 1 1 42 42 ARG N N 42 122.680 122.680 123.239 -0.559 17919 4753 1 12 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.629 -0.129 17919 4754 1 12 . 1 1 42 42 ARG C C 42 174.050 174.050 173.894 0.156 17919 4755 1 12 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.419 0.631 17919 4756 1 12 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.170 -1.421 17919 4757 1 12 . 1 1 42 42 ARG H H 42 8.530 8.530 8.202 0.328 17919 4758 1 12 . 1 1 43 43 LEU N N 43 124.040 124.040 125.108 -1.068 17919 4759 1 12 . 1 1 43 43 LEU C C 43 175.290 175.290 174.943 0.347 17919 4760 1 12 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.988 -1.008 17919 4761 1 12 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.739 1.051 17919 4762 1 12 . 1 1 43 43 LEU H H 43 8.820 8.820 8.612 0.208 17919 4763 1 12 . 1 1 44 44 ILE N N 44 121.920 121.920 123.789 -1.869 17919 4764 1 12 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.656 0.336 17919 4765 1 12 . 1 1 44 44 ILE C C 44 176.060 176.060 174.015 2.045 17919 4766 1 12 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.423 -1.443 17919 4767 1 12 . 1 1 44 44 ILE CB C 44 41.420 41.420 40.422 0.998 17919 4768 1 12 . 1 1 44 44 ILE H H 44 9.030 9.030 8.480 0.550 17919 4769 1 12 . 1 1 45 45 PHE N N 45 125.390 125.390 127.845 -2.455 17919 4770 1 12 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.000 0.045 17919 4771 1 12 . 1 1 45 45 PHE C C 45 174.470 174.470 174.628 -0.158 17919 4772 1 12 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.412 0.608 17919 4773 1 12 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.202 0.558 17919 4774 1 12 . 1 1 45 45 PHE H H 45 8.830 8.830 8.390 0.440 17919 4775 1 12 . 1 1 46 46 ALA N N 46 132.200 132.200 129.342 2.858 17919 4776 1 12 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.504 0.186 17919 4777 1 12 . 1 1 46 46 ALA C C 46 177.290 177.290 177.326 -0.036 17919 4778 1 12 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.936 -0.396 17919 4779 1 12 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.709 -0.139 17919 4780 1 12 . 1 1 46 46 ALA H H 46 8.810 8.810 8.007 0.803 17919 4781 1 12 . 1 1 47 47 GLY N N 47 102.340 102.340 103.477 -1.137 17919 4782 1 12 . 1 1 47 47 GLY C C 47 173.810 173.810 174.132 -0.322 17919 4783 1 12 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.170 0.180 17919 4784 1 12 . 1 1 47 47 GLY H H 47 8.130 8.130 8.261 -0.131 17919 4785 1 12 . 1 1 48 48 LYS N N 48 121.570 121.570 121.033 0.537 17919 4786 1 12 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.586 0.036 17919 4787 1 12 . 1 1 48 48 LYS C C 48 174.700 174.700 175.451 -0.751 17919 4788 1 12 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.947 -0.397 17919 4789 1 12 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.097 0.433 17919 4790 1 12 . 1 1 48 48 LYS H H 48 7.980 7.980 7.873 0.107 17919 4791 1 12 . 1 1 49 49 GLN N N 49 122.410 122.410 125.180 -2.770 17919 4792 1 12 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.688 -0.128 17919 4793 1 12 . 1 1 49 49 GLN C C 49 175.670 175.670 176.492 -0.822 17919 4794 1 12 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.907 -0.168 17919 4795 1 12 . 1 1 49 49 GLN CB C 49 29.000 29.000 28.723 0.277 17919 4796 1 12 . 1 1 49 49 GLN H H 49 8.600 8.600 8.657 -0.057 17919 4797 1 12 . 1 1 50 50 LEU N N 50 125.520 125.520 126.451 -0.931 17919 4798 1 12 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.006 0.084 17919 4799 1 12 . 1 1 50 50 LEU C C 50 176.660 176.660 176.516 0.144 17919 4800 1 12 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.935 0.305 17919 4801 1 12 . 1 1 50 50 LEU CB C 50 41.570 41.570 40.165 1.405 17919 4802 1 12 . 1 1 50 50 LEU H H 50 8.530 8.530 8.125 0.405 17919 4803 1 12 . 1 1 51 51 GLU N N 51 122.940 122.940 125.578 -2.638 17919 4804 1 12 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.071 0.417 17919 4805 1 12 . 1 1 51 51 GLU C C 51 175.870 175.870 177.080 -1.210 17919 4806 1 12 . 1 1 51 51 GLU CA C 51 55.960 55.960 57.207 -1.247 17919 4807 1 12 . 1 1 51 51 GLU CB C 51 31.570 31.570 30.662 0.908 17919 4808 1 12 . 1 1 51 51 GLU H H 51 8.400 8.400 8.369 0.031 17919 4809 1 12 . 1 1 52 52 ASP N N 52 120.030 120.030 126.074 -6.044 17919 4810 1 12 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.660 -0.301 17919 4811 1 12 . 1 1 52 52 ASP C C 52 177.330 177.330 177.154 0.176 17919 4812 1 12 . 1 1 52 52 ASP CA C 52 56.960 56.960 56.609 0.351 17919 4813 1 12 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.717 0.133 17919 4814 1 12 . 1 1 52 52 ASP H H 52 8.160 8.160 8.896 -0.736 17919 4815 1 12 . 1 1 53 53 GLY N N 53 106.660 106.660 106.049 0.611 17919 4816 1 12 . 1 1 53 53 GLY C C 53 174.870 174.870 174.265 0.605 17919 4817 1 12 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.684 0.486 17919 4818 1 12 . 1 1 53 53 GLY H H 53 9.390 9.390 8.180 1.210 17919 4819 1 12 . 1 1 54 54 ARG N N 54 119.050 119.050 119.726 -0.676 17919 4820 1 12 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.700 -0.005 17919 4821 1 12 . 1 1 54 54 ARG C C 54 175.350 175.350 176.220 -0.870 17919 4822 1 12 . 1 1 54 54 ARG CA C 54 54.390 54.390 52.374 2.016 17919 4823 1 12 . 1 1 54 54 ARG CB C 54 32.650 32.650 31.185 1.465 17919 4824 1 12 . 1 1 54 54 ARG H H 54 7.460 7.460 7.377 0.083 17919 4825 1 12 . 1 1 55 55 THR N N 55 108.400 108.400 113.642 -5.242 17919 4826 1 12 . 1 1 55 55 THR HA H 55 5.240 5.240 4.879 0.361 17919 4827 1 12 . 1 1 55 55 THR C C 55 176.560 176.560 176.147 0.413 17919 4828 1 12 . 1 1 55 55 THR CA C 55 59.690 59.690 61.236 -1.546 17919 4829 1 12 . 1 1 55 55 THR CB C 55 72.260 72.260 70.412 1.848 17919 4830 1 12 . 1 1 55 55 THR H H 55 8.730 8.730 9.021 -0.291 17919 4831 1 12 . 1 1 56 56 LEU N N 56 117.920 117.920 122.015 -4.095 17919 4832 1 12 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.077 -0.017 17919 4833 1 12 . 1 1 56 56 LEU C C 56 180.810 180.810 179.067 1.743 17919 4834 1 12 . 1 1 56 56 LEU CA C 56 58.710 58.710 57.558 1.152 17919 4835 1 12 . 1 1 56 56 LEU CB C 56 40.370 40.370 39.905 0.465 17919 4836 1 12 . 1 1 56 56 LEU H H 56 8.140 8.140 8.118 0.022 17919 4837 1 12 . 1 1 57 57 SER N N 57 113.330 113.330 114.668 -1.338 17919 4838 1 12 . 1 1 57 57 SER HA H 57 4.370 4.370 4.178 0.192 17919 4839 1 12 . 1 1 57 57 SER C C 57 178.310 178.310 176.814 1.496 17919 4840 1 12 . 1 1 57 57 SER CA C 57 61.080 61.080 61.988 -0.908 17919 4841 1 12 . 1 1 57 57 SER CB C 57 62.530 62.530 62.920 -0.390 17919 4842 1 12 . 1 1 57 57 SER H H 57 8.470 8.470 8.323 0.147 17919 4843 1 12 . 1 1 58 58 ASP N N 58 124.190 124.190 122.708 1.482 17919 4844 1 12 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.258 0.038 17919 4845 1 12 . 1 1 58 58 ASP C C 58 177.400 177.400 177.394 0.006 17919 4846 1 12 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.946 0.234 17919 4847 1 12 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.572 -0.472 17919 4848 1 12 . 1 1 58 58 ASP H H 58 7.930 7.930 7.765 0.165 17919 4849 1 12 . 1 1 59 59 TYR N N 59 115.510 115.510 115.044 0.466 17919 4850 1 12 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.665 0.005 17919 4851 1 12 . 1 1 59 59 TYR C C 59 174.700 174.700 174.667 0.033 17919 4852 1 12 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.426 0.824 17919 4853 1 12 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.069 2.001 17919 4854 1 12 . 1 1 59 59 TYR H H 59 7.250 7.250 7.279 -0.029 17919 4855 1 12 . 1 1 60 60 ASN N N 60 115.900 115.900 115.518 0.382 17919 4856 1 12 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.302 0.053 17919 4857 1 12 . 1 1 60 60 ASN C C 60 174.340 174.340 174.457 -0.117 17919 4858 1 12 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.328 -0.208 17919 4859 1 12 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.235 0.175 17919 4860 1 12 . 1 1 60 60 ASN H H 60 8.150 8.150 7.729 0.421 17919 4861 1 12 . 1 1 61 61 ILE N N 61 118.600 118.600 119.791 -1.191 17919 4862 1 12 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.708 -0.315 17919 4863 1 12 . 1 1 61 61 ILE C C 61 174.610 174.610 175.109 -0.499 17919 4864 1 12 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.852 0.568 17919 4865 1 12 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.783 -1.043 17919 4866 1 12 . 1 1 61 61 ILE H H 61 7.250 7.250 7.875 -0.625 17919 4867 1 12 . 1 1 62 62 GLN N N 62 124.740 124.740 126.276 -1.536 17919 4868 1 12 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.565 -0.059 17919 4869 1 12 . 1 1 62 62 GLN C C 62 175.970 175.970 175.049 0.921 17919 4870 1 12 . 1 1 62 62 GLN CA C 62 53.660 53.660 54.300 -0.640 17919 4871 1 12 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.817 -0.167 17919 4872 1 12 . 1 1 62 62 GLN H H 62 7.610 7.610 8.173 -0.563 17919 4873 1 12 . 1 1 63 63 LYS N N 63 120.300 120.300 119.175 1.125 17919 4874 1 12 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.041 -0.040 17919 4875 1 12 . 1 1 63 63 LYS C C 63 175.810 175.810 177.360 -1.550 17919 4876 1 12 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.375 0.415 17919 4877 1 12 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.303 0.347 17919 4878 1 12 . 1 1 63 63 LYS H H 63 8.490 8.490 8.347 0.143 17919 4879 1 12 . 1 1 64 64 GLU N N 64 113.950 113.950 119.171 -5.221 17919 4880 1 12 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.552 -0.087 17919 4881 1 12 . 1 1 64 64 GLU C C 64 175.250 175.250 175.226 0.024 17919 4882 1 12 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.462 0.428 17919 4883 1 12 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.151 -2.252 17919 4884 1 12 . 1 1 64 64 GLU H H 64 9.280 9.280 8.510 0.770 17919 4885 1 12 . 1 1 65 65 SER N N 65 114.730 114.730 113.536 1.194 17919 4886 1 12 . 1 1 65 65 SER HA H 65 4.640 4.640 4.771 -0.131 17919 4887 1 12 . 1 1 65 65 SER C C 65 172.160 172.160 173.448 -1.288 17919 4888 1 12 . 1 1 65 65 SER CA C 65 60.890 60.890 58.637 2.253 17919 4889 1 12 . 1 1 65 65 SER CB C 65 64.910 64.910 65.257 -0.347 17919 4890 1 12 . 1 1 65 65 SER H H 65 7.670 7.670 7.499 0.171 17919 4891 1 12 . 1 1 66 66 THR N N 66 117.110 117.110 117.940 -0.830 17919 4892 1 12 . 1 1 66 66 THR HA H 66 5.270 5.270 5.019 0.251 17919 4893 1 12 . 1 1 66 66 THR C C 66 173.950 173.950 173.345 0.605 17919 4894 1 12 . 1 1 66 66 THR CA C 66 62.340 62.340 62.435 -0.095 17919 4895 1 12 . 1 1 66 66 THR CB C 66 70.080 70.080 70.519 -0.439 17919 4896 1 12 . 1 1 66 66 THR H H 66 8.730 8.730 8.704 0.026 17919 4897 1 12 . 1 1 67 67 LEU N N 67 127.110 127.110 127.966 -0.856 17919 4898 1 12 . 1 1 67 67 LEU HA H 67 5.060 5.060 5.140 -0.080 17919 4899 1 12 . 1 1 67 67 LEU C C 67 175.770 175.770 175.249 0.521 17919 4900 1 12 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.073 -0.173 17919 4901 1 12 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.223 0.037 17919 4902 1 12 . 1 1 67 67 LEU H H 67 9.410 9.410 9.298 0.112 17919 4903 1 12 . 1 1 68 68 HIS N N 68 118.380 118.380 124.371 -5.991 17919 4904 1 12 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.279 -0.039 17919 4905 1 12 . 1 1 68 68 HIS C C 68 173.150 173.150 174.007 -0.857 17919 4906 1 12 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.261 0.739 17919 4907 1 12 . 1 1 68 68 HIS CB C 68 30.530 30.530 31.101 -0.570 17919 4908 1 12 . 1 1 68 68 HIS H H 68 9.230 9.230 9.133 0.097 17919 4909 1 12 . 1 1 69 69 LEU N N 69 124.460 124.460 129.445 -4.985 17919 4910 1 12 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.848 0.342 17919 4911 1 12 . 1 1 69 69 LEU C C 69 175.270 175.270 175.200 0.070 17919 4912 1 12 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.910 -0.020 17919 4913 1 12 . 1 1 69 69 LEU CB C 69 44.380 44.380 43.338 1.042 17919 4914 1 12 . 1 1 69 69 LEU H H 69 8.340 8.340 7.773 0.567 17919 4915 1 12 . 1 1 70 70 VAL N N 70 126.940 126.940 127.890 -0.950 17919 4916 1 12 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.211 0.139 17919 4917 1 12 . 1 1 70 70 VAL C C 70 174.000 174.000 174.668 -0.668 17919 4918 1 12 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.544 0.256 17919 4919 1 12 . 1 1 70 70 VAL CB C 70 34.910 34.910 32.884 2.026 17919 4920 1 12 . 1 1 70 70 VAL H H 70 9.200 9.200 8.784 0.416 17919 4921 1 12 . 1 1 71 71 LEU N N 71 123.130 123.130 126.553 -3.423 17919 4922 1 12 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.726 0.334 17919 4923 1 12 . 1 1 71 71 LEU C C 71 177.830 177.830 176.867 0.963 17919 4924 1 12 . 1 1 71 71 LEU CA C 71 53.940 53.940 54.166 -0.226 17919 4925 1 12 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.657 0.193 17919 4926 1 12 . 1 1 71 71 LEU H H 71 8.120 8.120 8.529 -0.409 17919 4927 1 12 . 1 1 72 72 ARG N N 72 123.490 123.490 125.332 -1.842 17919 4928 1 12 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.497 -0.196 17919 4929 1 12 . 1 1 72 72 ARG C C 72 175.350 175.350 175.036 0.314 17919 4930 1 12 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.978 -0.368 17919 4931 1 12 . 1 1 72 72 ARG CB C 72 31.350 31.350 32.363 -1.013 17919 4932 1 12 . 1 1 72 72 ARG H H 72 8.580 8.580 8.563 0.017 17919 4933 1 13 . 1 1 2 2 GLN N N 2 123.220 123.220 119.292 3.928 17919 4934 1 13 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.347 -0.098 17919 4935 1 13 . 1 1 2 2 GLN C C 2 175.920 175.920 175.368 0.552 17919 4936 1 13 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.040 1.040 17919 4937 1 13 . 1 1 2 2 GLN CB C 2 30.760 30.760 31.305 -0.545 17919 4938 1 13 . 1 1 2 2 GLN H H 2 8.900 8.900 8.383 0.517 17919 4939 1 13 . 1 1 3 3 ILE N N 3 115.340 115.340 116.822 -1.482 17919 4940 1 13 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.548 -0.335 17919 4941 1 13 . 1 1 3 3 ILE C C 3 172.450 172.450 173.598 -1.148 17919 4942 1 13 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.119 0.451 17919 4943 1 13 . 1 1 3 3 ILE CB C 3 42.210 42.210 40.617 1.593 17919 4944 1 13 . 1 1 3 3 ILE H H 3 8.320 8.320 7.986 0.334 17919 4945 1 13 . 1 1 4 4 PHE N N 4 118.110 118.110 119.080 -0.970 17919 4946 1 13 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.475 0.155 17919 4947 1 13 . 1 1 4 4 PHE C C 4 175.320 175.320 175.106 0.214 17919 4948 1 13 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.487 -0.277 17919 4949 1 13 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.672 -1.192 17919 4950 1 13 . 1 1 4 4 PHE H H 4 8.610 8.610 8.727 -0.117 17919 4951 1 13 . 1 1 5 5 VAL N N 5 121.000 121.000 120.941 0.059 17919 4952 1 13 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.706 0.019 17919 4953 1 13 . 1 1 5 5 VAL C C 5 174.870 174.870 174.323 0.547 17919 4954 1 13 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.318 -0.698 17919 4955 1 13 . 1 1 5 5 VAL CB C 5 34.230 34.230 35.015 -0.785 17919 4956 1 13 . 1 1 5 5 VAL H H 5 9.300 9.300 8.931 0.369 17919 4957 1 13 . 1 1 6 6 LYS N N 6 127.520 127.520 128.711 -1.191 17919 4958 1 13 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.241 0.126 17919 4959 1 13 . 1 1 6 6 LYS C C 6 177.140 177.140 175.942 1.198 17919 4960 1 13 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.409 0.111 17919 4961 1 13 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.713 -0.663 17919 4962 1 13 . 1 1 6 6 LYS H H 6 8.820 8.820 9.162 -0.342 17919 4963 1 13 . 1 1 7 7 THR N N 7 115.400 115.400 118.076 -2.676 17919 4964 1 13 . 1 1 7 7 THR HA H 7 4.970 4.970 4.743 0.227 17919 4965 1 13 . 1 1 7 7 THR C C 7 176.910 176.910 176.414 0.496 17919 4966 1 13 . 1 1 7 7 THR CA C 7 60.470 60.470 60.164 0.306 17919 4967 1 13 . 1 1 7 7 THR CB C 7 70.630 70.630 71.502 -0.872 17919 4968 1 13 . 1 1 7 7 THR H H 7 8.730 8.730 7.977 0.753 17919 4969 1 13 . 1 1 8 8 LEU N N 8 121.330 121.330 122.754 -1.424 17919 4970 1 13 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.010 0.300 17919 4971 1 13 . 1 1 8 8 LEU C C 8 178.800 178.800 177.541 1.259 17919 4972 1 13 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.502 0.078 17919 4973 1 13 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.636 0.334 17919 4974 1 13 . 1 1 8 8 LEU H H 8 9.100 9.100 8.825 0.275 17919 4975 1 13 . 1 1 9 9 THR N N 9 105.590 105.590 106.131 -0.541 17919 4976 1 13 . 1 1 9 9 THR HA H 9 4.428 4.428 4.160 0.268 17919 4977 1 13 . 1 1 9 9 THR C C 9 175.520 175.520 175.435 0.085 17919 4978 1 13 . 1 1 9 9 THR CA C 9 61.400 61.400 62.713 -1.313 17919 4979 1 13 . 1 1 9 9 THR CB C 9 69.140 69.140 68.757 0.383 17919 4980 1 13 . 1 1 9 9 THR H H 9 7.630 7.630 7.865 -0.235 17919 4981 1 13 . 1 1 10 10 GLY N N 10 108.890 108.890 109.368 -0.478 17919 4982 1 13 . 1 1 10 10 GLY C C 10 174.070 174.070 173.571 0.499 17919 4983 1 13 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.615 0.845 17919 4984 1 13 . 1 1 10 10 GLY H H 10 7.810 7.810 7.766 0.044 17919 4985 1 13 . 1 1 11 11 LYS N N 11 121.600 121.600 121.781 -0.181 17919 4986 1 13 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.741 -0.380 17919 4987 1 13 . 1 1 11 11 LYS C C 11 175.940 175.940 175.271 0.669 17919 4988 1 13 . 1 1 11 11 LYS CA C 11 56.280 56.280 54.636 1.644 17919 4989 1 13 . 1 1 11 11 LYS CB C 11 33.200 33.200 35.124 -1.924 17919 4990 1 13 . 1 1 11 11 LYS H H 11 7.280 7.280 8.019 -0.739 17919 4991 1 13 . 1 1 12 12 THR N N 12 120.440 120.440 115.902 4.538 17919 4992 1 13 . 1 1 12 12 THR HA H 12 5.046 5.046 4.970 0.076 17919 4993 1 13 . 1 1 12 12 THR C C 12 174.320 174.320 173.704 0.616 17919 4994 1 13 . 1 1 12 12 THR CA C 12 62.390 62.390 61.220 1.170 17919 4995 1 13 . 1 1 12 12 THR CB C 12 69.910 69.910 70.694 -0.784 17919 4996 1 13 . 1 1 12 12 THR H H 12 8.650 8.650 8.357 0.293 17919 4997 1 13 . 1 1 13 13 ILE N N 13 127.110 127.110 127.322 -0.212 17919 4998 1 13 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.521 0.023 17919 4999 1 13 . 1 1 13 13 ILE C C 13 175.220 175.220 175.279 -0.059 17919 5000 1 13 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.430 -0.450 17919 5001 1 13 . 1 1 13 13 ILE CB C 13 40.950 40.950 39.504 1.446 17919 5002 1 13 . 1 1 13 13 ILE H H 13 9.450 9.450 9.206 0.244 17919 5003 1 13 . 1 1 14 14 THR N N 14 121.520 121.520 123.812 -2.292 17919 5004 1 13 . 1 1 14 14 THR HA H 14 4.964 4.964 4.974 -0.010 17919 5005 1 13 . 1 1 14 14 THR C C 14 173.790 173.790 173.841 -0.051 17919 5006 1 13 . 1 1 14 14 THR CA C 14 61.940 61.940 62.403 -0.463 17919 5007 1 13 . 1 1 14 14 THR CB C 14 69.650 69.650 70.020 -0.370 17919 5008 1 13 . 1 1 14 14 THR H H 14 8.710 8.710 8.528 0.182 17919 5009 1 13 . 1 1 15 15 LEU N N 15 124.800 124.800 125.869 -1.069 17919 5010 1 13 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.728 0.052 17919 5011 1 13 . 1 1 15 15 LEU C C 15 174.670 174.670 174.361 0.309 17919 5012 1 13 . 1 1 15 15 LEU CA C 15 52.830 52.830 54.397 -1.567 17919 5013 1 13 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.825 1.245 17919 5014 1 13 . 1 1 15 15 LEU H H 15 8.710 8.710 8.185 0.525 17919 5015 1 13 . 1 1 16 16 GLU N N 16 122.160 122.160 124.192 -2.032 17919 5016 1 13 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.119 -0.202 17919 5017 1 13 . 1 1 16 16 GLU C C 16 175.860 175.860 176.111 -0.251 17919 5018 1 13 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.352 -0.532 17919 5019 1 13 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.685 -1.235 17919 5020 1 13 . 1 1 16 16 GLU H H 16 8.140 8.140 8.604 -0.464 17919 5021 1 13 . 1 1 17 17 VAL N N 17 117.210 117.210 119.912 -2.702 17919 5022 1 13 . 1 1 17 17 VAL HA H 17 4.714 4.714 5.127 -0.413 17919 5023 1 13 . 1 1 17 17 VAL C C 17 174.160 174.160 175.015 -0.855 17919 5024 1 13 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.091 -0.661 17919 5025 1 13 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.954 0.446 17919 5026 1 13 . 1 1 17 17 VAL H H 17 8.900 8.900 8.774 0.126 17919 5027 1 13 . 1 1 18 18 GLU N N 18 118.990 118.990 121.494 -2.504 17919 5028 1 13 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.867 0.212 17919 5029 1 13 . 1 1 18 18 GLU C C 18 176.160 176.160 175.281 0.879 17919 5030 1 13 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.735 -0.015 17919 5031 1 13 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.615 -0.305 17919 5032 1 13 . 1 1 18 18 GLU H H 18 8.640 8.640 8.554 0.086 17919 5033 1 13 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.238 -0.097 17919 5034 1 13 . 1 1 19 19 PRO C C 19 175.310 175.310 178.038 -2.728 17919 5035 1 13 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.637 -0.167 17919 5036 1 13 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.909 0.041 17919 5037 1 13 . 1 1 20 20 SER N N 20 103.400 103.400 109.399 -5.999 17919 5038 1 13 . 1 1 20 20 SER HA H 20 4.370 4.370 4.341 0.029 17919 5039 1 13 . 1 1 20 20 SER C C 20 174.660 174.660 174.513 0.147 17919 5040 1 13 . 1 1 20 20 SER CA C 20 57.400 57.400 59.072 -1.673 17919 5041 1 13 . 1 1 20 20 SER CB C 20 63.370 63.370 62.847 0.522 17919 5042 1 13 . 1 1 20 20 SER H H 20 7.040 7.040 8.038 -0.998 17919 5043 1 13 . 1 1 21 21 ASP N N 21 123.480 123.480 124.693 -1.213 17919 5044 1 13 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.618 0.077 17919 5045 1 13 . 1 1 21 21 ASP C C 21 176.360 176.360 176.245 0.115 17919 5046 1 13 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.664 0.035 17919 5047 1 13 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.548 -0.749 17919 5048 1 13 . 1 1 21 21 ASP H H 21 8.030 8.030 7.679 0.351 17919 5049 1 13 . 1 1 22 22 THR N N 22 108.800 108.800 114.688 -5.888 17919 5050 1 13 . 1 1 22 22 THR HA H 22 4.920 4.920 4.504 0.416 17919 5051 1 13 . 1 1 22 22 THR C C 22 176.750 176.750 176.088 0.662 17919 5052 1 13 . 1 1 22 22 THR CA C 22 59.690 59.690 62.560 -2.870 17919 5053 1 13 . 1 1 22 22 THR CB C 22 71.200 71.200 69.956 1.244 17919 5054 1 13 . 1 1 22 22 THR H H 22 7.900 7.900 8.432 -0.532 17919 5055 1 13 . 1 1 23 23 ILE N N 23 121.190 121.190 122.878 -1.688 17919 5056 1 13 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.772 -0.115 17919 5057 1 13 . 1 1 23 23 ILE C C 23 179.040 179.040 177.670 1.370 17919 5058 1 13 . 1 1 23 23 ILE CA C 23 62.260 62.260 61.341 0.919 17919 5059 1 13 . 1 1 23 23 ILE CB C 23 34.350 34.350 35.932 -1.582 17919 5060 1 13 . 1 1 23 23 ILE H H 23 8.560 8.560 9.215 -0.655 17919 5061 1 13 . 1 1 24 24 GLU N N 24 120.830 120.830 120.784 0.046 17919 5062 1 13 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.895 0.022 17919 5063 1 13 . 1 1 24 24 GLU C C 24 178.640 178.640 178.681 -0.041 17919 5064 1 13 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.032 0.188 17919 5065 1 13 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.418 -1.138 17919 5066 1 13 . 1 1 24 24 GLU H H 24 9.760 9.760 8.169 1.591 17919 5067 1 13 . 1 1 25 25 ASN N N 25 120.570 120.570 117.708 2.862 17919 5068 1 13 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.538 -0.013 17919 5069 1 13 . 1 1 25 25 ASN C C 25 178.380 178.380 178.018 0.362 17919 5070 1 13 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.981 0.079 17919 5071 1 13 . 1 1 25 25 ASN CB C 25 38.450 38.450 37.837 0.613 17919 5072 1 13 . 1 1 25 25 ASN H H 25 7.920 7.920 8.303 -0.383 17919 5073 1 13 . 1 1 26 26 VAL N N 26 121.710 121.710 120.060 1.650 17919 5074 1 13 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.593 -0.196 17919 5075 1 13 . 1 1 26 26 VAL C C 26 177.950 177.950 177.728 0.222 17919 5076 1 13 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.692 0.968 17919 5077 1 13 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.313 -0.473 17919 5078 1 13 . 1 1 26 26 VAL H H 26 8.070 8.070 7.750 0.320 17919 5079 1 13 . 1 1 27 27 LYS N N 27 118.860 118.860 120.362 -1.502 17919 5080 1 13 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.288 0.292 17919 5081 1 13 . 1 1 27 27 LYS C C 27 180.550 180.550 179.109 1.441 17919 5082 1 13 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.437 -0.187 17919 5083 1 13 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.126 1.604 17919 5084 1 13 . 1 1 27 27 LYS H H 27 8.560 8.560 8.303 0.257 17919 5085 1 13 . 1 1 28 28 ALA N N 28 123.440 123.440 122.318 1.122 17919 5086 1 13 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.157 0.003 17919 5087 1 13 . 1 1 28 28 ALA C C 28 180.300 180.300 179.329 0.971 17919 5088 1 13 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.974 0.396 17919 5089 1 13 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.286 -0.576 17919 5090 1 13 . 1 1 28 28 ALA H H 28 8.060 8.060 8.342 -0.282 17919 5091 1 13 . 1 1 29 29 LYS N N 29 119.940 119.940 120.218 -0.278 17919 5092 1 13 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.015 0.192 17919 5093 1 13 . 1 1 29 29 LYS C C 29 180.320 180.320 179.107 1.213 17919 5094 1 13 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.657 -0.007 17919 5095 1 13 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.326 0.964 17919 5096 1 13 . 1 1 29 29 LYS H H 29 7.850 7.850 7.441 0.409 17919 5097 1 13 . 1 1 30 30 ILE N N 30 121.080 121.080 120.449 0.631 17919 5098 1 13 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.530 -0.023 17919 5099 1 13 . 1 1 30 30 ILE C C 30 178.310 178.310 177.562 0.748 17919 5100 1 13 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.396 0.754 17919 5101 1 13 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.631 -0.831 17919 5102 1 13 . 1 1 30 30 ILE H H 30 8.280 8.280 8.673 -0.393 17919 5103 1 13 . 1 1 31 31 GLN N N 31 123.490 123.490 119.366 4.124 17919 5104 1 13 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.903 -0.074 17919 5105 1 13 . 1 1 31 31 GLN C C 31 178.890 178.890 178.548 0.342 17919 5106 1 13 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.206 0.794 17919 5107 1 13 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.410 -0.690 17919 5108 1 13 . 1 1 31 31 GLN H H 31 8.580 8.580 8.066 0.514 17919 5109 1 13 . 1 1 32 32 ASP N N 32 119.360 119.360 120.237 -0.877 17919 5110 1 13 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.412 -0.058 17919 5111 1 13 . 1 1 32 32 ASP C C 32 177.250 177.250 177.995 -0.745 17919 5112 1 13 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.695 0.495 17919 5113 1 13 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.694 -0.114 17919 5114 1 13 . 1 1 32 32 ASP H H 32 8.010 8.010 8.162 -0.152 17919 5115 1 13 . 1 1 33 33 LYS N N 33 115.130 115.130 116.543 -1.413 17919 5116 1 13 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.435 -0.098 17919 5117 1 13 . 1 1 33 33 LYS C C 33 177.870 177.870 177.758 0.112 17919 5118 1 13 . 1 1 33 33 LYS CA C 33 58.050 58.050 56.911 1.139 17919 5119 1 13 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.243 0.927 17919 5120 1 13 . 1 1 33 33 LYS H H 33 7.430 7.430 7.809 -0.380 17919 5121 1 13 . 1 1 34 34 GLU N N 34 113.870 113.870 114.637 -0.767 17919 5122 1 13 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.505 0.120 17919 5123 1 13 . 1 1 34 34 GLU C C 34 177.840 177.840 177.214 0.626 17919 5124 1 13 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.165 -0.995 17919 5125 1 13 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.980 0.680 17919 5126 1 13 . 1 1 34 34 GLU H H 34 8.740 8.740 8.320 0.420 17919 5127 1 13 . 1 1 35 35 GLY N N 35 108.650 108.650 110.151 -1.501 17919 5128 1 13 . 1 1 35 35 GLY C C 35 173.960 173.960 174.179 -0.219 17919 5129 1 13 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.750 0.330 17919 5130 1 13 . 1 1 35 35 GLY H H 35 8.530 8.530 7.943 0.587 17919 5131 1 13 . 1 1 36 36 ILE N N 36 119.880 119.880 118.721 1.159 17919 5132 1 13 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.360 0.085 17919 5133 1 13 . 1 1 36 36 ILE C C 36 173.590 173.590 173.603 -0.013 17919 5134 1 13 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.783 -0.033 17919 5135 1 13 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.023 2.557 17919 5136 1 13 . 1 1 36 36 ILE H H 36 6.150 6.150 7.525 -1.375 17919 5137 1 13 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.819 -0.185 17919 5138 1 13 . 1 1 37 37 PRO C C 37 176.940 176.940 175.967 0.973 17919 5139 1 13 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.078 0.582 17919 5140 1 13 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.372 0.478 17919 5141 1 13 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.224 -0.107 17919 5142 1 13 . 1 1 38 38 PRO C C 38 178.320 178.320 178.654 -0.334 17919 5143 1 13 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.269 0.991 17919 5144 1 13 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.962 0.928 17919 5145 1 13 . 1 1 39 39 ASP N N 39 113.380 113.380 118.591 -5.211 17919 5146 1 13 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.218 0.212 17919 5147 1 13 . 1 1 39 39 ASP C C 39 177.090 177.090 178.369 -1.279 17919 5148 1 13 . 1 1 39 39 ASP CA C 39 55.640 55.640 57.414 -1.774 17919 5149 1 13 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.387 -0.847 17919 5150 1 13 . 1 1 39 39 ASP H H 39 8.550 8.550 8.615 -0.065 17919 5151 1 13 . 1 1 40 40 GLN N N 40 116.780 116.780 117.559 -0.779 17919 5152 1 13 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.126 0.338 17919 5153 1 13 . 1 1 40 40 GLN C C 40 175.380 175.380 176.230 -0.850 17919 5154 1 13 . 1 1 40 40 GLN CA C 40 55.640 55.640 57.342 -1.702 17919 5155 1 13 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.412 0.728 17919 5156 1 13 . 1 1 40 40 GLN H H 40 7.820 7.820 8.016 -0.196 17919 5157 1 13 . 1 1 41 41 GLN N N 41 117.720 117.720 118.781 -1.061 17919 5158 1 13 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.723 -0.479 17919 5159 1 13 . 1 1 41 41 GLN C C 41 176.300 176.300 174.688 1.612 17919 5160 1 13 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.493 0.977 17919 5161 1 13 . 1 1 41 41 GLN CB C 41 31.650 31.650 30.257 1.393 17919 5162 1 13 . 1 1 41 41 GLN H H 41 7.480 7.480 7.465 0.015 17919 5163 1 13 . 1 1 42 42 ARG N N 42 122.680 122.680 125.016 -2.336 17919 5164 1 13 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.647 -0.147 17919 5165 1 13 . 1 1 42 42 ARG C C 42 174.050 174.050 173.923 0.127 17919 5166 1 13 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.122 -0.072 17919 5167 1 13 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.188 -0.438 17919 5168 1 13 . 1 1 42 42 ARG H H 42 8.530 8.530 8.658 -0.128 17919 5169 1 13 . 1 1 43 43 LEU N N 43 124.040 124.040 127.826 -3.786 17919 5170 1 13 . 1 1 43 43 LEU C C 43 175.290 175.290 175.357 -0.067 17919 5171 1 13 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.934 -1.954 17919 5172 1 13 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.726 2.064 17919 5173 1 13 . 1 1 43 43 LEU H H 43 8.820 8.820 8.836 -0.016 17919 5174 1 13 . 1 1 44 44 ILE N N 44 121.920 121.920 121.815 0.105 17919 5175 1 13 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.791 0.201 17919 5176 1 13 . 1 1 44 44 ILE C C 44 176.060 176.060 174.699 1.361 17919 5177 1 13 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.160 -1.180 17919 5178 1 13 . 1 1 44 44 ILE CB C 44 41.420 41.420 40.672 0.747 17919 5179 1 13 . 1 1 44 44 ILE H H 44 9.030 9.030 7.917 1.113 17919 5180 1 13 . 1 1 45 45 PHE N N 45 125.390 125.390 128.202 -2.812 17919 5181 1 13 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.022 0.023 17919 5182 1 13 . 1 1 45 45 PHE C C 45 174.470 174.470 174.444 0.026 17919 5183 1 13 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.369 0.651 17919 5184 1 13 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.256 0.504 17919 5185 1 13 . 1 1 45 45 PHE H H 45 8.830 8.830 8.424 0.406 17919 5186 1 13 . 1 1 46 46 ALA N N 46 132.200 132.200 129.143 3.057 17919 5187 1 13 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.684 0.006 17919 5188 1 13 . 1 1 46 46 ALA C C 46 177.290 177.290 177.896 -0.606 17919 5189 1 13 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.612 -0.072 17919 5190 1 13 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.679 -0.109 17919 5191 1 13 . 1 1 46 46 ALA H H 46 8.810 8.810 8.724 0.086 17919 5192 1 13 . 1 1 47 47 GLY N N 47 102.340 102.340 105.030 -2.690 17919 5193 1 13 . 1 1 47 47 GLY C C 47 173.810 173.810 174.391 -0.581 17919 5194 1 13 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.219 0.131 17919 5195 1 13 . 1 1 47 47 GLY H H 47 8.130 8.130 8.478 -0.348 17919 5196 1 13 . 1 1 48 48 LYS N N 48 121.570 121.570 122.437 -0.867 17919 5197 1 13 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.602 0.020 17919 5198 1 13 . 1 1 48 48 LYS C C 48 174.700 174.700 175.517 -0.817 17919 5199 1 13 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.839 -0.289 17919 5200 1 13 . 1 1 48 48 LYS CB C 48 34.530 34.530 33.648 0.882 17919 5201 1 13 . 1 1 48 48 LYS H H 48 7.980 7.980 7.953 0.027 17919 5202 1 13 . 1 1 49 49 GLN N N 49 122.410 122.410 125.004 -2.594 17919 5203 1 13 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.671 -0.111 17919 5204 1 13 . 1 1 49 49 GLN C C 49 175.670 175.670 175.720 -0.050 17919 5205 1 13 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.590 -0.850 17919 5206 1 13 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.543 -0.543 17919 5207 1 13 . 1 1 49 49 GLN H H 49 8.600 8.600 8.632 -0.032 17919 5208 1 13 . 1 1 50 50 LEU N N 50 125.520 125.520 126.123 -0.603 17919 5209 1 13 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.320 -0.230 17919 5210 1 13 . 1 1 50 50 LEU C C 50 176.660 176.660 176.084 0.576 17919 5211 1 13 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.772 0.468 17919 5212 1 13 . 1 1 50 50 LEU CB C 50 41.570 41.570 43.002 -1.431 17919 5213 1 13 . 1 1 50 50 LEU H H 50 8.530 8.530 8.140 0.390 17919 5214 1 13 . 1 1 51 51 GLU N N 51 122.940 122.940 124.194 -1.254 17919 5215 1 13 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.542 -0.054 17919 5216 1 13 . 1 1 51 51 GLU C C 51 175.870 175.870 177.018 -1.148 17919 5217 1 13 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.613 0.347 17919 5218 1 13 . 1 1 51 51 GLU CB C 51 31.570 31.570 30.975 0.595 17919 5219 1 13 . 1 1 51 51 GLU H H 51 8.400 8.400 8.751 -0.351 17919 5220 1 13 . 1 1 52 52 ASP N N 52 120.030 120.030 124.804 -4.774 17919 5221 1 13 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.318 0.041 17919 5222 1 13 . 1 1 52 52 ASP C C 52 177.330 177.330 177.924 -0.594 17919 5223 1 13 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.999 -1.039 17919 5224 1 13 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.768 0.082 17919 5225 1 13 . 1 1 52 52 ASP H H 52 8.160 8.160 8.796 -0.636 17919 5226 1 13 . 1 1 53 53 GLY N N 53 106.660 106.660 103.525 3.135 17919 5227 1 13 . 1 1 53 53 GLY C C 53 174.870 174.870 173.865 1.005 17919 5228 1 13 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.736 0.434 17919 5229 1 13 . 1 1 53 53 GLY H H 53 9.390 9.390 8.511 0.879 17919 5230 1 13 . 1 1 54 54 ARG N N 54 119.050 119.050 119.590 -0.540 17919 5231 1 13 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.618 0.077 17919 5232 1 13 . 1 1 54 54 ARG C C 54 175.350 175.350 175.746 -0.396 17919 5233 1 13 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.003 0.387 17919 5234 1 13 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.036 -0.386 17919 5235 1 13 . 1 1 54 54 ARG H H 54 7.460 7.460 7.372 0.088 17919 5236 1 13 . 1 1 55 55 THR N N 55 108.400 108.400 113.871 -5.471 17919 5237 1 13 . 1 1 55 55 THR HA H 55 5.240 5.240 4.520 0.720 17919 5238 1 13 . 1 1 55 55 THR C C 55 176.560 176.560 176.620 -0.060 17919 5239 1 13 . 1 1 55 55 THR CA C 55 59.690 59.690 61.922 -2.232 17919 5240 1 13 . 1 1 55 55 THR CB C 55 72.260 72.260 70.054 2.206 17919 5241 1 13 . 1 1 55 55 THR H H 55 8.730 8.730 8.320 0.410 17919 5242 1 13 . 1 1 56 56 LEU N N 56 117.920 117.920 124.779 -6.859 17919 5243 1 13 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.022 0.038 17919 5244 1 13 . 1 1 56 56 LEU C C 56 180.810 180.810 178.839 1.971 17919 5245 1 13 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.622 0.088 17919 5246 1 13 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.419 -1.049 17919 5247 1 13 . 1 1 56 56 LEU H H 56 8.140 8.140 8.868 -0.728 17919 5248 1 13 . 1 1 57 57 SER N N 57 113.330 113.330 114.098 -0.768 17919 5249 1 13 . 1 1 57 57 SER HA H 57 4.370 4.370 4.110 0.260 17919 5250 1 13 . 1 1 57 57 SER C C 57 178.310 178.310 176.706 1.604 17919 5251 1 13 . 1 1 57 57 SER CA C 57 61.080 61.080 62.005 -0.925 17919 5252 1 13 . 1 1 57 57 SER CB C 57 62.530 62.530 62.677 -0.147 17919 5253 1 13 . 1 1 57 57 SER H H 57 8.470 8.470 8.012 0.458 17919 5254 1 13 . 1 1 58 58 ASP N N 58 124.190 124.190 121.195 2.995 17919 5255 1 13 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.297 -0.001 17919 5256 1 13 . 1 1 58 58 ASP C C 58 177.400 177.400 176.943 0.457 17919 5257 1 13 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.706 0.474 17919 5258 1 13 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.532 -0.433 17919 5259 1 13 . 1 1 58 58 ASP H H 58 7.930 7.930 7.894 0.036 17919 5260 1 13 . 1 1 59 59 TYR N N 59 115.510 115.510 115.781 -0.271 17919 5261 1 13 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.467 0.203 17919 5262 1 13 . 1 1 59 59 TYR C C 59 174.700 174.700 175.425 -0.725 17919 5263 1 13 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.825 0.425 17919 5264 1 13 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.169 1.901 17919 5265 1 13 . 1 1 59 59 TYR H H 59 7.250 7.250 6.981 0.269 17919 5266 1 13 . 1 1 60 60 ASN N N 60 115.900 115.900 114.631 1.269 17919 5267 1 13 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.267 0.088 17919 5268 1 13 . 1 1 60 60 ASN C C 60 174.340 174.340 174.293 0.047 17919 5269 1 13 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.387 -0.267 17919 5270 1 13 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.311 0.099 17919 5271 1 13 . 1 1 60 60 ASN H H 60 8.150 8.150 7.952 0.198 17919 5272 1 13 . 1 1 61 61 ILE N N 61 118.600 118.600 120.408 -1.808 17919 5273 1 13 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.634 -0.241 17919 5274 1 13 . 1 1 61 61 ILE C C 61 174.610 174.610 175.120 -0.510 17919 5275 1 13 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.244 0.176 17919 5276 1 13 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.636 -0.896 17919 5277 1 13 . 1 1 61 61 ILE H H 61 7.250 7.250 7.484 -0.234 17919 5278 1 13 . 1 1 62 62 GLN N N 62 124.740 124.740 127.718 -2.978 17919 5279 1 13 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.716 -0.210 17919 5280 1 13 . 1 1 62 62 GLN C C 62 175.970 175.970 174.853 1.117 17919 5281 1 13 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.227 0.433 17919 5282 1 13 . 1 1 62 62 GLN CB C 62 31.650 31.650 30.742 0.908 17919 5283 1 13 . 1 1 62 62 GLN H H 62 7.610 7.610 8.006 -0.396 17919 5284 1 13 . 1 1 63 63 LYS N N 63 120.300 120.300 119.545 0.755 17919 5285 1 13 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.107 -0.106 17919 5286 1 13 . 1 1 63 63 LYS C C 63 175.810 175.810 176.728 -0.918 17919 5287 1 13 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.914 -0.124 17919 5288 1 13 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.907 0.743 17919 5289 1 13 . 1 1 63 63 LYS H H 63 8.490 8.490 8.459 0.031 17919 5290 1 13 . 1 1 64 64 GLU N N 64 113.950 113.950 117.703 -3.753 17919 5291 1 13 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.801 -0.336 17919 5292 1 13 . 1 1 64 64 GLU C C 64 175.250 175.250 175.678 -0.428 17919 5293 1 13 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.456 0.434 17919 5294 1 13 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.314 -2.414 17919 5295 1 13 . 1 1 64 64 GLU H H 64 9.280 9.280 8.868 0.412 17919 5296 1 13 . 1 1 65 65 SER N N 65 114.730 114.730 114.302 0.428 17919 5297 1 13 . 1 1 65 65 SER HA H 65 4.640 4.640 4.499 0.141 17919 5298 1 13 . 1 1 65 65 SER C C 65 172.160 172.160 174.266 -2.106 17919 5299 1 13 . 1 1 65 65 SER CA C 65 60.890 60.890 60.758 0.132 17919 5300 1 13 . 1 1 65 65 SER CB C 65 64.910 64.910 64.058 0.852 17919 5301 1 13 . 1 1 65 65 SER H H 65 7.670 7.670 7.479 0.191 17919 5302 1 13 . 1 1 66 66 THR N N 66 117.110 117.110 121.976 -4.866 17919 5303 1 13 . 1 1 66 66 THR HA H 66 5.270 5.270 5.207 0.063 17919 5304 1 13 . 1 1 66 66 THR C C 66 173.950 173.950 174.422 -0.472 17919 5305 1 13 . 1 1 66 66 THR CA C 66 62.340 62.340 62.335 0.005 17919 5306 1 13 . 1 1 66 66 THR CB C 66 70.080 70.080 69.877 0.203 17919 5307 1 13 . 1 1 66 66 THR H H 66 8.730 8.730 8.674 0.056 17919 5308 1 13 . 1 1 67 67 LEU N N 67 127.110 127.110 126.845 0.265 17919 5309 1 13 . 1 1 67 67 LEU HA H 67 5.060 5.060 5.114 -0.054 17919 5310 1 13 . 1 1 67 67 LEU C C 67 175.770 175.770 176.153 -0.383 17919 5311 1 13 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.971 -0.071 17919 5312 1 13 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.416 -0.156 17919 5313 1 13 . 1 1 67 67 LEU H H 67 9.410 9.410 9.188 0.222 17919 5314 1 13 . 1 1 68 68 HIS N N 68 118.380 118.380 122.163 -3.783 17919 5315 1 13 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.136 0.104 17919 5316 1 13 . 1 1 68 68 HIS C C 68 173.150 173.150 175.278 -2.128 17919 5317 1 13 . 1 1 68 68 HIS CA C 68 55.000 55.000 53.915 1.085 17919 5318 1 13 . 1 1 68 68 HIS CB C 68 30.530 30.530 29.436 1.094 17919 5319 1 13 . 1 1 68 68 HIS H H 68 9.230 9.230 8.857 0.373 17919 5320 1 13 . 1 1 69 69 LEU N N 69 124.460 124.460 127.018 -2.558 17919 5321 1 13 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.181 1.009 17919 5322 1 13 . 1 1 69 69 LEU C C 69 175.270 175.270 174.997 0.273 17919 5323 1 13 . 1 1 69 69 LEU CA C 69 53.890 53.890 56.047 -2.157 17919 5324 1 13 . 1 1 69 69 LEU CB C 69 44.380 44.380 42.263 2.117 17919 5325 1 13 . 1 1 69 69 LEU H H 69 8.340 8.340 7.673 0.667 17919 5326 1 13 . 1 1 70 70 VAL N N 70 126.940 126.940 122.569 4.371 17919 5327 1 13 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.527 -0.177 17919 5328 1 13 . 1 1 70 70 VAL C C 70 174.000 174.000 173.977 0.023 17919 5329 1 13 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.337 1.463 17919 5330 1 13 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.211 -0.301 17919 5331 1 13 . 1 1 70 70 VAL H H 70 9.200 9.200 8.975 0.225 17919 5332 1 13 . 1 1 71 71 LEU N N 71 123.130 123.130 121.156 1.974 17919 5333 1 13 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.056 0.004 17919 5334 1 13 . 1 1 71 71 LEU C C 71 177.830 177.830 176.726 1.104 17919 5335 1 13 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.398 0.542 17919 5336 1 13 . 1 1 71 71 LEU CB C 71 42.850 42.850 44.383 -1.533 17919 5337 1 13 . 1 1 71 71 LEU H H 71 8.120 8.120 8.228 -0.108 17919 5338 1 13 . 1 1 72 72 ARG N N 72 123.490 123.490 122.344 1.146 17919 5339 1 13 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.473 -0.172 17919 5340 1 13 . 1 1 72 72 ARG C C 72 175.350 175.350 175.293 0.057 17919 5341 1 13 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.936 -0.326 17919 5342 1 13 . 1 1 72 72 ARG CB C 72 31.350 31.350 31.267 0.083 17919 5343 1 13 . 1 1 72 72 ARG H H 72 8.580 8.580 8.334 0.246 17919 5344 1 14 . 1 1 2 2 GLN N N 2 123.220 123.220 120.844 2.376 17919 5345 1 14 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.287 -0.038 17919 5346 1 14 . 1 1 2 2 GLN C C 2 175.920 175.920 175.750 0.170 17919 5347 1 14 . 1 1 2 2 GLN CA C 2 55.080 55.080 55.355 -0.275 17919 5348 1 14 . 1 1 2 2 GLN CB C 2 30.760 30.760 29.811 0.949 17919 5349 1 14 . 1 1 2 2 GLN H H 2 8.900 8.900 8.579 0.321 17919 5350 1 14 . 1 1 3 3 ILE N N 3 115.340 115.340 116.454 -1.114 17919 5351 1 14 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.263 -0.050 17919 5352 1 14 . 1 1 3 3 ILE C C 3 172.450 172.450 173.641 -1.191 17919 5353 1 14 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.469 0.101 17919 5354 1 14 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.664 0.546 17919 5355 1 14 . 1 1 3 3 ILE H H 3 8.320 8.320 8.606 -0.286 17919 5356 1 14 . 1 1 4 4 PHE N N 4 118.110 118.110 120.763 -2.653 17919 5357 1 14 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.472 0.158 17919 5358 1 14 . 1 1 4 4 PHE C C 4 175.320 175.320 175.606 -0.286 17919 5359 1 14 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.173 0.036 17919 5360 1 14 . 1 1 4 4 PHE CB C 4 41.480 41.480 40.647 0.833 17919 5361 1 14 . 1 1 4 4 PHE H H 4 8.610 8.610 7.926 0.684 17919 5362 1 14 . 1 1 5 5 VAL N N 5 121.000 121.000 122.558 -1.558 17919 5363 1 14 . 1 1 5 5 VAL HA H 5 4.725 4.725 5.088 -0.363 17919 5364 1 14 . 1 1 5 5 VAL C C 5 174.870 174.870 175.407 -0.537 17919 5365 1 14 . 1 1 5 5 VAL CA C 5 60.620 60.620 60.883 -0.263 17919 5366 1 14 . 1 1 5 5 VAL CB C 5 34.230 34.230 32.746 1.484 17919 5367 1 14 . 1 1 5 5 VAL H H 5 9.300 9.300 8.489 0.811 17919 5368 1 14 . 1 1 6 6 LYS N N 6 127.520 127.520 128.087 -0.567 17919 5369 1 14 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.444 -0.077 17919 5370 1 14 . 1 1 6 6 LYS C C 6 177.140 177.140 176.326 0.814 17919 5371 1 14 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.404 0.116 17919 5372 1 14 . 1 1 6 6 LYS CB C 6 35.050 35.050 36.102 -1.052 17919 5373 1 14 . 1 1 6 6 LYS H H 6 8.820 8.820 8.767 0.053 17919 5374 1 14 . 1 1 7 7 THR N N 7 115.400 115.400 114.041 1.359 17919 5375 1 14 . 1 1 7 7 THR HA H 7 4.970 4.970 5.137 -0.167 17919 5376 1 14 . 1 1 7 7 THR C C 7 176.910 176.910 176.384 0.526 17919 5377 1 14 . 1 1 7 7 THR CA C 7 60.470 60.470 60.090 0.380 17919 5378 1 14 . 1 1 7 7 THR CB C 7 70.630 70.630 70.990 -0.360 17919 5379 1 14 . 1 1 7 7 THR H H 7 8.730 8.730 8.525 0.205 17919 5380 1 14 . 1 1 8 8 LEU N N 8 121.330 121.330 121.567 -0.237 17919 5381 1 14 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.380 -0.070 17919 5382 1 14 . 1 1 8 8 LEU C C 8 178.800 178.800 178.100 0.700 17919 5383 1 14 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.138 0.442 17919 5384 1 14 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.339 -0.369 17919 5385 1 14 . 1 1 8 8 LEU H H 8 9.100 9.100 8.778 0.322 17919 5386 1 14 . 1 1 9 9 THR N N 9 105.590 105.590 108.180 -2.590 17919 5387 1 14 . 1 1 9 9 THR HA H 9 4.428 4.428 4.248 0.180 17919 5388 1 14 . 1 1 9 9 THR C C 9 175.520 175.520 175.718 -0.198 17919 5389 1 14 . 1 1 9 9 THR CA C 9 61.400 61.400 62.526 -1.126 17919 5390 1 14 . 1 1 9 9 THR CB C 9 69.140 69.140 69.326 -0.186 17919 5391 1 14 . 1 1 9 9 THR H H 9 7.630 7.630 7.916 -0.286 17919 5392 1 14 . 1 1 10 10 GLY N N 10 108.890 108.890 110.940 -2.050 17919 5393 1 14 . 1 1 10 10 GLY C C 10 174.070 174.070 173.879 0.191 17919 5394 1 14 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.458 1.002 17919 5395 1 14 . 1 1 10 10 GLY H H 10 7.810 7.810 7.678 0.132 17919 5396 1 14 . 1 1 11 11 LYS N N 11 121.600 121.600 122.295 -0.695 17919 5397 1 14 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.333 0.028 17919 5398 1 14 . 1 1 11 11 LYS C C 11 175.940 175.940 175.587 0.353 17919 5399 1 14 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.131 0.149 17919 5400 1 14 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.490 -0.290 17919 5401 1 14 . 1 1 11 11 LYS H H 11 7.280 7.280 7.705 -0.425 17919 5402 1 14 . 1 1 12 12 THR N N 12 120.440 120.440 120.780 -0.340 17919 5403 1 14 . 1 1 12 12 THR HA H 12 5.046 5.046 4.752 0.294 17919 5404 1 14 . 1 1 12 12 THR C C 12 174.320 174.320 173.974 0.346 17919 5405 1 14 . 1 1 12 12 THR CA C 12 62.390 62.390 61.523 0.867 17919 5406 1 14 . 1 1 12 12 THR CB C 12 69.910 69.910 69.845 0.065 17919 5407 1 14 . 1 1 12 12 THR H H 12 8.650 8.650 8.277 0.373 17919 5408 1 14 . 1 1 13 13 ILE N N 13 127.110 127.110 122.412 4.698 17919 5409 1 14 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.724 -0.180 17919 5410 1 14 . 1 1 13 13 ILE C C 13 175.220 175.220 173.589 1.631 17919 5411 1 14 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.217 0.763 17919 5412 1 14 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.476 -0.526 17919 5413 1 14 . 1 1 13 13 ILE H H 13 9.450 9.450 8.905 0.545 17919 5414 1 14 . 1 1 14 14 THR N N 14 121.520 121.520 120.858 0.662 17919 5415 1 14 . 1 1 14 14 THR HA H 14 4.964 4.964 5.314 -0.350 17919 5416 1 14 . 1 1 14 14 THR C C 14 173.790 173.790 173.746 0.044 17919 5417 1 14 . 1 1 14 14 THR CA C 14 61.940 61.940 61.481 0.459 17919 5418 1 14 . 1 1 14 14 THR CB C 14 69.650 69.650 70.199 -0.549 17919 5419 1 14 . 1 1 14 14 THR H H 14 8.710 8.710 8.266 0.444 17919 5420 1 14 . 1 1 15 15 LEU N N 15 124.800 124.800 126.256 -1.456 17919 5421 1 14 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.830 -0.050 17919 5422 1 14 . 1 1 15 15 LEU C C 15 174.670 174.670 174.716 -0.046 17919 5423 1 14 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.584 -0.754 17919 5424 1 14 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.107 1.963 17919 5425 1 14 . 1 1 15 15 LEU H H 15 8.710 8.710 8.409 0.301 17919 5426 1 14 . 1 1 16 16 GLU N N 16 122.160 122.160 121.493 0.667 17919 5427 1 14 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.446 -0.529 17919 5428 1 14 . 1 1 16 16 GLU C C 16 175.860 175.860 175.164 0.696 17919 5429 1 14 . 1 1 16 16 GLU CA C 16 54.820 54.820 54.798 0.022 17919 5430 1 14 . 1 1 16 16 GLU CB C 16 29.450 29.450 31.687 -2.237 17919 5431 1 14 . 1 1 16 16 GLU H H 16 8.140 8.140 8.315 -0.175 17919 5432 1 14 . 1 1 17 17 VAL N N 17 117.210 117.210 117.882 -0.672 17919 5433 1 14 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.507 0.207 17919 5434 1 14 . 1 1 17 17 VAL C C 17 174.160 174.160 174.261 -0.101 17919 5435 1 14 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.806 -0.376 17919 5436 1 14 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.174 1.226 17919 5437 1 14 . 1 1 17 17 VAL H H 17 8.900 8.900 9.200 -0.300 17919 5438 1 14 . 1 1 18 18 GLU N N 18 118.990 118.990 118.807 0.183 17919 5439 1 14 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.764 0.315 17919 5440 1 14 . 1 1 18 18 GLU C C 18 176.160 176.160 174.961 1.199 17919 5441 1 14 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.615 -0.895 17919 5442 1 14 . 1 1 18 18 GLU CB C 18 30.310 30.310 31.139 -0.829 17919 5443 1 14 . 1 1 18 18 GLU H H 18 8.640 8.640 8.526 0.114 17919 5444 1 14 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.149 -0.008 17919 5445 1 14 . 1 1 19 19 PRO C C 19 175.310 175.310 178.204 -2.894 17919 5446 1 14 . 1 1 19 19 PRO CA C 19 65.470 65.470 66.048 -0.578 17919 5447 1 14 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.901 0.049 17919 5448 1 14 . 1 1 20 20 SER N N 20 103.400 103.400 109.990 -6.590 17919 5449 1 14 . 1 1 20 20 SER HA H 20 4.370 4.370 4.313 0.057 17919 5450 1 14 . 1 1 20 20 SER C C 20 174.660 174.660 174.094 0.566 17919 5451 1 14 . 1 1 20 20 SER CA C 20 57.400 57.400 58.613 -1.213 17919 5452 1 14 . 1 1 20 20 SER CB C 20 63.370 63.370 62.993 0.377 17919 5453 1 14 . 1 1 20 20 SER H H 20 7.040 7.040 8.256 -1.216 17919 5454 1 14 . 1 1 21 21 ASP N N 21 123.480 123.480 122.353 1.127 17919 5455 1 14 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.566 0.129 17919 5456 1 14 . 1 1 21 21 ASP C C 21 176.360 176.360 176.008 0.352 17919 5457 1 14 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.481 0.219 17919 5458 1 14 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.651 -0.851 17919 5459 1 14 . 1 1 21 21 ASP H H 21 8.030 8.030 7.749 0.281 17919 5460 1 14 . 1 1 22 22 THR N N 22 108.800 108.800 111.856 -3.056 17919 5461 1 14 . 1 1 22 22 THR HA H 22 4.920 4.920 4.828 0.092 17919 5462 1 14 . 1 1 22 22 THR C C 22 176.750 176.750 176.249 0.501 17919 5463 1 14 . 1 1 22 22 THR CA C 22 59.690 59.690 60.684 -0.994 17919 5464 1 14 . 1 1 22 22 THR CB C 22 71.200 71.200 70.819 0.381 17919 5465 1 14 . 1 1 22 22 THR H H 22 7.900 7.900 8.607 -0.707 17919 5466 1 14 . 1 1 23 23 ILE N N 23 121.190 121.190 122.194 -1.004 17919 5467 1 14 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.782 -0.125 17919 5468 1 14 . 1 1 23 23 ILE C C 23 179.040 179.040 177.637 1.403 17919 5469 1 14 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.764 -0.504 17919 5470 1 14 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.047 -1.696 17919 5471 1 14 . 1 1 23 23 ILE H H 23 8.560 8.560 8.863 -0.303 17919 5472 1 14 . 1 1 24 24 GLU N N 24 120.830 120.830 121.460 -0.630 17919 5473 1 14 . 1 1 24 24 GLU HA H 24 3.917 3.917 4.001 -0.084 17919 5474 1 14 . 1 1 24 24 GLU C C 24 178.640 178.640 178.559 0.081 17919 5475 1 14 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.864 0.356 17919 5476 1 14 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.614 -1.334 17919 5477 1 14 . 1 1 24 24 GLU H H 24 9.760 9.760 8.584 1.176 17919 5478 1 14 . 1 1 25 25 ASN N N 25 120.570 120.570 119.312 1.258 17919 5479 1 14 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.389 0.136 17919 5480 1 14 . 1 1 25 25 ASN C C 25 178.380 178.380 178.209 0.171 17919 5481 1 14 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.612 -0.552 17919 5482 1 14 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.494 -0.044 17919 5483 1 14 . 1 1 25 25 ASN H H 25 7.920 7.920 8.044 -0.124 17919 5484 1 14 . 1 1 26 26 VAL N N 26 121.710 121.710 120.217 1.493 17919 5485 1 14 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.780 -0.383 17919 5486 1 14 . 1 1 26 26 VAL C C 26 177.950 177.950 176.850 1.100 17919 5487 1 14 . 1 1 26 26 VAL CA C 26 67.660 67.660 65.145 2.515 17919 5488 1 14 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.883 -1.043 17919 5489 1 14 . 1 1 26 26 VAL H H 26 8.070 8.070 7.974 0.096 17919 5490 1 14 . 1 1 27 27 LYS N N 27 118.860 118.860 121.252 -2.392 17919 5491 1 14 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.296 0.284 17919 5492 1 14 . 1 1 27 27 LYS C C 27 180.550 180.550 178.665 1.885 17919 5493 1 14 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.830 -0.580 17919 5494 1 14 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.448 1.282 17919 5495 1 14 . 1 1 27 27 LYS H H 27 8.560 8.560 8.346 0.214 17919 5496 1 14 . 1 1 28 28 ALA N N 28 123.440 123.440 120.801 2.639 17919 5497 1 14 . 1 1 28 28 ALA HA H 28 4.160 4.160 3.979 0.181 17919 5498 1 14 . 1 1 28 28 ALA C C 28 180.300 180.300 179.242 1.058 17919 5499 1 14 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.343 0.027 17919 5500 1 14 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.322 -0.612 17919 5501 1 14 . 1 1 28 28 ALA H H 28 8.060 8.060 8.208 -0.148 17919 5502 1 14 . 1 1 29 29 LYS N N 29 119.940 119.940 119.530 0.410 17919 5503 1 14 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.194 0.013 17919 5504 1 14 . 1 1 29 29 LYS C C 29 180.320 180.320 179.033 1.287 17919 5505 1 14 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.148 0.502 17919 5506 1 14 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.446 0.844 17919 5507 1 14 . 1 1 29 29 LYS H H 29 7.850 7.850 7.298 0.552 17919 5508 1 14 . 1 1 30 30 ILE N N 30 121.080 121.080 120.439 0.641 17919 5509 1 14 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.543 -0.036 17919 5510 1 14 . 1 1 30 30 ILE C C 30 178.310 178.310 177.819 0.491 17919 5511 1 14 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.244 0.906 17919 5512 1 14 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.586 -0.786 17919 5513 1 14 . 1 1 30 30 ILE H H 30 8.280 8.280 8.253 0.027 17919 5514 1 14 . 1 1 31 31 GLN N N 31 123.490 123.490 120.048 3.442 17919 5515 1 14 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.875 -0.046 17919 5516 1 14 . 1 1 31 31 GLN C C 31 178.890 178.890 178.210 0.680 17919 5517 1 14 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.243 0.757 17919 5518 1 14 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.576 -0.856 17919 5519 1 14 . 1 1 31 31 GLN H H 31 8.580 8.580 8.440 0.140 17919 5520 1 14 . 1 1 32 32 ASP N N 32 119.360 119.360 117.548 1.812 17919 5521 1 14 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.416 -0.062 17919 5522 1 14 . 1 1 32 32 ASP C C 32 177.250 177.250 177.469 -0.219 17919 5523 1 14 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.703 0.487 17919 5524 1 14 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.709 -0.128 17919 5525 1 14 . 1 1 32 32 ASP H H 32 8.010 8.010 8.183 -0.173 17919 5526 1 14 . 1 1 33 33 LYS N N 33 115.130 115.130 118.219 -3.089 17919 5527 1 14 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.441 -0.104 17919 5528 1 14 . 1 1 33 33 LYS C C 33 177.870 177.870 178.009 -0.139 17919 5529 1 14 . 1 1 33 33 LYS CA C 33 58.050 58.050 56.986 1.064 17919 5530 1 14 . 1 1 33 33 LYS CB C 33 34.170 34.170 34.050 0.120 17919 5531 1 14 . 1 1 33 33 LYS H H 33 7.430 7.430 7.438 -0.008 17919 5532 1 14 . 1 1 34 34 GLU N N 34 113.870 113.870 115.946 -2.076 17919 5533 1 14 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.474 0.151 17919 5534 1 14 . 1 1 34 34 GLU C C 34 177.840 177.840 177.730 0.110 17919 5535 1 14 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.222 -1.052 17919 5536 1 14 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.064 1.596 17919 5537 1 14 . 1 1 34 34 GLU H H 34 8.740 8.740 8.287 0.453 17919 5538 1 14 . 1 1 35 35 GLY N N 35 108.650 108.650 109.601 -0.951 17919 5539 1 14 . 1 1 35 35 GLY C C 35 173.960 173.960 174.198 -0.238 17919 5540 1 14 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.702 0.378 17919 5541 1 14 . 1 1 35 35 GLY H H 35 8.530 8.530 7.935 0.595 17919 5542 1 14 . 1 1 36 36 ILE N N 36 119.880 119.880 121.434 -1.554 17919 5543 1 14 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.329 0.116 17919 5544 1 14 . 1 1 36 36 ILE C C 36 173.590 173.590 174.211 -0.621 17919 5545 1 14 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.737 0.013 17919 5546 1 14 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.925 1.655 17919 5547 1 14 . 1 1 36 36 ILE H H 36 6.150 6.150 7.660 -1.510 17919 5548 1 14 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.682 -0.048 17919 5549 1 14 . 1 1 37 37 PRO C C 37 176.940 176.940 176.288 0.652 17919 5550 1 14 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.654 0.006 17919 5551 1 14 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.348 0.502 17919 5552 1 14 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.183 -0.066 17919 5553 1 14 . 1 1 38 38 PRO C C 38 178.320 178.320 177.867 0.453 17919 5554 1 14 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.830 0.430 17919 5555 1 14 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.888 1.002 17919 5556 1 14 . 1 1 39 39 ASP N N 39 113.380 113.380 112.904 0.476 17919 5557 1 14 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.497 -0.067 17919 5558 1 14 . 1 1 39 39 ASP C C 39 177.090 177.090 176.783 0.307 17919 5559 1 14 . 1 1 39 39 ASP CA C 39 55.640 55.640 55.492 0.148 17919 5560 1 14 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.376 -0.836 17919 5561 1 14 . 1 1 39 39 ASP H H 39 8.550 8.550 8.523 0.027 17919 5562 1 14 . 1 1 40 40 GLN N N 40 116.780 116.780 117.166 -0.386 17919 5563 1 14 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.349 0.115 17919 5564 1 14 . 1 1 40 40 GLN C C 40 175.380 175.380 176.689 -1.309 17919 5565 1 14 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.753 -0.113 17919 5566 1 14 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.595 0.545 17919 5567 1 14 . 1 1 40 40 GLN H H 40 7.820 7.820 7.604 0.216 17919 5568 1 14 . 1 1 41 41 GLN N N 41 117.720 117.720 119.767 -2.047 17919 5569 1 14 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.157 0.087 17919 5570 1 14 . 1 1 41 41 GLN C C 41 176.300 176.300 175.761 0.539 17919 5571 1 14 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.718 -0.248 17919 5572 1 14 . 1 1 41 41 GLN CB C 41 31.650 31.650 28.442 3.208 17919 5573 1 14 . 1 1 41 41 GLN H H 41 7.480 7.480 7.370 0.110 17919 5574 1 14 . 1 1 42 42 ARG N N 42 122.680 122.680 127.039 -4.359 17919 5575 1 14 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.474 0.026 17919 5576 1 14 . 1 1 42 42 ARG C C 42 174.050 174.050 174.139 -0.089 17919 5577 1 14 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.285 -0.235 17919 5578 1 14 . 1 1 42 42 ARG CB C 42 31.750 31.750 31.421 0.330 17919 5579 1 14 . 1 1 42 42 ARG H H 42 8.530 8.530 8.766 -0.236 17919 5580 1 14 . 1 1 43 43 LEU N N 43 124.040 124.040 127.485 -3.445 17919 5581 1 14 . 1 1 43 43 LEU C C 43 175.290 175.290 175.927 -0.637 17919 5582 1 14 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.473 -0.493 17919 5583 1 14 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.480 1.310 17919 5584 1 14 . 1 1 43 43 LEU H H 43 8.820 8.820 8.734 0.086 17919 5585 1 14 . 1 1 44 44 ILE N N 44 121.920 121.920 121.274 0.646 17919 5586 1 14 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.233 -0.241 17919 5587 1 14 . 1 1 44 44 ILE C C 44 176.060 176.060 174.280 1.780 17919 5588 1 14 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.917 -0.937 17919 5589 1 14 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.967 -0.547 17919 5590 1 14 . 1 1 44 44 ILE H H 44 9.030 9.030 8.573 0.457 17919 5591 1 14 . 1 1 45 45 PHE N N 45 125.390 125.390 126.790 -1.400 17919 5592 1 14 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.003 0.042 17919 5593 1 14 . 1 1 45 45 PHE C C 45 174.470 174.470 174.339 0.131 17919 5594 1 14 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.600 0.420 17919 5595 1 14 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.078 0.682 17919 5596 1 14 . 1 1 45 45 PHE H H 45 8.830 8.830 9.014 -0.184 17919 5597 1 14 . 1 1 46 46 ALA N N 46 132.200 132.200 129.548 2.652 17919 5598 1 14 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.559 0.131 17919 5599 1 14 . 1 1 46 46 ALA C C 46 177.290 177.290 177.282 0.008 17919 5600 1 14 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.980 -0.439 17919 5601 1 14 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.794 -0.224 17919 5602 1 14 . 1 1 46 46 ALA H H 46 8.810 8.810 8.595 0.215 17919 5603 1 14 . 1 1 47 47 GLY N N 47 102.340 102.340 103.019 -0.679 17919 5604 1 14 . 1 1 47 47 GLY C C 47 173.810 173.810 174.416 -0.606 17919 5605 1 14 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.184 0.167 17919 5606 1 14 . 1 1 47 47 GLY H H 47 8.130 8.130 8.427 -0.297 17919 5607 1 14 . 1 1 48 48 LYS N N 48 121.570 121.570 121.268 0.302 17919 5608 1 14 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.609 0.013 17919 5609 1 14 . 1 1 48 48 LYS C C 48 174.700 174.700 175.459 -0.759 17919 5610 1 14 . 1 1 48 48 LYS CA C 48 54.550 54.550 53.946 0.604 17919 5611 1 14 . 1 1 48 48 LYS CB C 48 34.530 34.530 33.877 0.653 17919 5612 1 14 . 1 1 48 48 LYS H H 48 7.980 7.980 7.976 0.004 17919 5613 1 14 . 1 1 49 49 GLN N N 49 122.410 122.410 124.620 -2.210 17919 5614 1 14 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.396 0.164 17919 5615 1 14 . 1 1 49 49 GLN C C 49 175.670 175.670 175.658 0.012 17919 5616 1 14 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.460 -0.720 17919 5617 1 14 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.084 -0.084 17919 5618 1 14 . 1 1 49 49 GLN H H 49 8.600 8.600 8.570 0.030 17919 5619 1 14 . 1 1 50 50 LEU N N 50 125.520 125.520 126.823 -1.303 17919 5620 1 14 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.300 -0.210 17919 5621 1 14 . 1 1 50 50 LEU C C 50 176.660 176.660 176.975 -0.315 17919 5622 1 14 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.489 -0.249 17919 5623 1 14 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.745 -1.175 17919 5624 1 14 . 1 1 50 50 LEU H H 50 8.530 8.530 8.042 0.488 17919 5625 1 14 . 1 1 51 51 GLU N N 51 122.940 122.940 119.896 3.044 17919 5626 1 14 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.599 -0.111 17919 5627 1 14 . 1 1 51 51 GLU C C 51 175.870 175.870 176.426 -0.556 17919 5628 1 14 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.592 0.368 17919 5629 1 14 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.279 -0.709 17919 5630 1 14 . 1 1 51 51 GLU H H 51 8.400 8.400 8.498 -0.098 17919 5631 1 14 . 1 1 52 52 ASP N N 52 120.030 120.030 125.207 -5.177 17919 5632 1 14 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.477 -0.118 17919 5633 1 14 . 1 1 52 52 ASP C C 52 177.330 177.330 178.093 -0.763 17919 5634 1 14 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.734 -0.774 17919 5635 1 14 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.953 -0.103 17919 5636 1 14 . 1 1 52 52 ASP H H 52 8.160 8.160 8.867 -0.707 17919 5637 1 14 . 1 1 53 53 GLY N N 53 106.660 106.660 106.586 0.074 17919 5638 1 14 . 1 1 53 53 GLY C C 53 174.870 174.870 174.472 0.398 17919 5639 1 14 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.419 -0.249 17919 5640 1 14 . 1 1 53 53 GLY H H 53 9.390 9.390 8.271 1.119 17919 5641 1 14 . 1 1 54 54 ARG N N 54 119.050 119.050 122.328 -3.278 17919 5642 1 14 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.374 0.321 17919 5643 1 14 . 1 1 54 54 ARG C C 54 175.350 175.350 175.597 -0.247 17919 5644 1 14 . 1 1 54 54 ARG CA C 54 54.390 54.390 55.609 -1.219 17919 5645 1 14 . 1 1 54 54 ARG CB C 54 32.650 32.650 30.961 1.689 17919 5646 1 14 . 1 1 54 54 ARG H H 54 7.460 7.460 7.558 -0.098 17919 5647 1 14 . 1 1 55 55 THR N N 55 108.400 108.400 117.536 -9.136 17919 5648 1 14 . 1 1 55 55 THR HA H 55 5.240 5.240 4.800 0.440 17919 5649 1 14 . 1 1 55 55 THR C C 55 176.560 176.560 175.890 0.670 17919 5650 1 14 . 1 1 55 55 THR CA C 55 59.690 59.690 61.067 -1.377 17919 5651 1 14 . 1 1 55 55 THR CB C 55 72.260 72.260 70.216 2.044 17919 5652 1 14 . 1 1 55 55 THR H H 55 8.730 8.730 8.275 0.455 17919 5653 1 14 . 1 1 56 56 LEU N N 56 117.920 117.920 123.579 -5.659 17919 5654 1 14 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.898 0.162 17919 5655 1 14 . 1 1 56 56 LEU C C 56 180.810 180.810 178.861 1.949 17919 5656 1 14 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.739 -0.029 17919 5657 1 14 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.085 -0.715 17919 5658 1 14 . 1 1 56 56 LEU H H 56 8.140 8.140 8.607 -0.467 17919 5659 1 14 . 1 1 57 57 SER N N 57 113.330 113.330 113.007 0.323 17919 5660 1 14 . 1 1 57 57 SER HA H 57 4.370 4.370 3.958 0.412 17919 5661 1 14 . 1 1 57 57 SER C C 57 178.310 178.310 177.055 1.255 17919 5662 1 14 . 1 1 57 57 SER CA C 57 61.080 61.080 61.496 -0.416 17919 5663 1 14 . 1 1 57 57 SER CB C 57 62.530 62.530 62.212 0.318 17919 5664 1 14 . 1 1 57 57 SER H H 57 8.470 8.470 8.002 0.468 17919 5665 1 14 . 1 1 58 58 ASP N N 58 124.190 124.190 122.164 2.026 17919 5666 1 14 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.384 -0.088 17919 5667 1 14 . 1 1 58 58 ASP C C 58 177.400 177.400 176.462 0.938 17919 5668 1 14 . 1 1 58 58 ASP CA C 58 57.180 57.180 55.888 1.292 17919 5669 1 14 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.873 -0.774 17919 5670 1 14 . 1 1 58 58 ASP H H 58 7.930 7.930 7.799 0.131 17919 5671 1 14 . 1 1 59 59 TYR N N 59 115.510 115.510 114.877 0.633 17919 5672 1 14 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.604 0.066 17919 5673 1 14 . 1 1 59 59 TYR C C 59 174.700 174.700 175.110 -0.410 17919 5674 1 14 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.136 1.114 17919 5675 1 14 . 1 1 59 59 TYR CB C 59 40.070 40.070 37.879 2.191 17919 5676 1 14 . 1 1 59 59 TYR H H 59 7.250 7.250 7.265 -0.015 17919 5677 1 14 . 1 1 60 60 ASN N N 60 115.900 115.900 117.340 -1.440 17919 5678 1 14 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.352 0.003 17919 5679 1 14 . 1 1 60 60 ASN C C 60 174.340 174.340 174.395 -0.055 17919 5680 1 14 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.004 0.116 17919 5681 1 14 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.626 -0.216 17919 5682 1 14 . 1 1 60 60 ASN H H 60 8.150 8.150 7.648 0.502 17919 5683 1 14 . 1 1 61 61 ILE N N 61 118.600 118.600 120.120 -1.520 17919 5684 1 14 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.955 -0.562 17919 5685 1 14 . 1 1 61 61 ILE C C 61 174.610 174.610 174.004 0.606 17919 5686 1 14 . 1 1 61 61 ILE CA C 61 62.420 62.420 60.836 1.584 17919 5687 1 14 . 1 1 61 61 ILE CB C 61 36.740 36.740 36.064 0.676 17919 5688 1 14 . 1 1 61 61 ILE H H 61 7.250 7.250 8.308 -1.058 17919 5689 1 14 . 1 1 62 62 GLN N N 62 124.740 124.740 125.553 -0.813 17919 5690 1 14 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.643 -0.137 17919 5691 1 14 . 1 1 62 62 GLN C C 62 175.970 175.970 175.515 0.455 17919 5692 1 14 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.525 0.135 17919 5693 1 14 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.116 0.534 17919 5694 1 14 . 1 1 62 62 GLN H H 62 7.610 7.610 7.560 0.050 17919 5695 1 14 . 1 1 63 63 LYS N N 63 120.300 120.300 123.496 -3.196 17919 5696 1 14 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.959 0.042 17919 5697 1 14 . 1 1 63 63 LYS C C 63 175.810 175.810 176.620 -0.810 17919 5698 1 14 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.267 -0.477 17919 5699 1 14 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.688 0.962 17919 5700 1 14 . 1 1 63 63 LYS H H 63 8.490 8.490 8.509 -0.019 17919 5701 1 14 . 1 1 64 64 GLU N N 64 113.950 113.950 120.557 -6.607 17919 5702 1 14 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.519 -0.054 17919 5703 1 14 . 1 1 64 64 GLU C C 64 175.250 175.250 175.238 0.012 17919 5704 1 14 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.918 -0.028 17919 5705 1 14 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.719 -2.819 17919 5706 1 14 . 1 1 64 64 GLU H H 64 9.280 9.280 8.590 0.690 17919 5707 1 14 . 1 1 65 65 SER N N 65 114.730 114.730 115.854 -1.124 17919 5708 1 14 . 1 1 65 65 SER HA H 65 4.640 4.640 4.514 0.126 17919 5709 1 14 . 1 1 65 65 SER C C 65 172.160 172.160 173.883 -1.723 17919 5710 1 14 . 1 1 65 65 SER CA C 65 60.890 60.890 59.380 1.510 17919 5711 1 14 . 1 1 65 65 SER CB C 65 64.910 64.910 63.789 1.121 17919 5712 1 14 . 1 1 65 65 SER H H 65 7.670 7.670 7.778 -0.108 17919 5713 1 14 . 1 1 66 66 THR N N 66 117.110 117.110 121.993 -4.883 17919 5714 1 14 . 1 1 66 66 THR HA H 66 5.270 5.270 5.023 0.247 17919 5715 1 14 . 1 1 66 66 THR C C 66 173.950 173.950 174.578 -0.628 17919 5716 1 14 . 1 1 66 66 THR CA C 66 62.340 62.340 62.148 0.192 17919 5717 1 14 . 1 1 66 66 THR CB C 66 70.080 70.080 69.729 0.351 17919 5718 1 14 . 1 1 66 66 THR H H 66 8.730 8.730 8.756 -0.026 17919 5719 1 14 . 1 1 67 67 LEU N N 67 127.110 127.110 127.827 -0.717 17919 5720 1 14 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.914 0.146 17919 5721 1 14 . 1 1 67 67 LEU C C 67 175.770 175.770 175.889 -0.119 17919 5722 1 14 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.265 -0.365 17919 5723 1 14 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.302 0.958 17919 5724 1 14 . 1 1 67 67 LEU H H 67 9.410 9.410 8.837 0.573 17919 5725 1 14 . 1 1 68 68 HIS N N 68 118.380 118.380 121.998 -3.618 17919 5726 1 14 . 1 1 68 68 HIS HA H 68 5.240 5.240 4.941 0.299 17919 5727 1 14 . 1 1 68 68 HIS C C 68 173.150 173.150 173.642 -0.492 17919 5728 1 14 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.294 0.706 17919 5729 1 14 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.197 -1.667 17919 5730 1 14 . 1 1 68 68 HIS H H 68 9.230 9.230 9.058 0.172 17919 5731 1 14 . 1 1 69 69 LEU N N 69 124.460 124.460 129.328 -4.868 17919 5732 1 14 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.103 0.087 17919 5733 1 14 . 1 1 69 69 LEU C C 69 175.270 175.270 174.216 1.054 17919 5734 1 14 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.487 0.403 17919 5735 1 14 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.502 -0.122 17919 5736 1 14 . 1 1 69 69 LEU H H 69 8.340 8.340 9.067 -0.727 17919 5737 1 14 . 1 1 70 70 VAL N N 70 126.940 126.940 125.919 1.021 17919 5738 1 14 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.229 0.121 17919 5739 1 14 . 1 1 70 70 VAL C C 70 174.000 174.000 174.766 -0.766 17919 5740 1 14 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.265 0.535 17919 5741 1 14 . 1 1 70 70 VAL CB C 70 34.910 34.910 33.683 1.227 17919 5742 1 14 . 1 1 70 70 VAL H H 70 9.200 9.200 8.752 0.448 17919 5743 1 14 . 1 1 71 71 LEU N N 71 123.130 123.130 123.129 0.001 17919 5744 1 14 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.942 0.118 17919 5745 1 14 . 1 1 71 71 LEU C C 71 177.830 177.830 177.141 0.689 17919 5746 1 14 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.882 0.058 17919 5747 1 14 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.573 -0.723 17919 5748 1 14 . 1 1 71 71 LEU H H 71 8.120 8.120 8.412 -0.292 17919 5749 1 14 . 1 1 72 72 ARG N N 72 123.490 123.490 122.085 1.405 17919 5750 1 14 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.590 -0.289 17919 5751 1 14 . 1 1 72 72 ARG C C 72 175.350 175.350 175.383 -0.033 17919 5752 1 14 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.275 0.335 17919 5753 1 14 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.670 0.680 17919 5754 1 14 . 1 1 72 72 ARG H H 72 8.580 8.580 8.154 0.426 17919 5755 1 15 . 1 1 2 2 GLN N N 2 123.220 123.220 123.829 -0.609 17919 5756 1 15 . 1 1 2 2 GLN HA H 2 5.249 5.249 4.721 0.528 17919 5757 1 15 . 1 1 2 2 GLN C C 2 175.920 175.920 174.819 1.101 17919 5758 1 15 . 1 1 2 2 GLN CA C 2 55.080 55.080 55.205 -0.125 17919 5759 1 15 . 1 1 2 2 GLN CB C 2 30.760 30.760 29.902 0.858 17919 5760 1 15 . 1 1 2 2 GLN H H 2 8.900 8.900 8.585 0.315 17919 5761 1 15 . 1 1 3 3 ILE N N 3 115.340 115.340 119.577 -4.237 17919 5762 1 15 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.369 -0.156 17919 5763 1 15 . 1 1 3 3 ILE C C 3 172.450 172.450 173.676 -1.226 17919 5764 1 15 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.586 -0.016 17919 5765 1 15 . 1 1 3 3 ILE CB C 3 42.210 42.210 40.799 1.411 17919 5766 1 15 . 1 1 3 3 ILE H H 3 8.320 8.320 7.445 0.875 17919 5767 1 15 . 1 1 4 4 PHE N N 4 118.110 118.110 120.056 -1.946 17919 5768 1 15 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.323 0.307 17919 5769 1 15 . 1 1 4 4 PHE C C 4 175.320 175.320 174.961 0.359 17919 5770 1 15 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.744 -0.534 17919 5771 1 15 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.768 -1.288 17919 5772 1 15 . 1 1 4 4 PHE H H 4 8.610 8.610 7.929 0.681 17919 5773 1 15 . 1 1 5 5 VAL N N 5 121.000 121.000 121.588 -0.588 17919 5774 1 15 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.955 -0.231 17919 5775 1 15 . 1 1 5 5 VAL C C 5 174.870 174.870 174.633 0.237 17919 5776 1 15 . 1 1 5 5 VAL CA C 5 60.620 60.620 60.961 -0.341 17919 5777 1 15 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.414 -0.184 17919 5778 1 15 . 1 1 5 5 VAL H H 5 9.300 9.300 9.228 0.072 17919 5779 1 15 . 1 1 6 6 LYS N N 6 127.520 127.520 129.456 -1.936 17919 5780 1 15 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.295 0.072 17919 5781 1 15 . 1 1 6 6 LYS C C 6 177.140 177.140 176.059 1.081 17919 5782 1 15 . 1 1 6 6 LYS CA C 6 54.520 54.520 53.601 0.919 17919 5783 1 15 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.218 -0.168 17919 5784 1 15 . 1 1 6 6 LYS H H 6 8.820 8.820 8.457 0.363 17919 5785 1 15 . 1 1 7 7 THR N N 7 115.400 115.400 117.125 -1.725 17919 5786 1 15 . 1 1 7 7 THR HA H 7 4.970 4.970 4.624 0.346 17919 5787 1 15 . 1 1 7 7 THR C C 7 176.910 176.910 176.040 0.870 17919 5788 1 15 . 1 1 7 7 THR CA C 7 60.470 60.470 60.717 -0.247 17919 5789 1 15 . 1 1 7 7 THR CB C 7 70.630 70.630 70.610 0.020 17919 5790 1 15 . 1 1 7 7 THR H H 7 8.730 8.730 8.672 0.058 17919 5791 1 15 . 1 1 8 8 LEU N N 8 121.330 121.330 122.918 -1.588 17919 5792 1 15 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.017 0.293 17919 5793 1 15 . 1 1 8 8 LEU C C 8 178.800 178.800 177.563 1.237 17919 5794 1 15 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.774 -0.194 17919 5795 1 15 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.925 0.045 17919 5796 1 15 . 1 1 8 8 LEU H H 8 9.100 9.100 8.797 0.303 17919 5797 1 15 . 1 1 9 9 THR N N 9 105.590 105.590 108.447 -2.857 17919 5798 1 15 . 1 1 9 9 THR HA H 9 4.428 4.428 4.336 0.092 17919 5799 1 15 . 1 1 9 9 THR C C 9 175.520 175.520 175.057 0.463 17919 5800 1 15 . 1 1 9 9 THR CA C 9 61.400 61.400 61.969 -0.569 17919 5801 1 15 . 1 1 9 9 THR CB C 9 69.140 69.140 68.616 0.524 17919 5802 1 15 . 1 1 9 9 THR H H 9 7.630 7.630 7.823 -0.193 17919 5803 1 15 . 1 1 10 10 GLY N N 10 108.890 108.890 110.748 -1.858 17919 5804 1 15 . 1 1 10 10 GLY C C 10 174.070 174.070 173.829 0.241 17919 5805 1 15 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.899 0.561 17919 5806 1 15 . 1 1 10 10 GLY H H 10 7.810 7.810 7.842 -0.032 17919 5807 1 15 . 1 1 11 11 LYS N N 11 121.600 121.600 121.616 -0.016 17919 5808 1 15 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.666 -0.305 17919 5809 1 15 . 1 1 11 11 LYS C C 11 175.940 175.940 175.623 0.317 17919 5810 1 15 . 1 1 11 11 LYS CA C 11 56.280 56.280 54.614 1.666 17919 5811 1 15 . 1 1 11 11 LYS CB C 11 33.200 33.200 34.104 -0.904 17919 5812 1 15 . 1 1 11 11 LYS H H 11 7.280 7.280 7.888 -0.608 17919 5813 1 15 . 1 1 12 12 THR N N 12 120.440 120.440 118.613 1.827 17919 5814 1 15 . 1 1 12 12 THR HA H 12 5.046 5.046 4.631 0.415 17919 5815 1 15 . 1 1 12 12 THR C C 12 174.320 174.320 174.553 -0.233 17919 5816 1 15 . 1 1 12 12 THR CA C 12 62.390 62.390 62.373 0.017 17919 5817 1 15 . 1 1 12 12 THR CB C 12 69.910 69.910 69.349 0.561 17919 5818 1 15 . 1 1 12 12 THR H H 12 8.650 8.650 8.382 0.268 17919 5819 1 15 . 1 1 13 13 ILE N N 13 127.110 127.110 128.296 -1.186 17919 5820 1 15 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.510 0.035 17919 5821 1 15 . 1 1 13 13 ILE C C 13 175.220 175.220 175.283 -0.063 17919 5822 1 15 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.766 -0.786 17919 5823 1 15 . 1 1 13 13 ILE CB C 13 40.950 40.950 38.789 2.161 17919 5824 1 15 . 1 1 13 13 ILE H H 13 9.450 9.450 9.080 0.370 17919 5825 1 15 . 1 1 14 14 THR N N 14 121.520 121.520 124.168 -2.648 17919 5826 1 15 . 1 1 14 14 THR HA H 14 4.964 4.964 4.726 0.238 17919 5827 1 15 . 1 1 14 14 THR C C 14 173.790 173.790 174.077 -0.287 17919 5828 1 15 . 1 1 14 14 THR CA C 14 61.940 61.940 62.588 -0.648 17919 5829 1 15 . 1 1 14 14 THR CB C 14 69.650 69.650 69.642 0.008 17919 5830 1 15 . 1 1 14 14 THR H H 14 8.710 8.710 8.337 0.373 17919 5831 1 15 . 1 1 15 15 LEU N N 15 124.800 124.800 128.320 -3.520 17919 5832 1 15 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.666 0.114 17919 5833 1 15 . 1 1 15 15 LEU C C 15 174.670 174.670 175.467 -0.797 17919 5834 1 15 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.597 -0.767 17919 5835 1 15 . 1 1 15 15 LEU CB C 15 47.070 47.070 44.877 2.193 17919 5836 1 15 . 1 1 15 15 LEU H H 15 8.710 8.710 8.135 0.575 17919 5837 1 15 . 1 1 16 16 GLU N N 16 122.160 122.160 121.703 0.457 17919 5838 1 15 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.495 0.422 17919 5839 1 15 . 1 1 16 16 GLU C C 16 175.860 175.860 176.241 -0.381 17919 5840 1 15 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.259 -0.439 17919 5841 1 15 . 1 1 16 16 GLU CB C 16 29.450 29.450 29.666 -0.216 17919 5842 1 15 . 1 1 16 16 GLU H H 16 8.140 8.140 8.497 -0.357 17919 5843 1 15 . 1 1 17 17 VAL N N 17 117.210 117.210 119.584 -2.374 17919 5844 1 15 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.695 0.019 17919 5845 1 15 . 1 1 17 17 VAL C C 17 174.160 174.160 175.105 -0.945 17919 5846 1 15 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.611 -1.181 17919 5847 1 15 . 1 1 17 17 VAL CB C 17 36.400 36.400 34.723 1.677 17919 5848 1 15 . 1 1 17 17 VAL H H 17 8.900 8.900 7.768 1.132 17919 5849 1 15 . 1 1 18 18 GLU N N 18 118.990 118.990 120.097 -1.107 17919 5850 1 15 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.934 0.145 17919 5851 1 15 . 1 1 18 18 GLU C C 18 176.160 176.160 175.148 1.012 17919 5852 1 15 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.101 -0.381 17919 5853 1 15 . 1 1 18 18 GLU CB C 18 30.310 30.310 32.988 -2.678 17919 5854 1 15 . 1 1 18 18 GLU H H 18 8.640 8.640 8.580 0.060 17919 5855 1 15 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.201 -0.060 17919 5856 1 15 . 1 1 19 19 PRO C C 19 175.310 175.310 177.338 -2.028 17919 5857 1 15 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.526 -0.056 17919 5858 1 15 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.007 -0.057 17919 5859 1 15 . 1 1 20 20 SER N N 20 103.400 103.400 109.315 -5.915 17919 5860 1 15 . 1 1 20 20 SER HA H 20 4.370 4.370 4.470 -0.100 17919 5861 1 15 . 1 1 20 20 SER C C 20 174.660 174.660 173.664 0.996 17919 5862 1 15 . 1 1 20 20 SER CA C 20 57.400 57.400 58.823 -1.423 17919 5863 1 15 . 1 1 20 20 SER CB C 20 63.370 63.370 62.832 0.538 17919 5864 1 15 . 1 1 20 20 SER H H 20 7.040 7.040 8.013 -0.973 17919 5865 1 15 . 1 1 21 21 ASP N N 21 123.480 123.480 123.730 -0.250 17919 5866 1 15 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.690 0.005 17919 5867 1 15 . 1 1 21 21 ASP C C 21 176.360 176.360 175.534 0.826 17919 5868 1 15 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.001 0.699 17919 5869 1 15 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.898 -1.098 17919 5870 1 15 . 1 1 21 21 ASP H H 21 8.030 8.030 8.199 -0.169 17919 5871 1 15 . 1 1 22 22 THR N N 22 108.800 108.800 113.246 -4.446 17919 5872 1 15 . 1 1 22 22 THR HA H 22 4.920 4.920 4.634 0.286 17919 5873 1 15 . 1 1 22 22 THR C C 22 176.750 176.750 176.013 0.737 17919 5874 1 15 . 1 1 22 22 THR CA C 22 59.690 59.690 61.510 -1.820 17919 5875 1 15 . 1 1 22 22 THR CB C 22 71.200 71.200 69.762 1.438 17919 5876 1 15 . 1 1 22 22 THR H H 22 7.900 7.900 8.452 -0.552 17919 5877 1 15 . 1 1 23 23 ILE N N 23 121.190 121.190 123.394 -2.204 17919 5878 1 15 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.734 -0.077 17919 5879 1 15 . 1 1 23 23 ILE C C 23 179.040 179.040 177.525 1.515 17919 5880 1 15 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.791 -0.531 17919 5881 1 15 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.406 -2.056 17919 5882 1 15 . 1 1 23 23 ILE H H 23 8.560 8.560 8.971 -0.411 17919 5883 1 15 . 1 1 24 24 GLU N N 24 120.830 120.830 120.146 0.684 17919 5884 1 15 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.902 0.015 17919 5885 1 15 . 1 1 24 24 GLU C C 24 178.640 178.640 178.468 0.172 17919 5886 1 15 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.927 0.293 17919 5887 1 15 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.518 -1.238 17919 5888 1 15 . 1 1 24 24 GLU H H 24 9.760 9.760 8.430 1.330 17919 5889 1 15 . 1 1 25 25 ASN N N 25 120.570 120.570 117.946 2.624 17919 5890 1 15 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.518 0.007 17919 5891 1 15 . 1 1 25 25 ASN C C 25 178.380 178.380 177.824 0.556 17919 5892 1 15 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.927 0.133 17919 5893 1 15 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.207 0.243 17919 5894 1 15 . 1 1 25 25 ASN H H 25 7.920 7.920 7.673 0.247 17919 5895 1 15 . 1 1 26 26 VAL N N 26 121.710 121.710 120.554 1.156 17919 5896 1 15 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.707 -0.310 17919 5897 1 15 . 1 1 26 26 VAL C C 26 177.950 177.950 177.845 0.105 17919 5898 1 15 . 1 1 26 26 VAL CA C 26 67.660 67.660 65.710 1.950 17919 5899 1 15 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.702 -0.862 17919 5900 1 15 . 1 1 26 26 VAL H H 26 8.070 8.070 7.843 0.227 17919 5901 1 15 . 1 1 27 27 LYS N N 27 118.860 118.860 120.722 -1.862 17919 5902 1 15 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.074 0.506 17919 5903 1 15 . 1 1 27 27 LYS C C 27 180.550 180.550 178.923 1.627 17919 5904 1 15 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.846 -0.596 17919 5905 1 15 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.347 1.383 17919 5906 1 15 . 1 1 27 27 LYS H H 27 8.560 8.560 8.309 0.251 17919 5907 1 15 . 1 1 28 28 ALA N N 28 123.440 123.440 121.184 2.256 17919 5908 1 15 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.064 0.096 17919 5909 1 15 . 1 1 28 28 ALA C C 28 180.300 180.300 179.498 0.802 17919 5910 1 15 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.986 0.384 17919 5911 1 15 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.305 -0.595 17919 5912 1 15 . 1 1 28 28 ALA H H 28 8.060 8.060 8.245 -0.185 17919 5913 1 15 . 1 1 29 29 LYS N N 29 119.940 119.940 118.394 1.546 17919 5914 1 15 . 1 1 29 29 LYS HA H 29 4.207 4.207 3.935 0.272 17919 5915 1 15 . 1 1 29 29 LYS C C 29 180.320 180.320 178.969 1.351 17919 5916 1 15 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.547 0.103 17919 5917 1 15 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.138 1.152 17919 5918 1 15 . 1 1 29 29 LYS H H 29 7.850 7.850 7.523 0.327 17919 5919 1 15 . 1 1 30 30 ILE N N 30 121.080 121.080 119.441 1.639 17919 5920 1 15 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.688 -0.181 17919 5921 1 15 . 1 1 30 30 ILE C C 30 178.310 178.310 177.447 0.863 17919 5922 1 15 . 1 1 30 30 ILE CA C 30 66.150 66.150 64.707 1.443 17919 5923 1 15 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.594 -0.795 17919 5924 1 15 . 1 1 30 30 ILE H H 30 8.280 8.280 8.020 0.260 17919 5925 1 15 . 1 1 31 31 GLN N N 31 123.490 123.490 120.551 2.939 17919 5926 1 15 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.842 -0.013 17919 5927 1 15 . 1 1 31 31 GLN C C 31 178.890 178.890 178.246 0.644 17919 5928 1 15 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.437 0.563 17919 5929 1 15 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.333 -0.613 17919 5930 1 15 . 1 1 31 31 GLN H H 31 8.580 8.580 8.361 0.219 17919 5931 1 15 . 1 1 32 32 ASP N N 32 119.360 119.360 118.375 0.985 17919 5932 1 15 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.408 -0.054 17919 5933 1 15 . 1 1 32 32 ASP C C 32 177.250 177.250 177.460 -0.210 17919 5934 1 15 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.852 0.338 17919 5935 1 15 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.707 -0.127 17919 5936 1 15 . 1 1 32 32 ASP H H 32 8.010 8.010 8.025 -0.015 17919 5937 1 15 . 1 1 33 33 LYS N N 33 115.130 115.130 118.845 -3.715 17919 5938 1 15 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.333 0.004 17919 5939 1 15 . 1 1 33 33 LYS C C 33 177.870 177.870 178.248 -0.378 17919 5940 1 15 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.765 0.285 17919 5941 1 15 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.420 0.750 17919 5942 1 15 . 1 1 33 33 LYS H H 33 7.430 7.430 7.584 -0.154 17919 5943 1 15 . 1 1 34 34 GLU N N 34 113.870 113.870 114.996 -1.126 17919 5944 1 15 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.544 0.081 17919 5945 1 15 . 1 1 34 34 GLU C C 34 177.840 177.840 176.890 0.950 17919 5946 1 15 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.022 -0.852 17919 5947 1 15 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.966 0.694 17919 5948 1 15 . 1 1 34 34 GLU H H 34 8.740 8.740 8.334 0.406 17919 5949 1 15 . 1 1 35 35 GLY N N 35 108.650 108.650 108.694 -0.044 17919 5950 1 15 . 1 1 35 35 GLY C C 35 173.960 173.960 174.255 -0.295 17919 5951 1 15 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.486 0.594 17919 5952 1 15 . 1 1 35 35 GLY H H 35 8.530 8.530 8.134 0.396 17919 5953 1 15 . 1 1 36 36 ILE N N 36 119.880 119.880 121.847 -1.967 17919 5954 1 15 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.605 -0.160 17919 5955 1 15 . 1 1 36 36 ILE C C 36 173.590 173.590 174.327 -0.737 17919 5956 1 15 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.330 0.420 17919 5957 1 15 . 1 1 36 36 ILE CB C 36 40.580 40.580 37.172 3.408 17919 5958 1 15 . 1 1 36 36 ILE H H 36 6.150 6.150 7.670 -1.520 17919 5959 1 15 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.452 0.182 17919 5960 1 15 . 1 1 37 37 PRO C C 37 176.940 176.940 176.261 0.679 17919 5961 1 15 . 1 1 37 37 PRO CA C 37 61.660 61.660 62.730 -1.070 17919 5962 1 15 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.649 0.201 17919 5963 1 15 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.221 -0.104 17919 5964 1 15 . 1 1 38 38 PRO C C 38 178.320 178.320 178.586 -0.266 17919 5965 1 15 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.615 0.645 17919 5966 1 15 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.860 1.030 17919 5967 1 15 . 1 1 39 39 ASP N N 39 113.380 113.380 116.307 -2.927 17919 5968 1 15 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.377 0.053 17919 5969 1 15 . 1 1 39 39 ASP C C 39 177.090 177.090 177.556 -0.466 17919 5970 1 15 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.462 -0.822 17919 5971 1 15 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.579 -1.039 17919 5972 1 15 . 1 1 39 39 ASP H H 39 8.550 8.550 8.591 -0.041 17919 5973 1 15 . 1 1 40 40 GLN N N 40 116.780 116.780 116.625 0.155 17919 5974 1 15 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.286 0.178 17919 5975 1 15 . 1 1 40 40 GLN C C 40 175.380 175.380 176.383 -1.003 17919 5976 1 15 . 1 1 40 40 GLN CA C 40 55.640 55.640 57.640 -2.000 17919 5977 1 15 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.586 0.554 17919 5978 1 15 . 1 1 40 40 GLN H H 40 7.820 7.820 7.660 0.160 17919 5979 1 15 . 1 1 41 41 GLN N N 41 117.720 117.720 117.991 -0.271 17919 5980 1 15 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.857 -0.613 17919 5981 1 15 . 1 1 41 41 GLN C C 41 176.300 176.300 175.090 1.210 17919 5982 1 15 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.176 1.294 17919 5983 1 15 . 1 1 41 41 GLN CB C 41 31.650 31.650 30.045 1.605 17919 5984 1 15 . 1 1 41 41 GLN H H 41 7.480 7.480 7.466 0.014 17919 5985 1 15 . 1 1 42 42 ARG N N 42 122.680 122.680 123.617 -0.937 17919 5986 1 15 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.607 -0.107 17919 5987 1 15 . 1 1 42 42 ARG C C 42 174.050 174.050 174.881 -0.831 17919 5988 1 15 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.683 0.367 17919 5989 1 15 . 1 1 42 42 ARG CB C 42 31.750 31.750 31.565 0.185 17919 5990 1 15 . 1 1 42 42 ARG H H 42 8.530 8.530 8.939 -0.409 17919 5991 1 15 . 1 1 43 43 LEU N N 43 124.040 124.040 126.216 -2.176 17919 5992 1 15 . 1 1 43 43 LEU C C 43 175.290 175.290 176.014 -0.724 17919 5993 1 15 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.588 -0.608 17919 5994 1 15 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.992 1.798 17919 5995 1 15 . 1 1 43 43 LEU H H 43 8.820 8.820 8.776 0.044 17919 5996 1 15 . 1 1 44 44 ILE N N 44 121.920 121.920 122.678 -0.758 17919 5997 1 15 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.015 -0.023 17919 5998 1 15 . 1 1 44 44 ILE C C 44 176.060 176.060 174.683 1.377 17919 5999 1 15 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.387 -0.407 17919 6000 1 15 . 1 1 44 44 ILE CB C 44 41.420 41.420 40.179 1.241 17919 6001 1 15 . 1 1 44 44 ILE H H 44 9.030 9.030 8.615 0.415 17919 6002 1 15 . 1 1 45 45 PHE N N 45 125.390 125.390 128.112 -2.722 17919 6003 1 15 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.008 0.037 17919 6004 1 15 . 1 1 45 45 PHE C C 45 174.470 174.470 174.340 0.130 17919 6005 1 15 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.638 0.382 17919 6006 1 15 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.891 0.869 17919 6007 1 15 . 1 1 45 45 PHE H H 45 8.830 8.830 8.563 0.267 17919 6008 1 15 . 1 1 46 46 ALA N N 46 132.200 132.200 130.483 1.717 17919 6009 1 15 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.673 0.017 17919 6010 1 15 . 1 1 46 46 ALA C C 46 177.290 177.290 177.167 0.123 17919 6011 1 15 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.772 -0.232 17919 6012 1 15 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.565 0.005 17919 6013 1 15 . 1 1 46 46 ALA H H 46 8.810 8.810 8.846 -0.036 17919 6014 1 15 . 1 1 47 47 GLY N N 47 102.340 102.340 103.650 -1.310 17919 6015 1 15 . 1 1 47 47 GLY C C 47 173.810 173.810 174.398 -0.588 17919 6016 1 15 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.602 -0.252 17919 6017 1 15 . 1 1 47 47 GLY H H 47 8.130 8.130 8.577 -0.447 17919 6018 1 15 . 1 1 48 48 LYS N N 48 121.570 121.570 120.585 0.985 17919 6019 1 15 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.620 0.002 17919 6020 1 15 . 1 1 48 48 LYS C C 48 174.700 174.700 175.742 -1.042 17919 6021 1 15 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.842 -0.292 17919 6022 1 15 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.591 -0.061 17919 6023 1 15 . 1 1 48 48 LYS H H 48 7.980 7.980 8.016 -0.036 17919 6024 1 15 . 1 1 49 49 GLN N N 49 122.410 122.410 122.916 -0.506 17919 6025 1 15 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.557 0.003 17919 6026 1 15 . 1 1 49 49 GLN C C 49 175.670 175.670 175.954 -0.284 17919 6027 1 15 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.070 -0.330 17919 6028 1 15 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.590 -0.590 17919 6029 1 15 . 1 1 49 49 GLN H H 49 8.600 8.600 8.536 0.064 17919 6030 1 15 . 1 1 50 50 LEU N N 50 125.520 125.520 124.480 1.040 17919 6031 1 15 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.127 -0.037 17919 6032 1 15 . 1 1 50 50 LEU C C 50 176.660 176.660 175.848 0.812 17919 6033 1 15 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.092 0.148 17919 6034 1 15 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.560 -0.990 17919 6035 1 15 . 1 1 50 50 LEU H H 50 8.530 8.530 8.143 0.387 17919 6036 1 15 . 1 1 51 51 GLU N N 51 122.940 122.940 123.472 -0.532 17919 6037 1 15 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.614 -0.126 17919 6038 1 15 . 1 1 51 51 GLU C C 51 175.870 175.870 176.343 -0.473 17919 6039 1 15 . 1 1 51 51 GLU CA C 51 55.960 55.960 54.798 1.162 17919 6040 1 15 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.823 -1.253 17919 6041 1 15 . 1 1 51 51 GLU H H 51 8.400 8.400 8.761 -0.361 17919 6042 1 15 . 1 1 52 52 ASP N N 52 120.030 120.030 125.275 -5.245 17919 6043 1 15 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.484 -0.125 17919 6044 1 15 . 1 1 52 52 ASP C C 52 177.330 177.330 177.891 -0.561 17919 6045 1 15 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.353 -0.393 17919 6046 1 15 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.868 -0.018 17919 6047 1 15 . 1 1 52 52 ASP H H 52 8.160 8.160 8.829 -0.669 17919 6048 1 15 . 1 1 53 53 GLY N N 53 106.660 106.660 105.641 1.019 17919 6049 1 15 . 1 1 53 53 GLY C C 53 174.870 174.870 174.216 0.654 17919 6050 1 15 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.882 0.288 17919 6051 1 15 . 1 1 53 53 GLY H H 53 9.390 9.390 8.444 0.946 17919 6052 1 15 . 1 1 54 54 ARG N N 54 119.050 119.050 120.016 -0.966 17919 6053 1 15 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.640 0.055 17919 6054 1 15 . 1 1 54 54 ARG C C 54 175.350 175.350 174.770 0.580 17919 6055 1 15 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.298 0.092 17919 6056 1 15 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.507 -0.857 17919 6057 1 15 . 1 1 54 54 ARG H H 54 7.460 7.460 7.643 -0.183 17919 6058 1 15 . 1 1 55 55 THR N N 55 108.400 108.400 110.836 -2.436 17919 6059 1 15 . 1 1 55 55 THR HA H 55 5.240 5.240 5.139 0.101 17919 6060 1 15 . 1 1 55 55 THR C C 55 176.560 176.560 175.985 0.575 17919 6061 1 15 . 1 1 55 55 THR CA C 55 59.690 59.690 59.696 -0.006 17919 6062 1 15 . 1 1 55 55 THR CB C 55 72.260 72.260 71.585 0.675 17919 6063 1 15 . 1 1 55 55 THR H H 55 8.730 8.730 8.861 -0.131 17919 6064 1 15 . 1 1 56 56 LEU N N 56 117.920 117.920 120.699 -2.779 17919 6065 1 15 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.904 0.156 17919 6066 1 15 . 1 1 56 56 LEU C C 56 180.810 180.810 178.823 1.987 17919 6067 1 15 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.571 0.139 17919 6068 1 15 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.531 -1.161 17919 6069 1 15 . 1 1 56 56 LEU H H 56 8.140 8.140 8.120 0.020 17919 6070 1 15 . 1 1 57 57 SER N N 57 113.330 113.330 114.526 -1.196 17919 6071 1 15 . 1 1 57 57 SER HA H 57 4.370 4.370 4.120 0.250 17919 6072 1 15 . 1 1 57 57 SER C C 57 178.310 178.310 176.814 1.496 17919 6073 1 15 . 1 1 57 57 SER CA C 57 61.080 61.080 61.713 -0.633 17919 6074 1 15 . 1 1 57 57 SER CB C 57 62.530 62.530 62.727 -0.197 17919 6075 1 15 . 1 1 57 57 SER H H 57 8.470 8.470 7.956 0.514 17919 6076 1 15 . 1 1 58 58 ASP N N 58 124.190 124.190 120.631 3.559 17919 6077 1 15 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.335 -0.039 17919 6078 1 15 . 1 1 58 58 ASP C C 58 177.400 177.400 176.212 1.188 17919 6079 1 15 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.216 0.964 17919 6080 1 15 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.299 -0.199 17919 6081 1 15 . 1 1 58 58 ASP H H 58 7.930 7.930 7.757 0.173 17919 6082 1 15 . 1 1 59 59 TYR N N 59 115.510 115.510 114.201 1.309 17919 6083 1 15 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.624 0.046 17919 6084 1 15 . 1 1 59 59 TYR C C 59 174.700 174.700 174.836 -0.136 17919 6085 1 15 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.070 1.180 17919 6086 1 15 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.815 1.255 17919 6087 1 15 . 1 1 59 59 TYR H H 59 7.250 7.250 7.251 -0.001 17919 6088 1 15 . 1 1 60 60 ASN N N 60 115.900 115.900 117.988 -2.088 17919 6089 1 15 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.343 0.012 17919 6090 1 15 . 1 1 60 60 ASN C C 60 174.340 174.340 174.560 -0.220 17919 6091 1 15 . 1 1 60 60 ASN CA C 60 54.120 54.120 53.755 0.365 17919 6092 1 15 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.722 -0.312 17919 6093 1 15 . 1 1 60 60 ASN H H 60 8.150 8.150 7.631 0.519 17919 6094 1 15 . 1 1 61 61 ILE N N 61 118.600 118.600 118.359 0.241 17919 6095 1 15 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.892 -0.499 17919 6096 1 15 . 1 1 61 61 ILE C C 61 174.610 174.610 175.650 -1.040 17919 6097 1 15 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.493 0.927 17919 6098 1 15 . 1 1 61 61 ILE CB C 61 36.740 36.740 38.243 -1.503 17919 6099 1 15 . 1 1 61 61 ILE H H 61 7.250 7.250 7.664 -0.414 17919 6100 1 15 . 1 1 62 62 GLN N N 62 124.740 124.740 124.869 -0.129 17919 6101 1 15 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.780 -0.274 17919 6102 1 15 . 1 1 62 62 GLN C C 62 175.970 175.970 175.398 0.572 17919 6103 1 15 . 1 1 62 62 GLN CA C 62 53.660 53.660 52.894 0.766 17919 6104 1 15 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.375 0.275 17919 6105 1 15 . 1 1 62 62 GLN H H 62 7.610 7.610 8.272 -0.662 17919 6106 1 15 . 1 1 63 63 LYS N N 63 120.300 120.300 120.476 -0.176 17919 6107 1 15 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.039 -0.038 17919 6108 1 15 . 1 1 63 63 LYS C C 63 175.810 175.810 176.653 -0.843 17919 6109 1 15 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.659 0.131 17919 6110 1 15 . 1 1 63 63 LYS CB C 63 32.650 32.650 30.321 2.329 17919 6111 1 15 . 1 1 63 63 LYS H H 63 8.490 8.490 8.614 -0.124 17919 6112 1 15 . 1 1 64 64 GLU N N 64 113.950 113.950 119.242 -5.292 17919 6113 1 15 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.818 -0.353 17919 6114 1 15 . 1 1 64 64 GLU C C 64 175.250 175.250 176.011 -0.761 17919 6115 1 15 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.530 0.360 17919 6116 1 15 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.337 -2.437 17919 6117 1 15 . 1 1 64 64 GLU H H 64 9.280 9.280 8.692 0.588 17919 6118 1 15 . 1 1 65 65 SER N N 65 114.730 114.730 116.897 -2.167 17919 6119 1 15 . 1 1 65 65 SER HA H 65 4.640 4.640 4.504 0.136 17919 6120 1 15 . 1 1 65 65 SER C C 65 172.160 172.160 174.468 -2.308 17919 6121 1 15 . 1 1 65 65 SER CA C 65 60.890 60.890 59.922 0.968 17919 6122 1 15 . 1 1 65 65 SER CB C 65 64.910 64.910 63.650 1.260 17919 6123 1 15 . 1 1 65 65 SER H H 65 7.670 7.670 7.763 -0.093 17919 6124 1 15 . 1 1 66 66 THR N N 66 117.110 117.110 123.475 -6.365 17919 6125 1 15 . 1 1 66 66 THR HA H 66 5.270 5.270 4.892 0.378 17919 6126 1 15 . 1 1 66 66 THR C C 66 173.950 173.950 174.424 -0.474 17919 6127 1 15 . 1 1 66 66 THR CA C 66 62.340 62.340 63.921 -1.581 17919 6128 1 15 . 1 1 66 66 THR CB C 66 70.080 70.080 69.608 0.472 17919 6129 1 15 . 1 1 66 66 THR H H 66 8.730 8.730 8.601 0.129 17919 6130 1 15 . 1 1 67 67 LEU N N 67 127.110 127.110 126.166 0.944 17919 6131 1 15 . 1 1 67 67 LEU HA H 67 5.060 5.060 5.218 -0.158 17919 6132 1 15 . 1 1 67 67 LEU C C 67 175.770 175.770 175.583 0.187 17919 6133 1 15 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.064 0.836 17919 6134 1 15 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.789 -0.529 17919 6135 1 15 . 1 1 67 67 LEU H H 67 9.410 9.410 8.399 1.011 17919 6136 1 15 . 1 1 68 68 HIS N N 68 118.380 118.380 118.176 0.204 17919 6137 1 15 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.352 -0.112 17919 6138 1 15 . 1 1 68 68 HIS C C 68 173.150 173.150 174.203 -1.053 17919 6139 1 15 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.918 0.082 17919 6140 1 15 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.877 -2.347 17919 6141 1 15 . 1 1 68 68 HIS H H 68 9.230 9.230 8.515 0.715 17919 6142 1 15 . 1 1 69 69 LEU N N 69 124.460 124.460 124.661 -0.201 17919 6143 1 15 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.038 0.152 17919 6144 1 15 . 1 1 69 69 LEU C C 69 175.270 175.270 175.044 0.226 17919 6145 1 15 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.908 -0.018 17919 6146 1 15 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.054 0.326 17919 6147 1 15 . 1 1 69 69 LEU H H 69 8.340 8.340 8.282 0.058 17919 6148 1 15 . 1 1 70 70 VAL N N 70 126.940 126.940 124.512 2.428 17919 6149 1 15 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.493 -0.143 17919 6150 1 15 . 1 1 70 70 VAL C C 70 174.000 174.000 174.187 -0.187 17919 6151 1 15 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.517 0.284 17919 6152 1 15 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.701 -0.791 17919 6153 1 15 . 1 1 70 70 VAL H H 70 9.200 9.200 8.676 0.524 17919 6154 1 15 . 1 1 71 71 LEU N N 71 123.130 123.130 123.327 -0.197 17919 6155 1 15 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.395 -0.335 17919 6156 1 15 . 1 1 71 71 LEU C C 71 177.830 177.830 176.154 1.676 17919 6157 1 15 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.218 0.722 17919 6158 1 15 . 1 1 71 71 LEU CB C 71 42.850 42.850 44.435 -1.585 17919 6159 1 15 . 1 1 71 71 LEU H H 71 8.120 8.120 8.341 -0.221 17919 6160 1 15 . 1 1 72 72 ARG N N 72 123.490 123.490 122.845 0.645 17919 6161 1 15 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.674 -0.373 17919 6162 1 15 . 1 1 72 72 ARG C C 72 175.350 175.350 175.292 0.058 17919 6163 1 15 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.463 0.147 17919 6164 1 15 . 1 1 72 72 ARG CB C 72 31.350 31.350 32.806 -1.456 17919 6165 1 15 . 1 1 72 72 ARG H H 72 8.580 8.580 8.761 -0.181 17919 6166 1 16 . 1 1 2 2 GLN N N 2 123.220 123.220 122.801 0.419 17919 6167 1 16 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.115 0.134 17919 6168 1 16 . 1 1 2 2 GLN C C 2 175.920 175.920 175.611 0.309 17919 6169 1 16 . 1 1 2 2 GLN CA C 2 55.080 55.080 55.075 0.005 17919 6170 1 16 . 1 1 2 2 GLN CB C 2 30.760 30.760 29.825 0.935 17919 6171 1 16 . 1 1 2 2 GLN H H 2 8.900 8.900 8.477 0.423 17919 6172 1 16 . 1 1 3 3 ILE N N 3 115.340 115.340 117.535 -2.195 17919 6173 1 16 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.200 0.013 17919 6174 1 16 . 1 1 3 3 ILE C C 3 172.450 172.450 173.526 -1.076 17919 6175 1 16 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.390 0.180 17919 6176 1 16 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.181 1.030 17919 6177 1 16 . 1 1 3 3 ILE H H 3 8.320 8.320 8.200 0.120 17919 6178 1 16 . 1 1 4 4 PHE N N 4 118.110 118.110 121.252 -3.142 17919 6179 1 16 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.397 0.233 17919 6180 1 16 . 1 1 4 4 PHE C C 4 175.320 175.320 176.081 -0.761 17919 6181 1 16 . 1 1 4 4 PHE CA C 4 55.210 55.210 56.379 -1.169 17919 6182 1 16 . 1 1 4 4 PHE CB C 4 41.480 41.480 40.770 0.710 17919 6183 1 16 . 1 1 4 4 PHE H H 4 8.610 8.610 7.672 0.938 17919 6184 1 16 . 1 1 5 5 VAL N N 5 121.000 121.000 121.196 -0.196 17919 6185 1 16 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.742 -0.017 17919 6186 1 16 . 1 1 5 5 VAL C C 5 174.870 174.870 175.286 -0.416 17919 6187 1 16 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.480 -0.860 17919 6188 1 16 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.793 0.437 17919 6189 1 16 . 1 1 5 5 VAL H H 5 9.300 9.300 8.757 0.543 17919 6190 1 16 . 1 1 6 6 LYS N N 6 127.520 127.520 128.211 -0.691 17919 6191 1 16 . 1 1 6 6 LYS HA H 6 5.367 5.367 4.877 0.490 17919 6192 1 16 . 1 1 6 6 LYS C C 6 177.140 177.140 176.848 0.292 17919 6193 1 16 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.090 0.430 17919 6194 1 16 . 1 1 6 6 LYS CB C 6 35.050 35.050 33.245 1.805 17919 6195 1 16 . 1 1 6 6 LYS H H 6 8.820 8.820 9.032 -0.212 17919 6196 1 16 . 1 1 7 7 THR N N 7 115.400 115.400 115.590 -0.190 17919 6197 1 16 . 1 1 7 7 THR HA H 7 4.970 4.970 4.492 0.478 17919 6198 1 16 . 1 1 7 7 THR C C 7 176.910 176.910 176.306 0.604 17919 6199 1 16 . 1 1 7 7 THR CA C 7 60.470 60.470 60.092 0.378 17919 6200 1 16 . 1 1 7 7 THR CB C 7 70.630 70.630 70.612 0.018 17919 6201 1 16 . 1 1 7 7 THR H H 7 8.730 8.730 7.741 0.989 17919 6202 1 16 . 1 1 8 8 LEU N N 8 121.330 121.330 119.755 1.575 17919 6203 1 16 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.227 0.083 17919 6204 1 16 . 1 1 8 8 LEU C C 8 178.800 178.800 178.361 0.439 17919 6205 1 16 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.643 -0.063 17919 6206 1 16 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.931 0.039 17919 6207 1 16 . 1 1 8 8 LEU H H 8 9.100 9.100 8.692 0.408 17919 6208 1 16 . 1 1 9 9 THR N N 9 105.590 105.590 106.987 -1.397 17919 6209 1 16 . 1 1 9 9 THR HA H 9 4.428 4.428 4.273 0.155 17919 6210 1 16 . 1 1 9 9 THR C C 9 175.520 175.520 175.750 -0.230 17919 6211 1 16 . 1 1 9 9 THR CA C 9 61.400 61.400 62.406 -1.006 17919 6212 1 16 . 1 1 9 9 THR CB C 9 69.140 69.140 68.661 0.479 17919 6213 1 16 . 1 1 9 9 THR H H 9 7.630 7.630 7.751 -0.121 17919 6214 1 16 . 1 1 10 10 GLY N N 10 108.890 108.890 111.298 -2.408 17919 6215 1 16 . 1 1 10 10 GLY C C 10 174.070 174.070 173.826 0.244 17919 6216 1 16 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.941 0.519 17919 6217 1 16 . 1 1 10 10 GLY H H 10 7.810 7.810 7.685 0.125 17919 6218 1 16 . 1 1 11 11 LYS N N 11 121.600 121.600 120.151 1.449 17919 6219 1 16 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.288 0.073 17919 6220 1 16 . 1 1 11 11 LYS C C 11 175.940 175.940 176.036 -0.096 17919 6221 1 16 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.359 -0.079 17919 6222 1 16 . 1 1 11 11 LYS CB C 11 33.200 33.200 32.943 0.257 17919 6223 1 16 . 1 1 11 11 LYS H H 11 7.280 7.280 7.572 -0.292 17919 6224 1 16 . 1 1 12 12 THR N N 12 120.440 120.440 117.151 3.289 17919 6225 1 16 . 1 1 12 12 THR HA H 12 5.046 5.046 5.082 -0.036 17919 6226 1 16 . 1 1 12 12 THR C C 12 174.320 174.320 174.425 -0.105 17919 6227 1 16 . 1 1 12 12 THR CA C 12 62.390 62.390 62.172 0.218 17919 6228 1 16 . 1 1 12 12 THR CB C 12 69.910 69.910 70.270 -0.360 17919 6229 1 16 . 1 1 12 12 THR H H 12 8.650 8.650 8.192 0.458 17919 6230 1 16 . 1 1 13 13 ILE N N 13 127.110 127.110 123.973 3.137 17919 6231 1 16 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.458 0.086 17919 6232 1 16 . 1 1 13 13 ILE C C 13 175.220 175.220 174.995 0.225 17919 6233 1 16 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.151 -0.171 17919 6234 1 16 . 1 1 13 13 ILE CB C 13 40.950 40.950 42.538 -1.589 17919 6235 1 16 . 1 1 13 13 ILE H H 13 9.450 9.450 8.390 1.060 17919 6236 1 16 . 1 1 14 14 THR N N 14 121.520 121.520 122.527 -1.007 17919 6237 1 16 . 1 1 14 14 THR HA H 14 4.964 4.964 5.067 -0.103 17919 6238 1 16 . 1 1 14 14 THR C C 14 173.790 173.790 173.573 0.217 17919 6239 1 16 . 1 1 14 14 THR CA C 14 61.940 61.940 61.853 0.087 17919 6240 1 16 . 1 1 14 14 THR CB C 14 69.650 69.650 69.534 0.117 17919 6241 1 16 . 1 1 14 14 THR H H 14 8.710 8.710 8.362 0.348 17919 6242 1 16 . 1 1 15 15 LEU N N 15 124.800 124.800 127.756 -2.956 17919 6243 1 16 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.738 0.042 17919 6244 1 16 . 1 1 15 15 LEU C C 15 174.670 174.670 174.470 0.200 17919 6245 1 16 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.988 -1.158 17919 6246 1 16 . 1 1 15 15 LEU CB C 15 47.070 47.070 46.333 0.737 17919 6247 1 16 . 1 1 15 15 LEU H H 15 8.710 8.710 8.977 -0.267 17919 6248 1 16 . 1 1 16 16 GLU N N 16 122.160 122.160 125.336 -3.176 17919 6249 1 16 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.469 0.448 17919 6250 1 16 . 1 1 16 16 GLU C C 16 175.860 175.860 175.037 0.823 17919 6251 1 16 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.749 -0.929 17919 6252 1 16 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.371 -0.921 17919 6253 1 16 . 1 1 16 16 GLU H H 16 8.140 8.140 8.734 -0.594 17919 6254 1 16 . 1 1 17 17 VAL N N 17 117.210 117.210 121.754 -4.544 17919 6255 1 16 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.301 0.413 17919 6256 1 16 . 1 1 17 17 VAL C C 17 174.160 174.160 174.814 -0.654 17919 6257 1 16 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.861 -1.431 17919 6258 1 16 . 1 1 17 17 VAL CB C 17 36.400 36.400 34.057 2.343 17919 6259 1 16 . 1 1 17 17 VAL H H 17 8.900 8.900 7.901 0.999 17919 6260 1 16 . 1 1 18 18 GLU N N 18 118.990 118.990 123.377 -4.387 17919 6261 1 16 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.802 0.277 17919 6262 1 16 . 1 1 18 18 GLU C C 18 176.160 176.160 176.081 0.079 17919 6263 1 16 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.935 -0.215 17919 6264 1 16 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.144 0.166 17919 6265 1 16 . 1 1 18 18 GLU H H 18 8.640 8.640 7.975 0.665 17919 6266 1 16 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.266 -0.125 17919 6267 1 16 . 1 1 19 19 PRO C C 19 175.310 175.310 177.081 -1.771 17919 6268 1 16 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.540 -0.070 17919 6269 1 16 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.081 -0.131 17919 6270 1 16 . 1 1 20 20 SER N N 20 103.400 103.400 108.060 -4.660 17919 6271 1 16 . 1 1 20 20 SER HA H 20 4.370 4.370 4.429 -0.060 17919 6272 1 16 . 1 1 20 20 SER C C 20 174.660 174.660 173.884 0.776 17919 6273 1 16 . 1 1 20 20 SER CA C 20 57.400 57.400 56.833 0.567 17919 6274 1 16 . 1 1 20 20 SER CB C 20 63.370 63.370 62.705 0.665 17919 6275 1 16 . 1 1 20 20 SER H H 20 7.040 7.040 7.741 -0.701 17919 6276 1 16 . 1 1 21 21 ASP N N 21 123.480 123.480 124.137 -0.657 17919 6277 1 16 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.442 0.253 17919 6278 1 16 . 1 1 21 21 ASP C C 21 176.360 176.360 176.604 -0.244 17919 6279 1 16 . 1 1 21 21 ASP CA C 21 55.700 55.700 56.383 -0.683 17919 6280 1 16 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.806 -1.006 17919 6281 1 16 . 1 1 21 21 ASP H H 21 8.030 8.030 7.762 0.268 17919 6282 1 16 . 1 1 22 22 THR N N 22 108.800 108.800 113.242 -4.442 17919 6283 1 16 . 1 1 22 22 THR HA H 22 4.920 4.920 5.131 -0.211 17919 6284 1 16 . 1 1 22 22 THR C C 22 176.750 176.750 176.392 0.358 17919 6285 1 16 . 1 1 22 22 THR CA C 22 59.690 59.690 60.454 -0.764 17919 6286 1 16 . 1 1 22 22 THR CB C 22 71.200 71.200 70.806 0.394 17919 6287 1 16 . 1 1 22 22 THR H H 22 7.900 7.900 8.471 -0.571 17919 6288 1 16 . 1 1 23 23 ILE N N 23 121.190 121.190 121.484 -0.294 17919 6289 1 16 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.833 -0.176 17919 6290 1 16 . 1 1 23 23 ILE C C 23 179.040 179.040 177.798 1.242 17919 6291 1 16 . 1 1 23 23 ILE CA C 23 62.260 62.260 61.929 0.331 17919 6292 1 16 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.093 -1.743 17919 6293 1 16 . 1 1 23 23 ILE H H 23 8.560 8.560 9.032 -0.472 17919 6294 1 16 . 1 1 24 24 GLU N N 24 120.830 120.830 120.428 0.402 17919 6295 1 16 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.975 -0.058 17919 6296 1 16 . 1 1 24 24 GLU C C 24 178.640 178.640 178.345 0.295 17919 6297 1 16 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.631 0.589 17919 6298 1 16 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.430 -1.150 17919 6299 1 16 . 1 1 24 24 GLU H H 24 9.760 9.760 8.195 1.565 17919 6300 1 16 . 1 1 25 25 ASN N N 25 120.570 120.570 118.572 1.998 17919 6301 1 16 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.496 0.029 17919 6302 1 16 . 1 1 25 25 ASN C C 25 178.380 178.380 177.833 0.547 17919 6303 1 16 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.917 0.143 17919 6304 1 16 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.476 -0.026 17919 6305 1 16 . 1 1 25 25 ASN H H 25 7.920 7.920 7.545 0.375 17919 6306 1 16 . 1 1 26 26 VAL N N 26 121.710 121.710 121.145 0.565 17919 6307 1 16 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.625 -0.228 17919 6308 1 16 . 1 1 26 26 VAL C C 26 177.950 177.950 177.831 0.119 17919 6309 1 16 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.377 1.283 17919 6310 1 16 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.085 -0.246 17919 6311 1 16 . 1 1 26 26 VAL H H 26 8.070 8.070 8.300 -0.230 17919 6312 1 16 . 1 1 27 27 LYS N N 27 118.860 118.860 119.161 -0.301 17919 6313 1 16 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.069 0.511 17919 6314 1 16 . 1 1 27 27 LYS C C 27 180.550 180.550 179.092 1.458 17919 6315 1 16 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.661 -0.411 17919 6316 1 16 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.209 1.521 17919 6317 1 16 . 1 1 27 27 LYS H H 27 8.560 8.560 7.859 0.701 17919 6318 1 16 . 1 1 28 28 ALA N N 28 123.440 123.440 121.894 1.546 17919 6319 1 16 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.092 0.068 17919 6320 1 16 . 1 1 28 28 ALA C C 28 180.300 180.300 179.047 1.253 17919 6321 1 16 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.975 0.395 17919 6322 1 16 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.423 -0.713 17919 6323 1 16 . 1 1 28 28 ALA H H 28 8.060 8.060 7.652 0.408 17919 6324 1 16 . 1 1 29 29 LYS N N 29 119.940 119.940 119.747 0.193 17919 6325 1 16 . 1 1 29 29 LYS HA H 29 4.207 4.207 3.982 0.225 17919 6326 1 16 . 1 1 29 29 LYS C C 29 180.320 180.320 179.220 1.100 17919 6327 1 16 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.397 0.253 17919 6328 1 16 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.299 0.991 17919 6329 1 16 . 1 1 29 29 LYS H H 29 7.850 7.850 7.386 0.464 17919 6330 1 16 . 1 1 30 30 ILE N N 30 121.080 121.080 119.292 1.788 17919 6331 1 16 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.606 -0.099 17919 6332 1 16 . 1 1 30 30 ILE C C 30 178.310 178.310 177.481 0.829 17919 6333 1 16 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.102 1.048 17919 6334 1 16 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.296 -0.496 17919 6335 1 16 . 1 1 30 30 ILE H H 30 8.280 8.280 8.069 0.211 17919 6336 1 16 . 1 1 31 31 GLN N N 31 123.490 123.490 119.641 3.849 17919 6337 1 16 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.995 -0.166 17919 6338 1 16 . 1 1 31 31 GLN C C 31 178.890 178.890 178.546 0.344 17919 6339 1 16 . 1 1 31 31 GLN CA C 31 60.000 60.000 58.683 1.317 17919 6340 1 16 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.412 -0.692 17919 6341 1 16 . 1 1 31 31 GLN H H 31 8.580 8.580 7.995 0.585 17919 6342 1 16 . 1 1 32 32 ASP N N 32 119.360 119.360 120.432 -1.072 17919 6343 1 16 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.359 -0.005 17919 6344 1 16 . 1 1 32 32 ASP C C 32 177.250 177.250 177.615 -0.365 17919 6345 1 16 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.932 0.258 17919 6346 1 16 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.780 -0.200 17919 6347 1 16 . 1 1 32 32 ASP H H 32 8.010 8.010 8.142 -0.132 17919 6348 1 16 . 1 1 33 33 LYS N N 33 115.130 115.130 117.184 -2.054 17919 6349 1 16 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.376 -0.039 17919 6350 1 16 . 1 1 33 33 LYS C C 33 177.870 177.870 178.305 -0.435 17919 6351 1 16 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.779 0.271 17919 6352 1 16 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.152 1.018 17919 6353 1 16 . 1 1 33 33 LYS H H 33 7.430 7.430 7.721 -0.291 17919 6354 1 16 . 1 1 34 34 GLU N N 34 113.870 113.870 115.857 -1.987 17919 6355 1 16 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.448 0.177 17919 6356 1 16 . 1 1 34 34 GLU C C 34 177.840 177.840 177.527 0.313 17919 6357 1 16 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.418 -1.248 17919 6358 1 16 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.446 1.214 17919 6359 1 16 . 1 1 34 34 GLU H H 34 8.740 8.740 8.000 0.740 17919 6360 1 16 . 1 1 35 35 GLY N N 35 108.650 108.650 108.448 0.202 17919 6361 1 16 . 1 1 35 35 GLY C C 35 173.960 173.960 174.381 -0.421 17919 6362 1 16 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.432 0.648 17919 6363 1 16 . 1 1 35 35 GLY H H 35 8.530 8.530 7.860 0.670 17919 6364 1 16 . 1 1 36 36 ILE N N 36 119.880 119.880 120.917 -1.037 17919 6365 1 16 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.178 0.267 17919 6366 1 16 . 1 1 36 36 ILE C C 36 173.590 173.590 173.973 -0.383 17919 6367 1 16 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.369 -0.619 17919 6368 1 16 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.047 2.534 17919 6369 1 16 . 1 1 36 36 ILE H H 36 6.150 6.150 7.706 -1.556 17919 6370 1 16 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.983 -0.349 17919 6371 1 16 . 1 1 37 37 PRO C C 37 176.940 176.940 176.317 0.623 17919 6372 1 16 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.170 0.490 17919 6373 1 16 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.466 0.384 17919 6374 1 16 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.167 -0.050 17919 6375 1 16 . 1 1 38 38 PRO C C 38 178.320 178.320 178.362 -0.042 17919 6376 1 16 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.652 0.608 17919 6377 1 16 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.886 1.004 17919 6378 1 16 . 1 1 39 39 ASP N N 39 113.380 113.380 116.437 -3.057 17919 6379 1 16 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.273 0.157 17919 6380 1 16 . 1 1 39 39 ASP C C 39 177.090 177.090 177.940 -0.850 17919 6381 1 16 . 1 1 39 39 ASP CA C 39 55.640 55.640 57.174 -1.534 17919 6382 1 16 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.557 -1.017 17919 6383 1 16 . 1 1 39 39 ASP H H 39 8.550 8.550 8.751 -0.201 17919 6384 1 16 . 1 1 40 40 GLN N N 40 116.780 116.780 117.303 -0.523 17919 6385 1 16 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.228 0.236 17919 6386 1 16 . 1 1 40 40 GLN C C 40 175.380 175.380 177.147 -1.767 17919 6387 1 16 . 1 1 40 40 GLN CA C 40 55.640 55.640 57.175 -1.534 17919 6388 1 16 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.925 0.215 17919 6389 1 16 . 1 1 40 40 GLN H H 40 7.820 7.820 7.878 -0.058 17919 6390 1 16 . 1 1 41 41 GLN N N 41 117.720 117.720 119.046 -1.326 17919 6391 1 16 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.165 0.079 17919 6392 1 16 . 1 1 41 41 GLN C C 41 176.300 176.300 175.067 1.233 17919 6393 1 16 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.629 -0.159 17919 6394 1 16 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.252 2.398 17919 6395 1 16 . 1 1 41 41 GLN H H 41 7.480 7.480 7.408 0.072 17919 6396 1 16 . 1 1 42 42 ARG N N 42 122.680 122.680 121.566 1.114 17919 6397 1 16 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.624 -0.124 17919 6398 1 16 . 1 1 42 42 ARG C C 42 174.050 174.050 174.279 -0.229 17919 6399 1 16 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.404 0.646 17919 6400 1 16 . 1 1 42 42 ARG CB C 42 31.750 31.750 31.860 -0.110 17919 6401 1 16 . 1 1 42 42 ARG H H 42 8.530 8.530 8.378 0.152 17919 6402 1 16 . 1 1 43 43 LEU N N 43 124.040 124.040 126.080 -2.040 17919 6403 1 16 . 1 1 43 43 LEU C C 43 175.290 175.290 175.830 -0.540 17919 6404 1 16 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.354 -1.374 17919 6405 1 16 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.863 1.927 17919 6406 1 16 . 1 1 43 43 LEU H H 43 8.820 8.820 8.729 0.091 17919 6407 1 16 . 1 1 44 44 ILE N N 44 121.920 121.920 122.968 -1.048 17919 6408 1 16 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.163 -0.171 17919 6409 1 16 . 1 1 44 44 ILE C C 44 176.060 176.060 174.756 1.304 17919 6410 1 16 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.428 -0.448 17919 6411 1 16 . 1 1 44 44 ILE CB C 44 41.420 41.420 40.539 0.881 17919 6412 1 16 . 1 1 44 44 ILE H H 44 9.030 9.030 8.992 0.038 17919 6413 1 16 . 1 1 45 45 PHE N N 45 125.390 125.390 127.199 -1.809 17919 6414 1 16 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.888 0.157 17919 6415 1 16 . 1 1 45 45 PHE C C 45 174.470 174.470 174.161 0.309 17919 6416 1 16 . 1 1 45 45 PHE CA C 45 57.020 57.020 57.342 -0.322 17919 6417 1 16 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.656 1.104 17919 6418 1 16 . 1 1 45 45 PHE H H 45 8.830 8.830 9.096 -0.266 17919 6419 1 16 . 1 1 46 46 ALA N N 46 132.200 132.200 129.921 2.279 17919 6420 1 16 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.660 0.030 17919 6421 1 16 . 1 1 46 46 ALA C C 46 177.290 177.290 177.778 -0.488 17919 6422 1 16 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.820 -0.280 17919 6423 1 16 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.377 0.193 17919 6424 1 16 . 1 1 46 46 ALA H H 46 8.810 8.810 8.916 -0.106 17919 6425 1 16 . 1 1 47 47 GLY N N 47 102.340 102.340 103.572 -1.232 17919 6426 1 16 . 1 1 47 47 GLY C C 47 173.810 173.810 174.142 -0.332 17919 6427 1 16 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.742 0.608 17919 6428 1 16 . 1 1 47 47 GLY H H 47 8.130 8.130 8.441 -0.311 17919 6429 1 16 . 1 1 48 48 LYS N N 48 121.570 121.570 121.752 -0.182 17919 6430 1 16 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.587 0.035 17919 6431 1 16 . 1 1 48 48 LYS C C 48 174.700 174.700 175.305 -0.605 17919 6432 1 16 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.909 -0.359 17919 6433 1 16 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.430 0.100 17919 6434 1 16 . 1 1 48 48 LYS H H 48 7.980 7.980 7.604 0.376 17919 6435 1 16 . 1 1 49 49 GLN N N 49 122.410 122.410 126.029 -3.619 17919 6436 1 16 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.699 -0.139 17919 6437 1 16 . 1 1 49 49 GLN C C 49 175.670 175.670 175.800 -0.130 17919 6438 1 16 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.041 -0.301 17919 6439 1 16 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.478 -0.478 17919 6440 1 16 . 1 1 49 49 GLN H H 49 8.600 8.600 8.692 -0.092 17919 6441 1 16 . 1 1 50 50 LEU N N 50 125.520 125.520 128.283 -2.763 17919 6442 1 16 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.347 -0.257 17919 6443 1 16 . 1 1 50 50 LEU C C 50 176.660 176.660 176.867 -0.207 17919 6444 1 16 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.994 -0.754 17919 6445 1 16 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.571 -0.001 17919 6446 1 16 . 1 1 50 50 LEU H H 50 8.530 8.530 8.442 0.088 17919 6447 1 16 . 1 1 51 51 GLU N N 51 122.940 122.940 124.687 -1.747 17919 6448 1 16 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.502 -0.014 17919 6449 1 16 . 1 1 51 51 GLU C C 51 175.870 175.870 176.184 -0.314 17919 6450 1 16 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.430 0.530 17919 6451 1 16 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.446 0.124 17919 6452 1 16 . 1 1 51 51 GLU H H 51 8.400 8.400 8.540 -0.140 17919 6453 1 16 . 1 1 52 52 ASP N N 52 120.030 120.030 123.500 -3.470 17919 6454 1 16 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.496 -0.137 17919 6455 1 16 . 1 1 52 52 ASP C C 52 177.330 177.330 176.889 0.441 17919 6456 1 16 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.281 -0.321 17919 6457 1 16 . 1 1 52 52 ASP CB C 52 40.850 40.850 41.179 -0.329 17919 6458 1 16 . 1 1 52 52 ASP H H 52 8.160 8.160 8.736 -0.576 17919 6459 1 16 . 1 1 53 53 GLY N N 53 106.660 106.660 106.083 0.577 17919 6460 1 16 . 1 1 53 53 GLY C C 53 174.870 174.870 173.934 0.936 17919 6461 1 16 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.570 0.600 17919 6462 1 16 . 1 1 53 53 GLY H H 53 9.390 9.390 8.237 1.153 17919 6463 1 16 . 1 1 54 54 ARG N N 54 119.050 119.050 120.474 -1.424 17919 6464 1 16 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.695 0.000 17919 6465 1 16 . 1 1 54 54 ARG C C 54 175.350 175.350 175.066 0.284 17919 6466 1 16 . 1 1 54 54 ARG CA C 54 54.390 54.390 52.970 1.420 17919 6467 1 16 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.620 0.031 17919 6468 1 16 . 1 1 54 54 ARG H H 54 7.460 7.460 7.549 -0.089 17919 6469 1 16 . 1 1 55 55 THR N N 55 108.400 108.400 112.494 -4.094 17919 6470 1 16 . 1 1 55 55 THR HA H 55 5.240 5.240 4.968 0.272 17919 6471 1 16 . 1 1 55 55 THR C C 55 176.560 176.560 176.918 -0.358 17919 6472 1 16 . 1 1 55 55 THR CA C 55 59.690 59.690 60.340 -0.650 17919 6473 1 16 . 1 1 55 55 THR CB C 55 72.260 72.260 70.561 1.700 17919 6474 1 16 . 1 1 55 55 THR H H 55 8.730 8.730 8.550 0.180 17919 6475 1 16 . 1 1 56 56 LEU N N 56 117.920 117.920 122.122 -4.202 17919 6476 1 16 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.150 -0.090 17919 6477 1 16 . 1 1 56 56 LEU C C 56 180.810 180.810 178.739 2.071 17919 6478 1 16 . 1 1 56 56 LEU CA C 56 58.710 58.710 57.854 0.856 17919 6479 1 16 . 1 1 56 56 LEU CB C 56 40.370 40.370 40.089 0.281 17919 6480 1 16 . 1 1 56 56 LEU H H 56 8.140 8.140 8.368 -0.228 17919 6481 1 16 . 1 1 57 57 SER N N 57 113.330 113.330 114.057 -0.727 17919 6482 1 16 . 1 1 57 57 SER HA H 57 4.370 4.370 4.174 0.196 17919 6483 1 16 . 1 1 57 57 SER C C 57 178.310 178.310 176.862 1.448 17919 6484 1 16 . 1 1 57 57 SER CA C 57 61.080 61.080 61.566 -0.486 17919 6485 1 16 . 1 1 57 57 SER CB C 57 62.530 62.530 62.627 -0.097 17919 6486 1 16 . 1 1 57 57 SER H H 57 8.470 8.470 7.824 0.646 17919 6487 1 16 . 1 1 58 58 ASP N N 58 124.190 124.190 123.350 0.840 17919 6488 1 16 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.362 -0.066 17919 6489 1 16 . 1 1 58 58 ASP C C 58 177.400 177.400 177.436 -0.036 17919 6490 1 16 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.901 0.279 17919 6491 1 16 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.375 -0.275 17919 6492 1 16 . 1 1 58 58 ASP H H 58 7.930 7.930 7.830 0.100 17919 6493 1 16 . 1 1 59 59 TYR N N 59 115.510 115.510 115.292 0.218 17919 6494 1 16 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.781 -0.111 17919 6495 1 16 . 1 1 59 59 TYR C C 59 174.700 174.700 175.880 -1.180 17919 6496 1 16 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.285 0.965 17919 6497 1 16 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.679 1.391 17919 6498 1 16 . 1 1 59 59 TYR H H 59 7.250 7.250 7.433 -0.183 17919 6499 1 16 . 1 1 60 60 ASN N N 60 115.900 115.900 117.570 -1.670 17919 6500 1 16 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.405 -0.050 17919 6501 1 16 . 1 1 60 60 ASN C C 60 174.340 174.340 174.358 -0.018 17919 6502 1 16 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.175 -0.055 17919 6503 1 16 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.891 -0.481 17919 6504 1 16 . 1 1 60 60 ASN H H 60 8.150 8.150 7.857 0.293 17919 6505 1 16 . 1 1 61 61 ILE N N 61 118.600 118.600 120.719 -2.119 17919 6506 1 16 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.661 -0.268 17919 6507 1 16 . 1 1 61 61 ILE C C 61 174.610 174.610 175.195 -0.585 17919 6508 1 16 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.187 0.233 17919 6509 1 16 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.103 -0.363 17919 6510 1 16 . 1 1 61 61 ILE H H 61 7.250 7.250 7.454 -0.204 17919 6511 1 16 . 1 1 62 62 GLN N N 62 124.740 124.740 126.383 -1.643 17919 6512 1 16 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.691 -0.185 17919 6513 1 16 . 1 1 62 62 GLN C C 62 175.970 175.970 176.234 -0.264 17919 6514 1 16 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.822 -0.162 17919 6515 1 16 . 1 1 62 62 GLN CB C 62 31.650 31.650 30.864 0.786 17919 6516 1 16 . 1 1 62 62 GLN H H 62 7.610 7.610 7.937 -0.327 17919 6517 1 16 . 1 1 63 63 LYS N N 63 120.300 120.300 122.246 -1.946 17919 6518 1 16 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.792 0.209 17919 6519 1 16 . 1 1 63 63 LYS C C 63 175.810 175.810 176.681 -0.871 17919 6520 1 16 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.632 0.158 17919 6521 1 16 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.660 0.990 17919 6522 1 16 . 1 1 63 63 LYS H H 63 8.490 8.490 8.784 -0.294 17919 6523 1 16 . 1 1 64 64 GLU N N 64 113.950 113.950 116.737 -2.787 17919 6524 1 16 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.627 -0.162 17919 6525 1 16 . 1 1 64 64 GLU C C 64 175.250 175.250 175.690 -0.440 17919 6526 1 16 . 1 1 64 64 GLU CA C 64 57.890 57.890 58.226 -0.336 17919 6527 1 16 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.728 -2.828 17919 6528 1 16 . 1 1 64 64 GLU H H 64 9.280 9.280 8.842 0.438 17919 6529 1 16 . 1 1 65 65 SER N N 65 114.730 114.730 115.679 -0.949 17919 6530 1 16 . 1 1 65 65 SER HA H 65 4.640 4.640 4.552 0.088 17919 6531 1 16 . 1 1 65 65 SER C C 65 172.160 172.160 174.388 -2.228 17919 6532 1 16 . 1 1 65 65 SER CA C 65 60.890 60.890 59.931 0.959 17919 6533 1 16 . 1 1 65 65 SER CB C 65 64.910 64.910 63.779 1.131 17919 6534 1 16 . 1 1 65 65 SER H H 65 7.670 7.670 7.536 0.134 17919 6535 1 16 . 1 1 66 66 THR N N 66 117.110 117.110 122.920 -5.810 17919 6536 1 16 . 1 1 66 66 THR HA H 66 5.270 5.270 4.614 0.656 17919 6537 1 16 . 1 1 66 66 THR C C 66 173.950 173.950 174.056 -0.106 17919 6538 1 16 . 1 1 66 66 THR CA C 66 62.340 62.340 62.704 -0.364 17919 6539 1 16 . 1 1 66 66 THR CB C 66 70.080 70.080 69.706 0.375 17919 6540 1 16 . 1 1 66 66 THR H H 66 8.730 8.730 8.566 0.164 17919 6541 1 16 . 1 1 67 67 LEU N N 67 127.110 127.110 127.881 -0.771 17919 6542 1 16 . 1 1 67 67 LEU HA H 67 5.060 5.060 5.215 -0.155 17919 6543 1 16 . 1 1 67 67 LEU C C 67 175.770 175.770 175.674 0.096 17919 6544 1 16 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.419 0.481 17919 6545 1 16 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.129 0.131 17919 6546 1 16 . 1 1 67 67 LEU H H 67 9.410 9.410 8.260 1.150 17919 6547 1 16 . 1 1 68 68 HIS N N 68 118.380 118.380 120.016 -1.636 17919 6548 1 16 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.829 -0.589 17919 6549 1 16 . 1 1 68 68 HIS C C 68 173.150 173.150 173.783 -0.633 17919 6550 1 16 . 1 1 68 68 HIS CA C 68 55.000 55.000 53.644 1.356 17919 6551 1 16 . 1 1 68 68 HIS CB C 68 30.530 30.530 33.862 -3.332 17919 6552 1 16 . 1 1 68 68 HIS H H 68 9.230 9.230 8.548 0.682 17919 6553 1 16 . 1 1 69 69 LEU N N 69 124.460 124.460 123.311 1.149 17919 6554 1 16 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.901 0.289 17919 6555 1 16 . 1 1 69 69 LEU C C 69 175.270 175.270 174.177 1.093 17919 6556 1 16 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.595 -0.705 17919 6557 1 16 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.575 -0.195 17919 6558 1 16 . 1 1 69 69 LEU H H 69 8.340 8.340 7.206 1.134 17919 6559 1 16 . 1 1 70 70 VAL N N 70 126.940 126.940 125.980 0.960 17919 6560 1 16 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.500 -0.150 17919 6561 1 16 . 1 1 70 70 VAL C C 70 174.000 174.000 174.378 -0.378 17919 6562 1 16 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.048 0.752 17919 6563 1 16 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.198 -0.288 17919 6564 1 16 . 1 1 70 70 VAL H H 70 9.200 9.200 9.071 0.129 17919 6565 1 16 . 1 1 71 71 LEU N N 71 123.130 123.130 125.869 -2.739 17919 6566 1 16 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.680 0.380 17919 6567 1 16 . 1 1 71 71 LEU C C 71 177.830 177.830 177.177 0.653 17919 6568 1 16 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.974 -0.034 17919 6569 1 16 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.504 -0.654 17919 6570 1 16 . 1 1 71 71 LEU H H 71 8.120 8.120 8.721 -0.601 17919 6571 1 16 . 1 1 72 72 ARG N N 72 123.490 123.490 127.816 -4.326 17919 6572 1 16 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.353 -0.052 17919 6573 1 16 . 1 1 72 72 ARG C C 72 175.350 175.350 175.430 -0.080 17919 6574 1 16 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.404 0.206 17919 6575 1 16 . 1 1 72 72 ARG CB C 72 31.350 31.350 29.195 2.155 17919 6576 1 16 . 1 1 72 72 ARG H H 72 8.580 8.580 8.528 0.052 17919 6577 1 17 . 1 1 2 2 GLN N N 2 123.220 123.220 125.751 -2.531 17919 6578 1 17 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.109 0.140 17919 6579 1 17 . 1 1 2 2 GLN C C 2 175.920 175.920 175.481 0.439 17919 6580 1 17 . 1 1 2 2 GLN CA C 2 55.080 55.080 55.216 -0.136 17919 6581 1 17 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.052 0.708 17919 6582 1 17 . 1 1 2 2 GLN H H 2 8.900 8.900 8.493 0.407 17919 6583 1 17 . 1 1 3 3 ILE N N 3 115.340 115.340 116.820 -1.480 17919 6584 1 17 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.412 -0.199 17919 6585 1 17 . 1 1 3 3 ILE C C 3 172.450 172.450 174.155 -1.705 17919 6586 1 17 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.017 0.553 17919 6587 1 17 . 1 1 3 3 ILE CB C 3 42.210 42.210 40.832 1.378 17919 6588 1 17 . 1 1 3 3 ILE H H 3 8.320 8.320 8.568 -0.248 17919 6589 1 17 . 1 1 4 4 PHE N N 4 118.110 118.110 121.137 -3.027 17919 6590 1 17 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.215 0.415 17919 6591 1 17 . 1 1 4 4 PHE C C 4 175.320 175.320 175.838 -0.518 17919 6592 1 17 . 1 1 4 4 PHE CA C 4 55.210 55.210 54.922 0.288 17919 6593 1 17 . 1 1 4 4 PHE CB C 4 41.480 41.480 39.593 1.887 17919 6594 1 17 . 1 1 4 4 PHE H H 4 8.610 8.610 7.860 0.750 17919 6595 1 17 . 1 1 5 5 VAL N N 5 121.000 121.000 125.396 -4.396 17919 6596 1 17 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.755 -0.030 17919 6597 1 17 . 1 1 5 5 VAL C C 5 174.870 174.870 175.653 -0.783 17919 6598 1 17 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.979 -1.359 17919 6599 1 17 . 1 1 5 5 VAL CB C 5 34.230 34.230 32.179 2.051 17919 6600 1 17 . 1 1 5 5 VAL H H 5 9.300 9.300 8.859 0.441 17919 6601 1 17 . 1 1 6 6 LYS N N 6 127.520 127.520 128.377 -0.857 17919 6602 1 17 . 1 1 6 6 LYS HA H 6 5.367 5.367 4.908 0.459 17919 6603 1 17 . 1 1 6 6 LYS C C 6 177.140 177.140 176.159 0.981 17919 6604 1 17 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.906 -0.386 17919 6605 1 17 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.055 -0.005 17919 6606 1 17 . 1 1 6 6 LYS H H 6 8.820 8.820 8.883 -0.063 17919 6607 1 17 . 1 1 7 7 THR N N 7 115.400 115.400 113.000 2.400 17919 6608 1 17 . 1 1 7 7 THR HA H 7 4.970 4.970 4.649 0.321 17919 6609 1 17 . 1 1 7 7 THR C C 7 176.910 176.910 176.867 0.043 17919 6610 1 17 . 1 1 7 7 THR CA C 7 60.470 60.470 59.664 0.806 17919 6611 1 17 . 1 1 7 7 THR CB C 7 70.630 70.630 71.056 -0.426 17919 6612 1 17 . 1 1 7 7 THR H H 7 8.730 8.730 8.221 0.509 17919 6613 1 17 . 1 1 8 8 LEU N N 8 121.330 121.330 116.388 4.942 17919 6614 1 17 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.376 -0.066 17919 6615 1 17 . 1 1 8 8 LEU C C 8 178.800 178.800 176.925 1.875 17919 6616 1 17 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.361 0.219 17919 6617 1 17 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.391 0.579 17919 6618 1 17 . 1 1 8 8 LEU H H 8 9.100 9.100 8.372 0.728 17919 6619 1 17 . 1 1 9 9 THR N N 9 105.590 105.590 109.003 -3.413 17919 6620 1 17 . 1 1 9 9 THR HA H 9 4.428 4.428 4.446 -0.018 17919 6621 1 17 . 1 1 9 9 THR C C 9 175.520 175.520 175.446 0.074 17919 6622 1 17 . 1 1 9 9 THR CA C 9 61.400 61.400 61.470 -0.070 17919 6623 1 17 . 1 1 9 9 THR CB C 9 69.140 69.140 69.976 -0.836 17919 6624 1 17 . 1 1 9 9 THR H H 9 7.630 7.630 7.584 0.046 17919 6625 1 17 . 1 1 10 10 GLY N N 10 108.890 108.890 112.249 -3.359 17919 6626 1 17 . 1 1 10 10 GLY C C 10 174.070 174.070 174.313 -0.243 17919 6627 1 17 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.099 0.361 17919 6628 1 17 . 1 1 10 10 GLY H H 10 7.810 7.810 8.083 -0.273 17919 6629 1 17 . 1 1 11 11 LYS N N 11 121.600 121.600 121.863 -0.263 17919 6630 1 17 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.445 -0.084 17919 6631 1 17 . 1 1 11 11 LYS C C 11 175.940 175.940 175.661 0.279 17919 6632 1 17 . 1 1 11 11 LYS CA C 11 56.280 56.280 55.845 0.435 17919 6633 1 17 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.081 0.119 17919 6634 1 17 . 1 1 11 11 LYS H H 11 7.280 7.280 7.755 -0.475 17919 6635 1 17 . 1 1 12 12 THR N N 12 120.440 120.440 115.387 5.053 17919 6636 1 17 . 1 1 12 12 THR HA H 12 5.046 5.046 4.639 0.407 17919 6637 1 17 . 1 1 12 12 THR C C 12 174.320 174.320 173.834 0.486 17919 6638 1 17 . 1 1 12 12 THR CA C 12 62.390 62.390 61.468 0.922 17919 6639 1 17 . 1 1 12 12 THR CB C 12 69.910 69.910 70.654 -0.744 17919 6640 1 17 . 1 1 12 12 THR H H 12 8.650 8.650 8.181 0.469 17919 6641 1 17 . 1 1 13 13 ILE N N 13 127.110 127.110 124.121 2.989 17919 6642 1 17 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.583 -0.039 17919 6643 1 17 . 1 1 13 13 ILE C C 13 175.220 175.220 174.427 0.793 17919 6644 1 17 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.727 -0.747 17919 6645 1 17 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.675 -0.725 17919 6646 1 17 . 1 1 13 13 ILE H H 13 9.450 9.450 8.746 0.704 17919 6647 1 17 . 1 1 14 14 THR N N 14 121.520 121.520 123.297 -1.777 17919 6648 1 17 . 1 1 14 14 THR HA H 14 4.964 4.964 5.179 -0.215 17919 6649 1 17 . 1 1 14 14 THR C C 14 173.790 173.790 173.719 0.071 17919 6650 1 17 . 1 1 14 14 THR CA C 14 61.940 61.940 61.870 0.070 17919 6651 1 17 . 1 1 14 14 THR CB C 14 69.650 69.650 69.814 -0.163 17919 6652 1 17 . 1 1 14 14 THR H H 14 8.710 8.710 8.332 0.378 17919 6653 1 17 . 1 1 15 15 LEU N N 15 124.800 124.800 128.825 -4.025 17919 6654 1 17 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.718 0.062 17919 6655 1 17 . 1 1 15 15 LEU C C 15 174.670 174.670 174.300 0.370 17919 6656 1 17 . 1 1 15 15 LEU CA C 15 52.830 52.830 54.390 -1.560 17919 6657 1 17 . 1 1 15 15 LEU CB C 15 47.070 47.070 46.399 0.671 17919 6658 1 17 . 1 1 15 15 LEU H H 15 8.710 8.710 8.656 0.054 17919 6659 1 17 . 1 1 16 16 GLU N N 16 122.160 122.160 125.832 -3.672 17919 6660 1 17 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.475 0.442 17919 6661 1 17 . 1 1 16 16 GLU C C 16 175.860 175.860 175.867 -0.007 17919 6662 1 17 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.334 -0.514 17919 6663 1 17 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.480 -1.030 17919 6664 1 17 . 1 1 16 16 GLU H H 16 8.140 8.140 8.632 -0.492 17919 6665 1 17 . 1 1 17 17 VAL N N 17 117.210 117.210 122.992 -5.782 17919 6666 1 17 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.569 0.145 17919 6667 1 17 . 1 1 17 17 VAL C C 17 174.160 174.160 174.408 -0.248 17919 6668 1 17 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.782 -1.352 17919 6669 1 17 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.270 1.130 17919 6670 1 17 . 1 1 17 17 VAL H H 17 8.900 8.900 8.174 0.726 17919 6671 1 17 . 1 1 18 18 GLU N N 18 118.990 118.990 118.908 0.082 17919 6672 1 17 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.781 0.298 17919 6673 1 17 . 1 1 18 18 GLU C C 18 176.160 176.160 175.282 0.878 17919 6674 1 17 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.246 -0.526 17919 6675 1 17 . 1 1 18 18 GLU CB C 18 30.310 30.310 31.273 -0.963 17919 6676 1 17 . 1 1 18 18 GLU H H 18 8.640 8.640 8.778 -0.138 17919 6677 1 17 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.301 -0.160 17919 6678 1 17 . 1 1 19 19 PRO C C 19 175.310 175.310 178.417 -3.107 17919 6679 1 17 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.296 0.174 17919 6680 1 17 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.912 0.038 17919 6681 1 17 . 1 1 20 20 SER N N 20 103.400 103.400 113.435 -10.035 17919 6682 1 17 . 1 1 20 20 SER HA H 20 4.370 4.370 4.184 0.186 17919 6683 1 17 . 1 1 20 20 SER C C 20 174.660 174.660 174.743 -0.083 17919 6684 1 17 . 1 1 20 20 SER CA C 20 57.400 57.400 60.592 -3.192 17919 6685 1 17 . 1 1 20 20 SER CB C 20 63.370 63.370 63.014 0.356 17919 6686 1 17 . 1 1 20 20 SER H H 20 7.040 7.040 8.423 -1.383 17919 6687 1 17 . 1 1 21 21 ASP N N 21 123.480 123.480 121.408 2.072 17919 6688 1 17 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.754 -0.059 17919 6689 1 17 . 1 1 21 21 ASP C C 21 176.360 176.360 175.572 0.788 17919 6690 1 17 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.997 0.703 17919 6691 1 17 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.432 -0.632 17919 6692 1 17 . 1 1 21 21 ASP H H 21 8.030 8.030 7.854 0.176 17919 6693 1 17 . 1 1 22 22 THR N N 22 108.800 108.800 112.334 -3.534 17919 6694 1 17 . 1 1 22 22 THR HA H 22 4.920 4.920 4.705 0.215 17919 6695 1 17 . 1 1 22 22 THR C C 22 176.750 176.750 176.307 0.443 17919 6696 1 17 . 1 1 22 22 THR CA C 22 59.690 59.690 61.392 -1.702 17919 6697 1 17 . 1 1 22 22 THR CB C 22 71.200 71.200 70.012 1.188 17919 6698 1 17 . 1 1 22 22 THR H H 22 7.900 7.900 8.206 -0.306 17919 6699 1 17 . 1 1 23 23 ILE N N 23 121.190 121.190 123.511 -2.321 17919 6700 1 17 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.659 -0.002 17919 6701 1 17 . 1 1 23 23 ILE C C 23 179.040 179.040 177.618 1.422 17919 6702 1 17 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.136 -0.876 17919 6703 1 17 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.263 -1.913 17919 6704 1 17 . 1 1 23 23 ILE H H 23 8.560 8.560 8.719 -0.159 17919 6705 1 17 . 1 1 24 24 GLU N N 24 120.830 120.830 118.983 1.847 17919 6706 1 17 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.935 -0.018 17919 6707 1 17 . 1 1 24 24 GLU C C 24 178.640 178.640 178.595 0.045 17919 6708 1 17 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.420 0.800 17919 6709 1 17 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.417 -1.137 17919 6710 1 17 . 1 1 24 24 GLU H H 24 9.760 9.760 8.196 1.564 17919 6711 1 17 . 1 1 25 25 ASN N N 25 120.570 120.570 117.994 2.576 17919 6712 1 17 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.549 -0.024 17919 6713 1 17 . 1 1 25 25 ASN C C 25 178.380 178.380 178.244 0.136 17919 6714 1 17 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.889 0.172 17919 6715 1 17 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.597 -0.147 17919 6716 1 17 . 1 1 25 25 ASN H H 25 7.920 7.920 7.700 0.220 17919 6717 1 17 . 1 1 26 26 VAL N N 26 121.710 121.710 120.323 1.387 17919 6718 1 17 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.536 -0.139 17919 6719 1 17 . 1 1 26 26 VAL C C 26 177.950 177.950 177.844 0.106 17919 6720 1 17 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.634 1.026 17919 6721 1 17 . 1 1 26 26 VAL CB C 26 30.840 30.840 30.982 -0.142 17919 6722 1 17 . 1 1 26 26 VAL H H 26 8.070 8.070 8.105 -0.035 17919 6723 1 17 . 1 1 27 27 LYS N N 27 118.860 118.860 118.943 -0.083 17919 6724 1 17 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.212 0.368 17919 6725 1 17 . 1 1 27 27 LYS C C 27 180.550 180.550 179.275 1.275 17919 6726 1 17 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.316 -0.066 17919 6727 1 17 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.185 1.545 17919 6728 1 17 . 1 1 27 27 LYS H H 27 8.560 8.560 7.705 0.855 17919 6729 1 17 . 1 1 28 28 ALA N N 28 123.440 123.440 121.519 1.921 17919 6730 1 17 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.024 0.136 17919 6731 1 17 . 1 1 28 28 ALA C C 28 180.300 180.300 179.344 0.956 17919 6732 1 17 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.339 0.031 17919 6733 1 17 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.087 -0.378 17919 6734 1 17 . 1 1 28 28 ALA H H 28 8.060 8.060 8.183 -0.123 17919 6735 1 17 . 1 1 29 29 LYS N N 29 119.940 119.940 118.877 1.063 17919 6736 1 17 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.016 0.191 17919 6737 1 17 . 1 1 29 29 LYS C C 29 180.320 180.320 179.239 1.081 17919 6738 1 17 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.333 0.317 17919 6739 1 17 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.340 0.950 17919 6740 1 17 . 1 1 29 29 LYS H H 29 7.850 7.850 7.492 0.358 17919 6741 1 17 . 1 1 30 30 ILE N N 30 121.080 121.080 119.636 1.444 17919 6742 1 17 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.605 -0.098 17919 6743 1 17 . 1 1 30 30 ILE C C 30 178.310 178.310 177.550 0.760 17919 6744 1 17 . 1 1 30 30 ILE CA C 30 66.150 66.150 64.949 1.201 17919 6745 1 17 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.355 -0.555 17919 6746 1 17 . 1 1 30 30 ILE H H 30 8.280 8.280 7.516 0.764 17919 6747 1 17 . 1 1 31 31 GLN N N 31 123.490 123.490 119.916 3.574 17919 6748 1 17 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.975 -0.146 17919 6749 1 17 . 1 1 31 31 GLN C C 31 178.890 178.890 177.941 0.949 17919 6750 1 17 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.351 0.649 17919 6751 1 17 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.501 -0.781 17919 6752 1 17 . 1 1 31 31 GLN H H 31 8.580 8.580 8.246 0.334 17919 6753 1 17 . 1 1 32 32 ASP N N 32 119.360 119.360 119.289 0.071 17919 6754 1 17 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.364 -0.010 17919 6755 1 17 . 1 1 32 32 ASP C C 32 177.250 177.250 178.102 -0.852 17919 6756 1 17 . 1 1 32 32 ASP CA C 32 57.190 57.190 57.016 0.174 17919 6757 1 17 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.850 -0.270 17919 6758 1 17 . 1 1 32 32 ASP H H 32 8.010 8.010 8.108 -0.098 17919 6759 1 17 . 1 1 33 33 LYS N N 33 115.130 115.130 118.529 -3.399 17919 6760 1 17 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.210 0.127 17919 6761 1 17 . 1 1 33 33 LYS C C 33 177.870 177.870 178.031 -0.161 17919 6762 1 17 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.118 -0.069 17919 6763 1 17 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.535 0.635 17919 6764 1 17 . 1 1 33 33 LYS H H 33 7.430 7.430 7.512 -0.082 17919 6765 1 17 . 1 1 34 34 GLU N N 34 113.870 113.870 114.566 -0.696 17919 6766 1 17 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.496 0.129 17919 6767 1 17 . 1 1 34 34 GLU C C 34 177.840 177.840 176.812 1.028 17919 6768 1 17 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.894 -0.724 17919 6769 1 17 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.006 1.654 17919 6770 1 17 . 1 1 34 34 GLU H H 34 8.740 8.740 7.835 0.905 17919 6771 1 17 . 1 1 35 35 GLY N N 35 108.650 108.650 108.959 -0.309 17919 6772 1 17 . 1 1 35 35 GLY C C 35 173.960 173.960 174.100 -0.140 17919 6773 1 17 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.894 0.186 17919 6774 1 17 . 1 1 35 35 GLY H H 35 8.530 8.530 8.552 -0.022 17919 6775 1 17 . 1 1 36 36 ILE N N 36 119.880 119.880 121.255 -1.375 17919 6776 1 17 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.357 0.088 17919 6777 1 17 . 1 1 36 36 ILE C C 36 173.590 173.590 173.661 -0.071 17919 6778 1 17 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.791 -0.041 17919 6779 1 17 . 1 1 36 36 ILE CB C 36 40.580 40.580 39.134 1.446 17919 6780 1 17 . 1 1 36 36 ILE H H 36 6.150 6.150 7.436 -1.286 17919 6781 1 17 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.726 -0.092 17919 6782 1 17 . 1 1 37 37 PRO C C 37 176.940 176.940 176.449 0.491 17919 6783 1 17 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.267 0.393 17919 6784 1 17 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.433 0.417 17919 6785 1 17 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.199 -0.082 17919 6786 1 17 . 1 1 38 38 PRO C C 38 178.320 178.320 178.026 0.294 17919 6787 1 17 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.302 0.958 17919 6788 1 17 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.674 1.216 17919 6789 1 17 . 1 1 39 39 ASP N N 39 113.380 113.380 116.304 -2.924 17919 6790 1 17 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.314 0.116 17919 6791 1 17 . 1 1 39 39 ASP C C 39 177.090 177.090 177.540 -0.450 17919 6792 1 17 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.846 -1.206 17919 6793 1 17 . 1 1 39 39 ASP CB C 39 39.540 39.540 39.511 0.029 17919 6794 1 17 . 1 1 39 39 ASP H H 39 8.550 8.550 8.863 -0.313 17919 6795 1 17 . 1 1 40 40 GLN N N 40 116.780 116.780 116.654 0.126 17919 6796 1 17 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.811 -0.347 17919 6797 1 17 . 1 1 40 40 GLN C C 40 175.380 175.380 176.089 -0.709 17919 6798 1 17 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.019 -0.379 17919 6799 1 17 . 1 1 40 40 GLN CB C 40 30.140 30.140 31.228 -1.088 17919 6800 1 17 . 1 1 40 40 GLN H H 40 7.820 7.820 7.678 0.142 17919 6801 1 17 . 1 1 41 41 GLN N N 41 117.720 117.720 119.632 -1.912 17919 6802 1 17 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.220 0.024 17919 6803 1 17 . 1 1 41 41 GLN C C 41 176.300 176.300 175.173 1.127 17919 6804 1 17 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.568 -0.098 17919 6805 1 17 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.392 2.257 17919 6806 1 17 . 1 1 41 41 GLN H H 41 7.480 7.480 7.317 0.163 17919 6807 1 17 . 1 1 42 42 ARG N N 42 122.680 122.680 122.449 0.231 17919 6808 1 17 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.573 -0.073 17919 6809 1 17 . 1 1 42 42 ARG C C 42 174.050 174.050 174.352 -0.302 17919 6810 1 17 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.025 0.025 17919 6811 1 17 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.086 -1.335 17919 6812 1 17 . 1 1 42 42 ARG H H 42 8.530 8.530 7.944 0.586 17919 6813 1 17 . 1 1 43 43 LEU N N 43 124.040 124.040 126.526 -2.486 17919 6814 1 17 . 1 1 43 43 LEU C C 43 175.290 175.290 175.520 -0.230 17919 6815 1 17 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.873 -0.893 17919 6816 1 17 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.800 1.990 17919 6817 1 17 . 1 1 43 43 LEU H H 43 8.820 8.820 8.822 -0.002 17919 6818 1 17 . 1 1 44 44 ILE N N 44 121.920 121.920 124.029 -2.109 17919 6819 1 17 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.620 0.372 17919 6820 1 17 . 1 1 44 44 ILE C C 44 176.060 176.060 174.904 1.156 17919 6821 1 17 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.883 -1.903 17919 6822 1 17 . 1 1 44 44 ILE CB C 44 41.420 41.420 40.139 1.280 17919 6823 1 17 . 1 1 44 44 ILE H H 44 9.030 9.030 8.987 0.043 17919 6824 1 17 . 1 1 45 45 PHE N N 45 125.390 125.390 129.623 -4.233 17919 6825 1 17 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.826 0.219 17919 6826 1 17 . 1 1 45 45 PHE C C 45 174.470 174.470 174.781 -0.311 17919 6827 1 17 . 1 1 45 45 PHE CA C 45 57.020 57.020 57.798 -0.778 17919 6828 1 17 . 1 1 45 45 PHE CB C 45 43.760 43.760 41.601 2.159 17919 6829 1 17 . 1 1 45 45 PHE H H 45 8.830 8.830 8.533 0.297 17919 6830 1 17 . 1 1 46 46 ALA N N 46 132.200 132.200 120.623 11.577 17919 6831 1 17 . 1 1 46 46 ALA HA H 46 3.690 3.690 4.579 -0.889 17919 6832 1 17 . 1 1 46 46 ALA C C 46 177.290 177.290 178.433 -1.143 17919 6833 1 17 . 1 1 46 46 ALA CA C 46 52.540 52.540 51.610 0.930 17919 6834 1 17 . 1 1 46 46 ALA CB C 46 16.570 16.570 19.230 -2.659 17919 6835 1 17 . 1 1 46 46 ALA H H 46 8.810 8.810 7.280 1.530 17919 6836 1 17 . 1 1 47 47 GLY N N 47 102.340 102.340 106.471 -4.131 17919 6837 1 17 . 1 1 47 47 GLY C C 47 173.810 173.810 174.289 -0.479 17919 6838 1 17 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.371 -0.021 17919 6839 1 17 . 1 1 47 47 GLY H H 47 8.130 8.130 8.159 -0.029 17919 6840 1 17 . 1 1 48 48 LYS N N 48 121.570 121.570 120.645 0.925 17919 6841 1 17 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.534 0.088 17919 6842 1 17 . 1 1 48 48 LYS C C 48 174.700 174.700 174.681 0.019 17919 6843 1 17 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.138 -0.588 17919 6844 1 17 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.257 0.273 17919 6845 1 17 . 1 1 48 48 LYS H H 48 7.980 7.980 7.441 0.539 17919 6846 1 17 . 1 1 49 49 GLN N N 49 122.410 122.410 125.362 -2.952 17919 6847 1 17 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.668 -0.108 17919 6848 1 17 . 1 1 49 49 GLN C C 49 175.670 175.670 175.261 0.409 17919 6849 1 17 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.148 0.592 17919 6850 1 17 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.113 -0.113 17919 6851 1 17 . 1 1 49 49 GLN H H 49 8.600 8.600 8.600 -0.000 17919 6852 1 17 . 1 1 50 50 LEU N N 50 125.520 125.520 128.896 -3.376 17919 6853 1 17 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.007 0.083 17919 6854 1 17 . 1 1 50 50 LEU C C 50 176.660 176.660 175.773 0.887 17919 6855 1 17 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.342 -0.102 17919 6856 1 17 . 1 1 50 50 LEU CB C 50 41.570 41.570 39.846 1.724 17919 6857 1 17 . 1 1 50 50 LEU H H 50 8.530 8.530 9.015 -0.485 17919 6858 1 17 . 1 1 51 51 GLU N N 51 122.940 122.940 124.348 -1.408 17919 6859 1 17 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.666 -0.178 17919 6860 1 17 . 1 1 51 51 GLU C C 51 175.870 175.870 177.360 -1.490 17919 6861 1 17 . 1 1 51 51 GLU CA C 51 55.960 55.960 54.822 1.139 17919 6862 1 17 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.439 0.131 17919 6863 1 17 . 1 1 51 51 GLU H H 51 8.400 8.400 8.596 -0.196 17919 6864 1 17 . 1 1 52 52 ASP N N 52 120.030 120.030 119.406 0.624 17919 6865 1 17 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.630 -0.271 17919 6866 1 17 . 1 1 52 52 ASP C C 52 177.330 177.330 177.938 -0.608 17919 6867 1 17 . 1 1 52 52 ASP CA C 52 56.960 56.960 56.459 0.501 17919 6868 1 17 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.862 -0.012 17919 6869 1 17 . 1 1 52 52 ASP H H 52 8.160 8.160 8.819 -0.659 17919 6870 1 17 . 1 1 53 53 GLY N N 53 106.660 106.660 108.328 -1.668 17919 6871 1 17 . 1 1 53 53 GLY C C 53 174.870 174.870 173.897 0.973 17919 6872 1 17 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.950 0.220 17919 6873 1 17 . 1 1 53 53 GLY H H 53 9.390 9.390 8.372 1.018 17919 6874 1 17 . 1 1 54 54 ARG N N 54 119.050 119.050 118.822 0.228 17919 6875 1 17 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.570 0.125 17919 6876 1 17 . 1 1 54 54 ARG C C 54 175.350 175.350 174.597 0.753 17919 6877 1 17 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.883 -0.493 17919 6878 1 17 . 1 1 54 54 ARG CB C 54 32.650 32.650 34.145 -1.495 17919 6879 1 17 . 1 1 54 54 ARG H H 54 7.460 7.460 7.629 -0.169 17919 6880 1 17 . 1 1 55 55 THR N N 55 108.400 108.400 112.948 -4.548 17919 6881 1 17 . 1 1 55 55 THR HA H 55 5.240 5.240 5.039 0.201 17919 6882 1 17 . 1 1 55 55 THR C C 55 176.560 176.560 175.965 0.595 17919 6883 1 17 . 1 1 55 55 THR CA C 55 59.690 59.690 60.409 -0.719 17919 6884 1 17 . 1 1 55 55 THR CB C 55 72.260 72.260 70.479 1.781 17919 6885 1 17 . 1 1 55 55 THR H H 55 8.730 8.730 8.556 0.174 17919 6886 1 17 . 1 1 56 56 LEU N N 56 117.920 117.920 121.612 -3.692 17919 6887 1 17 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.132 -0.072 17919 6888 1 17 . 1 1 56 56 LEU C C 56 180.810 180.810 178.993 1.817 17919 6889 1 17 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.008 0.702 17919 6890 1 17 . 1 1 56 56 LEU CB C 56 40.370 40.370 40.904 -0.534 17919 6891 1 17 . 1 1 56 56 LEU H H 56 8.140 8.140 8.470 -0.330 17919 6892 1 17 . 1 1 57 57 SER N N 57 113.330 113.330 116.162 -2.832 17919 6893 1 17 . 1 1 57 57 SER HA H 57 4.370 4.370 4.102 0.268 17919 6894 1 17 . 1 1 57 57 SER C C 57 178.310 178.310 177.139 1.171 17919 6895 1 17 . 1 1 57 57 SER CA C 57 61.080 61.080 62.160 -1.080 17919 6896 1 17 . 1 1 57 57 SER CB C 57 62.530 62.530 62.818 -0.288 17919 6897 1 17 . 1 1 57 57 SER H H 57 8.470 8.470 7.930 0.540 17919 6898 1 17 . 1 1 58 58 ASP N N 58 124.190 124.190 121.773 2.417 17919 6899 1 17 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.454 -0.158 17919 6900 1 17 . 1 1 58 58 ASP C C 58 177.400 177.400 177.995 -0.595 17919 6901 1 17 . 1 1 58 58 ASP CA C 58 57.180 57.180 57.459 -0.279 17919 6902 1 17 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.833 -0.733 17919 6903 1 17 . 1 1 58 58 ASP H H 58 7.930 7.930 8.064 -0.134 17919 6904 1 17 . 1 1 59 59 TYR N N 59 115.510 115.510 116.113 -0.603 17919 6905 1 17 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.637 0.033 17919 6906 1 17 . 1 1 59 59 TYR C C 59 174.700 174.700 174.699 0.001 17919 6907 1 17 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.514 0.736 17919 6908 1 17 . 1 1 59 59 TYR CB C 59 40.070 40.070 37.980 2.090 17919 6909 1 17 . 1 1 59 59 TYR H H 59 7.250 7.250 7.232 0.018 17919 6910 1 17 . 1 1 60 60 ASN N N 60 115.900 115.900 115.468 0.432 17919 6911 1 17 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.372 -0.017 17919 6912 1 17 . 1 1 60 60 ASN C C 60 174.340 174.340 174.642 -0.302 17919 6913 1 17 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.244 -0.124 17919 6914 1 17 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.145 0.265 17919 6915 1 17 . 1 1 60 60 ASN H H 60 8.150 8.150 7.741 0.409 17919 6916 1 17 . 1 1 61 61 ILE N N 61 118.600 118.600 120.500 -1.900 17919 6917 1 17 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.914 -0.521 17919 6918 1 17 . 1 1 61 61 ILE C C 61 174.610 174.610 175.173 -0.563 17919 6919 1 17 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.162 0.258 17919 6920 1 17 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.204 -0.464 17919 6921 1 17 . 1 1 61 61 ILE H H 61 7.250 7.250 8.150 -0.900 17919 6922 1 17 . 1 1 62 62 GLN N N 62 124.740 124.740 125.631 -0.891 17919 6923 1 17 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.789 -0.283 17919 6924 1 17 . 1 1 62 62 GLN C C 62 175.970 175.970 175.592 0.378 17919 6925 1 17 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.008 0.652 17919 6926 1 17 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.793 -0.143 17919 6927 1 17 . 1 1 62 62 GLN H H 62 7.610 7.610 7.980 -0.370 17919 6928 1 17 . 1 1 63 63 LYS N N 63 120.300 120.300 123.773 -3.473 17919 6929 1 17 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.794 0.207 17919 6930 1 17 . 1 1 63 63 LYS C C 63 175.810 175.810 176.539 -0.729 17919 6931 1 17 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.140 -0.350 17919 6932 1 17 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.947 0.703 17919 6933 1 17 . 1 1 63 63 LYS H H 63 8.490 8.490 8.745 -0.256 17919 6934 1 17 . 1 1 64 64 GLU N N 64 113.950 113.950 119.773 -5.823 17919 6935 1 17 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.556 -0.091 17919 6936 1 17 . 1 1 64 64 GLU C C 64 175.250 175.250 175.250 0.000 17919 6937 1 17 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.432 0.458 17919 6938 1 17 . 1 1 64 64 GLU CB C 64 25.900 25.900 27.834 -1.934 17919 6939 1 17 . 1 1 64 64 GLU H H 64 9.280 9.280 8.592 0.688 17919 6940 1 17 . 1 1 65 65 SER N N 65 114.730 114.730 114.723 0.007 17919 6941 1 17 . 1 1 65 65 SER HA H 65 4.640 4.640 4.642 -0.002 17919 6942 1 17 . 1 1 65 65 SER C C 65 172.160 172.160 173.673 -1.513 17919 6943 1 17 . 1 1 65 65 SER CA C 65 60.890 60.890 59.801 1.089 17919 6944 1 17 . 1 1 65 65 SER CB C 65 64.910 64.910 64.200 0.710 17919 6945 1 17 . 1 1 65 65 SER H H 65 7.670 7.670 7.685 -0.015 17919 6946 1 17 . 1 1 66 66 THR N N 66 117.110 117.110 116.159 0.951 17919 6947 1 17 . 1 1 66 66 THR HA H 66 5.270 5.270 4.876 0.394 17919 6948 1 17 . 1 1 66 66 THR C C 66 173.950 173.950 173.412 0.538 17919 6949 1 17 . 1 1 66 66 THR CA C 66 62.340 62.340 62.225 0.115 17919 6950 1 17 . 1 1 66 66 THR CB C 66 70.080 70.080 71.421 -1.341 17919 6951 1 17 . 1 1 66 66 THR H H 66 8.730 8.730 8.540 0.190 17919 6952 1 17 . 1 1 67 67 LEU N N 67 127.110 127.110 125.793 1.317 17919 6953 1 17 . 1 1 67 67 LEU HA H 67 5.060 5.060 5.009 0.051 17919 6954 1 17 . 1 1 67 67 LEU C C 67 175.770 175.770 175.378 0.392 17919 6955 1 17 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.429 0.471 17919 6956 1 17 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.764 -0.504 17919 6957 1 17 . 1 1 67 67 LEU H H 67 9.410 9.410 8.856 0.554 17919 6958 1 17 . 1 1 68 68 HIS N N 68 118.380 118.380 120.934 -2.554 17919 6959 1 17 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.379 -0.139 17919 6960 1 17 . 1 1 68 68 HIS C C 68 173.150 173.150 173.903 -0.753 17919 6961 1 17 . 1 1 68 68 HIS CA C 68 55.000 55.000 55.086 -0.086 17919 6962 1 17 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.894 -2.364 17919 6963 1 17 . 1 1 68 68 HIS H H 68 9.230 9.230 9.018 0.212 17919 6964 1 17 . 1 1 69 69 LEU N N 69 124.460 124.460 126.945 -2.485 17919 6965 1 17 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.195 -0.005 17919 6966 1 17 . 1 1 69 69 LEU C C 69 175.270 175.270 174.346 0.924 17919 6967 1 17 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.371 0.519 17919 6968 1 17 . 1 1 69 69 LEU CB C 69 44.380 44.380 45.157 -0.777 17919 6969 1 17 . 1 1 69 69 LEU H H 69 8.340 8.340 7.858 0.482 17919 6970 1 17 . 1 1 70 70 VAL N N 70 126.940 126.940 121.093 5.847 17919 6971 1 17 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.576 -0.226 17919 6972 1 17 . 1 1 70 70 VAL C C 70 174.000 174.000 174.181 -0.181 17919 6973 1 17 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.406 1.394 17919 6974 1 17 . 1 1 70 70 VAL CB C 70 34.910 34.910 34.975 -0.065 17919 6975 1 17 . 1 1 70 70 VAL H H 70 9.200 9.200 8.411 0.789 17919 6976 1 17 . 1 1 71 71 LEU N N 71 123.130 123.130 121.688 1.442 17919 6977 1 17 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.620 0.440 17919 6978 1 17 . 1 1 71 71 LEU C C 71 177.830 177.830 176.298 1.532 17919 6979 1 17 . 1 1 71 71 LEU CA C 71 53.940 53.940 54.067 -0.127 17919 6980 1 17 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.865 -0.015 17919 6981 1 17 . 1 1 71 71 LEU H H 71 8.120 8.120 8.186 -0.066 17919 6982 1 17 . 1 1 72 72 ARG N N 72 123.490 123.490 126.383 -2.893 17919 6983 1 17 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.681 -0.380 17919 6984 1 17 . 1 1 72 72 ARG C C 72 175.350 175.350 173.987 1.363 17919 6985 1 17 . 1 1 72 72 ARG CA C 72 55.610 55.610 54.999 0.611 17919 6986 1 17 . 1 1 72 72 ARG CB C 72 31.350 31.350 31.870 -0.520 17919 6987 1 17 . 1 1 72 72 ARG H H 72 8.580 8.580 8.495 0.085 17919 6988 1 18 . 1 1 2 2 GLN N N 2 123.220 123.220 117.673 5.547 17919 6989 1 18 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.151 0.098 17919 6990 1 18 . 1 1 2 2 GLN C C 2 175.920 175.920 174.228 1.692 17919 6991 1 18 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.518 0.562 17919 6992 1 18 . 1 1 2 2 GLN CB C 2 30.760 30.760 32.406 -1.646 17919 6993 1 18 . 1 1 2 2 GLN H H 2 8.900 8.900 8.134 0.766 17919 6994 1 18 . 1 1 3 3 ILE N N 3 115.340 115.340 114.568 0.772 17919 6995 1 18 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.229 -0.016 17919 6996 1 18 . 1 1 3 3 ILE C C 3 172.450 172.450 173.757 -1.307 17919 6997 1 18 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.505 0.065 17919 6998 1 18 . 1 1 3 3 ILE CB C 3 42.210 42.210 40.978 1.232 17919 6999 1 18 . 1 1 3 3 ILE H H 3 8.320 8.320 8.631 -0.311 17919 7000 1 18 . 1 1 4 4 PHE N N 4 118.110 118.110 118.147 -0.037 17919 7001 1 18 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.338 0.292 17919 7002 1 18 . 1 1 4 4 PHE C C 4 175.320 175.320 175.710 -0.390 17919 7003 1 18 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.241 -0.031 17919 7004 1 18 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.587 -0.107 17919 7005 1 18 . 1 1 4 4 PHE H H 4 8.610 8.610 8.388 0.222 17919 7006 1 18 . 1 1 5 5 VAL N N 5 121.000 121.000 120.533 0.467 17919 7007 1 18 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.727 -0.002 17919 7008 1 18 . 1 1 5 5 VAL C C 5 174.870 174.870 174.542 0.328 17919 7009 1 18 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.310 -0.690 17919 7010 1 18 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.208 0.022 17919 7011 1 18 . 1 1 5 5 VAL H H 5 9.300 9.300 8.383 0.917 17919 7012 1 18 . 1 1 6 6 LYS N N 6 127.520 127.520 129.104 -1.584 17919 7013 1 18 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.285 0.082 17919 7014 1 18 . 1 1 6 6 LYS C C 6 177.140 177.140 176.173 0.967 17919 7015 1 18 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.635 -0.115 17919 7016 1 18 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.371 -0.321 17919 7017 1 18 . 1 1 6 6 LYS H H 6 8.820 8.820 9.047 -0.227 17919 7018 1 18 . 1 1 7 7 THR N N 7 115.400 115.400 117.461 -2.061 17919 7019 1 18 . 1 1 7 7 THR HA H 7 4.970 4.970 4.582 0.388 17919 7020 1 18 . 1 1 7 7 THR C C 7 176.910 176.910 175.874 1.036 17919 7021 1 18 . 1 1 7 7 THR CA C 7 60.470 60.470 60.080 0.390 17919 7022 1 18 . 1 1 7 7 THR CB C 7 70.630 70.630 70.844 -0.214 17919 7023 1 18 . 1 1 7 7 THR H H 7 8.730 8.730 8.754 -0.024 17919 7024 1 18 . 1 1 8 8 LEU N N 8 121.330 121.330 123.945 -2.615 17919 7025 1 18 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.419 -0.109 17919 7026 1 18 . 1 1 8 8 LEU C C 8 178.800 178.800 177.956 0.844 17919 7027 1 18 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.697 -0.117 17919 7028 1 18 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.087 -0.117 17919 7029 1 18 . 1 1 8 8 LEU H H 8 9.100 9.100 8.992 0.108 17919 7030 1 18 . 1 1 9 9 THR N N 9 105.590 105.590 108.888 -3.298 17919 7031 1 18 . 1 1 9 9 THR HA H 9 4.428 4.428 4.327 0.101 17919 7032 1 18 . 1 1 9 9 THR C C 9 175.520 175.520 175.650 -0.130 17919 7033 1 18 . 1 1 9 9 THR CA C 9 61.400 61.400 62.185 -0.785 17919 7034 1 18 . 1 1 9 9 THR CB C 9 69.140 69.140 69.617 -0.477 17919 7035 1 18 . 1 1 9 9 THR H H 9 7.630 7.630 8.107 -0.477 17919 7036 1 18 . 1 1 10 10 GLY N N 10 108.890 108.890 110.777 -1.887 17919 7037 1 18 . 1 1 10 10 GLY C C 10 174.070 174.070 173.502 0.568 17919 7038 1 18 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.564 0.896 17919 7039 1 18 . 1 1 10 10 GLY H H 10 7.810 7.810 7.753 0.057 17919 7040 1 18 . 1 1 11 11 LYS N N 11 121.600 121.600 122.408 -0.808 17919 7041 1 18 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.406 -0.045 17919 7042 1 18 . 1 1 11 11 LYS C C 11 175.940 175.940 175.564 0.376 17919 7043 1 18 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.086 0.195 17919 7044 1 18 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.375 -0.175 17919 7045 1 18 . 1 1 11 11 LYS H H 11 7.280 7.280 7.644 -0.364 17919 7046 1 18 . 1 1 12 12 THR N N 12 120.440 120.440 122.077 -1.637 17919 7047 1 18 . 1 1 12 12 THR HA H 12 5.046 5.046 5.359 -0.313 17919 7048 1 18 . 1 1 12 12 THR C C 12 174.320 174.320 173.969 0.351 17919 7049 1 18 . 1 1 12 12 THR CA C 12 62.390 62.390 60.990 1.400 17919 7050 1 18 . 1 1 12 12 THR CB C 12 69.910 69.910 69.960 -0.050 17919 7051 1 18 . 1 1 12 12 THR H H 12 8.650 8.650 8.365 0.285 17919 7052 1 18 . 1 1 13 13 ILE N N 13 127.110 127.110 123.087 4.023 17919 7053 1 18 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.683 -0.139 17919 7054 1 18 . 1 1 13 13 ILE C C 13 175.220 175.220 174.798 0.422 17919 7055 1 18 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.270 0.709 17919 7056 1 18 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.193 -0.242 17919 7057 1 18 . 1 1 13 13 ILE H H 13 9.450 9.450 8.753 0.697 17919 7058 1 18 . 1 1 14 14 THR N N 14 121.520 121.520 119.682 1.838 17919 7059 1 18 . 1 1 14 14 THR HA H 14 4.964 4.964 4.872 0.092 17919 7060 1 18 . 1 1 14 14 THR C C 14 173.790 173.790 174.176 -0.386 17919 7061 1 18 . 1 1 14 14 THR CA C 14 61.940 61.940 62.393 -0.453 17919 7062 1 18 . 1 1 14 14 THR CB C 14 69.650 69.650 69.777 -0.127 17919 7063 1 18 . 1 1 14 14 THR H H 14 8.710 8.710 8.335 0.375 17919 7064 1 18 . 1 1 15 15 LEU N N 15 124.800 124.800 126.169 -1.369 17919 7065 1 18 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.719 0.061 17919 7066 1 18 . 1 1 15 15 LEU C C 15 174.670 174.670 175.237 -0.567 17919 7067 1 18 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.878 -1.048 17919 7068 1 18 . 1 1 15 15 LEU CB C 15 47.070 47.070 44.794 2.276 17919 7069 1 18 . 1 1 15 15 LEU H H 15 8.710 8.710 8.485 0.225 17919 7070 1 18 . 1 1 16 16 GLU N N 16 122.160 122.160 124.069 -1.909 17919 7071 1 18 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.846 0.071 17919 7072 1 18 . 1 1 16 16 GLU C C 16 175.860 175.860 175.244 0.616 17919 7073 1 18 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.145 -0.325 17919 7074 1 18 . 1 1 16 16 GLU CB C 16 29.450 29.450 31.232 -1.782 17919 7075 1 18 . 1 1 16 16 GLU H H 16 8.140 8.140 8.716 -0.576 17919 7076 1 18 . 1 1 17 17 VAL N N 17 117.210 117.210 120.682 -3.472 17919 7077 1 18 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.271 0.443 17919 7078 1 18 . 1 1 17 17 VAL C C 17 174.160 174.160 174.220 -0.060 17919 7079 1 18 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.508 -1.078 17919 7080 1 18 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.244 1.156 17919 7081 1 18 . 1 1 17 17 VAL H H 17 8.900 8.900 8.091 0.809 17919 7082 1 18 . 1 1 18 18 GLU N N 18 118.990 118.990 119.690 -0.700 17919 7083 1 18 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.784 0.295 17919 7084 1 18 . 1 1 18 18 GLU C C 18 176.160 176.160 175.793 0.367 17919 7085 1 18 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.870 -1.150 17919 7086 1 18 . 1 1 18 18 GLU CB C 18 30.310 30.310 31.102 -0.791 17919 7087 1 18 . 1 1 18 18 GLU H H 18 8.640 8.640 8.477 0.163 17919 7088 1 18 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.253 -0.112 17919 7089 1 18 . 1 1 19 19 PRO C C 19 175.310 175.310 178.045 -2.735 17919 7090 1 18 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.459 0.011 17919 7091 1 18 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.892 0.058 17919 7092 1 18 . 1 1 20 20 SER N N 20 103.400 103.400 110.612 -7.212 17919 7093 1 18 . 1 1 20 20 SER HA H 20 4.370 4.370 4.325 0.045 17919 7094 1 18 . 1 1 20 20 SER C C 20 174.660 174.660 174.735 -0.075 17919 7095 1 18 . 1 1 20 20 SER CA C 20 57.400 57.400 58.727 -1.327 17919 7096 1 18 . 1 1 20 20 SER CB C 20 63.370 63.370 63.039 0.331 17919 7097 1 18 . 1 1 20 20 SER H H 20 7.040 7.040 7.920 -0.880 17919 7098 1 18 . 1 1 21 21 ASP N N 21 123.480 123.480 124.636 -1.156 17919 7099 1 18 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.628 0.067 17919 7100 1 18 . 1 1 21 21 ASP C C 21 176.360 176.360 176.422 -0.062 17919 7101 1 18 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.095 0.605 17919 7102 1 18 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.504 -0.704 17919 7103 1 18 . 1 1 21 21 ASP H H 21 8.030 8.030 7.927 0.103 17919 7104 1 18 . 1 1 22 22 THR N N 22 108.800 108.800 116.103 -7.303 17919 7105 1 18 . 1 1 22 22 THR HA H 22 4.920 4.920 4.464 0.456 17919 7106 1 18 . 1 1 22 22 THR C C 22 176.750 176.750 176.374 0.376 17919 7107 1 18 . 1 1 22 22 THR CA C 22 59.690 59.690 62.264 -2.574 17919 7108 1 18 . 1 1 22 22 THR CB C 22 71.200 71.200 69.784 1.416 17919 7109 1 18 . 1 1 22 22 THR H H 22 7.900 7.900 8.230 -0.330 17919 7110 1 18 . 1 1 23 23 ILE N N 23 121.190 121.190 122.952 -1.762 17919 7111 1 18 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.681 -0.024 17919 7112 1 18 . 1 1 23 23 ILE C C 23 179.040 179.040 177.619 1.421 17919 7113 1 18 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.423 -1.163 17919 7114 1 18 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.115 -1.765 17919 7115 1 18 . 1 1 23 23 ILE H H 23 8.560 8.560 9.105 -0.545 17919 7116 1 18 . 1 1 24 24 GLU N N 24 120.830 120.830 120.064 0.766 17919 7117 1 18 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.973 -0.056 17919 7118 1 18 . 1 1 24 24 GLU C C 24 178.640 178.640 178.192 0.448 17919 7119 1 18 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.854 0.366 17919 7120 1 18 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.477 -1.197 17919 7121 1 18 . 1 1 24 24 GLU H H 24 9.760 9.760 7.961 1.799 17919 7122 1 18 . 1 1 25 25 ASN N N 25 120.570 120.570 118.017 2.553 17919 7123 1 18 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.477 0.048 17919 7124 1 18 . 1 1 25 25 ASN C C 25 178.380 178.380 177.811 0.569 17919 7125 1 18 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.708 0.352 17919 7126 1 18 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.485 -0.035 17919 7127 1 18 . 1 1 25 25 ASN H H 25 7.920 7.920 7.631 0.289 17919 7128 1 18 . 1 1 26 26 VAL N N 26 121.710 121.710 120.778 0.932 17919 7129 1 18 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.571 -0.174 17919 7130 1 18 . 1 1 26 26 VAL C C 26 177.950 177.950 177.415 0.535 17919 7131 1 18 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.749 0.911 17919 7132 1 18 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.350 -0.510 17919 7133 1 18 . 1 1 26 26 VAL H H 26 8.070 8.070 8.054 0.016 17919 7134 1 18 . 1 1 27 27 LYS N N 27 118.860 118.860 119.920 -1.060 17919 7135 1 18 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.180 0.400 17919 7136 1 18 . 1 1 27 27 LYS C C 27 180.550 180.550 178.993 1.557 17919 7137 1 18 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.566 -0.316 17919 7138 1 18 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.209 1.521 17919 7139 1 18 . 1 1 27 27 LYS H H 27 8.560 8.560 8.017 0.543 17919 7140 1 18 . 1 1 28 28 ALA N N 28 123.440 123.440 120.020 3.420 17919 7141 1 18 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.188 -0.028 17919 7142 1 18 . 1 1 28 28 ALA C C 28 180.300 180.300 179.215 1.085 17919 7143 1 18 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.632 0.738 17919 7144 1 18 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.364 -0.654 17919 7145 1 18 . 1 1 28 28 ALA H H 28 8.060 8.060 8.167 -0.107 17919 7146 1 18 . 1 1 29 29 LYS N N 29 119.940 119.940 119.536 0.404 17919 7147 1 18 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.149 0.058 17919 7148 1 18 . 1 1 29 29 LYS C C 29 180.320 180.320 178.950 1.370 17919 7149 1 18 . 1 1 29 29 LYS CA C 29 59.650 59.650 58.842 0.808 17919 7150 1 18 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.453 0.837 17919 7151 1 18 . 1 1 29 29 LYS H H 29 7.850 7.850 7.726 0.124 17919 7152 1 18 . 1 1 30 30 ILE N N 30 121.080 121.080 120.586 0.494 17919 7153 1 18 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.608 -0.101 17919 7154 1 18 . 1 1 30 30 ILE C C 30 178.310 178.310 177.600 0.710 17919 7155 1 18 . 1 1 30 30 ILE CA C 30 66.150 66.150 64.773 1.377 17919 7156 1 18 . 1 1 30 30 ILE CB C 30 36.800 36.800 36.504 0.296 17919 7157 1 18 . 1 1 30 30 ILE H H 30 8.280 8.280 8.457 -0.177 17919 7158 1 18 . 1 1 31 31 GLN N N 31 123.490 123.490 119.563 3.927 17919 7159 1 18 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.971 -0.142 17919 7160 1 18 . 1 1 31 31 GLN C C 31 178.890 178.890 178.302 0.588 17919 7161 1 18 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.141 0.859 17919 7162 1 18 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.527 -0.807 17919 7163 1 18 . 1 1 31 31 GLN H H 31 8.580 8.580 7.877 0.703 17919 7164 1 18 . 1 1 32 32 ASP N N 32 119.360 119.360 118.935 0.425 17919 7165 1 18 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.425 -0.071 17919 7166 1 18 . 1 1 32 32 ASP C C 32 177.250 177.250 177.938 -0.688 17919 7167 1 18 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.560 0.629 17919 7168 1 18 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.730 -0.150 17919 7169 1 18 . 1 1 32 32 ASP H H 32 8.010 8.010 7.725 0.285 17919 7170 1 18 . 1 1 33 33 LYS N N 33 115.130 115.130 118.967 -3.837 17919 7171 1 18 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.257 0.080 17919 7172 1 18 . 1 1 33 33 LYS C C 33 177.870 177.870 178.419 -0.549 17919 7173 1 18 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.221 -0.171 17919 7174 1 18 . 1 1 33 33 LYS CB C 33 34.170 34.170 32.887 1.283 17919 7175 1 18 . 1 1 33 33 LYS H H 33 7.430 7.430 7.596 -0.166 17919 7176 1 18 . 1 1 34 34 GLU N N 34 113.870 113.870 113.922 -0.052 17919 7177 1 18 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.511 0.114 17919 7178 1 18 . 1 1 34 34 GLU C C 34 177.840 177.840 177.391 0.449 17919 7179 1 18 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.710 -0.540 17919 7180 1 18 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.682 0.978 17919 7181 1 18 . 1 1 34 34 GLU H H 34 8.740 8.740 8.201 0.539 17919 7182 1 18 . 1 1 35 35 GLY N N 35 108.650 108.650 109.455 -0.805 17919 7183 1 18 . 1 1 35 35 GLY C C 35 173.960 173.960 174.455 -0.495 17919 7184 1 18 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.885 0.195 17919 7185 1 18 . 1 1 35 35 GLY H H 35 8.530 8.530 8.213 0.317 17919 7186 1 18 . 1 1 36 36 ILE N N 36 119.880 119.880 121.575 -1.695 17919 7187 1 18 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.296 0.149 17919 7188 1 18 . 1 1 36 36 ILE C C 36 173.590 173.590 173.989 -0.399 17919 7189 1 18 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.033 -0.283 17919 7190 1 18 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.198 2.382 17919 7191 1 18 . 1 1 36 36 ILE H H 36 6.150 6.150 7.641 -1.491 17919 7192 1 18 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.618 0.016 17919 7193 1 18 . 1 1 37 37 PRO C C 37 176.940 176.940 176.273 0.667 17919 7194 1 18 . 1 1 37 37 PRO CA C 37 61.660 61.660 62.098 -0.438 17919 7195 1 18 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.306 0.544 17919 7196 1 18 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.066 0.051 17919 7197 1 18 . 1 1 38 38 PRO C C 38 178.320 178.320 178.578 -0.258 17919 7198 1 18 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.959 0.301 17919 7199 1 18 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.783 1.107 17919 7200 1 18 . 1 1 39 39 ASP N N 39 113.380 113.380 115.574 -2.194 17919 7201 1 18 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.360 0.070 17919 7202 1 18 . 1 1 39 39 ASP C C 39 177.090 177.090 177.980 -0.890 17919 7203 1 18 . 1 1 39 39 ASP CA C 39 55.640 55.640 57.176 -1.536 17919 7204 1 18 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.316 -0.776 17919 7205 1 18 . 1 1 39 39 ASP H H 39 8.550 8.550 8.775 -0.225 17919 7206 1 18 . 1 1 40 40 GLN N N 40 116.780 116.780 117.046 -0.266 17919 7207 1 18 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.649 -0.185 17919 7208 1 18 . 1 1 40 40 GLN C C 40 175.380 175.380 176.246 -0.866 17919 7209 1 18 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.184 -0.544 17919 7210 1 18 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.731 0.409 17919 7211 1 18 . 1 1 40 40 GLN H H 40 7.820 7.820 7.574 0.246 17919 7212 1 18 . 1 1 41 41 GLN N N 41 117.720 117.720 120.072 -2.352 17919 7213 1 18 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.368 -0.124 17919 7214 1 18 . 1 1 41 41 GLN C C 41 176.300 176.300 175.123 1.177 17919 7215 1 18 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.292 0.178 17919 7216 1 18 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.430 2.220 17919 7217 1 18 . 1 1 41 41 GLN H H 41 7.480 7.480 7.446 0.034 17919 7218 1 18 . 1 1 42 42 ARG N N 42 122.680 122.680 123.841 -1.161 17919 7219 1 18 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.552 -0.052 17919 7220 1 18 . 1 1 42 42 ARG C C 42 174.050 174.050 174.853 -0.803 17919 7221 1 18 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.098 -0.048 17919 7222 1 18 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.189 -0.439 17919 7223 1 18 . 1 1 42 42 ARG H H 42 8.530 8.530 8.285 0.245 17919 7224 1 18 . 1 1 43 43 LEU N N 43 124.040 124.040 125.409 -1.369 17919 7225 1 18 . 1 1 43 43 LEU C C 43 175.290 175.290 176.030 -0.740 17919 7226 1 18 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.755 -0.775 17919 7227 1 18 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.682 2.108 17919 7228 1 18 . 1 1 43 43 LEU H H 43 8.820 8.820 8.767 0.053 17919 7229 1 18 . 1 1 44 44 ILE N N 44 121.920 121.920 122.013 -0.093 17919 7230 1 18 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.003 -0.011 17919 7231 1 18 . 1 1 44 44 ILE C C 44 176.060 176.060 174.464 1.596 17919 7232 1 18 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.429 -1.449 17919 7233 1 18 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.526 -0.106 17919 7234 1 18 . 1 1 44 44 ILE H H 44 9.030 9.030 8.732 0.298 17919 7235 1 18 . 1 1 45 45 PHE N N 45 125.390 125.390 127.826 -2.436 17919 7236 1 18 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.054 -0.009 17919 7237 1 18 . 1 1 45 45 PHE C C 45 174.470 174.470 174.684 -0.214 17919 7238 1 18 . 1 1 45 45 PHE CA C 45 57.020 57.020 55.425 1.595 17919 7239 1 18 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.059 0.701 17919 7240 1 18 . 1 1 45 45 PHE H H 45 8.830 8.830 9.061 -0.231 17919 7241 1 18 . 1 1 46 46 ALA N N 46 132.200 132.200 129.158 3.042 17919 7242 1 18 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.636 0.054 17919 7243 1 18 . 1 1 46 46 ALA C C 46 177.290 177.290 177.804 -0.514 17919 7244 1 18 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.569 -0.029 17919 7245 1 18 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.373 0.197 17919 7246 1 18 . 1 1 46 46 ALA H H 46 8.810 8.810 9.011 -0.201 17919 7247 1 18 . 1 1 47 47 GLY N N 47 102.340 102.340 104.396 -2.056 17919 7248 1 18 . 1 1 47 47 GLY C C 47 173.810 173.810 174.493 -0.683 17919 7249 1 18 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.013 0.337 17919 7250 1 18 . 1 1 47 47 GLY H H 47 8.130 8.130 8.466 -0.336 17919 7251 1 18 . 1 1 48 48 LYS N N 48 121.570 121.570 121.719 -0.149 17919 7252 1 18 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.512 0.110 17919 7253 1 18 . 1 1 48 48 LYS C C 48 174.700 174.700 175.732 -1.032 17919 7254 1 18 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.229 -0.679 17919 7255 1 18 . 1 1 48 48 LYS CB C 48 34.530 34.530 33.565 0.965 17919 7256 1 18 . 1 1 48 48 LYS H H 48 7.980 7.980 7.857 0.123 17919 7257 1 18 . 1 1 49 49 GLN N N 49 122.410 122.410 124.247 -1.837 17919 7258 1 18 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.361 0.199 17919 7259 1 18 . 1 1 49 49 GLN C C 49 175.670 175.670 175.412 0.258 17919 7260 1 18 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.640 -0.900 17919 7261 1 18 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.471 -0.471 17919 7262 1 18 . 1 1 49 49 GLN H H 49 8.600 8.600 8.585 0.015 17919 7263 1 18 . 1 1 50 50 LEU N N 50 125.520 125.520 125.026 0.494 17919 7264 1 18 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.354 -0.264 17919 7265 1 18 . 1 1 50 50 LEU C C 50 176.660 176.660 176.497 0.163 17919 7266 1 18 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.673 0.567 17919 7267 1 18 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.900 -1.330 17919 7268 1 18 . 1 1 50 50 LEU H H 50 8.530 8.530 8.512 0.018 17919 7269 1 18 . 1 1 51 51 GLU N N 51 122.940 122.940 123.118 -0.178 17919 7270 1 18 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.399 0.089 17919 7271 1 18 . 1 1 51 51 GLU C C 51 175.870 175.870 177.395 -1.525 17919 7272 1 18 . 1 1 51 51 GLU CA C 51 55.960 55.960 56.290 -0.330 17919 7273 1 18 . 1 1 51 51 GLU CB C 51 31.570 31.570 30.471 1.099 17919 7274 1 18 . 1 1 51 51 GLU H H 51 8.400 8.400 9.167 -0.767 17919 7275 1 18 . 1 1 52 52 ASP N N 52 120.030 120.030 124.234 -4.204 17919 7276 1 18 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.401 -0.042 17919 7277 1 18 . 1 1 52 52 ASP C C 52 177.330 177.330 177.968 -0.638 17919 7278 1 18 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.029 -0.069 17919 7279 1 18 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.546 0.304 17919 7280 1 18 . 1 1 52 52 ASP H H 52 8.160 8.160 8.793 -0.633 17919 7281 1 18 . 1 1 53 53 GLY N N 53 106.660 106.660 105.899 0.761 17919 7282 1 18 . 1 1 53 53 GLY C C 53 174.870 174.870 174.620 0.250 17919 7283 1 18 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.124 0.046 17919 7284 1 18 . 1 1 53 53 GLY H H 53 9.390 9.390 8.468 0.922 17919 7285 1 18 . 1 1 54 54 ARG N N 54 119.050 119.050 120.970 -1.920 17919 7286 1 18 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.873 -0.178 17919 7287 1 18 . 1 1 54 54 ARG C C 54 175.350 175.350 175.831 -0.481 17919 7288 1 18 . 1 1 54 54 ARG CA C 54 54.390 54.390 52.418 1.972 17919 7289 1 18 . 1 1 54 54 ARG CB C 54 32.650 32.650 31.472 1.178 17919 7290 1 18 . 1 1 54 54 ARG H H 54 7.460 7.460 7.495 -0.035 17919 7291 1 18 . 1 1 55 55 THR N N 55 108.400 108.400 112.426 -4.026 17919 7292 1 18 . 1 1 55 55 THR HA H 55 5.240 5.240 4.946 0.294 17919 7293 1 18 . 1 1 55 55 THR C C 55 176.560 176.560 176.469 0.091 17919 7294 1 18 . 1 1 55 55 THR CA C 55 59.690 59.690 60.615 -0.925 17919 7295 1 18 . 1 1 55 55 THR CB C 55 72.260 72.260 70.954 1.306 17919 7296 1 18 . 1 1 55 55 THR H H 55 8.730 8.730 8.930 -0.200 17919 7297 1 18 . 1 1 56 56 LEU N N 56 117.920 117.920 121.724 -3.804 17919 7298 1 18 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.837 0.223 17919 7299 1 18 . 1 1 56 56 LEU C C 56 180.810 180.810 178.973 1.837 17919 7300 1 18 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.681 0.029 17919 7301 1 18 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.431 -1.061 17919 7302 1 18 . 1 1 56 56 LEU H H 56 8.140 8.140 8.280 -0.140 17919 7303 1 18 . 1 1 57 57 SER N N 57 113.330 113.330 114.175 -0.845 17919 7304 1 18 . 1 1 57 57 SER HA H 57 4.370 4.370 4.134 0.236 17919 7305 1 18 . 1 1 57 57 SER C C 57 178.310 178.310 176.886 1.424 17919 7306 1 18 . 1 1 57 57 SER CA C 57 61.080 61.080 62.114 -1.034 17919 7307 1 18 . 1 1 57 57 SER CB C 57 62.530 62.530 62.844 -0.314 17919 7308 1 18 . 1 1 57 57 SER H H 57 8.470 8.470 7.792 0.678 17919 7309 1 18 . 1 1 58 58 ASP N N 58 124.190 124.190 122.742 1.448 17919 7310 1 18 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.353 -0.057 17919 7311 1 18 . 1 1 58 58 ASP C C 58 177.400 177.400 177.571 -0.171 17919 7312 1 18 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.805 0.375 17919 7313 1 18 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.467 -0.367 17919 7314 1 18 . 1 1 58 58 ASP H H 58 7.930 7.930 7.781 0.149 17919 7315 1 18 . 1 1 59 59 TYR N N 59 115.510 115.510 116.124 -0.614 17919 7316 1 18 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.614 0.056 17919 7317 1 18 . 1 1 59 59 TYR C C 59 174.700 174.700 175.823 -1.123 17919 7318 1 18 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.445 0.805 17919 7319 1 18 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.194 1.876 17919 7320 1 18 . 1 1 59 59 TYR H H 59 7.250 7.250 7.323 -0.073 17919 7321 1 18 . 1 1 60 60 ASN N N 60 115.900 115.900 115.533 0.367 17919 7322 1 18 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.409 -0.054 17919 7323 1 18 . 1 1 60 60 ASN C C 60 174.340 174.340 174.362 -0.022 17919 7324 1 18 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.551 -0.431 17919 7325 1 18 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.812 -0.402 17919 7326 1 18 . 1 1 60 60 ASN H H 60 8.150 8.150 7.952 0.198 17919 7327 1 18 . 1 1 61 61 ILE N N 61 118.600 118.600 121.116 -2.516 17919 7328 1 18 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.744 -0.351 17919 7329 1 18 . 1 1 61 61 ILE C C 61 174.610 174.610 174.712 -0.102 17919 7330 1 18 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.026 0.394 17919 7331 1 18 . 1 1 61 61 ILE CB C 61 36.740 36.740 36.893 -0.153 17919 7332 1 18 . 1 1 61 61 ILE H H 61 7.250 7.250 8.241 -0.991 17919 7333 1 18 . 1 1 62 62 GLN N N 62 124.740 124.740 125.866 -1.126 17919 7334 1 18 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.683 -0.177 17919 7335 1 18 . 1 1 62 62 GLN C C 62 175.970 175.970 176.131 -0.161 17919 7336 1 18 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.076 0.584 17919 7337 1 18 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.879 -0.229 17919 7338 1 18 . 1 1 62 62 GLN H H 62 7.610 7.610 7.873 -0.263 17919 7339 1 18 . 1 1 63 63 LYS N N 63 120.300 120.300 120.594 -0.294 17919 7340 1 18 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.092 -0.091 17919 7341 1 18 . 1 1 63 63 LYS C C 63 175.810 175.810 177.391 -1.581 17919 7342 1 18 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.395 0.396 17919 7343 1 18 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.071 0.579 17919 7344 1 18 . 1 1 63 63 LYS H H 63 8.490 8.490 8.580 -0.090 17919 7345 1 18 . 1 1 64 64 GLU N N 64 113.950 113.950 118.457 -4.507 17919 7346 1 18 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.339 0.126 17919 7347 1 18 . 1 1 64 64 GLU C C 64 175.250 175.250 175.139 0.111 17919 7348 1 18 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.581 0.309 17919 7349 1 18 . 1 1 64 64 GLU CB C 64 25.900 25.900 27.882 -1.982 17919 7350 1 18 . 1 1 64 64 GLU H H 64 9.280 9.280 8.270 1.010 17919 7351 1 18 . 1 1 65 65 SER N N 65 114.730 114.730 115.507 -0.777 17919 7352 1 18 . 1 1 65 65 SER HA H 65 4.640 4.640 4.662 -0.022 17919 7353 1 18 . 1 1 65 65 SER C C 65 172.160 172.160 173.964 -1.804 17919 7354 1 18 . 1 1 65 65 SER CA C 65 60.890 60.890 58.877 2.013 17919 7355 1 18 . 1 1 65 65 SER CB C 65 64.910 64.910 64.450 0.460 17919 7356 1 18 . 1 1 65 65 SER H H 65 7.670 7.670 7.457 0.213 17919 7357 1 18 . 1 1 66 66 THR N N 66 117.110 117.110 118.932 -1.822 17919 7358 1 18 . 1 1 66 66 THR HA H 66 5.270 5.270 5.262 0.008 17919 7359 1 18 . 1 1 66 66 THR C C 66 173.950 173.950 174.173 -0.223 17919 7360 1 18 . 1 1 66 66 THR CA C 66 62.340 62.340 62.105 0.235 17919 7361 1 18 . 1 1 66 66 THR CB C 66 70.080 70.080 70.458 -0.378 17919 7362 1 18 . 1 1 66 66 THR H H 66 8.730 8.730 8.534 0.196 17919 7363 1 18 . 1 1 67 67 LEU N N 67 127.110 127.110 127.179 -0.069 17919 7364 1 18 . 1 1 67 67 LEU HA H 67 5.060 5.060 5.213 -0.152 17919 7365 1 18 . 1 1 67 67 LEU C C 67 175.770 175.770 175.587 0.183 17919 7366 1 18 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.769 0.131 17919 7367 1 18 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.863 -0.603 17919 7368 1 18 . 1 1 67 67 LEU H H 67 9.410 9.410 9.017 0.393 17919 7369 1 18 . 1 1 68 68 HIS N N 68 118.380 118.380 119.929 -1.549 17919 7370 1 18 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.651 -0.411 17919 7371 1 18 . 1 1 68 68 HIS C C 68 173.150 173.150 173.857 -0.707 17919 7372 1 18 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.316 0.684 17919 7373 1 18 . 1 1 68 68 HIS CB C 68 30.530 30.530 33.413 -2.882 17919 7374 1 18 . 1 1 68 68 HIS H H 68 9.230 9.230 8.877 0.353 17919 7375 1 18 . 1 1 69 69 LEU N N 69 124.460 124.460 124.618 -0.158 17919 7376 1 18 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.451 -0.261 17919 7377 1 18 . 1 1 69 69 LEU C C 69 175.270 175.270 174.212 1.058 17919 7378 1 18 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.516 0.374 17919 7379 1 18 . 1 1 69 69 LEU CB C 69 44.380 44.380 45.054 -0.674 17919 7380 1 18 . 1 1 69 69 LEU H H 69 8.340 8.340 7.391 0.949 17919 7381 1 18 . 1 1 70 70 VAL N N 70 126.940 126.940 125.340 1.600 17919 7382 1 18 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.471 -0.121 17919 7383 1 18 . 1 1 70 70 VAL C C 70 174.000 174.000 174.269 -0.269 17919 7384 1 18 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.161 0.639 17919 7385 1 18 . 1 1 70 70 VAL CB C 70 34.910 34.910 34.752 0.158 17919 7386 1 18 . 1 1 70 70 VAL H H 70 9.200 9.200 8.082 1.118 17919 7387 1 18 . 1 1 71 71 LEU N N 71 123.130 123.130 123.758 -0.628 17919 7388 1 18 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.357 -0.297 17919 7389 1 18 . 1 1 71 71 LEU C C 71 177.830 177.830 176.097 1.733 17919 7390 1 18 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.602 0.338 17919 7391 1 18 . 1 1 71 71 LEU CB C 71 42.850 42.850 44.394 -1.544 17919 7392 1 18 . 1 1 71 71 LEU H H 71 8.120 8.120 8.486 -0.366 17919 7393 1 18 . 1 1 72 72 ARG N N 72 123.490 123.490 128.289 -4.799 17919 7394 1 18 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.667 -0.366 17919 7395 1 18 . 1 1 72 72 ARG C C 72 175.350 175.350 174.657 0.693 17919 7396 1 18 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.414 0.195 17919 7397 1 18 . 1 1 72 72 ARG CB C 72 31.350 31.350 31.365 -0.015 17919 7398 1 18 . 1 1 72 72 ARG H H 72 8.580 8.580 8.411 0.169 17919 7399 1 19 . 1 1 2 2 GLN N N 2 123.220 123.220 121.821 1.399 17919 7400 1 19 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.155 0.094 17919 7401 1 19 . 1 1 2 2 GLN C C 2 175.920 175.920 175.892 0.028 17919 7402 1 19 . 1 1 2 2 GLN CA C 2 55.080 55.080 56.120 -1.040 17919 7403 1 19 . 1 1 2 2 GLN CB C 2 30.760 30.760 29.024 1.736 17919 7404 1 19 . 1 1 2 2 GLN H H 2 8.900 8.900 8.723 0.177 17919 7405 1 19 . 1 1 3 3 ILE N N 3 115.340 115.340 115.809 -0.469 17919 7406 1 19 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.269 -0.056 17919 7407 1 19 . 1 1 3 3 ILE C C 3 172.450 172.450 173.668 -1.218 17919 7408 1 19 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.203 0.367 17919 7409 1 19 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.512 0.698 17919 7410 1 19 . 1 1 3 3 ILE H H 3 8.320 8.320 7.977 0.343 17919 7411 1 19 . 1 1 4 4 PHE N N 4 118.110 118.110 120.264 -2.154 17919 7412 1 19 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.276 0.354 17919 7413 1 19 . 1 1 4 4 PHE C C 4 175.320 175.320 174.926 0.394 17919 7414 1 19 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.184 0.026 17919 7415 1 19 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.839 -0.359 17919 7416 1 19 . 1 1 4 4 PHE H H 4 8.610 8.610 8.324 0.286 17919 7417 1 19 . 1 1 5 5 VAL N N 5 121.000 121.000 121.880 -0.880 17919 7418 1 19 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.661 0.064 17919 7419 1 19 . 1 1 5 5 VAL C C 5 174.870 174.870 174.989 -0.119 17919 7420 1 19 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.017 -0.398 17919 7421 1 19 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.472 0.758 17919 7422 1 19 . 1 1 5 5 VAL H H 5 9.300 9.300 9.103 0.197 17919 7423 1 19 . 1 1 6 6 LYS N N 6 127.520 127.520 129.284 -1.764 17919 7424 1 19 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.140 0.227 17919 7425 1 19 . 1 1 6 6 LYS C C 6 177.140 177.140 176.217 0.923 17919 7426 1 19 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.862 -0.342 17919 7427 1 19 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.208 -0.158 17919 7428 1 19 . 1 1 6 6 LYS H H 6 8.820 8.820 9.212 -0.392 17919 7429 1 19 . 1 1 7 7 THR N N 7 115.400 115.400 116.452 -1.052 17919 7430 1 19 . 1 1 7 7 THR HA H 7 4.970 4.970 4.927 0.043 17919 7431 1 19 . 1 1 7 7 THR C C 7 176.910 176.910 176.595 0.315 17919 7432 1 19 . 1 1 7 7 THR CA C 7 60.470 60.470 59.645 0.826 17919 7433 1 19 . 1 1 7 7 THR CB C 7 70.630 70.630 71.531 -0.902 17919 7434 1 19 . 1 1 7 7 THR H H 7 8.730 8.730 7.919 0.811 17919 7435 1 19 . 1 1 8 8 LEU N N 8 121.330 121.330 121.186 0.144 17919 7436 1 19 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.075 0.235 17919 7437 1 19 . 1 1 8 8 LEU C C 8 178.800 178.800 177.573 1.227 17919 7438 1 19 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.230 0.350 17919 7439 1 19 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.308 0.662 17919 7440 1 19 . 1 1 8 8 LEU H H 8 9.100 9.100 9.007 0.093 17919 7441 1 19 . 1 1 9 9 THR N N 9 105.590 105.590 108.850 -3.260 17919 7442 1 19 . 1 1 9 9 THR HA H 9 4.428 4.428 4.357 0.071 17919 7443 1 19 . 1 1 9 9 THR C C 9 175.520 175.520 175.498 0.022 17919 7444 1 19 . 1 1 9 9 THR CA C 9 61.400 61.400 61.856 -0.456 17919 7445 1 19 . 1 1 9 9 THR CB C 9 69.140 69.140 69.221 -0.081 17919 7446 1 19 . 1 1 9 9 THR H H 9 7.630 7.630 7.694 -0.064 17919 7447 1 19 . 1 1 10 10 GLY N N 10 108.890 108.890 110.970 -2.080 17919 7448 1 19 . 1 1 10 10 GLY C C 10 174.070 174.070 173.900 0.170 17919 7449 1 19 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.694 0.766 17919 7450 1 19 . 1 1 10 10 GLY H H 10 7.810 7.810 7.644 0.166 17919 7451 1 19 . 1 1 11 11 LYS N N 11 121.600 121.600 122.670 -1.070 17919 7452 1 19 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.390 -0.029 17919 7453 1 19 . 1 1 11 11 LYS C C 11 175.940 175.940 175.507 0.433 17919 7454 1 19 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.163 0.117 17919 7455 1 19 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.080 0.120 17919 7456 1 19 . 1 1 11 11 LYS H H 11 7.280 7.280 7.610 -0.330 17919 7457 1 19 . 1 1 12 12 THR N N 12 120.440 120.440 121.918 -1.478 17919 7458 1 19 . 1 1 12 12 THR HA H 12 5.046 5.046 4.821 0.225 17919 7459 1 19 . 1 1 12 12 THR C C 12 174.320 174.320 174.424 -0.104 17919 7460 1 19 . 1 1 12 12 THR CA C 12 62.390 62.390 62.367 0.023 17919 7461 1 19 . 1 1 12 12 THR CB C 12 69.910 69.910 69.519 0.391 17919 7462 1 19 . 1 1 12 12 THR H H 12 8.650 8.650 8.407 0.243 17919 7463 1 19 . 1 1 13 13 ILE N N 13 127.110 127.110 129.022 -1.912 17919 7464 1 19 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.386 0.158 17919 7465 1 19 . 1 1 13 13 ILE C C 13 175.220 175.220 175.050 0.170 17919 7466 1 19 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.688 -0.708 17919 7467 1 19 . 1 1 13 13 ILE CB C 13 40.950 40.950 38.769 2.181 17919 7468 1 19 . 1 1 13 13 ILE H H 13 9.450 9.450 9.348 0.102 17919 7469 1 19 . 1 1 14 14 THR N N 14 121.520 121.520 124.361 -2.841 17919 7470 1 19 . 1 1 14 14 THR HA H 14 4.964 4.964 4.685 0.279 17919 7471 1 19 . 1 1 14 14 THR C C 14 173.790 173.790 173.842 -0.052 17919 7472 1 19 . 1 1 14 14 THR CA C 14 61.940 61.940 63.035 -1.095 17919 7473 1 19 . 1 1 14 14 THR CB C 14 69.650 69.650 69.672 -0.022 17919 7474 1 19 . 1 1 14 14 THR H H 14 8.710 8.710 8.642 0.068 17919 7475 1 19 . 1 1 15 15 LEU N N 15 124.800 124.800 127.774 -2.974 17919 7476 1 19 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.801 -0.021 17919 7477 1 19 . 1 1 15 15 LEU C C 15 174.670 174.670 174.795 -0.125 17919 7478 1 19 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.418 -0.588 17919 7479 1 19 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.857 1.213 17919 7480 1 19 . 1 1 15 15 LEU H H 15 8.710 8.710 8.591 0.119 17919 7481 1 19 . 1 1 16 16 GLU N N 16 122.160 122.160 123.465 -1.305 17919 7482 1 19 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.726 0.191 17919 7483 1 19 . 1 1 16 16 GLU C C 16 175.860 175.860 176.028 -0.168 17919 7484 1 19 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.604 -0.784 17919 7485 1 19 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.120 -0.670 17919 7486 1 19 . 1 1 16 16 GLU H H 16 8.140 8.140 8.596 -0.456 17919 7487 1 19 . 1 1 17 17 VAL N N 17 117.210 117.210 120.030 -2.820 17919 7488 1 19 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.572 0.142 17919 7489 1 19 . 1 1 17 17 VAL C C 17 174.160 174.160 174.376 -0.216 17919 7490 1 19 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.630 -1.200 17919 7491 1 19 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.734 0.666 17919 7492 1 19 . 1 1 17 17 VAL H H 17 8.900 8.900 8.940 -0.040 17919 7493 1 19 . 1 1 18 18 GLU N N 18 118.990 118.990 117.960 1.030 17919 7494 1 19 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.803 0.276 17919 7495 1 19 . 1 1 18 18 GLU C C 18 176.160 176.160 174.967 1.193 17919 7496 1 19 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.394 -0.674 17919 7497 1 19 . 1 1 18 18 GLU CB C 18 30.310 30.310 31.511 -1.201 17919 7498 1 19 . 1 1 18 18 GLU H H 18 8.640 8.640 8.335 0.305 17919 7499 1 19 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.228 -0.087 17919 7500 1 19 . 1 1 19 19 PRO C C 19 175.310 175.310 177.337 -2.027 17919 7501 1 19 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.542 -0.072 17919 7502 1 19 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.120 -0.170 17919 7503 1 19 . 1 1 20 20 SER N N 20 103.400 103.400 107.126 -3.726 17919 7504 1 19 . 1 1 20 20 SER HA H 20 4.370 4.370 4.446 -0.076 17919 7505 1 19 . 1 1 20 20 SER C C 20 174.660 174.660 174.163 0.497 17919 7506 1 19 . 1 1 20 20 SER CA C 20 57.400 57.400 57.206 0.194 17919 7507 1 19 . 1 1 20 20 SER CB C 20 63.370 63.370 63.290 0.080 17919 7508 1 19 . 1 1 20 20 SER H H 20 7.040 7.040 7.844 -0.804 17919 7509 1 19 . 1 1 21 21 ASP N N 21 123.480 123.480 125.130 -1.650 17919 7510 1 19 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.611 0.084 17919 7511 1 19 . 1 1 21 21 ASP C C 21 176.360 176.360 175.808 0.552 17919 7512 1 19 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.635 0.065 17919 7513 1 19 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.661 -0.861 17919 7514 1 19 . 1 1 21 21 ASP H H 21 8.030 8.030 7.578 0.452 17919 7515 1 19 . 1 1 22 22 THR N N 22 108.800 108.800 112.358 -3.558 17919 7516 1 19 . 1 1 22 22 THR HA H 22 4.920 4.920 4.734 0.186 17919 7517 1 19 . 1 1 22 22 THR C C 22 176.750 176.750 175.923 0.827 17919 7518 1 19 . 1 1 22 22 THR CA C 22 59.690 59.690 60.724 -1.034 17919 7519 1 19 . 1 1 22 22 THR CB C 22 71.200 71.200 70.209 0.991 17919 7520 1 19 . 1 1 22 22 THR H H 22 7.900 7.900 8.366 -0.466 17919 7521 1 19 . 1 1 23 23 ILE N N 23 121.190 121.190 122.571 -1.381 17919 7522 1 19 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.850 -0.193 17919 7523 1 19 . 1 1 23 23 ILE C C 23 179.040 179.040 177.683 1.357 17919 7524 1 19 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.278 -0.018 17919 7525 1 19 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.480 -2.130 17919 7526 1 19 . 1 1 23 23 ILE H H 23 8.560 8.560 8.551 0.009 17919 7527 1 19 . 1 1 24 24 GLU N N 24 120.830 120.830 121.534 -0.704 17919 7528 1 19 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.816 0.101 17919 7529 1 19 . 1 1 24 24 GLU C C 24 178.640 178.640 178.664 -0.024 17919 7530 1 19 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.363 -0.143 17919 7531 1 19 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.326 -1.046 17919 7532 1 19 . 1 1 24 24 GLU H H 24 9.760 9.760 8.116 1.644 17919 7533 1 19 . 1 1 25 25 ASN N N 25 120.570 120.570 116.977 3.593 17919 7534 1 19 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.564 -0.039 17919 7535 1 19 . 1 1 25 25 ASN C C 25 178.380 178.380 178.065 0.315 17919 7536 1 19 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.820 0.240 17919 7537 1 19 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.470 -0.020 17919 7538 1 19 . 1 1 25 25 ASN H H 25 7.920 7.920 8.212 -0.292 17919 7539 1 19 . 1 1 26 26 VAL N N 26 121.710 121.710 120.221 1.489 17919 7540 1 19 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.558 -0.161 17919 7541 1 19 . 1 1 26 26 VAL C C 26 177.950 177.950 177.930 0.020 17919 7542 1 19 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.550 1.110 17919 7543 1 19 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.378 -0.538 17919 7544 1 19 . 1 1 26 26 VAL H H 26 8.070 8.070 8.507 -0.437 17919 7545 1 19 . 1 1 27 27 LYS N N 27 118.860 118.860 119.718 -0.858 17919 7546 1 19 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.152 0.428 17919 7547 1 19 . 1 1 27 27 LYS C C 27 180.550 180.550 179.188 1.362 17919 7548 1 19 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.516 -0.266 17919 7549 1 19 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.108 1.622 17919 7550 1 19 . 1 1 27 27 LYS H H 27 8.560 8.560 7.928 0.632 17919 7551 1 19 . 1 1 28 28 ALA N N 28 123.440 123.440 121.235 2.205 17919 7552 1 19 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.062 0.098 17919 7553 1 19 . 1 1 28 28 ALA C C 28 180.300 180.300 178.969 1.331 17919 7554 1 19 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.144 0.226 17919 7555 1 19 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.341 -0.631 17919 7556 1 19 . 1 1 28 28 ALA H H 28 8.060 8.060 7.991 0.069 17919 7557 1 19 . 1 1 29 29 LYS N N 29 119.940 119.940 119.746 0.194 17919 7558 1 19 . 1 1 29 29 LYS HA H 29 4.207 4.207 3.974 0.233 17919 7559 1 19 . 1 1 29 29 LYS C C 29 180.320 180.320 179.204 1.116 17919 7560 1 19 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.231 0.419 17919 7561 1 19 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.271 1.019 17919 7562 1 19 . 1 1 29 29 LYS H H 29 7.850 7.850 7.513 0.337 17919 7563 1 19 . 1 1 30 30 ILE N N 30 121.080 121.080 120.161 0.919 17919 7564 1 19 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.566 -0.059 17919 7565 1 19 . 1 1 30 30 ILE C C 30 178.310 178.310 177.314 0.996 17919 7566 1 19 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.786 0.364 17919 7567 1 19 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.798 -0.998 17919 7568 1 19 . 1 1 30 30 ILE H H 30 8.280 8.280 8.430 -0.150 17919 7569 1 19 . 1 1 31 31 GLN N N 31 123.490 123.490 119.333 4.157 17919 7570 1 19 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.933 -0.104 17919 7571 1 19 . 1 1 31 31 GLN C C 31 178.890 178.890 178.503 0.387 17919 7572 1 19 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.331 0.669 17919 7573 1 19 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.320 -0.600 17919 7574 1 19 . 1 1 31 31 GLN H H 31 8.580 8.580 7.995 0.585 17919 7575 1 19 . 1 1 32 32 ASP N N 32 119.360 119.360 118.799 0.561 17919 7576 1 19 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.405 -0.051 17919 7577 1 19 . 1 1 32 32 ASP C C 32 177.250 177.250 177.599 -0.349 17919 7578 1 19 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.872 0.318 17919 7579 1 19 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.751 -0.171 17919 7580 1 19 . 1 1 32 32 ASP H H 32 8.010 8.010 8.089 -0.079 17919 7581 1 19 . 1 1 33 33 LYS N N 33 115.130 115.130 117.329 -2.199 17919 7582 1 19 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.369 -0.032 17919 7583 1 19 . 1 1 33 33 LYS C C 33 177.870 177.870 178.171 -0.301 17919 7584 1 19 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.991 0.059 17919 7585 1 19 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.934 0.236 17919 7586 1 19 . 1 1 33 33 LYS H H 33 7.430 7.430 7.291 0.139 17919 7587 1 19 . 1 1 34 34 GLU N N 34 113.870 113.870 115.462 -1.592 17919 7588 1 19 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.438 0.187 17919 7589 1 19 . 1 1 34 34 GLU C C 34 177.840 177.840 177.599 0.241 17919 7590 1 19 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.964 -0.794 17919 7591 1 19 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.123 1.537 17919 7592 1 19 . 1 1 34 34 GLU H H 34 8.740 8.740 8.104 0.636 17919 7593 1 19 . 1 1 35 35 GLY N N 35 108.650 108.650 108.529 0.121 17919 7594 1 19 . 1 1 35 35 GLY C C 35 173.960 173.960 174.558 -0.598 17919 7595 1 19 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.366 0.714 17919 7596 1 19 . 1 1 35 35 GLY H H 35 8.530 8.530 8.104 0.426 17919 7597 1 19 . 1 1 36 36 ILE N N 36 119.880 119.880 122.173 -2.293 17919 7598 1 19 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.419 0.026 17919 7599 1 19 . 1 1 36 36 ILE C C 36 173.590 173.590 174.276 -0.686 17919 7600 1 19 . 1 1 36 36 ILE CA C 36 57.750 57.750 56.880 0.870 17919 7601 1 19 . 1 1 36 36 ILE CB C 36 40.580 40.580 37.444 3.136 17919 7602 1 19 . 1 1 36 36 ILE H H 36 6.150 6.150 7.752 -1.602 17919 7603 1 19 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.889 -0.255 17919 7604 1 19 . 1 1 37 37 PRO C C 37 176.940 176.940 175.767 1.173 17919 7605 1 19 . 1 1 37 37 PRO CA C 37 61.660 61.660 60.817 0.843 17919 7606 1 19 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.570 0.280 17919 7607 1 19 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.246 -0.129 17919 7608 1 19 . 1 1 38 38 PRO C C 38 178.320 178.320 178.700 -0.380 17919 7609 1 19 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.683 0.577 17919 7610 1 19 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.878 1.012 17919 7611 1 19 . 1 1 39 39 ASP N N 39 113.380 113.380 118.108 -4.728 17919 7612 1 19 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.279 0.151 17919 7613 1 19 . 1 1 39 39 ASP C C 39 177.090 177.090 178.209 -1.119 17919 7614 1 19 . 1 1 39 39 ASP CA C 39 55.640 55.640 57.358 -1.718 17919 7615 1 19 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.468 -0.927 17919 7616 1 19 . 1 1 39 39 ASP H H 39 8.550 8.550 8.836 -0.286 17919 7617 1 19 . 1 1 40 40 GLN N N 40 116.780 116.780 117.276 -0.496 17919 7618 1 19 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.205 0.259 17919 7619 1 19 . 1 1 40 40 GLN C C 40 175.380 175.380 176.239 -0.859 17919 7620 1 19 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.649 -1.009 17919 7621 1 19 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.156 0.984 17919 7622 1 19 . 1 1 40 40 GLN H H 40 7.820 7.820 7.910 -0.090 17919 7623 1 19 . 1 1 41 41 GLN N N 41 117.720 117.720 119.781 -2.061 17919 7624 1 19 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.562 -0.318 17919 7625 1 19 . 1 1 41 41 GLN C C 41 176.300 176.300 174.753 1.547 17919 7626 1 19 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.971 0.499 17919 7627 1 19 . 1 1 41 41 GLN CB C 41 31.650 31.650 28.847 2.803 17919 7628 1 19 . 1 1 41 41 GLN H H 41 7.480 7.480 7.600 -0.120 17919 7629 1 19 . 1 1 42 42 ARG N N 42 122.680 122.680 126.213 -3.533 17919 7630 1 19 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.520 -0.020 17919 7631 1 19 . 1 1 42 42 ARG C C 42 174.050 174.050 173.991 0.059 17919 7632 1 19 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.318 -0.268 17919 7633 1 19 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.649 -0.899 17919 7634 1 19 . 1 1 42 42 ARG H H 42 8.530 8.530 8.465 0.065 17919 7635 1 19 . 1 1 43 43 LEU N N 43 124.040 124.040 125.925 -1.885 17919 7636 1 19 . 1 1 43 43 LEU C C 43 175.290 175.290 174.663 0.627 17919 7637 1 19 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.586 -0.606 17919 7638 1 19 . 1 1 43 43 LEU CB C 43 45.790 45.790 45.467 0.323 17919 7639 1 19 . 1 1 43 43 LEU H H 43 8.820 8.820 8.346 0.474 17919 7640 1 19 . 1 1 44 44 ILE N N 44 121.920 121.920 120.926 0.994 17919 7641 1 19 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.706 0.286 17919 7642 1 19 . 1 1 44 44 ILE C C 44 176.060 176.060 174.368 1.692 17919 7643 1 19 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.026 -1.046 17919 7644 1 19 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.498 -0.078 17919 7645 1 19 . 1 1 44 44 ILE H H 44 9.030 9.030 8.445 0.585 17919 7646 1 19 . 1 1 45 45 PHE N N 45 125.390 125.390 127.161 -1.771 17919 7647 1 19 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.024 0.021 17919 7648 1 19 . 1 1 45 45 PHE C C 45 174.470 174.470 174.225 0.245 17919 7649 1 19 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.327 0.693 17919 7650 1 19 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.325 0.435 17919 7651 1 19 . 1 1 45 45 PHE H H 45 8.830 8.830 8.235 0.595 17919 7652 1 19 . 1 1 46 46 ALA N N 46 132.200 132.200 128.053 4.147 17919 7653 1 19 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.619 0.071 17919 7654 1 19 . 1 1 46 46 ALA C C 46 177.290 177.290 177.810 -0.520 17919 7655 1 19 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.525 0.015 17919 7656 1 19 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.187 0.383 17919 7657 1 19 . 1 1 46 46 ALA H H 46 8.810 8.810 9.018 -0.208 17919 7658 1 19 . 1 1 47 47 GLY N N 47 102.340 102.340 104.620 -2.280 17919 7659 1 19 . 1 1 47 47 GLY C C 47 173.810 173.810 174.452 -0.642 17919 7660 1 19 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.193 0.157 17919 7661 1 19 . 1 1 47 47 GLY H H 47 8.130 8.130 8.490 -0.360 17919 7662 1 19 . 1 1 48 48 LYS N N 48 121.570 121.570 123.104 -1.534 17919 7663 1 19 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.553 0.069 17919 7664 1 19 . 1 1 48 48 LYS C C 48 174.700 174.700 175.490 -0.790 17919 7665 1 19 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.807 -0.257 17919 7666 1 19 . 1 1 48 48 LYS CB C 48 34.530 34.530 33.369 1.161 17919 7667 1 19 . 1 1 48 48 LYS H H 48 7.980 7.980 7.909 0.071 17919 7668 1 19 . 1 1 49 49 GLN N N 49 122.410 122.410 125.581 -3.171 17919 7669 1 19 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.619 -0.059 17919 7670 1 19 . 1 1 49 49 GLN C C 49 175.670 175.670 175.182 0.488 17919 7671 1 19 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.329 -0.589 17919 7672 1 19 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.468 -0.468 17919 7673 1 19 . 1 1 49 49 GLN H H 49 8.600 8.600 8.574 0.026 17919 7674 1 19 . 1 1 50 50 LEU N N 50 125.520 125.520 124.641 0.879 17919 7675 1 19 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.346 -0.256 17919 7676 1 19 . 1 1 50 50 LEU C C 50 176.660 176.660 175.645 1.015 17919 7677 1 19 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.655 0.585 17919 7678 1 19 . 1 1 50 50 LEU CB C 50 41.570 41.570 43.130 -1.560 17919 7679 1 19 . 1 1 50 50 LEU H H 50 8.530 8.530 8.665 -0.135 17919 7680 1 19 . 1 1 51 51 GLU N N 51 122.940 122.940 122.919 0.021 17919 7681 1 19 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.660 -0.172 17919 7682 1 19 . 1 1 51 51 GLU C C 51 175.870 175.870 176.293 -0.423 17919 7683 1 19 . 1 1 51 51 GLU CA C 51 55.960 55.960 54.966 0.994 17919 7684 1 19 . 1 1 51 51 GLU CB C 51 31.570 31.570 33.439 -1.869 17919 7685 1 19 . 1 1 51 51 GLU H H 51 8.400 8.400 8.513 -0.113 17919 7686 1 19 . 1 1 52 52 ASP N N 52 120.030 120.030 124.893 -4.863 17919 7687 1 19 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.555 -0.196 17919 7688 1 19 . 1 1 52 52 ASP C C 52 177.330 177.330 177.908 -0.578 17919 7689 1 19 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.496 -0.536 17919 7690 1 19 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.749 0.101 17919 7691 1 19 . 1 1 52 52 ASP H H 52 8.160 8.160 8.777 -0.617 17919 7692 1 19 . 1 1 53 53 GLY N N 53 106.660 106.660 105.473 1.187 17919 7693 1 19 . 1 1 53 53 GLY C C 53 174.870 174.870 174.485 0.385 17919 7694 1 19 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.011 0.159 17919 7695 1 19 . 1 1 53 53 GLY H H 53 9.390 9.390 8.394 0.996 17919 7696 1 19 . 1 1 54 54 ARG N N 54 119.050 119.050 119.863 -0.813 17919 7697 1 19 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.676 0.019 17919 7698 1 19 . 1 1 54 54 ARG C C 54 175.350 175.350 175.590 -0.240 17919 7699 1 19 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.669 -0.279 17919 7700 1 19 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.507 0.143 17919 7701 1 19 . 1 1 54 54 ARG H H 54 7.460 7.460 7.333 0.127 17919 7702 1 19 . 1 1 55 55 THR N N 55 108.400 108.400 111.269 -2.869 17919 7703 1 19 . 1 1 55 55 THR HA H 55 5.240 5.240 5.094 0.146 17919 7704 1 19 . 1 1 55 55 THR C C 55 176.560 176.560 176.162 0.398 17919 7705 1 19 . 1 1 55 55 THR CA C 55 59.690 59.690 59.425 0.265 17919 7706 1 19 . 1 1 55 55 THR CB C 55 72.260 72.260 71.927 0.333 17919 7707 1 19 . 1 1 55 55 THR H H 55 8.730 8.730 8.622 0.108 17919 7708 1 19 . 1 1 56 56 LEU N N 56 117.920 117.920 121.302 -3.382 17919 7709 1 19 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.078 -0.018 17919 7710 1 19 . 1 1 56 56 LEU C C 56 180.810 180.810 178.854 1.956 17919 7711 1 19 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.470 0.240 17919 7712 1 19 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.531 -1.161 17919 7713 1 19 . 1 1 56 56 LEU H H 56 8.140 8.140 8.460 -0.320 17919 7714 1 19 . 1 1 57 57 SER N N 57 113.330 113.330 114.940 -1.610 17919 7715 1 19 . 1 1 57 57 SER HA H 57 4.370 4.370 4.091 0.279 17919 7716 1 19 . 1 1 57 57 SER C C 57 178.310 178.310 176.943 1.367 17919 7717 1 19 . 1 1 57 57 SER CA C 57 61.080 61.080 62.011 -0.931 17919 7718 1 19 . 1 1 57 57 SER CB C 57 62.530 62.530 62.795 -0.265 17919 7719 1 19 . 1 1 57 57 SER H H 57 8.470 8.470 8.004 0.466 17919 7720 1 19 . 1 1 58 58 ASP N N 58 124.190 124.190 122.959 1.231 17919 7721 1 19 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.270 0.026 17919 7722 1 19 . 1 1 58 58 ASP C C 58 177.400 177.400 178.303 -0.903 17919 7723 1 19 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.758 0.422 17919 7724 1 19 . 1 1 58 58 ASP CB C 58 40.100 40.100 39.977 0.123 17919 7725 1 19 . 1 1 58 58 ASP H H 58 7.930 7.930 7.708 0.222 17919 7726 1 19 . 1 1 59 59 TYR N N 59 115.510 115.510 116.805 -1.295 17919 7727 1 19 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.462 0.208 17919 7728 1 19 . 1 1 59 59 TYR C C 59 174.700 174.700 175.149 -0.449 17919 7729 1 19 . 1 1 59 59 TYR CA C 59 58.250 58.250 58.416 -0.166 17919 7730 1 19 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.027 2.043 17919 7731 1 19 . 1 1 59 59 TYR H H 59 7.250 7.250 7.480 -0.230 17919 7732 1 19 . 1 1 60 60 ASN N N 60 115.900 115.900 115.069 0.831 17919 7733 1 19 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.345 0.010 17919 7734 1 19 . 1 1 60 60 ASN C C 60 174.340 174.340 174.274 0.066 17919 7735 1 19 . 1 1 60 60 ASN CA C 60 54.120 54.120 53.831 0.289 17919 7736 1 19 . 1 1 60 60 ASN CB C 60 37.410 37.410 36.321 1.089 17919 7737 1 19 . 1 1 60 60 ASN H H 60 8.150 8.150 8.255 -0.105 17919 7738 1 19 . 1 1 61 61 ILE N N 61 118.600 118.600 120.302 -1.702 17919 7739 1 19 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.789 -0.396 17919 7740 1 19 . 1 1 61 61 ILE C C 61 174.610 174.610 175.635 -1.025 17919 7741 1 19 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.242 1.178 17919 7742 1 19 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.418 -0.678 17919 7743 1 19 . 1 1 61 61 ILE H H 61 7.250 7.250 8.123 -0.873 17919 7744 1 19 . 1 1 62 62 GLN N N 62 124.740 124.740 127.717 -2.977 17919 7745 1 19 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.389 0.117 17919 7746 1 19 . 1 1 62 62 GLN C C 62 175.970 175.970 175.932 0.038 17919 7747 1 19 . 1 1 62 62 GLN CA C 62 53.660 53.660 54.471 -0.811 17919 7748 1 19 . 1 1 62 62 GLN CB C 62 31.650 31.650 29.920 1.730 17919 7749 1 19 . 1 1 62 62 GLN H H 62 7.610 7.610 8.170 -0.560 17919 7750 1 19 . 1 1 63 63 LYS N N 63 120.300 120.300 122.117 -1.817 17919 7751 1 19 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.791 0.210 17919 7752 1 19 . 1 1 63 63 LYS C C 63 175.810 175.810 176.401 -0.591 17919 7753 1 19 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.959 -0.168 17919 7754 1 19 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.454 1.196 17919 7755 1 19 . 1 1 63 63 LYS H H 63 8.490 8.490 8.662 -0.172 17919 7756 1 19 . 1 1 64 64 GLU N N 64 113.950 113.950 117.066 -3.116 17919 7757 1 19 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.612 -0.147 17919 7758 1 19 . 1 1 64 64 GLU C C 64 175.250 175.250 175.254 -0.004 17919 7759 1 19 . 1 1 64 64 GLU CA C 64 57.890 57.890 58.013 -0.123 17919 7760 1 19 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.473 -2.572 17919 7761 1 19 . 1 1 64 64 GLU H H 64 9.280 9.280 8.666 0.614 17919 7762 1 19 . 1 1 65 65 SER N N 65 114.730 114.730 116.572 -1.842 17919 7763 1 19 . 1 1 65 65 SER HA H 65 4.640 4.640 4.413 0.227 17919 7764 1 19 . 1 1 65 65 SER C C 65 172.160 172.160 174.186 -2.026 17919 7765 1 19 . 1 1 65 65 SER CA C 65 60.890 60.890 60.396 0.494 17919 7766 1 19 . 1 1 65 65 SER CB C 65 64.910 64.910 63.362 1.548 17919 7767 1 19 . 1 1 65 65 SER H H 65 7.670 7.670 7.527 0.143 17919 7768 1 19 . 1 1 66 66 THR N N 66 117.110 117.110 122.261 -5.151 17919 7769 1 19 . 1 1 66 66 THR HA H 66 5.270 5.270 4.662 0.608 17919 7770 1 19 . 1 1 66 66 THR C C 66 173.950 173.950 174.227 -0.277 17919 7771 1 19 . 1 1 66 66 THR CA C 66 62.340 62.340 63.175 -0.835 17919 7772 1 19 . 1 1 66 66 THR CB C 66 70.080 70.080 69.454 0.626 17919 7773 1 19 . 1 1 66 66 THR H H 66 8.730 8.730 8.385 0.345 17919 7774 1 19 . 1 1 67 67 LEU N N 67 127.110 127.110 127.201 -0.091 17919 7775 1 19 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.987 0.073 17919 7776 1 19 . 1 1 67 67 LEU C C 67 175.770 175.770 175.296 0.474 17919 7777 1 19 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.924 -0.024 17919 7778 1 19 . 1 1 67 67 LEU CB C 67 44.260 44.260 45.655 -1.395 17919 7779 1 19 . 1 1 67 67 LEU H H 67 9.410 9.410 9.043 0.367 17919 7780 1 19 . 1 1 68 68 HIS N N 68 118.380 118.380 122.048 -3.668 17919 7781 1 19 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.030 0.210 17919 7782 1 19 . 1 1 68 68 HIS C C 68 173.150 173.150 174.755 -1.605 17919 7783 1 19 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.610 0.390 17919 7784 1 19 . 1 1 68 68 HIS CB C 68 30.530 30.530 29.706 0.825 17919 7785 1 19 . 1 1 68 68 HIS H H 68 9.230 9.230 8.570 0.660 17919 7786 1 19 . 1 1 69 69 LEU N N 69 124.460 124.460 126.556 -2.096 17919 7787 1 19 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.349 0.841 17919 7788 1 19 . 1 1 69 69 LEU C C 69 175.270 175.270 175.335 -0.065 17919 7789 1 19 . 1 1 69 69 LEU CA C 69 53.890 53.890 55.751 -1.861 17919 7790 1 19 . 1 1 69 69 LEU CB C 69 44.380 44.380 42.742 1.638 17919 7791 1 19 . 1 1 69 69 LEU H H 69 8.340 8.340 7.937 0.403 17919 7792 1 19 . 1 1 70 70 VAL N N 70 126.940 126.940 121.400 5.540 17919 7793 1 19 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.553 -0.203 17919 7794 1 19 . 1 1 70 70 VAL C C 70 174.000 174.000 175.230 -1.230 17919 7795 1 19 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.419 1.381 17919 7796 1 19 . 1 1 70 70 VAL CB C 70 34.910 34.910 34.967 -0.057 17919 7797 1 19 . 1 1 70 70 VAL H H 70 9.200 9.200 8.676 0.524 17919 7798 1 19 . 1 1 71 71 LEU N N 71 123.130 123.130 121.777 1.353 17919 7799 1 19 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.585 0.475 17919 7800 1 19 . 1 1 71 71 LEU C C 71 177.830 177.830 178.143 -0.313 17919 7801 1 19 . 1 1 71 71 LEU CA C 71 53.940 53.940 55.607 -1.667 17919 7802 1 19 . 1 1 71 71 LEU CB C 71 42.850 42.850 41.716 1.134 17919 7803 1 19 . 1 1 71 71 LEU H H 71 8.120 8.120 8.542 -0.422 17919 7804 1 19 . 1 1 72 72 ARG N N 72 123.490 123.490 122.316 1.174 17919 7805 1 19 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.470 -0.169 17919 7806 1 19 . 1 1 72 72 ARG C C 72 175.350 175.350 176.365 -1.015 17919 7807 1 19 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.531 0.079 17919 7808 1 19 . 1 1 72 72 ARG CB C 72 31.350 31.350 28.540 2.810 17919 7809 1 19 . 1 1 72 72 ARG H H 72 8.580 8.580 8.413 0.167 17919 7810 1 20 . 1 1 2 2 GLN N N 2 123.220 123.220 127.683 -4.463 17919 7811 1 20 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.101 0.148 17919 7812 1 20 . 1 1 2 2 GLN C C 2 175.920 175.920 174.453 1.467 17919 7813 1 20 . 1 1 2 2 GLN CA C 2 55.080 55.080 55.304 -0.224 17919 7814 1 20 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.395 0.365 17919 7815 1 20 . 1 1 2 2 GLN H H 2 8.900 8.900 8.565 0.335 17919 7816 1 20 . 1 1 3 3 ILE N N 3 115.340 115.340 117.675 -2.335 17919 7817 1 20 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.277 -0.064 17919 7818 1 20 . 1 1 3 3 ILE C C 3 172.450 172.450 173.323 -0.873 17919 7819 1 20 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.605 -0.035 17919 7820 1 20 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.972 0.238 17919 7821 1 20 . 1 1 3 3 ILE H H 3 8.320 8.320 8.115 0.205 17919 7822 1 20 . 1 1 4 4 PHE N N 4 118.110 118.110 120.778 -2.668 17919 7823 1 20 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.356 0.274 17919 7824 1 20 . 1 1 4 4 PHE C C 4 175.320 175.320 175.099 0.221 17919 7825 1 20 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.612 -0.402 17919 7826 1 20 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.964 -0.484 17919 7827 1 20 . 1 1 4 4 PHE H H 4 8.610 8.610 8.616 -0.006 17919 7828 1 20 . 1 1 5 5 VAL N N 5 121.000 121.000 123.677 -2.677 17919 7829 1 20 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.814 -0.089 17919 7830 1 20 . 1 1 5 5 VAL C C 5 174.870 174.870 174.946 -0.076 17919 7831 1 20 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.218 -0.598 17919 7832 1 20 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.491 0.739 17919 7833 1 20 . 1 1 5 5 VAL H H 5 9.300 9.300 8.366 0.934 17919 7834 1 20 . 1 1 6 6 LYS N N 6 127.520 127.520 128.508 -0.988 17919 7835 1 20 . 1 1 6 6 LYS HA H 6 5.367 5.367 4.911 0.456 17919 7836 1 20 . 1 1 6 6 LYS C C 6 177.140 177.140 175.944 1.196 17919 7837 1 20 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.864 -0.344 17919 7838 1 20 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.521 -0.471 17919 7839 1 20 . 1 1 6 6 LYS H H 6 8.820 8.820 8.925 -0.105 17919 7840 1 20 . 1 1 7 7 THR N N 7 115.400 115.400 117.088 -1.688 17919 7841 1 20 . 1 1 7 7 THR HA H 7 4.970 4.970 4.830 0.140 17919 7842 1 20 . 1 1 7 7 THR C C 7 176.910 176.910 176.037 0.873 17919 7843 1 20 . 1 1 7 7 THR CA C 7 60.470 60.470 60.346 0.124 17919 7844 1 20 . 1 1 7 7 THR CB C 7 70.630 70.630 70.812 -0.182 17919 7845 1 20 . 1 1 7 7 THR H H 7 8.730 8.730 8.312 0.418 17919 7846 1 20 . 1 1 8 8 LEU N N 8 121.330 121.330 125.791 -4.461 17919 7847 1 20 . 1 1 8 8 LEU HA H 8 4.310 4.310 3.858 0.452 17919 7848 1 20 . 1 1 8 8 LEU C C 8 178.800 178.800 177.408 1.392 17919 7849 1 20 . 1 1 8 8 LEU CA C 8 57.580 57.580 58.241 -0.661 17919 7850 1 20 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.109 -0.139 17919 7851 1 20 . 1 1 8 8 LEU H H 8 9.100 9.100 9.304 -0.204 17919 7852 1 20 . 1 1 9 9 THR N N 9 105.590 105.590 107.843 -2.253 17919 7853 1 20 . 1 1 9 9 THR HA H 9 4.428 4.428 4.275 0.153 17919 7854 1 20 . 1 1 9 9 THR C C 9 175.520 175.520 175.812 -0.292 17919 7855 1 20 . 1 1 9 9 THR CA C 9 61.400 61.400 62.822 -1.422 17919 7856 1 20 . 1 1 9 9 THR CB C 9 69.140 69.140 70.048 -0.908 17919 7857 1 20 . 1 1 9 9 THR H H 9 7.630 7.630 8.004 -0.374 17919 7858 1 20 . 1 1 10 10 GLY N N 10 108.890 108.890 110.646 -1.756 17919 7859 1 20 . 1 1 10 10 GLY C C 10 174.070 174.070 173.004 1.066 17919 7860 1 20 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.762 0.698 17919 7861 1 20 . 1 1 10 10 GLY H H 10 7.810 7.810 7.951 -0.141 17919 7862 1 20 . 1 1 11 11 LYS N N 11 121.600 121.600 122.716 -1.116 17919 7863 1 20 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.412 -0.051 17919 7864 1 20 . 1 1 11 11 LYS C C 11 175.940 175.940 175.595 0.345 17919 7865 1 20 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.419 -0.140 17919 7866 1 20 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.506 -0.306 17919 7867 1 20 . 1 1 11 11 LYS H H 11 7.280 7.280 7.696 -0.416 17919 7868 1 20 . 1 1 12 12 THR N N 12 120.440 120.440 119.694 0.746 17919 7869 1 20 . 1 1 12 12 THR HA H 12 5.046 5.046 4.488 0.558 17919 7870 1 20 . 1 1 12 12 THR C C 12 174.320 174.320 174.149 0.171 17919 7871 1 20 . 1 1 12 12 THR CA C 12 62.390 62.390 62.090 0.300 17919 7872 1 20 . 1 1 12 12 THR CB C 12 69.910 69.910 69.989 -0.079 17919 7873 1 20 . 1 1 12 12 THR H H 12 8.650 8.650 8.270 0.380 17919 7874 1 20 . 1 1 13 13 ILE N N 13 127.110 127.110 124.124 2.986 17919 7875 1 20 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.443 0.101 17919 7876 1 20 . 1 1 13 13 ILE C C 13 175.220 175.220 174.572 0.648 17919 7877 1 20 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.739 -0.759 17919 7878 1 20 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.919 0.032 17919 7879 1 20 . 1 1 13 13 ILE H H 13 9.450 9.450 8.221 1.229 17919 7880 1 20 . 1 1 14 14 THR N N 14 121.520 121.520 123.552 -2.032 17919 7881 1 20 . 1 1 14 14 THR HA H 14 4.964 4.964 4.733 0.231 17919 7882 1 20 . 1 1 14 14 THR C C 14 173.790 173.790 173.432 0.358 17919 7883 1 20 . 1 1 14 14 THR CA C 14 61.940 61.940 62.432 -0.492 17919 7884 1 20 . 1 1 14 14 THR CB C 14 69.650 69.650 69.032 0.618 17919 7885 1 20 . 1 1 14 14 THR H H 14 8.710 8.710 8.646 0.064 17919 7886 1 20 . 1 1 15 15 LEU N N 15 124.800 124.800 128.148 -3.348 17919 7887 1 20 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.710 0.070 17919 7888 1 20 . 1 1 15 15 LEU C C 15 174.670 174.670 175.312 -0.642 17919 7889 1 20 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.872 -1.042 17919 7890 1 20 . 1 1 15 15 LEU CB C 15 47.070 47.070 44.101 2.969 17919 7891 1 20 . 1 1 15 15 LEU H H 15 8.710 8.710 8.020 0.690 17919 7892 1 20 . 1 1 16 16 GLU N N 16 122.160 122.160 123.825 -1.665 17919 7893 1 20 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.549 0.368 17919 7894 1 20 . 1 1 16 16 GLU C C 16 175.860 175.860 175.588 0.272 17919 7895 1 20 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.053 -0.233 17919 7896 1 20 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.091 -0.641 17919 7897 1 20 . 1 1 16 16 GLU H H 16 8.140 8.140 8.642 -0.502 17919 7898 1 20 . 1 1 17 17 VAL N N 17 117.210 117.210 118.751 -1.541 17919 7899 1 20 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.571 0.143 17919 7900 1 20 . 1 1 17 17 VAL C C 17 174.160 174.160 174.500 -0.340 17919 7901 1 20 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.236 -0.806 17919 7902 1 20 . 1 1 17 17 VAL CB C 17 36.400 36.400 34.752 1.647 17919 7903 1 20 . 1 1 17 17 VAL H H 17 8.900 8.900 8.584 0.316 17919 7904 1 20 . 1 1 18 18 GLU N N 18 118.990 118.990 120.814 -1.824 17919 7905 1 20 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.875 0.204 17919 7906 1 20 . 1 1 18 18 GLU C C 18 176.160 176.160 175.488 0.672 17919 7907 1 20 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.860 -0.140 17919 7908 1 20 . 1 1 18 18 GLU CB C 18 30.310 30.310 31.559 -1.249 17919 7909 1 20 . 1 1 18 18 GLU H H 18 8.640 8.640 8.482 0.158 17919 7910 1 20 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.120 0.021 17919 7911 1 20 . 1 1 19 19 PRO C C 19 175.310 175.310 178.391 -3.081 17919 7912 1 20 . 1 1 19 19 PRO CA C 19 65.470 65.470 66.057 -0.587 17919 7913 1 20 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.945 0.006 17919 7914 1 20 . 1 1 20 20 SER N N 20 103.400 103.400 109.737 -6.337 17919 7915 1 20 . 1 1 20 20 SER HA H 20 4.370 4.370 4.279 0.091 17919 7916 1 20 . 1 1 20 20 SER C C 20 174.660 174.660 174.906 -0.246 17919 7917 1 20 . 1 1 20 20 SER CA C 20 57.400 57.400 59.415 -2.015 17919 7918 1 20 . 1 1 20 20 SER CB C 20 63.370 63.370 62.781 0.589 17919 7919 1 20 . 1 1 20 20 SER H H 20 7.040 7.040 7.999 -0.959 17919 7920 1 20 . 1 1 21 21 ASP N N 21 123.480 123.480 124.112 -0.632 17919 7921 1 20 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.675 0.020 17919 7922 1 20 . 1 1 21 21 ASP C C 21 176.360 176.360 175.695 0.665 17919 7923 1 20 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.574 0.126 17919 7924 1 20 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.794 -0.994 17919 7925 1 20 . 1 1 21 21 ASP H H 21 8.030 8.030 7.884 0.146 17919 7926 1 20 . 1 1 22 22 THR N N 22 108.800 108.800 113.876 -5.076 17919 7927 1 20 . 1 1 22 22 THR HA H 22 4.920 4.920 4.544 0.376 17919 7928 1 20 . 1 1 22 22 THR C C 22 176.750 176.750 176.025 0.725 17919 7929 1 20 . 1 1 22 22 THR CA C 22 59.690 59.690 61.440 -1.750 17919 7930 1 20 . 1 1 22 22 THR CB C 22 71.200 71.200 70.335 0.865 17919 7931 1 20 . 1 1 22 22 THR H H 22 7.900 7.900 8.195 -0.295 17919 7932 1 20 . 1 1 23 23 ILE N N 23 121.190 121.190 123.530 -2.340 17919 7933 1 20 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.768 -0.111 17919 7934 1 20 . 1 1 23 23 ILE C C 23 179.040 179.040 177.614 1.426 17919 7935 1 20 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.032 0.228 17919 7936 1 20 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.114 -1.764 17919 7937 1 20 . 1 1 23 23 ILE H H 23 8.560 8.560 8.717 -0.157 17919 7938 1 20 . 1 1 24 24 GLU N N 24 120.830 120.830 120.794 0.036 17919 7939 1 20 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.800 0.117 17919 7940 1 20 . 1 1 24 24 GLU C C 24 178.640 178.640 178.580 0.060 17919 7941 1 20 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.449 -0.229 17919 7942 1 20 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.340 -1.060 17919 7943 1 20 . 1 1 24 24 GLU H H 24 9.760 9.760 8.916 0.844 17919 7944 1 20 . 1 1 25 25 ASN N N 25 120.570 120.570 117.647 2.923 17919 7945 1 20 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.493 0.032 17919 7946 1 20 . 1 1 25 25 ASN C C 25 178.380 178.380 178.109 0.271 17919 7947 1 20 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.872 0.188 17919 7948 1 20 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.413 0.037 17919 7949 1 20 . 1 1 25 25 ASN H H 25 7.920 7.920 7.542 0.378 17919 7950 1 20 . 1 1 26 26 VAL N N 26 121.710 121.710 120.813 0.897 17919 7951 1 20 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.542 -0.145 17919 7952 1 20 . 1 1 26 26 VAL C C 26 177.950 177.950 177.996 -0.046 17919 7953 1 20 . 1 1 26 26 VAL CA C 26 67.660 67.660 67.017 0.643 17919 7954 1 20 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.647 -0.807 17919 7955 1 20 . 1 1 26 26 VAL H H 26 8.070 8.070 8.123 -0.053 17919 7956 1 20 . 1 1 27 27 LYS N N 27 118.860 118.860 119.722 -0.862 17919 7957 1 20 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.166 0.414 17919 7958 1 20 . 1 1 27 27 LYS C C 27 180.550 180.550 179.086 1.464 17919 7959 1 20 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.495 -0.245 17919 7960 1 20 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.216 1.514 17919 7961 1 20 . 1 1 27 27 LYS H H 27 8.560 8.560 8.476 0.084 17919 7962 1 20 . 1 1 28 28 ALA N N 28 123.440 123.440 121.334 2.106 17919 7963 1 20 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.101 0.059 17919 7964 1 20 . 1 1 28 28 ALA C C 28 180.300 180.300 178.910 1.390 17919 7965 1 20 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.890 0.480 17919 7966 1 20 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.437 -0.727 17919 7967 1 20 . 1 1 28 28 ALA H H 28 8.060 8.060 8.636 -0.576 17919 7968 1 20 . 1 1 29 29 LYS N N 29 119.940 119.940 120.406 -0.466 17919 7969 1 20 . 1 1 29 29 LYS HA H 29 4.207 4.207 3.982 0.225 17919 7970 1 20 . 1 1 29 29 LYS C C 29 180.320 180.320 179.080 1.240 17919 7971 1 20 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.544 0.106 17919 7972 1 20 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.205 1.085 17919 7973 1 20 . 1 1 29 29 LYS H H 29 7.850 7.850 7.340 0.510 17919 7974 1 20 . 1 1 30 30 ILE N N 30 121.080 121.080 118.964 2.116 17919 7975 1 20 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.656 -0.149 17919 7976 1 20 . 1 1 30 30 ILE C C 30 178.310 178.310 177.510 0.800 17919 7977 1 20 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.374 0.776 17919 7978 1 20 . 1 1 30 30 ILE CB C 30 36.800 36.800 36.979 -0.179 17919 7979 1 20 . 1 1 30 30 ILE H H 30 8.280 8.280 8.509 -0.229 17919 7980 1 20 . 1 1 31 31 GLN N N 31 123.490 123.490 119.455 4.035 17919 7981 1 20 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.927 -0.098 17919 7982 1 20 . 1 1 31 31 GLN C C 31 178.890 178.890 178.505 0.385 17919 7983 1 20 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.111 0.889 17919 7984 1 20 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.314 -0.594 17919 7985 1 20 . 1 1 31 31 GLN H H 31 8.580 8.580 7.785 0.795 17919 7986 1 20 . 1 1 32 32 ASP N N 32 119.360 119.360 120.208 -0.848 17919 7987 1 20 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.379 -0.025 17919 7988 1 20 . 1 1 32 32 ASP C C 32 177.250 177.250 177.915 -0.665 17919 7989 1 20 . 1 1 32 32 ASP CA C 32 57.190 57.190 57.050 0.140 17919 7990 1 20 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.826 -0.246 17919 7991 1 20 . 1 1 32 32 ASP H H 32 8.010 8.010 8.362 -0.352 17919 7992 1 20 . 1 1 33 33 LYS N N 33 115.130 115.130 117.836 -2.706 17919 7993 1 20 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.322 0.015 17919 7994 1 20 . 1 1 33 33 LYS C C 33 177.870 177.870 178.677 -0.807 17919 7995 1 20 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.222 -0.173 17919 7996 1 20 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.675 0.495 17919 7997 1 20 . 1 1 33 33 LYS H H 33 7.430 7.430 7.448 -0.018 17919 7998 1 20 . 1 1 34 34 GLU N N 34 113.870 113.870 115.893 -2.023 17919 7999 1 20 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.425 0.200 17919 8000 1 20 . 1 1 34 34 GLU C C 34 177.840 177.840 177.431 0.409 17919 8001 1 20 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.833 -0.663 17919 8002 1 20 . 1 1 34 34 GLU CB C 34 32.660 32.660 30.820 1.840 17919 8003 1 20 . 1 1 34 34 GLU H H 34 8.740 8.740 8.199 0.541 17919 8004 1 20 . 1 1 35 35 GLY N N 35 108.650 108.650 108.858 -0.208 17919 8005 1 20 . 1 1 35 35 GLY C C 35 173.960 173.960 174.314 -0.354 17919 8006 1 20 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.782 0.298 17919 8007 1 20 . 1 1 35 35 GLY H H 35 8.530 8.530 8.020 0.510 17919 8008 1 20 . 1 1 36 36 ILE N N 36 119.880 119.880 121.417 -1.537 17919 8009 1 20 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.351 0.094 17919 8010 1 20 . 1 1 36 36 ILE C C 36 173.590 173.590 174.531 -0.941 17919 8011 1 20 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.042 0.708 17919 8012 1 20 . 1 1 36 36 ILE CB C 36 40.580 40.580 36.990 3.590 17919 8013 1 20 . 1 1 36 36 ILE H H 36 6.150 6.150 7.783 -1.633 17919 8014 1 20 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.794 -0.160 17919 8015 1 20 . 1 1 37 37 PRO C C 37 176.940 176.940 176.200 0.740 17919 8016 1 20 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.087 0.573 17919 8017 1 20 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.210 0.640 17919 8018 1 20 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.141 -0.024 17919 8019 1 20 . 1 1 38 38 PRO C C 38 178.320 178.320 177.927 0.393 17919 8020 1 20 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.791 0.469 17919 8021 1 20 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.849 1.042 17919 8022 1 20 . 1 1 39 39 ASP N N 39 113.380 113.380 115.161 -1.781 17919 8023 1 20 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.266 0.164 17919 8024 1 20 . 1 1 39 39 ASP C C 39 177.090 177.090 177.110 -0.020 17919 8025 1 20 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.468 -0.828 17919 8026 1 20 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.318 -0.778 17919 8027 1 20 . 1 1 39 39 ASP H H 39 8.550 8.550 8.633 -0.083 17919 8028 1 20 . 1 1 40 40 GLN N N 40 116.780 116.780 115.712 1.068 17919 8029 1 20 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.215 0.249 17919 8030 1 20 . 1 1 40 40 GLN C C 40 175.380 175.380 176.051 -0.671 17919 8031 1 20 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.528 -0.888 17919 8032 1 20 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.505 0.635 17919 8033 1 20 . 1 1 40 40 GLN H H 40 7.820 7.820 7.614 0.206 17919 8034 1 20 . 1 1 41 41 GLN N N 41 117.720 117.720 119.216 -1.496 17919 8035 1 20 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.773 -0.529 17919 8036 1 20 . 1 1 41 41 GLN C C 41 176.300 176.300 175.579 0.721 17919 8037 1 20 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.049 0.421 17919 8038 1 20 . 1 1 41 41 GLN CB C 41 31.650 31.650 30.011 1.639 17919 8039 1 20 . 1 1 41 41 GLN H H 41 7.480 7.480 7.366 0.114 17919 8040 1 20 . 1 1 42 42 ARG N N 42 122.680 122.680 122.994 -0.314 17919 8041 1 20 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.690 -0.190 17919 8042 1 20 . 1 1 42 42 ARG C C 42 174.050 174.050 174.215 -0.165 17919 8043 1 20 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.133 -0.083 17919 8044 1 20 . 1 1 42 42 ARG CB C 42 31.750 31.750 34.571 -2.821 17919 8045 1 20 . 1 1 42 42 ARG H H 42 8.530 8.530 8.626 -0.096 17919 8046 1 20 . 1 1 43 43 LEU N N 43 124.040 124.040 124.585 -0.545 17919 8047 1 20 . 1 1 43 43 LEU C C 43 175.290 175.290 175.612 -0.322 17919 8048 1 20 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.812 -0.832 17919 8049 1 20 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.038 2.752 17919 8050 1 20 . 1 1 43 43 LEU H H 43 8.820 8.820 8.842 -0.022 17919 8051 1 20 . 1 1 44 44 ILE N N 44 121.920 121.920 123.247 -1.327 17919 8052 1 20 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.014 -0.022 17919 8053 1 20 . 1 1 44 44 ILE C C 44 176.060 176.060 175.120 0.940 17919 8054 1 20 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.786 -0.806 17919 8055 1 20 . 1 1 44 44 ILE CB C 44 41.420 41.420 39.069 2.352 17919 8056 1 20 . 1 1 44 44 ILE H H 44 9.030 9.030 8.768 0.262 17919 8057 1 20 . 1 1 45 45 PHE N N 45 125.390 125.390 127.769 -2.379 17919 8058 1 20 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.862 0.183 17919 8059 1 20 . 1 1 45 45 PHE C C 45 174.470 174.470 173.865 0.605 17919 8060 1 20 . 1 1 45 45 PHE CA C 45 57.020 57.020 57.438 -0.418 17919 8061 1 20 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.569 1.191 17919 8062 1 20 . 1 1 45 45 PHE H H 45 8.830 8.830 9.082 -0.252 17919 8063 1 20 . 1 1 46 46 ALA N N 46 132.200 132.200 130.191 2.009 17919 8064 1 20 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.683 0.007 17919 8065 1 20 . 1 1 46 46 ALA C C 46 177.290 177.290 177.783 -0.493 17919 8066 1 20 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.593 -0.053 17919 8067 1 20 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.640 -0.070 17919 8068 1 20 . 1 1 46 46 ALA H H 46 8.810 8.810 8.510 0.300 17919 8069 1 20 . 1 1 47 47 GLY N N 47 102.340 102.340 104.121 -1.781 17919 8070 1 20 . 1 1 47 47 GLY C C 47 173.810 173.810 174.398 -0.588 17919 8071 1 20 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.630 -0.280 17919 8072 1 20 . 1 1 47 47 GLY H H 47 8.130 8.130 8.528 -0.398 17919 8073 1 20 . 1 1 48 48 LYS N N 48 121.570 121.570 120.250 1.320 17919 8074 1 20 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.609 0.013 17919 8075 1 20 . 1 1 48 48 LYS C C 48 174.700 174.700 175.428 -0.728 17919 8076 1 20 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.058 -0.508 17919 8077 1 20 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.707 -0.177 17919 8078 1 20 . 1 1 48 48 LYS H H 48 7.980 7.980 7.708 0.272 17919 8079 1 20 . 1 1 49 49 GLN N N 49 122.410 122.410 121.573 0.837 17919 8080 1 20 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.718 -0.158 17919 8081 1 20 . 1 1 49 49 GLN C C 49 175.670 175.670 175.271 0.399 17919 8082 1 20 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.673 0.067 17919 8083 1 20 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.989 -0.989 17919 8084 1 20 . 1 1 49 49 GLN H H 49 8.600 8.600 8.544 0.056 17919 8085 1 20 . 1 1 50 50 LEU N N 50 125.520 125.520 124.172 1.348 17919 8086 1 20 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.286 -0.196 17919 8087 1 20 . 1 1 50 50 LEU C C 50 176.660 176.660 176.042 0.618 17919 8088 1 20 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.888 0.352 17919 8089 1 20 . 1 1 50 50 LEU CB C 50 41.570 41.570 43.029 -1.459 17919 8090 1 20 . 1 1 50 50 LEU H H 50 8.530 8.530 8.132 0.398 17919 8091 1 20 . 1 1 51 51 GLU N N 51 122.940 122.940 124.339 -1.399 17919 8092 1 20 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.447 0.041 17919 8093 1 20 . 1 1 51 51 GLU C C 51 175.870 175.870 176.791 -0.921 17919 8094 1 20 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.365 0.595 17919 8095 1 20 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.710 -0.140 17919 8096 1 20 . 1 1 51 51 GLU H H 51 8.400 8.400 8.417 -0.017 17919 8097 1 20 . 1 1 52 52 ASP N N 52 120.030 120.030 126.948 -6.918 17919 8098 1 20 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.451 -0.092 17919 8099 1 20 . 1 1 52 52 ASP C C 52 177.330 177.330 178.058 -0.728 17919 8100 1 20 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.398 -0.438 17919 8101 1 20 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.584 0.266 17919 8102 1 20 . 1 1 52 52 ASP H H 52 8.160 8.160 8.883 -0.723 17919 8103 1 20 . 1 1 53 53 GLY N N 53 106.660 106.660 105.964 0.696 17919 8104 1 20 . 1 1 53 53 GLY C C 53 174.870 174.870 174.395 0.475 17919 8105 1 20 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.044 0.126 17919 8106 1 20 . 1 1 53 53 GLY H H 53 9.390 9.390 8.510 0.880 17919 8107 1 20 . 1 1 54 54 ARG N N 54 119.050 119.050 120.966 -1.916 17919 8108 1 20 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.669 0.026 17919 8109 1 20 . 1 1 54 54 ARG C C 54 175.350 175.350 175.351 -0.001 17919 8110 1 20 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.750 -0.360 17919 8111 1 20 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.080 0.570 17919 8112 1 20 . 1 1 54 54 ARG H H 54 7.460 7.460 7.655 -0.195 17919 8113 1 20 . 1 1 55 55 THR N N 55 108.400 108.400 114.247 -5.847 17919 8114 1 20 . 1 1 55 55 THR HA H 55 5.240 5.240 4.705 0.535 17919 8115 1 20 . 1 1 55 55 THR C C 55 176.560 176.560 176.142 0.418 17919 8116 1 20 . 1 1 55 55 THR CA C 55 59.690 59.690 61.782 -2.092 17919 8117 1 20 . 1 1 55 55 THR CB C 55 72.260 72.260 70.263 1.997 17919 8118 1 20 . 1 1 55 55 THR H H 55 8.730 8.730 8.130 0.600 17919 8119 1 20 . 1 1 56 56 LEU N N 56 117.920 117.920 121.793 -3.873 17919 8120 1 20 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.017 0.043 17919 8121 1 20 . 1 1 56 56 LEU C C 56 180.810 180.810 178.883 1.927 17919 8122 1 20 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.510 0.200 17919 8123 1 20 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.327 -0.957 17919 8124 1 20 . 1 1 56 56 LEU H H 56 8.140 8.140 8.623 -0.483 17919 8125 1 20 . 1 1 57 57 SER N N 57 113.330 113.330 113.652 -0.322 17919 8126 1 20 . 1 1 57 57 SER HA H 57 4.370 4.370 4.047 0.323 17919 8127 1 20 . 1 1 57 57 SER C C 57 178.310 178.310 176.532 1.778 17919 8128 1 20 . 1 1 57 57 SER CA C 57 61.080 61.080 62.134 -1.054 17919 8129 1 20 . 1 1 57 57 SER CB C 57 62.530 62.530 62.591 -0.061 17919 8130 1 20 . 1 1 57 57 SER H H 57 8.470 8.470 7.996 0.474 17919 8131 1 20 . 1 1 58 58 ASP N N 58 124.190 124.190 121.645 2.545 17919 8132 1 20 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.292 0.004 17919 8133 1 20 . 1 1 58 58 ASP C C 58 177.400 177.400 177.119 0.281 17919 8134 1 20 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.383 0.797 17919 8135 1 20 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.499 -0.399 17919 8136 1 20 . 1 1 58 58 ASP H H 58 7.930 7.930 7.682 0.248 17919 8137 1 20 . 1 1 59 59 TYR N N 59 115.510 115.510 115.759 -0.249 17919 8138 1 20 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.626 0.044 17919 8139 1 20 . 1 1 59 59 TYR C C 59 174.700 174.700 174.886 -0.186 17919 8140 1 20 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.960 0.290 17919 8141 1 20 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.568 1.502 17919 8142 1 20 . 1 1 59 59 TYR H H 59 7.250 7.250 7.339 -0.089 17919 8143 1 20 . 1 1 60 60 ASN N N 60 115.900 115.900 116.869 -0.969 17919 8144 1 20 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.330 0.025 17919 8145 1 20 . 1 1 60 60 ASN C C 60 174.340 174.340 174.772 -0.432 17919 8146 1 20 . 1 1 60 60 ASN CA C 60 54.120 54.120 53.924 0.196 17919 8147 1 20 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.357 0.053 17919 8148 1 20 . 1 1 60 60 ASN H H 60 8.150 8.150 7.580 0.570 17919 8149 1 20 . 1 1 61 61 ILE N N 61 118.600 118.600 121.295 -2.695 17919 8150 1 20 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.759 -0.366 17919 8151 1 20 . 1 1 61 61 ILE C C 61 174.610 174.610 174.991 -0.381 17919 8152 1 20 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.793 0.627 17919 8153 1 20 . 1 1 61 61 ILE CB C 61 36.740 36.740 36.590 0.150 17919 8154 1 20 . 1 1 61 61 ILE H H 61 7.250 7.250 7.722 -0.472 17919 8155 1 20 . 1 1 62 62 GLN N N 62 124.740 124.740 126.075 -1.335 17919 8156 1 20 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.467 0.039 17919 8157 1 20 . 1 1 62 62 GLN C C 62 175.970 175.970 176.098 -0.128 17919 8158 1 20 . 1 1 62 62 GLN CA C 62 53.660 53.660 54.297 -0.637 17919 8159 1 20 . 1 1 62 62 GLN CB C 62 31.650 31.650 30.111 1.539 17919 8160 1 20 . 1 1 62 62 GLN H H 62 7.610 7.610 7.788 -0.178 17919 8161 1 20 . 1 1 63 63 LYS N N 63 120.300 120.300 120.099 0.201 17919 8162 1 20 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.053 -0.052 17919 8163 1 20 . 1 1 63 63 LYS C C 63 175.810 175.810 176.863 -1.053 17919 8164 1 20 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.836 -0.046 17919 8165 1 20 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.673 0.977 17919 8166 1 20 . 1 1 63 63 LYS H H 63 8.490 8.490 8.649 -0.159 17919 8167 1 20 . 1 1 64 64 GLU N N 64 113.950 113.950 120.126 -6.176 17919 8168 1 20 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.845 -0.380 17919 8169 1 20 . 1 1 64 64 GLU C C 64 175.250 175.250 175.697 -0.447 17919 8170 1 20 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.662 0.228 17919 8171 1 20 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.545 -2.645 17919 8172 1 20 . 1 1 64 64 GLU H H 64 9.280 9.280 9.068 0.212 17919 8173 1 20 . 1 1 65 65 SER N N 65 114.730 114.730 115.326 -0.596 17919 8174 1 20 . 1 1 65 65 SER HA H 65 4.640 4.640 4.510 0.130 17919 8175 1 20 . 1 1 65 65 SER C C 65 172.160 172.160 174.603 -2.443 17919 8176 1 20 . 1 1 65 65 SER CA C 65 60.890 60.890 60.393 0.497 17919 8177 1 20 . 1 1 65 65 SER CB C 65 64.910 64.910 63.770 1.140 17919 8178 1 20 . 1 1 65 65 SER H H 65 7.670 7.670 7.613 0.057 17919 8179 1 20 . 1 1 66 66 THR N N 66 117.110 117.110 123.074 -5.964 17919 8180 1 20 . 1 1 66 66 THR HA H 66 5.270 5.270 5.009 0.261 17919 8181 1 20 . 1 1 66 66 THR C C 66 173.950 173.950 174.463 -0.513 17919 8182 1 20 . 1 1 66 66 THR CA C 66 62.340 62.340 63.065 -0.725 17919 8183 1 20 . 1 1 66 66 THR CB C 66 70.080 70.080 69.559 0.521 17919 8184 1 20 . 1 1 66 66 THR H H 66 8.730 8.730 8.377 0.353 17919 8185 1 20 . 1 1 67 67 LEU N N 67 127.110 127.110 127.751 -0.641 17919 8186 1 20 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.954 0.106 17919 8187 1 20 . 1 1 67 67 LEU C C 67 175.770 175.770 175.555 0.215 17919 8188 1 20 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.296 0.604 17919 8189 1 20 . 1 1 67 67 LEU CB C 67 44.260 44.260 45.082 -0.822 17919 8190 1 20 . 1 1 67 67 LEU H H 67 9.410 9.410 8.879 0.531 17919 8191 1 20 . 1 1 68 68 HIS N N 68 118.380 118.380 119.888 -1.508 17919 8192 1 20 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.162 0.078 17919 8193 1 20 . 1 1 68 68 HIS C C 68 173.150 173.150 174.688 -1.538 17919 8194 1 20 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.541 0.459 17919 8195 1 20 . 1 1 68 68 HIS CB C 68 30.530 30.530 30.413 0.117 17919 8196 1 20 . 1 1 68 68 HIS H H 68 9.230 9.230 8.648 0.582 17919 8197 1 20 . 1 1 69 69 LEU N N 69 124.460 124.460 129.255 -4.795 17919 8198 1 20 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.699 0.491 17919 8199 1 20 . 1 1 69 69 LEU C C 69 175.270 175.270 175.091 0.179 17919 8200 1 20 . 1 1 69 69 LEU CA C 69 53.890 53.890 55.190 -1.300 17919 8201 1 20 . 1 1 69 69 LEU CB C 69 44.380 44.380 42.055 2.325 17919 8202 1 20 . 1 1 69 69 LEU H H 69 8.340 8.340 7.995 0.345 17919 8203 1 20 . 1 1 70 70 VAL N N 70 126.940 126.940 127.749 -0.809 17919 8204 1 20 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.327 0.023 17919 8205 1 20 . 1 1 70 70 VAL C C 70 174.000 174.000 174.407 -0.407 17919 8206 1 20 . 1 1 70 70 VAL CA C 70 60.800 60.800 61.247 -0.447 17919 8207 1 20 . 1 1 70 70 VAL CB C 70 34.910 34.910 34.856 0.054 17919 8208 1 20 . 1 1 70 70 VAL H H 70 9.200 9.200 9.003 0.197 17919 8209 1 20 . 1 1 71 71 LEU N N 71 123.130 123.130 125.695 -2.565 17919 8210 1 20 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.147 -0.087 17919 8211 1 20 . 1 1 71 71 LEU C C 71 177.830 177.830 175.999 1.831 17919 8212 1 20 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.767 0.173 17919 8213 1 20 . 1 1 71 71 LEU CB C 71 42.850 42.850 44.321 -1.471 17919 8214 1 20 . 1 1 71 71 LEU H H 71 8.120 8.120 8.389 -0.269 17919 8215 1 20 . 1 1 72 72 ARG N N 72 123.490 123.490 125.819 -2.329 17919 8216 1 20 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.583 -0.282 17919 8217 1 20 . 1 1 72 72 ARG C C 72 175.350 175.350 175.439 -0.089 17919 8218 1 20 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.542 0.068 17919 8219 1 20 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.886 0.464 17919 8220 1 20 . 1 1 72 72 ARG H H 72 8.580 8.580 8.534 0.046 17919 8221 1 21 . 1 1 2 2 GLN N N 2 123.220 123.220 120.733 2.487 17919 8222 1 21 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.527 -0.278 17919 8223 1 21 . 1 1 2 2 GLN C C 2 175.920 175.920 174.410 1.510 17919 8224 1 21 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.094 0.986 17919 8225 1 21 . 1 1 2 2 GLN CB C 2 30.760 30.760 31.778 -1.018 17919 8226 1 21 . 1 1 2 2 GLN H H 2 8.900 8.900 8.401 0.499 17919 8227 1 21 . 1 1 3 3 ILE N N 3 115.340 115.340 118.816 -3.476 17919 8228 1 21 . 1 1 3 3 ILE HA H 3 4.213 4.213 3.993 0.220 17919 8229 1 21 . 1 1 3 3 ILE C C 3 172.450 172.450 173.389 -0.939 17919 8230 1 21 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.782 -0.212 17919 8231 1 21 . 1 1 3 3 ILE CB C 3 42.210 42.210 40.900 1.310 17919 8232 1 21 . 1 1 3 3 ILE H H 3 8.320 8.320 8.072 0.248 17919 8233 1 21 . 1 1 4 4 PHE N N 4 118.110 118.110 120.537 -2.427 17919 8234 1 21 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.531 0.099 17919 8235 1 21 . 1 1 4 4 PHE C C 4 175.320 175.320 175.121 0.199 17919 8236 1 21 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.303 -0.093 17919 8237 1 21 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.644 -1.164 17919 8238 1 21 . 1 1 4 4 PHE H H 4 8.610 8.610 7.770 0.840 17919 8239 1 21 . 1 1 5 5 VAL N N 5 121.000 121.000 120.760 0.240 17919 8240 1 21 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.868 -0.143 17919 8241 1 21 . 1 1 5 5 VAL C C 5 174.870 174.870 174.824 0.046 17919 8242 1 21 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.394 -0.774 17919 8243 1 21 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.081 0.149 17919 8244 1 21 . 1 1 5 5 VAL H H 5 9.300 9.300 8.766 0.534 17919 8245 1 21 . 1 1 6 6 LYS N N 6 127.520 127.520 129.783 -2.263 17919 8246 1 21 . 1 1 6 6 LYS HA H 6 5.367 5.367 4.953 0.414 17919 8247 1 21 . 1 1 6 6 LYS C C 6 177.140 177.140 176.963 0.177 17919 8248 1 21 . 1 1 6 6 LYS CA C 6 54.520 54.520 55.474 -0.954 17919 8249 1 21 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.282 0.768 17919 8250 1 21 . 1 1 6 6 LYS H H 6 8.820 8.820 8.595 0.225 17919 8251 1 21 . 1 1 7 7 THR N N 7 115.400 115.400 119.086 -3.686 17919 8252 1 21 . 1 1 7 7 THR HA H 7 4.970 4.970 4.422 0.548 17919 8253 1 21 . 1 1 7 7 THR C C 7 176.910 176.910 176.063 0.847 17919 8254 1 21 . 1 1 7 7 THR CA C 7 60.470 60.470 61.252 -0.782 17919 8255 1 21 . 1 1 7 7 THR CB C 7 70.630 70.630 70.046 0.584 17919 8256 1 21 . 1 1 7 7 THR H H 7 8.730 8.730 8.128 0.602 17919 8257 1 21 . 1 1 8 8 LEU N N 8 121.330 121.330 118.820 2.510 17919 8258 1 21 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.361 -0.051 17919 8259 1 21 . 1 1 8 8 LEU C C 8 178.800 178.800 178.634 0.166 17919 8260 1 21 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.014 0.566 17919 8261 1 21 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.047 -0.077 17919 8262 1 21 . 1 1 8 8 LEU H H 8 9.100 9.100 8.667 0.433 17919 8263 1 21 . 1 1 9 9 THR N N 9 105.590 105.590 110.207 -4.617 17919 8264 1 21 . 1 1 9 9 THR HA H 9 4.428 4.428 4.279 0.149 17919 8265 1 21 . 1 1 9 9 THR C C 9 175.520 175.520 175.547 -0.027 17919 8266 1 21 . 1 1 9 9 THR CA C 9 61.400 61.400 62.496 -1.096 17919 8267 1 21 . 1 1 9 9 THR CB C 9 69.140 69.140 68.920 0.220 17919 8268 1 21 . 1 1 9 9 THR H H 9 7.630 7.630 7.767 -0.137 17919 8269 1 21 . 1 1 10 10 GLY N N 10 108.890 108.890 110.732 -1.842 17919 8270 1 21 . 1 1 10 10 GLY C C 10 174.070 174.070 173.784 0.286 17919 8271 1 21 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.007 0.453 17919 8272 1 21 . 1 1 10 10 GLY H H 10 7.810 7.810 7.975 -0.165 17919 8273 1 21 . 1 1 11 11 LYS N N 11 121.600 121.600 121.030 0.570 17919 8274 1 21 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.404 -0.043 17919 8275 1 21 . 1 1 11 11 LYS C C 11 175.940 175.940 175.576 0.364 17919 8276 1 21 . 1 1 11 11 LYS CA C 11 56.280 56.280 55.950 0.330 17919 8277 1 21 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.350 -0.150 17919 8278 1 21 . 1 1 11 11 LYS H H 11 7.280 7.280 7.516 -0.236 17919 8279 1 21 . 1 1 12 12 THR N N 12 120.440 120.440 118.426 2.014 17919 8280 1 21 . 1 1 12 12 THR HA H 12 5.046 5.046 4.596 0.450 17919 8281 1 21 . 1 1 12 12 THR C C 12 174.320 174.320 174.058 0.262 17919 8282 1 21 . 1 1 12 12 THR CA C 12 62.390 62.390 61.434 0.955 17919 8283 1 21 . 1 1 12 12 THR CB C 12 69.910 69.910 69.931 -0.021 17919 8284 1 21 . 1 1 12 12 THR H H 12 8.650 8.650 8.264 0.386 17919 8285 1 21 . 1 1 13 13 ILE N N 13 127.110 127.110 127.774 -0.664 17919 8286 1 21 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.591 -0.047 17919 8287 1 21 . 1 1 13 13 ILE C C 13 175.220 175.220 174.850 0.370 17919 8288 1 21 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.298 -0.318 17919 8289 1 21 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.548 0.402 17919 8290 1 21 . 1 1 13 13 ILE H H 13 9.450 9.450 8.217 1.233 17919 8291 1 21 . 1 1 14 14 THR N N 14 121.520 121.520 120.547 0.973 17919 8292 1 21 . 1 1 14 14 THR HA H 14 4.964 4.964 5.431 -0.467 17919 8293 1 21 . 1 1 14 14 THR C C 14 173.790 173.790 173.543 0.247 17919 8294 1 21 . 1 1 14 14 THR CA C 14 61.940 61.940 59.789 2.151 17919 8295 1 21 . 1 1 14 14 THR CB C 14 69.650 69.650 70.667 -1.017 17919 8296 1 21 . 1 1 14 14 THR H H 14 8.710 8.710 8.352 0.358 17919 8297 1 21 . 1 1 15 15 LEU N N 15 124.800 124.800 125.769 -0.969 17919 8298 1 21 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.706 0.074 17919 8299 1 21 . 1 1 15 15 LEU C C 15 174.670 174.670 175.580 -0.910 17919 8300 1 21 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.819 -0.989 17919 8301 1 21 . 1 1 15 15 LEU CB C 15 47.070 47.070 46.911 0.159 17919 8302 1 21 . 1 1 15 15 LEU H H 15 8.710 8.710 8.900 -0.190 17919 8303 1 21 . 1 1 16 16 GLU N N 16 122.160 122.160 123.835 -1.675 17919 8304 1 21 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.954 -0.037 17919 8305 1 21 . 1 1 16 16 GLU C C 16 175.860 175.860 175.983 -0.123 17919 8306 1 21 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.277 -0.457 17919 8307 1 21 . 1 1 16 16 GLU CB C 16 29.450 29.450 29.629 -0.179 17919 8308 1 21 . 1 1 16 16 GLU H H 16 8.140 8.140 8.571 -0.431 17919 8309 1 21 . 1 1 17 17 VAL N N 17 117.210 117.210 118.116 -0.906 17919 8310 1 21 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.511 0.203 17919 8311 1 21 . 1 1 17 17 VAL C C 17 174.160 174.160 174.643 -0.483 17919 8312 1 21 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.867 -0.437 17919 8313 1 21 . 1 1 17 17 VAL CB C 17 36.400 36.400 34.797 1.603 17919 8314 1 21 . 1 1 17 17 VAL H H 17 8.900 8.900 8.688 0.212 17919 8315 1 21 . 1 1 18 18 GLU N N 18 118.990 118.990 121.115 -2.125 17919 8316 1 21 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.790 0.289 17919 8317 1 21 . 1 1 18 18 GLU C C 18 176.160 176.160 175.224 0.936 17919 8318 1 21 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.905 -0.185 17919 8319 1 21 . 1 1 18 18 GLU CB C 18 30.310 30.310 29.943 0.367 17919 8320 1 21 . 1 1 18 18 GLU H H 18 8.640 8.640 8.113 0.527 17919 8321 1 21 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.157 -0.016 17919 8322 1 21 . 1 1 19 19 PRO C C 19 175.310 175.310 177.659 -2.349 17919 8323 1 21 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.925 -0.455 17919 8324 1 21 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.966 -0.016 17919 8325 1 21 . 1 1 20 20 SER N N 20 103.400 103.400 109.176 -5.776 17919 8326 1 21 . 1 1 20 20 SER HA H 20 4.370 4.370 4.365 0.005 17919 8327 1 21 . 1 1 20 20 SER C C 20 174.660 174.660 173.763 0.897 17919 8328 1 21 . 1 1 20 20 SER CA C 20 57.400 57.400 58.886 -1.486 17919 8329 1 21 . 1 1 20 20 SER CB C 20 63.370 63.370 62.501 0.869 17919 8330 1 21 . 1 1 20 20 SER H H 20 7.040 7.040 8.013 -0.973 17919 8331 1 21 . 1 1 21 21 ASP N N 21 123.480 123.480 124.069 -0.589 17919 8332 1 21 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.581 0.114 17919 8333 1 21 . 1 1 21 21 ASP C C 21 176.360 176.360 175.188 1.172 17919 8334 1 21 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.034 0.666 17919 8335 1 21 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.495 -0.695 17919 8336 1 21 . 1 1 21 21 ASP H H 21 8.030 8.030 7.512 0.518 17919 8337 1 21 . 1 1 22 22 THR N N 22 108.800 108.800 116.600 -7.800 17919 8338 1 21 . 1 1 22 22 THR HA H 22 4.920 4.920 4.494 0.426 17919 8339 1 21 . 1 1 22 22 THR C C 22 176.750 176.750 175.733 1.017 17919 8340 1 21 . 1 1 22 22 THR CA C 22 59.690 59.690 61.705 -2.015 17919 8341 1 21 . 1 1 22 22 THR CB C 22 71.200 71.200 69.690 1.510 17919 8342 1 21 . 1 1 22 22 THR H H 22 7.900 7.900 8.429 -0.529 17919 8343 1 21 . 1 1 23 23 ILE N N 23 121.190 121.190 122.739 -1.549 17919 8344 1 21 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.818 -0.161 17919 8345 1 21 . 1 1 23 23 ILE C C 23 179.040 179.040 177.797 1.243 17919 8346 1 21 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.101 0.159 17919 8347 1 21 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.007 -1.657 17919 8348 1 21 . 1 1 23 23 ILE H H 23 8.560 8.560 8.758 -0.198 17919 8349 1 21 . 1 1 24 24 GLU N N 24 120.830 120.830 120.815 0.015 17919 8350 1 21 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.916 0.001 17919 8351 1 21 . 1 1 24 24 GLU C C 24 178.640 178.640 178.282 0.358 17919 8352 1 21 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.894 0.326 17919 8353 1 21 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.168 -0.888 17919 8354 1 21 . 1 1 24 24 GLU H H 24 9.760 9.760 8.412 1.348 17919 8355 1 21 . 1 1 25 25 ASN N N 25 120.570 120.570 117.137 3.433 17919 8356 1 21 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.533 -0.008 17919 8357 1 21 . 1 1 25 25 ASN C C 25 178.380 178.380 177.856 0.524 17919 8358 1 21 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.837 0.223 17919 8359 1 21 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.431 0.019 17919 8360 1 21 . 1 1 25 25 ASN H H 25 7.920 7.920 8.171 -0.251 17919 8361 1 21 . 1 1 26 26 VAL N N 26 121.710 121.710 121.675 0.035 17919 8362 1 21 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.748 -0.351 17919 8363 1 21 . 1 1 26 26 VAL C C 26 177.950 177.950 177.706 0.244 17919 8364 1 21 . 1 1 26 26 VAL CA C 26 67.660 67.660 65.937 1.723 17919 8365 1 21 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.732 -0.892 17919 8366 1 21 . 1 1 26 26 VAL H H 26 8.070 8.070 8.357 -0.287 17919 8367 1 21 . 1 1 27 27 LYS N N 27 118.860 118.860 120.276 -1.416 17919 8368 1 21 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.216 0.364 17919 8369 1 21 . 1 1 27 27 LYS C C 27 180.550 180.550 179.013 1.537 17919 8370 1 21 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.794 -0.544 17919 8371 1 21 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.271 1.459 17919 8372 1 21 . 1 1 27 27 LYS H H 27 8.560 8.560 8.596 -0.036 17919 8373 1 21 . 1 1 28 28 ALA N N 28 123.440 123.440 121.661 1.779 17919 8374 1 21 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.044 0.116 17919 8375 1 21 . 1 1 28 28 ALA C C 28 180.300 180.300 179.280 1.020 17919 8376 1 21 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.940 0.430 17919 8377 1 21 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.045 -0.335 17919 8378 1 21 . 1 1 28 28 ALA H H 28 8.060 8.060 7.804 0.256 17919 8379 1 21 . 1 1 29 29 LYS N N 29 119.940 119.940 119.341 0.599 17919 8380 1 21 . 1 1 29 29 LYS HA H 29 4.207 4.207 3.924 0.283 17919 8381 1 21 . 1 1 29 29 LYS C C 29 180.320 180.320 179.057 1.263 17919 8382 1 21 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.611 0.040 17919 8383 1 21 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.246 1.044 17919 8384 1 21 . 1 1 29 29 LYS H H 29 7.850 7.850 7.553 0.297 17919 8385 1 21 . 1 1 30 30 ILE N N 30 121.080 121.080 118.862 2.218 17919 8386 1 21 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.670 -0.163 17919 8387 1 21 . 1 1 30 30 ILE C C 30 178.310 178.310 177.418 0.892 17919 8388 1 21 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.291 0.859 17919 8389 1 21 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.367 -0.568 17919 8390 1 21 . 1 1 30 30 ILE H H 30 8.280 8.280 7.587 0.693 17919 8391 1 21 . 1 1 31 31 GLN N N 31 123.490 123.490 121.229 2.261 17919 8392 1 21 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.015 -0.186 17919 8393 1 21 . 1 1 31 31 GLN C C 31 178.890 178.890 178.109 0.781 17919 8394 1 21 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.393 0.607 17919 8395 1 21 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.385 -0.665 17919 8396 1 21 . 1 1 31 31 GLN H H 31 8.580 8.580 7.968 0.612 17919 8397 1 21 . 1 1 32 32 ASP N N 32 119.360 119.360 119.217 0.143 17919 8398 1 21 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.382 -0.028 17919 8399 1 21 . 1 1 32 32 ASP C C 32 177.250 177.250 178.328 -1.078 17919 8400 1 21 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.901 0.289 17919 8401 1 21 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.881 -0.301 17919 8402 1 21 . 1 1 32 32 ASP H H 32 8.010 8.010 8.049 -0.039 17919 8403 1 21 . 1 1 33 33 LYS N N 33 115.130 115.130 118.696 -3.566 17919 8404 1 21 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.231 0.106 17919 8405 1 21 . 1 1 33 33 LYS C C 33 177.870 177.870 178.071 -0.201 17919 8406 1 21 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.117 -0.067 17919 8407 1 21 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.284 0.886 17919 8408 1 21 . 1 1 33 33 LYS H H 33 7.430 7.430 7.780 -0.350 17919 8409 1 21 . 1 1 34 34 GLU N N 34 113.870 113.870 115.855 -1.985 17919 8410 1 21 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.484 0.141 17919 8411 1 21 . 1 1 34 34 GLU C C 34 177.840 177.840 176.648 1.192 17919 8412 1 21 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.327 -0.157 17919 8413 1 21 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.599 1.061 17919 8414 1 21 . 1 1 34 34 GLU H H 34 8.740 8.740 8.234 0.506 17919 8415 1 21 . 1 1 35 35 GLY N N 35 108.650 108.650 107.513 1.137 17919 8416 1 21 . 1 1 35 35 GLY C C 35 173.960 173.960 174.515 -0.555 17919 8417 1 21 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.684 0.396 17919 8418 1 21 . 1 1 35 35 GLY H H 35 8.530 8.530 7.812 0.718 17919 8419 1 21 . 1 1 36 36 ILE N N 36 119.880 119.880 122.685 -2.805 17919 8420 1 21 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.336 0.109 17919 8421 1 21 . 1 1 36 36 ILE C C 36 173.590 173.590 174.932 -1.342 17919 8422 1 21 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.164 -0.414 17919 8423 1 21 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.449 2.131 17919 8424 1 21 . 1 1 36 36 ILE H H 36 6.150 6.150 7.778 -1.628 17919 8425 1 21 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.562 0.072 17919 8426 1 21 . 1 1 37 37 PRO C C 37 176.940 176.940 176.155 0.785 17919 8427 1 21 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.748 -0.088 17919 8428 1 21 . 1 1 37 37 PRO CB C 37 31.850 31.850 30.877 0.973 17919 8429 1 21 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.078 0.039 17919 8430 1 21 . 1 1 38 38 PRO C C 38 178.320 178.320 179.023 -0.703 17919 8431 1 21 . 1 1 38 38 PRO CA C 38 66.260 66.260 66.171 0.089 17919 8432 1 21 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.848 1.042 17919 8433 1 21 . 1 1 39 39 ASP N N 39 113.380 113.380 116.452 -3.072 17919 8434 1 21 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.399 0.031 17919 8435 1 21 . 1 1 39 39 ASP C C 39 177.090 177.090 177.538 -0.448 17919 8436 1 21 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.494 -0.854 17919 8437 1 21 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.536 -0.996 17919 8438 1 21 . 1 1 39 39 ASP H H 39 8.550 8.550 8.451 0.099 17919 8439 1 21 . 1 1 40 40 GLN N N 40 116.780 116.780 117.272 -0.492 17919 8440 1 21 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.090 0.374 17919 8441 1 21 . 1 1 40 40 GLN C C 40 175.380 175.380 176.316 -0.936 17919 8442 1 21 . 1 1 40 40 GLN CA C 40 55.640 55.640 57.728 -2.088 17919 8443 1 21 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.317 0.823 17919 8444 1 21 . 1 1 40 40 GLN H H 40 7.820 7.820 7.786 0.034 17919 8445 1 21 . 1 1 41 41 GLN N N 41 117.720 117.720 118.762 -1.042 17919 8446 1 21 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.113 0.131 17919 8447 1 21 . 1 1 41 41 GLN C C 41 176.300 176.300 175.814 0.486 17919 8448 1 21 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.712 -0.241 17919 8449 1 21 . 1 1 41 41 GLN CB C 41 31.650 31.650 28.686 2.964 17919 8450 1 21 . 1 1 41 41 GLN H H 41 7.480 7.480 7.413 0.067 17919 8451 1 21 . 1 1 42 42 ARG N N 42 122.680 122.680 126.342 -3.662 17919 8452 1 21 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.548 -0.048 17919 8453 1 21 . 1 1 42 42 ARG C C 42 174.050 174.050 174.185 -0.135 17919 8454 1 21 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.215 -0.165 17919 8455 1 21 . 1 1 42 42 ARG CB C 42 31.750 31.750 31.729 0.021 17919 8456 1 21 . 1 1 42 42 ARG H H 42 8.530 8.530 8.654 -0.124 17919 8457 1 21 . 1 1 43 43 LEU N N 43 124.040 124.040 126.993 -2.953 17919 8458 1 21 . 1 1 43 43 LEU C C 43 175.290 175.290 175.570 -0.280 17919 8459 1 21 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.795 -0.815 17919 8460 1 21 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.686 1.104 17919 8461 1 21 . 1 1 43 43 LEU H H 43 8.820 8.820 8.753 0.067 17919 8462 1 21 . 1 1 44 44 ILE N N 44 121.920 121.920 122.257 -0.337 17919 8463 1 21 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.869 0.123 17919 8464 1 21 . 1 1 44 44 ILE C C 44 176.060 176.060 174.166 1.894 17919 8465 1 21 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.053 -1.073 17919 8466 1 21 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.922 -0.502 17919 8467 1 21 . 1 1 44 44 ILE H H 44 9.030 9.030 8.549 0.481 17919 8468 1 21 . 1 1 45 45 PHE N N 45 125.390 125.390 126.821 -1.431 17919 8469 1 21 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.113 -0.068 17919 8470 1 21 . 1 1 45 45 PHE C C 45 174.470 174.470 174.575 -0.105 17919 8471 1 21 . 1 1 45 45 PHE CA C 45 57.020 57.020 55.711 1.310 17919 8472 1 21 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.015 0.745 17919 8473 1 21 . 1 1 45 45 PHE H H 45 8.830 8.830 8.497 0.333 17919 8474 1 21 . 1 1 46 46 ALA N N 46 132.200 132.200 129.350 2.850 17919 8475 1 21 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.514 0.176 17919 8476 1 21 . 1 1 46 46 ALA C C 46 177.290 177.290 176.942 0.348 17919 8477 1 21 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.862 -0.322 17919 8478 1 21 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.023 0.547 17919 8479 1 21 . 1 1 46 46 ALA H H 46 8.810 8.810 8.766 0.044 17919 8480 1 21 . 1 1 47 47 GLY N N 47 102.340 102.340 103.648 -1.308 17919 8481 1 21 . 1 1 47 47 GLY C C 47 173.810 173.810 174.199 -0.389 17919 8482 1 21 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.207 0.143 17919 8483 1 21 . 1 1 47 47 GLY H H 47 8.130 8.130 8.332 -0.202 17919 8484 1 21 . 1 1 48 48 LYS N N 48 121.570 121.570 122.255 -0.685 17919 8485 1 21 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.545 0.077 17919 8486 1 21 . 1 1 48 48 LYS C C 48 174.700 174.700 175.020 -0.320 17919 8487 1 21 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.872 -0.322 17919 8488 1 21 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.199 0.331 17919 8489 1 21 . 1 1 48 48 LYS H H 48 7.980 7.980 7.743 0.237 17919 8490 1 21 . 1 1 49 49 GLN N N 49 122.410 122.410 127.322 -4.912 17919 8491 1 21 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.337 0.223 17919 8492 1 21 . 1 1 49 49 GLN C C 49 175.670 175.670 175.406 0.264 17919 8493 1 21 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.366 -0.626 17919 8494 1 21 . 1 1 49 49 GLN CB C 49 29.000 29.000 28.864 0.136 17919 8495 1 21 . 1 1 49 49 GLN H H 49 8.600 8.600 8.637 -0.037 17919 8496 1 21 . 1 1 50 50 LEU N N 50 125.520 125.520 130.169 -4.649 17919 8497 1 21 . 1 1 50 50 LEU HA H 50 4.090 4.090 3.812 0.278 17919 8498 1 21 . 1 1 50 50 LEU C C 50 176.660 176.660 176.057 0.603 17919 8499 1 21 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.763 -0.523 17919 8500 1 21 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.609 -0.040 17919 8501 1 21 . 1 1 50 50 LEU H H 50 8.530 8.530 8.659 -0.129 17919 8502 1 21 . 1 1 51 51 GLU N N 51 122.940 122.940 124.157 -1.217 17919 8503 1 21 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.598 -0.110 17919 8504 1 21 . 1 1 51 51 GLU C C 51 175.870 175.870 176.556 -0.686 17919 8505 1 21 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.119 0.841 17919 8506 1 21 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.978 -0.408 17919 8507 1 21 . 1 1 51 51 GLU H H 51 8.400 8.400 7.806 0.594 17919 8508 1 21 . 1 1 52 52 ASP N N 52 120.030 120.030 123.611 -3.581 17919 8509 1 21 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.512 -0.153 17919 8510 1 21 . 1 1 52 52 ASP C C 52 177.330 177.330 177.761 -0.431 17919 8511 1 21 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.252 -0.291 17919 8512 1 21 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.688 0.162 17919 8513 1 21 . 1 1 52 52 ASP H H 52 8.160 8.160 8.695 -0.535 17919 8514 1 21 . 1 1 53 53 GLY N N 53 106.660 106.660 105.697 0.963 17919 8515 1 21 . 1 1 53 53 GLY C C 53 174.870 174.870 174.645 0.225 17919 8516 1 21 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.783 0.387 17919 8517 1 21 . 1 1 53 53 GLY H H 53 9.390 9.390 8.522 0.868 17919 8518 1 21 . 1 1 54 54 ARG N N 54 119.050 119.050 119.912 -0.862 17919 8519 1 21 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.592 0.103 17919 8520 1 21 . 1 1 54 54 ARG C C 54 175.350 175.350 175.593 -0.243 17919 8521 1 21 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.693 -0.303 17919 8522 1 21 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.284 0.366 17919 8523 1 21 . 1 1 54 54 ARG H H 54 7.460 7.460 7.377 0.083 17919 8524 1 21 . 1 1 55 55 THR N N 55 108.400 108.400 112.453 -4.053 17919 8525 1 21 . 1 1 55 55 THR HA H 55 5.240 5.240 4.917 0.323 17919 8526 1 21 . 1 1 55 55 THR C C 55 176.560 176.560 176.119 0.441 17919 8527 1 21 . 1 1 55 55 THR CA C 55 59.690 59.690 60.650 -0.960 17919 8528 1 21 . 1 1 55 55 THR CB C 55 72.260 72.260 71.216 1.044 17919 8529 1 21 . 1 1 55 55 THR H H 55 8.730 8.730 8.841 -0.111 17919 8530 1 21 . 1 1 56 56 LEU N N 56 117.920 117.920 122.373 -4.453 17919 8531 1 21 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.895 0.165 17919 8532 1 21 . 1 1 56 56 LEU C C 56 180.810 180.810 179.024 1.786 17919 8533 1 21 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.555 0.155 17919 8534 1 21 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.293 -0.923 17919 8535 1 21 . 1 1 56 56 LEU H H 56 8.140 8.140 8.388 -0.248 17919 8536 1 21 . 1 1 57 57 SER N N 57 113.330 113.330 114.545 -1.215 17919 8537 1 21 . 1 1 57 57 SER HA H 57 4.370 4.370 4.094 0.276 17919 8538 1 21 . 1 1 57 57 SER C C 57 178.310 178.310 176.950 1.360 17919 8539 1 21 . 1 1 57 57 SER CA C 57 61.080 61.080 61.770 -0.690 17919 8540 1 21 . 1 1 57 57 SER CB C 57 62.530 62.530 62.503 0.027 17919 8541 1 21 . 1 1 57 57 SER H H 57 8.470 8.470 7.841 0.629 17919 8542 1 21 . 1 1 58 58 ASP N N 58 124.190 124.190 124.149 0.041 17919 8543 1 21 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.180 0.116 17919 8544 1 21 . 1 1 58 58 ASP C C 58 177.400 177.400 177.904 -0.504 17919 8545 1 21 . 1 1 58 58 ASP CA C 58 57.180 57.180 57.396 -0.216 17919 8546 1 21 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.173 -0.073 17919 8547 1 21 . 1 1 58 58 ASP H H 58 7.930 7.930 7.718 0.212 17919 8548 1 21 . 1 1 59 59 TYR N N 59 115.510 115.510 114.580 0.930 17919 8549 1 21 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.597 0.073 17919 8550 1 21 . 1 1 59 59 TYR C C 59 174.700 174.700 175.321 -0.621 17919 8551 1 21 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.565 0.685 17919 8552 1 21 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.245 1.825 17919 8553 1 21 . 1 1 59 59 TYR H H 59 7.250 7.250 7.224 0.026 17919 8554 1 21 . 1 1 60 60 ASN N N 60 115.900 115.900 117.781 -1.881 17919 8555 1 21 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.354 0.001 17919 8556 1 21 . 1 1 60 60 ASN C C 60 174.340 174.340 174.384 -0.044 17919 8557 1 21 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.132 -0.012 17919 8558 1 21 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.262 0.148 17919 8559 1 21 . 1 1 60 60 ASN H H 60 8.150 8.150 8.013 0.137 17919 8560 1 21 . 1 1 61 61 ILE N N 61 118.600 118.600 119.965 -1.365 17919 8561 1 21 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.630 -0.237 17919 8562 1 21 . 1 1 61 61 ILE C C 61 174.610 174.610 174.914 -0.304 17919 8563 1 21 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.251 1.169 17919 8564 1 21 . 1 1 61 61 ILE CB C 61 36.740 36.740 38.170 -1.430 17919 8565 1 21 . 1 1 61 61 ILE H H 61 7.250 7.250 7.908 -0.658 17919 8566 1 21 . 1 1 62 62 GLN N N 62 124.740 124.740 124.879 -0.139 17919 8567 1 21 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.649 -0.143 17919 8568 1 21 . 1 1 62 62 GLN C C 62 175.970 175.970 175.160 0.810 17919 8569 1 21 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.611 0.049 17919 8570 1 21 . 1 1 62 62 GLN CB C 62 31.650 31.650 32.942 -1.292 17919 8571 1 21 . 1 1 62 62 GLN H H 62 7.610 7.610 7.969 -0.359 17919 8572 1 21 . 1 1 63 63 LYS N N 63 120.300 120.300 120.606 -0.306 17919 8573 1 21 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.938 0.063 17919 8574 1 21 . 1 1 63 63 LYS C C 63 175.810 175.810 176.732 -0.922 17919 8575 1 21 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.781 0.009 17919 8576 1 21 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.674 0.977 17919 8577 1 21 . 1 1 63 63 LYS H H 63 8.490 8.490 8.668 -0.178 17919 8578 1 21 . 1 1 64 64 GLU N N 64 113.950 113.950 118.273 -4.323 17919 8579 1 21 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.543 -0.078 17919 8580 1 21 . 1 1 64 64 GLU C C 64 175.250 175.250 175.489 -0.239 17919 8581 1 21 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.470 0.420 17919 8582 1 21 . 1 1 64 64 GLU CB C 64 25.900 25.900 27.542 -1.642 17919 8583 1 21 . 1 1 64 64 GLU H H 64 9.280 9.280 8.794 0.486 17919 8584 1 21 . 1 1 65 65 SER N N 65 114.730 114.730 115.570 -0.840 17919 8585 1 21 . 1 1 65 65 SER HA H 65 4.640 4.640 4.505 0.135 17919 8586 1 21 . 1 1 65 65 SER C C 65 172.160 172.160 174.458 -2.298 17919 8587 1 21 . 1 1 65 65 SER CA C 65 60.890 60.890 59.450 1.440 17919 8588 1 21 . 1 1 65 65 SER CB C 65 64.910 64.910 63.678 1.232 17919 8589 1 21 . 1 1 65 65 SER H H 65 7.670 7.670 7.856 -0.186 17919 8590 1 21 . 1 1 66 66 THR N N 66 117.110 117.110 122.251 -5.141 17919 8591 1 21 . 1 1 66 66 THR HA H 66 5.270 5.270 4.740 0.530 17919 8592 1 21 . 1 1 66 66 THR C C 66 173.950 173.950 173.983 -0.033 17919 8593 1 21 . 1 1 66 66 THR CA C 66 62.340 62.340 62.459 -0.119 17919 8594 1 21 . 1 1 66 66 THR CB C 66 70.080 70.080 69.971 0.110 17919 8595 1 21 . 1 1 66 66 THR H H 66 8.730 8.730 8.481 0.249 17919 8596 1 21 . 1 1 67 67 LEU N N 67 127.110 127.110 127.460 -0.350 17919 8597 1 21 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.918 0.142 17919 8598 1 21 . 1 1 67 67 LEU C C 67 175.770 175.770 175.062 0.708 17919 8599 1 21 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.021 -0.121 17919 8600 1 21 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.096 0.164 17919 8601 1 21 . 1 1 67 67 LEU H H 67 9.410 9.410 9.232 0.178 17919 8602 1 21 . 1 1 68 68 HIS N N 68 118.380 118.380 123.069 -4.689 17919 8603 1 21 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.184 0.056 17919 8604 1 21 . 1 1 68 68 HIS C C 68 173.150 173.150 173.877 -0.727 17919 8605 1 21 . 1 1 68 68 HIS CA C 68 55.000 55.000 53.572 1.428 17919 8606 1 21 . 1 1 68 68 HIS CB C 68 30.530 30.530 31.752 -1.222 17919 8607 1 21 . 1 1 68 68 HIS H H 68 9.230 9.230 9.218 0.012 17919 8608 1 21 . 1 1 69 69 LEU N N 69 124.460 124.460 130.596 -6.136 17919 8609 1 21 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.942 0.248 17919 8610 1 21 . 1 1 69 69 LEU C C 69 175.270 175.270 174.579 0.691 17919 8611 1 21 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.607 -0.717 17919 8612 1 21 . 1 1 69 69 LEU CB C 69 44.380 44.380 43.294 1.086 17919 8613 1 21 . 1 1 69 69 LEU H H 69 8.340 8.340 7.805 0.535 17919 8614 1 21 . 1 1 70 70 VAL N N 70 126.940 126.940 125.914 1.026 17919 8615 1 21 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.215 0.135 17919 8616 1 21 . 1 1 70 70 VAL C C 70 174.000 174.000 174.622 -0.622 17919 8617 1 21 . 1 1 70 70 VAL CA C 70 60.800 60.800 61.014 -0.214 17919 8618 1 21 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.155 -0.245 17919 8619 1 21 . 1 1 70 70 VAL H H 70 9.200 9.200 8.859 0.341 17919 8620 1 21 . 1 1 71 71 LEU N N 71 123.130 123.130 123.356 -0.226 17919 8621 1 21 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.662 0.398 17919 8622 1 21 . 1 1 71 71 LEU C C 71 177.830 177.830 177.156 0.674 17919 8623 1 21 . 1 1 71 71 LEU CA C 71 53.940 53.940 54.038 -0.098 17919 8624 1 21 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.747 0.103 17919 8625 1 21 . 1 1 71 71 LEU H H 71 8.120 8.120 8.218 -0.098 17919 8626 1 21 . 1 1 72 72 ARG N N 72 123.490 123.490 123.490 0.000 17919 8627 1 21 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.252 0.049 17919 8628 1 21 . 1 1 72 72 ARG C C 72 175.350 175.350 174.832 0.518 17919 8629 1 21 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.983 -1.373 17919 8630 1 21 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.660 0.690 17919 8631 1 21 . 1 1 72 72 ARG H H 72 8.580 8.580 8.257 0.323 17919 8632 1 22 . 1 1 2 2 GLN N N 2 123.220 123.220 122.889 0.331 17919 8633 1 22 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.197 0.052 17919 8634 1 22 . 1 1 2 2 GLN C C 2 175.920 175.920 175.652 0.268 17919 8635 1 22 . 1 1 2 2 GLN CA C 2 55.080 55.080 55.342 -0.261 17919 8636 1 22 . 1 1 2 2 GLN CB C 2 30.760 30.760 29.838 0.922 17919 8637 1 22 . 1 1 2 2 GLN H H 2 8.900 8.900 8.450 0.450 17919 8638 1 22 . 1 1 3 3 ILE N N 3 115.340 115.340 115.610 -0.270 17919 8639 1 22 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.146 0.067 17919 8640 1 22 . 1 1 3 3 ILE C C 3 172.450 172.450 173.415 -0.965 17919 8641 1 22 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.631 -0.061 17919 8642 1 22 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.409 0.801 17919 8643 1 22 . 1 1 3 3 ILE H H 3 8.320 8.320 8.033 0.287 17919 8644 1 22 . 1 1 4 4 PHE N N 4 118.110 118.110 119.952 -1.842 17919 8645 1 22 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.059 0.571 17919 8646 1 22 . 1 1 4 4 PHE C C 4 175.320 175.320 175.020 0.300 17919 8647 1 22 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.980 -0.770 17919 8648 1 22 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.201 -0.721 17919 8649 1 22 . 1 1 4 4 PHE H H 4 8.610 8.610 8.037 0.573 17919 8650 1 22 . 1 1 5 5 VAL N N 5 121.000 121.000 122.067 -1.067 17919 8651 1 22 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.670 0.055 17919 8652 1 22 . 1 1 5 5 VAL C C 5 174.870 174.870 175.750 -0.880 17919 8653 1 22 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.287 -0.667 17919 8654 1 22 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.785 0.445 17919 8655 1 22 . 1 1 5 5 VAL H H 5 9.300 9.300 8.252 1.048 17919 8656 1 22 . 1 1 6 6 LYS N N 6 127.520 127.520 126.926 0.594 17919 8657 1 22 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.316 0.051 17919 8658 1 22 . 1 1 6 6 LYS C C 6 177.140 177.140 177.546 -0.406 17919 8659 1 22 . 1 1 6 6 LYS CA C 6 54.520 54.520 53.801 0.719 17919 8660 1 22 . 1 1 6 6 LYS CB C 6 35.050 35.050 33.386 1.664 17919 8661 1 22 . 1 1 6 6 LYS H H 6 8.820 8.820 8.781 0.039 17919 8662 1 22 . 1 1 7 7 THR N N 7 115.400 115.400 114.686 0.714 17919 8663 1 22 . 1 1 7 7 THR HA H 7 4.970 4.970 4.589 0.381 17919 8664 1 22 . 1 1 7 7 THR C C 7 176.910 176.910 176.771 0.139 17919 8665 1 22 . 1 1 7 7 THR CA C 7 60.470 60.470 60.498 -0.028 17919 8666 1 22 . 1 1 7 7 THR CB C 7 70.630 70.630 69.930 0.700 17919 8667 1 22 . 1 1 7 7 THR H H 7 8.730 8.730 8.521 0.209 17919 8668 1 22 . 1 1 8 8 LEU N N 8 121.330 121.330 120.459 0.871 17919 8669 1 22 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.258 0.052 17919 8670 1 22 . 1 1 8 8 LEU C C 8 178.800 178.800 177.895 0.905 17919 8671 1 22 . 1 1 8 8 LEU CA C 8 57.580 57.580 56.954 0.626 17919 8672 1 22 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.093 -0.122 17919 8673 1 22 . 1 1 8 8 LEU H H 8 9.100 9.100 8.843 0.257 17919 8674 1 22 . 1 1 9 9 THR N N 9 105.590 105.590 108.889 -3.299 17919 8675 1 22 . 1 1 9 9 THR HA H 9 4.428 4.428 4.409 0.019 17919 8676 1 22 . 1 1 9 9 THR C C 9 175.520 175.520 175.727 -0.207 17919 8677 1 22 . 1 1 9 9 THR CA C 9 61.400 61.400 61.431 -0.031 17919 8678 1 22 . 1 1 9 9 THR CB C 9 69.140 69.140 69.733 -0.593 17919 8679 1 22 . 1 1 9 9 THR H H 9 7.630 7.630 7.532 0.098 17919 8680 1 22 . 1 1 10 10 GLY N N 10 108.890 108.890 111.507 -2.617 17919 8681 1 22 . 1 1 10 10 GLY C C 10 174.070 174.070 174.135 -0.065 17919 8682 1 22 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.767 -0.307 17919 8683 1 22 . 1 1 10 10 GLY H H 10 7.810 7.810 7.737 0.073 17919 8684 1 22 . 1 1 11 11 LYS N N 11 121.600 121.600 121.133 0.467 17919 8685 1 22 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.438 -0.077 17919 8686 1 22 . 1 1 11 11 LYS C C 11 175.940 175.940 174.957 0.983 17919 8687 1 22 . 1 1 11 11 LYS CA C 11 56.280 56.280 55.972 0.308 17919 8688 1 22 . 1 1 11 11 LYS CB C 11 33.200 33.200 34.029 -0.829 17919 8689 1 22 . 1 1 11 11 LYS H H 11 7.280 7.280 7.370 -0.090 17919 8690 1 22 . 1 1 12 12 THR N N 12 120.440 120.440 118.240 2.200 17919 8691 1 22 . 1 1 12 12 THR HA H 12 5.046 5.046 5.107 -0.061 17919 8692 1 22 . 1 1 12 12 THR C C 12 174.320 174.320 174.347 -0.027 17919 8693 1 22 . 1 1 12 12 THR CA C 12 62.390 62.390 61.069 1.321 17919 8694 1 22 . 1 1 12 12 THR CB C 12 69.910 69.910 69.604 0.306 17919 8695 1 22 . 1 1 12 12 THR H H 12 8.650 8.650 8.302 0.348 17919 8696 1 22 . 1 1 13 13 ILE N N 13 127.110 127.110 127.155 -0.045 17919 8697 1 22 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.270 0.274 17919 8698 1 22 . 1 1 13 13 ILE C C 13 175.220 175.220 176.377 -1.157 17919 8699 1 22 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.802 -0.822 17919 8700 1 22 . 1 1 13 13 ILE CB C 13 40.950 40.950 37.892 3.058 17919 8701 1 22 . 1 1 13 13 ILE H H 13 9.450 9.450 8.603 0.847 17919 8702 1 22 . 1 1 14 14 THR N N 14 121.520 121.520 117.635 3.885 17919 8703 1 22 . 1 1 14 14 THR HA H 14 4.964 4.964 4.685 0.279 17919 8704 1 22 . 1 1 14 14 THR C C 14 173.790 173.790 173.613 0.177 17919 8705 1 22 . 1 1 14 14 THR CA C 14 61.940 61.940 60.659 1.281 17919 8706 1 22 . 1 1 14 14 THR CB C 14 69.650 69.650 70.400 -0.750 17919 8707 1 22 . 1 1 14 14 THR H H 14 8.710 8.710 8.210 0.500 17919 8708 1 22 . 1 1 15 15 LEU N N 15 124.800 124.800 127.257 -2.457 17919 8709 1 22 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.603 0.177 17919 8710 1 22 . 1 1 15 15 LEU C C 15 174.670 174.670 175.843 -1.173 17919 8711 1 22 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.449 -0.619 17919 8712 1 22 . 1 1 15 15 LEU CB C 15 47.070 47.070 43.746 3.324 17919 8713 1 22 . 1 1 15 15 LEU H H 15 8.710 8.710 8.459 0.251 17919 8714 1 22 . 1 1 16 16 GLU N N 16 122.160 122.160 124.115 -1.955 17919 8715 1 22 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.409 0.508 17919 8716 1 22 . 1 1 16 16 GLU C C 16 175.860 175.860 175.280 0.580 17919 8717 1 22 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.148 -0.328 17919 8718 1 22 . 1 1 16 16 GLU CB C 16 29.450 29.450 28.591 0.859 17919 8719 1 22 . 1 1 16 16 GLU H H 16 8.140 8.140 8.663 -0.523 17919 8720 1 22 . 1 1 17 17 VAL N N 17 117.210 117.210 120.098 -2.888 17919 8721 1 22 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.390 0.324 17919 8722 1 22 . 1 1 17 17 VAL C C 17 174.160 174.160 175.093 -0.933 17919 8723 1 22 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.711 -1.281 17919 8724 1 22 . 1 1 17 17 VAL CB C 17 36.400 36.400 34.342 2.058 17919 8725 1 22 . 1 1 17 17 VAL H H 17 8.900 8.900 7.915 0.985 17919 8726 1 22 . 1 1 18 18 GLU N N 18 118.990 118.990 121.118 -2.128 17919 8727 1 22 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.823 0.256 17919 8728 1 22 . 1 1 18 18 GLU C C 18 176.160 176.160 175.382 0.778 17919 8729 1 22 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.934 -0.214 17919 8730 1 22 . 1 1 18 18 GLU CB C 18 30.310 30.310 31.737 -1.427 17919 8731 1 22 . 1 1 18 18 GLU H H 18 8.640 8.640 7.941 0.699 17919 8732 1 22 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.317 -0.176 17919 8733 1 22 . 1 1 19 19 PRO C C 19 175.310 175.310 177.087 -1.777 17919 8734 1 22 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.175 0.295 17919 8735 1 22 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.047 -0.097 17919 8736 1 22 . 1 1 20 20 SER N N 20 103.400 103.400 110.692 -7.292 17919 8737 1 22 . 1 1 20 20 SER HA H 20 4.370 4.370 4.183 0.187 17919 8738 1 22 . 1 1 20 20 SER C C 20 174.660 174.660 174.866 -0.206 17919 8739 1 22 . 1 1 20 20 SER CA C 20 57.400 57.400 59.243 -1.843 17919 8740 1 22 . 1 1 20 20 SER CB C 20 63.370 63.370 62.937 0.433 17919 8741 1 22 . 1 1 20 20 SER H H 20 7.040 7.040 7.880 -0.840 17919 8742 1 22 . 1 1 21 21 ASP N N 21 123.480 123.480 123.156 0.324 17919 8743 1 22 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.567 0.128 17919 8744 1 22 . 1 1 21 21 ASP C C 21 176.360 176.360 175.612 0.748 17919 8745 1 22 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.904 -0.204 17919 8746 1 22 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.382 -0.582 17919 8747 1 22 . 1 1 21 21 ASP H H 21 8.030 8.030 7.963 0.067 17919 8748 1 22 . 1 1 22 22 THR N N 22 108.800 108.800 114.401 -5.601 17919 8749 1 22 . 1 1 22 22 THR HA H 22 4.920 4.920 4.955 -0.035 17919 8750 1 22 . 1 1 22 22 THR C C 22 176.750 176.750 175.841 0.909 17919 8751 1 22 . 1 1 22 22 THR CA C 22 59.690 59.690 60.873 -1.183 17919 8752 1 22 . 1 1 22 22 THR CB C 22 71.200 71.200 71.079 0.121 17919 8753 1 22 . 1 1 22 22 THR H H 22 7.900 7.900 8.136 -0.236 17919 8754 1 22 . 1 1 23 23 ILE N N 23 121.190 121.190 123.288 -2.098 17919 8755 1 22 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.713 -0.056 17919 8756 1 22 . 1 1 23 23 ILE C C 23 179.040 179.040 177.673 1.367 17919 8757 1 22 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.683 -0.423 17919 8758 1 22 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.378 -2.028 17919 8759 1 22 . 1 1 23 23 ILE H H 23 8.560 8.560 8.782 -0.222 17919 8760 1 22 . 1 1 24 24 GLU N N 24 120.830 120.830 120.042 0.788 17919 8761 1 22 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.861 0.056 17919 8762 1 22 . 1 1 24 24 GLU C C 24 178.640 178.640 178.431 0.209 17919 8763 1 22 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.901 0.319 17919 8764 1 22 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.458 -1.178 17919 8765 1 22 . 1 1 24 24 GLU H H 24 9.760 9.760 8.439 1.321 17919 8766 1 22 . 1 1 25 25 ASN N N 25 120.570 120.570 118.182 2.388 17919 8767 1 22 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.499 0.026 17919 8768 1 22 . 1 1 25 25 ASN C C 25 178.380 178.380 177.964 0.416 17919 8769 1 22 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.017 0.042 17919 8770 1 22 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.213 0.237 17919 8771 1 22 . 1 1 25 25 ASN H H 25 7.920 7.920 7.542 0.378 17919 8772 1 22 . 1 1 26 26 VAL N N 26 121.710 121.710 118.356 3.354 17919 8773 1 22 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.626 -0.229 17919 8774 1 22 . 1 1 26 26 VAL C C 26 177.950 177.950 178.215 -0.265 17919 8775 1 22 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.021 1.639 17919 8776 1 22 . 1 1 26 26 VAL CB C 26 30.840 30.840 30.318 0.522 17919 8777 1 22 . 1 1 26 26 VAL H H 26 8.070 8.070 8.246 -0.176 17919 8778 1 22 . 1 1 27 27 LYS N N 27 118.860 118.860 120.599 -1.739 17919 8779 1 22 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.224 0.356 17919 8780 1 22 . 1 1 27 27 LYS C C 27 180.550 180.550 179.239 1.311 17919 8781 1 22 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.567 -0.317 17919 8782 1 22 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.145 1.585 17919 8783 1 22 . 1 1 27 27 LYS H H 27 8.560 8.560 8.235 0.325 17919 8784 1 22 . 1 1 28 28 ALA N N 28 123.440 123.440 122.068 1.372 17919 8785 1 22 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.064 0.096 17919 8786 1 22 . 1 1 28 28 ALA C C 28 180.300 180.300 179.251 1.049 17919 8787 1 22 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.020 0.350 17919 8788 1 22 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.354 -0.644 17919 8789 1 22 . 1 1 28 28 ALA H H 28 8.060 8.060 8.253 -0.193 17919 8790 1 22 . 1 1 29 29 LYS N N 29 119.940 119.940 120.376 -0.436 17919 8791 1 22 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.256 -0.049 17919 8792 1 22 . 1 1 29 29 LYS C C 29 180.320 180.320 179.113 1.207 17919 8793 1 22 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.581 0.069 17919 8794 1 22 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.279 1.011 17919 8795 1 22 . 1 1 29 29 LYS H H 29 7.850 7.850 7.409 0.441 17919 8796 1 22 . 1 1 30 30 ILE N N 30 121.080 121.080 119.666 1.414 17919 8797 1 22 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.584 -0.077 17919 8798 1 22 . 1 1 30 30 ILE C C 30 178.310 178.310 177.821 0.489 17919 8799 1 22 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.037 1.113 17919 8800 1 22 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.035 -0.235 17919 8801 1 22 . 1 1 30 30 ILE H H 30 8.280 8.280 8.207 0.073 17919 8802 1 22 . 1 1 31 31 GLN N N 31 123.490 123.490 119.573 3.917 17919 8803 1 22 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.087 -0.258 17919 8804 1 22 . 1 1 31 31 GLN C C 31 178.890 178.890 178.240 0.650 17919 8805 1 22 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.167 0.833 17919 8806 1 22 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.599 -0.879 17919 8807 1 22 . 1 1 31 31 GLN H H 31 8.580 8.580 8.160 0.420 17919 8808 1 22 . 1 1 32 32 ASP N N 32 119.360 119.360 117.932 1.428 17919 8809 1 22 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.473 -0.119 17919 8810 1 22 . 1 1 32 32 ASP C C 32 177.250 177.250 177.740 -0.490 17919 8811 1 22 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.431 0.759 17919 8812 1 22 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.704 -0.124 17919 8813 1 22 . 1 1 32 32 ASP H H 32 8.010 8.010 8.167 -0.157 17919 8814 1 22 . 1 1 33 33 LYS N N 33 115.130 115.130 119.010 -3.880 17919 8815 1 22 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.471 -0.134 17919 8816 1 22 . 1 1 33 33 LYS C C 33 177.870 177.870 178.095 -0.225 17919 8817 1 22 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.081 0.969 17919 8818 1 22 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.924 0.246 17919 8819 1 22 . 1 1 33 33 LYS H H 33 7.430 7.430 7.610 -0.180 17919 8820 1 22 . 1 1 34 34 GLU N N 34 113.870 113.870 116.182 -2.312 17919 8821 1 22 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.447 0.178 17919 8822 1 22 . 1 1 34 34 GLU C C 34 177.840 177.840 177.340 0.500 17919 8823 1 22 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.572 -1.402 17919 8824 1 22 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.683 0.977 17919 8825 1 22 . 1 1 34 34 GLU H H 34 8.740 8.740 8.262 0.478 17919 8826 1 22 . 1 1 35 35 GLY N N 35 108.650 108.650 109.108 -0.458 17919 8827 1 22 . 1 1 35 35 GLY C C 35 173.960 173.960 174.097 -0.137 17919 8828 1 22 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.559 0.521 17919 8829 1 22 . 1 1 35 35 GLY H H 35 8.530 8.530 8.305 0.225 17919 8830 1 22 . 1 1 36 36 ILE N N 36 119.880 119.880 121.319 -1.439 17919 8831 1 22 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.398 0.047 17919 8832 1 22 . 1 1 36 36 ILE C C 36 173.590 173.590 174.336 -0.746 17919 8833 1 22 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.563 0.187 17919 8834 1 22 . 1 1 36 36 ILE CB C 36 40.580 40.580 39.058 1.522 17919 8835 1 22 . 1 1 36 36 ILE H H 36 6.150 6.150 7.561 -1.411 17919 8836 1 22 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.672 -0.038 17919 8837 1 22 . 1 1 37 37 PRO C C 37 176.940 176.940 176.173 0.767 17919 8838 1 22 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.634 0.026 17919 8839 1 22 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.278 0.572 17919 8840 1 22 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.215 -0.098 17919 8841 1 22 . 1 1 38 38 PRO C C 38 178.320 178.320 178.230 0.090 17919 8842 1 22 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.544 0.716 17919 8843 1 22 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.836 1.054 17919 8844 1 22 . 1 1 39 39 ASP N N 39 113.380 113.380 115.224 -1.844 17919 8845 1 22 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.315 0.115 17919 8846 1 22 . 1 1 39 39 ASP C C 39 177.090 177.090 177.932 -0.842 17919 8847 1 22 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.730 -1.089 17919 8848 1 22 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.336 -0.796 17919 8849 1 22 . 1 1 39 39 ASP H H 39 8.550 8.550 8.576 -0.026 17919 8850 1 22 . 1 1 40 40 GLN N N 40 116.780 116.780 117.050 -0.270 17919 8851 1 22 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.233 0.231 17919 8852 1 22 . 1 1 40 40 GLN C C 40 175.380 175.380 176.452 -1.072 17919 8853 1 22 . 1 1 40 40 GLN CA C 40 55.640 55.640 57.001 -1.361 17919 8854 1 22 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.515 0.625 17919 8855 1 22 . 1 1 40 40 GLN H H 40 7.820 7.820 7.884 -0.064 17919 8856 1 22 . 1 1 41 41 GLN N N 41 117.720 117.720 119.382 -1.662 17919 8857 1 22 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.271 -0.027 17919 8858 1 22 . 1 1 41 41 GLN C C 41 176.300 176.300 175.338 0.962 17919 8859 1 22 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.545 -0.075 17919 8860 1 22 . 1 1 41 41 GLN CB C 41 31.650 31.650 28.788 2.862 17919 8861 1 22 . 1 1 41 41 GLN H H 41 7.480 7.480 7.433 0.047 17919 8862 1 22 . 1 1 42 42 ARG N N 42 122.680 122.680 122.121 0.559 17919 8863 1 22 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.602 -0.102 17919 8864 1 22 . 1 1 42 42 ARG C C 42 174.050 174.050 174.935 -0.885 17919 8865 1 22 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.670 0.380 17919 8866 1 22 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.075 -1.325 17919 8867 1 22 . 1 1 42 42 ARG H H 42 8.530 8.530 8.094 0.436 17919 8868 1 22 . 1 1 43 43 LEU N N 43 124.040 124.040 125.094 -1.054 17919 8869 1 22 . 1 1 43 43 LEU C C 43 175.290 175.290 175.784 -0.494 17919 8870 1 22 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.596 -0.616 17919 8871 1 22 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.319 1.471 17919 8872 1 22 . 1 1 43 43 LEU H H 43 8.820 8.820 8.813 0.007 17919 8873 1 22 . 1 1 44 44 ILE N N 44 121.920 121.920 121.277 0.643 17919 8874 1 22 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.132 -0.140 17919 8875 1 22 . 1 1 44 44 ILE C C 44 176.060 176.060 174.421 1.639 17919 8876 1 22 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.971 -0.991 17919 8877 1 22 . 1 1 44 44 ILE CB C 44 41.420 41.420 40.567 0.853 17919 8878 1 22 . 1 1 44 44 ILE H H 44 9.030 9.030 8.097 0.933 17919 8879 1 22 . 1 1 45 45 PHE N N 45 125.390 125.390 127.256 -1.866 17919 8880 1 22 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.871 0.174 17919 8881 1 22 . 1 1 45 45 PHE C C 45 174.470 174.470 174.113 0.357 17919 8882 1 22 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.620 0.401 17919 8883 1 22 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.579 0.181 17919 8884 1 22 . 1 1 45 45 PHE H H 45 8.830 8.830 8.614 0.216 17919 8885 1 22 . 1 1 46 46 ALA N N 46 132.200 132.200 129.315 2.885 17919 8886 1 22 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.638 0.052 17919 8887 1 22 . 1 1 46 46 ALA C C 46 177.290 177.290 177.553 -0.263 17919 8888 1 22 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.965 -0.425 17919 8889 1 22 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.572 -0.002 17919 8890 1 22 . 1 1 46 46 ALA H H 46 8.810 8.810 8.421 0.389 17919 8891 1 22 . 1 1 47 47 GLY N N 47 102.340 102.340 103.991 -1.651 17919 8892 1 22 . 1 1 47 47 GLY C C 47 173.810 173.810 174.722 -0.912 17919 8893 1 22 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.377 -0.027 17919 8894 1 22 . 1 1 47 47 GLY H H 47 8.130 8.130 8.413 -0.283 17919 8895 1 22 . 1 1 48 48 LYS N N 48 121.570 121.570 122.716 -1.146 17919 8896 1 22 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.517 0.105 17919 8897 1 22 . 1 1 48 48 LYS C C 48 174.700 174.700 175.864 -1.164 17919 8898 1 22 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.036 -0.486 17919 8899 1 22 . 1 1 48 48 LYS CB C 48 34.530 34.530 33.359 1.171 17919 8900 1 22 . 1 1 48 48 LYS H H 48 7.980 7.980 7.845 0.135 17919 8901 1 22 . 1 1 49 49 GLN N N 49 122.410 122.410 123.622 -1.212 17919 8902 1 22 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.311 0.249 17919 8903 1 22 . 1 1 49 49 GLN C C 49 175.670 175.670 175.638 0.032 17919 8904 1 22 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.656 -0.916 17919 8905 1 22 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.457 -0.457 17919 8906 1 22 . 1 1 49 49 GLN H H 49 8.600 8.600 8.615 -0.015 17919 8907 1 22 . 1 1 50 50 LEU N N 50 125.520 125.520 125.689 -0.169 17919 8908 1 22 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.257 -0.167 17919 8909 1 22 . 1 1 50 50 LEU C C 50 176.660 176.660 175.555 1.105 17919 8910 1 22 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.843 0.397 17919 8911 1 22 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.930 -1.360 17919 8912 1 22 . 1 1 50 50 LEU H H 50 8.530 8.530 8.566 -0.036 17919 8913 1 22 . 1 1 51 51 GLU N N 51 122.940 122.940 122.612 0.328 17919 8914 1 22 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.575 -0.087 17919 8915 1 22 . 1 1 51 51 GLU C C 51 175.870 175.870 176.042 -0.172 17919 8916 1 22 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.071 0.889 17919 8917 1 22 . 1 1 51 51 GLU CB C 51 31.570 31.570 33.187 -1.617 17919 8918 1 22 . 1 1 51 51 GLU H H 51 8.400 8.400 8.612 -0.212 17919 8919 1 22 . 1 1 52 52 ASP N N 52 120.030 120.030 125.532 -5.502 17919 8920 1 22 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.493 -0.134 17919 8921 1 22 . 1 1 52 52 ASP C C 52 177.330 177.330 177.337 -0.007 17919 8922 1 22 . 1 1 52 52 ASP CA C 52 56.960 56.960 56.878 0.082 17919 8923 1 22 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.857 -0.007 17919 8924 1 22 . 1 1 52 52 ASP H H 52 8.160 8.160 8.728 -0.568 17919 8925 1 22 . 1 1 53 53 GLY N N 53 106.660 106.660 105.617 1.043 17919 8926 1 22 . 1 1 53 53 GLY C C 53 174.870 174.870 174.314 0.556 17919 8927 1 22 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.027 0.143 17919 8928 1 22 . 1 1 53 53 GLY H H 53 9.390 9.390 8.515 0.875 17919 8929 1 22 . 1 1 54 54 ARG N N 54 119.050 119.050 119.940 -0.890 17919 8930 1 22 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.795 -0.100 17919 8931 1 22 . 1 1 54 54 ARG C C 54 175.350 175.350 174.918 0.432 17919 8932 1 22 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.260 0.130 17919 8933 1 22 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.143 -0.493 17919 8934 1 22 . 1 1 54 54 ARG H H 54 7.460 7.460 7.595 -0.135 17919 8935 1 22 . 1 1 55 55 THR N N 55 108.400 108.400 112.825 -4.425 17919 8936 1 22 . 1 1 55 55 THR HA H 55 5.240 5.240 5.044 0.196 17919 8937 1 22 . 1 1 55 55 THR C C 55 176.560 176.560 176.460 0.100 17919 8938 1 22 . 1 1 55 55 THR CA C 55 59.690 59.690 60.583 -0.893 17919 8939 1 22 . 1 1 55 55 THR CB C 55 72.260 72.260 70.433 1.827 17919 8940 1 22 . 1 1 55 55 THR H H 55 8.730 8.730 8.244 0.486 17919 8941 1 22 . 1 1 56 56 LEU N N 56 117.920 117.920 121.246 -3.326 17919 8942 1 22 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.959 0.101 17919 8943 1 22 . 1 1 56 56 LEU C C 56 180.810 180.810 178.578 2.232 17919 8944 1 22 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.636 0.073 17919 8945 1 22 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.299 -0.929 17919 8946 1 22 . 1 1 56 56 LEU H H 56 8.140 8.140 8.661 -0.521 17919 8947 1 22 . 1 1 57 57 SER N N 57 113.330 113.330 112.799 0.531 17919 8948 1 22 . 1 1 57 57 SER HA H 57 4.370 4.370 4.083 0.287 17919 8949 1 22 . 1 1 57 57 SER C C 57 178.310 178.310 176.817 1.493 17919 8950 1 22 . 1 1 57 57 SER CA C 57 61.080 61.080 61.327 -0.247 17919 8951 1 22 . 1 1 57 57 SER CB C 57 62.530 62.530 62.464 0.066 17919 8952 1 22 . 1 1 57 57 SER H H 57 8.470 8.470 8.110 0.360 17919 8953 1 22 . 1 1 58 58 ASP N N 58 124.190 124.190 122.343 1.847 17919 8954 1 22 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.341 -0.045 17919 8955 1 22 . 1 1 58 58 ASP C C 58 177.400 177.400 177.140 0.260 17919 8956 1 22 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.503 0.677 17919 8957 1 22 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.783 -0.683 17919 8958 1 22 . 1 1 58 58 ASP H H 58 7.930 7.930 7.857 0.073 17919 8959 1 22 . 1 1 59 59 TYR N N 59 115.510 115.510 116.800 -1.290 17919 8960 1 22 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.466 0.204 17919 8961 1 22 . 1 1 59 59 TYR C C 59 174.700 174.700 175.064 -0.364 17919 8962 1 22 . 1 1 59 59 TYR CA C 59 58.250 58.250 58.372 -0.122 17919 8963 1 22 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.210 1.860 17919 8964 1 22 . 1 1 59 59 TYR H H 59 7.250 7.250 7.361 -0.111 17919 8965 1 22 . 1 1 60 60 ASN N N 60 115.900 115.900 114.136 1.764 17919 8966 1 22 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.348 0.007 17919 8967 1 22 . 1 1 60 60 ASN C C 60 174.340 174.340 174.710 -0.370 17919 8968 1 22 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.187 -0.067 17919 8969 1 22 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.287 0.123 17919 8970 1 22 . 1 1 60 60 ASN H H 60 8.150 8.150 7.647 0.503 17919 8971 1 22 . 1 1 61 61 ILE N N 61 118.600 118.600 120.302 -1.702 17919 8972 1 22 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.787 -0.394 17919 8973 1 22 . 1 1 61 61 ILE C C 61 174.610 174.610 175.277 -0.667 17919 8974 1 22 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.656 -0.236 17919 8975 1 22 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.623 -0.883 17919 8976 1 22 . 1 1 61 61 ILE H H 61 7.250 7.250 7.650 -0.400 17919 8977 1 22 . 1 1 62 62 GLN N N 62 124.740 124.740 125.377 -0.637 17919 8978 1 22 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.747 -0.241 17919 8979 1 22 . 1 1 62 62 GLN C C 62 175.970 175.970 175.719 0.251 17919 8980 1 22 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.367 0.293 17919 8981 1 22 . 1 1 62 62 GLN CB C 62 31.650 31.650 32.125 -0.475 17919 8982 1 22 . 1 1 62 62 GLN H H 62 7.610 7.610 7.945 -0.335 17919 8983 1 22 . 1 1 63 63 LYS N N 63 120.300 120.300 123.588 -3.288 17919 8984 1 22 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.977 0.024 17919 8985 1 22 . 1 1 63 63 LYS C C 63 175.810 175.810 177.123 -1.313 17919 8986 1 22 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.004 -0.214 17919 8987 1 22 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.999 0.651 17919 8988 1 22 . 1 1 63 63 LYS H H 63 8.490 8.490 8.659 -0.169 17919 8989 1 22 . 1 1 64 64 GLU N N 64 113.950 113.950 118.892 -4.942 17919 8990 1 22 . 1 1 64 64 GLU HA H 64 3.465 3.465 4.007 -0.542 17919 8991 1 22 . 1 1 64 64 GLU C C 64 175.250 175.250 175.227 0.023 17919 8992 1 22 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.797 0.093 17919 8993 1 22 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.657 -2.757 17919 8994 1 22 . 1 1 64 64 GLU H H 64 9.280 9.280 8.721 0.559 17919 8995 1 22 . 1 1 65 65 SER N N 65 114.730 114.730 114.944 -0.214 17919 8996 1 22 . 1 1 65 65 SER HA H 65 4.640 4.640 4.555 0.085 17919 8997 1 22 . 1 1 65 65 SER C C 65 172.160 172.160 173.998 -1.838 17919 8998 1 22 . 1 1 65 65 SER CA C 65 60.890 60.890 59.410 1.480 17919 8999 1 22 . 1 1 65 65 SER CB C 65 64.910 64.910 64.068 0.842 17919 9000 1 22 . 1 1 65 65 SER H H 65 7.670 7.670 7.563 0.107 17919 9001 1 22 . 1 1 66 66 THR N N 66 117.110 117.110 119.702 -2.592 17919 9002 1 22 . 1 1 66 66 THR HA H 66 5.270 5.270 4.920 0.350 17919 9003 1 22 . 1 1 66 66 THR C C 66 173.950 173.950 173.815 0.135 17919 9004 1 22 . 1 1 66 66 THR CA C 66 62.340 62.340 62.133 0.207 17919 9005 1 22 . 1 1 66 66 THR CB C 66 70.080 70.080 69.856 0.224 17919 9006 1 22 . 1 1 66 66 THR H H 66 8.730 8.730 8.626 0.104 17919 9007 1 22 . 1 1 67 67 LEU N N 67 127.110 127.110 127.726 -0.616 17919 9008 1 22 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.943 0.117 17919 9009 1 22 . 1 1 67 67 LEU C C 67 175.770 175.770 176.533 -0.763 17919 9010 1 22 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.669 0.231 17919 9011 1 22 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.177 1.083 17919 9012 1 22 . 1 1 67 67 LEU H H 67 9.410 9.410 9.026 0.384 17919 9013 1 22 . 1 1 68 68 HIS N N 68 118.380 118.380 118.191 0.189 17919 9014 1 22 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.653 -0.413 17919 9015 1 22 . 1 1 68 68 HIS C C 68 173.150 173.150 173.711 -0.561 17919 9016 1 22 . 1 1 68 68 HIS CA C 68 55.000 55.000 52.805 2.195 17919 9017 1 22 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.835 -2.305 17919 9018 1 22 . 1 1 68 68 HIS H H 68 9.230 9.230 8.120 1.110 17919 9019 1 22 . 1 1 69 69 LEU N N 69 124.460 124.460 122.458 2.002 17919 9020 1 22 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.346 -0.156 17919 9021 1 22 . 1 1 69 69 LEU C C 69 175.270 175.270 175.370 -0.100 17919 9022 1 22 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.491 -0.601 17919 9023 1 22 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.733 -0.353 17919 9024 1 22 . 1 1 69 69 LEU H H 69 8.340 8.340 8.045 0.295 17919 9025 1 22 . 1 1 70 70 VAL N N 70 126.940 126.940 125.623 1.317 17919 9026 1 22 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.508 -0.158 17919 9027 1 22 . 1 1 70 70 VAL C C 70 174.000 174.000 174.059 -0.059 17919 9028 1 22 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.044 0.756 17919 9029 1 22 . 1 1 70 70 VAL CB C 70 34.910 34.910 34.842 0.068 17919 9030 1 22 . 1 1 70 70 VAL H H 70 9.200 9.200 8.637 0.563 17919 9031 1 22 . 1 1 71 71 LEU N N 71 123.130 123.130 127.809 -4.679 17919 9032 1 22 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.746 0.314 17919 9033 1 22 . 1 1 71 71 LEU C C 71 177.830 177.830 177.037 0.793 17919 9034 1 22 . 1 1 71 71 LEU CA C 71 53.940 53.940 54.201 -0.261 17919 9035 1 22 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.323 0.527 17919 9036 1 22 . 1 1 71 71 LEU H H 71 8.120 8.120 8.489 -0.369 17919 9037 1 22 . 1 1 72 72 ARG N N 72 123.490 123.490 125.244 -1.754 17919 9038 1 22 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.347 -0.046 17919 9039 1 22 . 1 1 72 72 ARG C C 72 175.350 175.350 176.047 -0.697 17919 9040 1 22 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.480 0.130 17919 9041 1 22 . 1 1 72 72 ARG CB C 72 31.350 31.350 31.412 -0.062 17919 9042 1 22 . 1 1 72 72 ARG H H 72 8.580 8.580 7.860 0.720 17919 9043 1 23 . 1 1 2 2 GLN N N 2 123.220 123.220 123.959 -0.739 17919 9044 1 23 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.096 0.153 17919 9045 1 23 . 1 1 2 2 GLN C C 2 175.920 175.920 174.861 1.059 17919 9046 1 23 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.967 0.113 17919 9047 1 23 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.442 0.318 17919 9048 1 23 . 1 1 2 2 GLN H H 2 8.900 8.900 8.553 0.347 17919 9049 1 23 . 1 1 3 3 ILE N N 3 115.340 115.340 117.874 -2.534 17919 9050 1 23 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.156 0.057 17919 9051 1 23 . 1 1 3 3 ILE C C 3 172.450 172.450 173.407 -0.957 17919 9052 1 23 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.551 0.019 17919 9053 1 23 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.442 0.768 17919 9054 1 23 . 1 1 3 3 ILE H H 3 8.320 8.320 8.564 -0.244 17919 9055 1 23 . 1 1 4 4 PHE N N 4 118.110 118.110 119.624 -1.514 17919 9056 1 23 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.620 0.010 17919 9057 1 23 . 1 1 4 4 PHE C C 4 175.320 175.320 175.299 0.021 17919 9058 1 23 . 1 1 4 4 PHE CA C 4 55.210 55.210 54.814 0.396 17919 9059 1 23 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.084 -0.604 17919 9060 1 23 . 1 1 4 4 PHE H H 4 8.610 8.610 7.877 0.733 17919 9061 1 23 . 1 1 5 5 VAL N N 5 121.000 121.000 123.800 -2.800 17919 9062 1 23 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.902 -0.177 17919 9063 1 23 . 1 1 5 5 VAL C C 5 174.870 174.870 175.429 -0.559 17919 9064 1 23 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.321 -0.701 17919 9065 1 23 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.306 0.924 17919 9066 1 23 . 1 1 5 5 VAL H H 5 9.300 9.300 9.297 0.003 17919 9067 1 23 . 1 1 6 6 LYS N N 6 127.520 127.520 129.066 -1.546 17919 9068 1 23 . 1 1 6 6 LYS HA H 6 5.367 5.367 4.902 0.465 17919 9069 1 23 . 1 1 6 6 LYS C C 6 177.140 177.140 176.603 0.537 17919 9070 1 23 . 1 1 6 6 LYS CA C 6 54.520 54.520 55.693 -1.173 17919 9071 1 23 . 1 1 6 6 LYS CB C 6 35.050 35.050 33.910 1.140 17919 9072 1 23 . 1 1 6 6 LYS H H 6 8.820 8.820 9.300 -0.480 17919 9073 1 23 . 1 1 7 7 THR N N 7 115.400 115.400 114.220 1.180 17919 9074 1 23 . 1 1 7 7 THR HA H 7 4.970 4.970 5.051 -0.081 17919 9075 1 23 . 1 1 7 7 THR C C 7 176.910 176.910 176.835 0.075 17919 9076 1 23 . 1 1 7 7 THR CA C 7 60.470 60.470 59.497 0.973 17919 9077 1 23 . 1 1 7 7 THR CB C 7 70.630 70.630 71.674 -1.044 17919 9078 1 23 . 1 1 7 7 THR H H 7 8.730 8.730 7.964 0.766 17919 9079 1 23 . 1 1 8 8 LEU N N 8 121.330 121.330 120.437 0.893 17919 9080 1 23 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.268 0.042 17919 9081 1 23 . 1 1 8 8 LEU C C 8 178.800 178.800 178.156 0.644 17919 9082 1 23 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.571 0.009 17919 9083 1 23 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.629 0.341 17919 9084 1 23 . 1 1 8 8 LEU H H 8 9.100 9.100 8.889 0.211 17919 9085 1 23 . 1 1 9 9 THR N N 9 105.590 105.590 108.591 -3.001 17919 9086 1 23 . 1 1 9 9 THR HA H 9 4.428 4.428 4.411 0.017 17919 9087 1 23 . 1 1 9 9 THR C C 9 175.520 175.520 176.021 -0.501 17919 9088 1 23 . 1 1 9 9 THR CA C 9 61.400 61.400 61.442 -0.042 17919 9089 1 23 . 1 1 9 9 THR CB C 9 69.140 69.140 69.363 -0.223 17919 9090 1 23 . 1 1 9 9 THR H H 9 7.630 7.630 7.835 -0.205 17919 9091 1 23 . 1 1 10 10 GLY N N 10 108.890 108.890 111.870 -2.980 17919 9092 1 23 . 1 1 10 10 GLY C C 10 174.070 174.070 174.107 -0.037 17919 9093 1 23 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.173 0.287 17919 9094 1 23 . 1 1 10 10 GLY H H 10 7.810 7.810 8.145 -0.335 17919 9095 1 23 . 1 1 11 11 LYS N N 11 121.600 121.600 121.046 0.554 17919 9096 1 23 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.130 0.231 17919 9097 1 23 . 1 1 11 11 LYS C C 11 175.940 175.940 175.148 0.792 17919 9098 1 23 . 1 1 11 11 LYS CA C 11 56.280 56.280 57.126 -0.846 17919 9099 1 23 . 1 1 11 11 LYS CB C 11 33.200 33.200 32.728 0.472 17919 9100 1 23 . 1 1 11 11 LYS H H 11 7.280 7.280 7.692 -0.412 17919 9101 1 23 . 1 1 12 12 THR N N 12 120.440 120.440 115.691 4.749 17919 9102 1 23 . 1 1 12 12 THR HA H 12 5.046 5.046 4.944 0.102 17919 9103 1 23 . 1 1 12 12 THR C C 12 174.320 174.320 173.950 0.370 17919 9104 1 23 . 1 1 12 12 THR CA C 12 62.390 62.390 61.854 0.536 17919 9105 1 23 . 1 1 12 12 THR CB C 12 69.910 69.910 70.922 -1.012 17919 9106 1 23 . 1 1 12 12 THR H H 12 8.650 8.650 8.134 0.516 17919 9107 1 23 . 1 1 13 13 ILE N N 13 127.110 127.110 128.169 -1.059 17919 9108 1 23 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.427 0.117 17919 9109 1 23 . 1 1 13 13 ILE C C 13 175.220 175.220 175.036 0.184 17919 9110 1 23 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.213 -0.233 17919 9111 1 23 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.782 0.168 17919 9112 1 23 . 1 1 13 13 ILE H H 13 9.450 9.450 9.074 0.376 17919 9113 1 23 . 1 1 14 14 THR N N 14 121.520 121.520 124.028 -2.508 17919 9114 1 23 . 1 1 14 14 THR HA H 14 4.964 4.964 4.947 0.017 17919 9115 1 23 . 1 1 14 14 THR C C 14 173.790 173.790 173.764 0.026 17919 9116 1 23 . 1 1 14 14 THR CA C 14 61.940 61.940 62.056 -0.116 17919 9117 1 23 . 1 1 14 14 THR CB C 14 69.650 69.650 70.003 -0.353 17919 9118 1 23 . 1 1 14 14 THR H H 14 8.710 8.710 8.594 0.116 17919 9119 1 23 . 1 1 15 15 LEU N N 15 124.800 124.800 126.843 -2.043 17919 9120 1 23 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.693 0.087 17919 9121 1 23 . 1 1 15 15 LEU C C 15 174.670 174.670 174.924 -0.254 17919 9122 1 23 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.941 -1.111 17919 9123 1 23 . 1 1 15 15 LEU CB C 15 47.070 47.070 46.191 0.878 17919 9124 1 23 . 1 1 15 15 LEU H H 15 8.710 8.710 8.479 0.231 17919 9125 1 23 . 1 1 16 16 GLU N N 16 122.160 122.160 123.537 -1.377 17919 9126 1 23 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.527 0.390 17919 9127 1 23 . 1 1 16 16 GLU C C 16 175.860 175.860 176.015 -0.155 17919 9128 1 23 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.598 -0.778 17919 9129 1 23 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.221 -0.771 17919 9130 1 23 . 1 1 16 16 GLU H H 16 8.140 8.140 8.703 -0.563 17919 9131 1 23 . 1 1 17 17 VAL N N 17 117.210 117.210 120.418 -3.208 17919 9132 1 23 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.580 0.134 17919 9133 1 23 . 1 1 17 17 VAL C C 17 174.160 174.160 175.150 -0.990 17919 9134 1 23 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.448 -1.018 17919 9135 1 23 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.448 0.952 17919 9136 1 23 . 1 1 17 17 VAL H H 17 8.900 8.900 8.556 0.344 17919 9137 1 23 . 1 1 18 18 GLU N N 18 118.990 118.990 119.668 -0.678 17919 9138 1 23 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.941 0.138 17919 9139 1 23 . 1 1 18 18 GLU C C 18 176.160 176.160 175.356 0.804 17919 9140 1 23 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.863 -0.143 17919 9141 1 23 . 1 1 18 18 GLU CB C 18 30.310 30.310 31.977 -1.667 17919 9142 1 23 . 1 1 18 18 GLU H H 18 8.640 8.640 8.804 -0.164 17919 9143 1 23 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.321 -0.180 17919 9144 1 23 . 1 1 19 19 PRO C C 19 175.310 175.310 177.844 -2.534 17919 9145 1 23 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.129 0.341 17919 9146 1 23 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.848 0.103 17919 9147 1 23 . 1 1 20 20 SER N N 20 103.400 103.400 111.109 -7.709 17919 9148 1 23 . 1 1 20 20 SER HA H 20 4.370 4.370 4.305 0.065 17919 9149 1 23 . 1 1 20 20 SER C C 20 174.660 174.660 174.605 0.055 17919 9150 1 23 . 1 1 20 20 SER CA C 20 57.400 57.400 59.314 -1.914 17919 9151 1 23 . 1 1 20 20 SER CB C 20 63.370 63.370 63.207 0.163 17919 9152 1 23 . 1 1 20 20 SER H H 20 7.040 7.040 7.962 -0.922 17919 9153 1 23 . 1 1 21 21 ASP N N 21 123.480 123.480 122.487 0.993 17919 9154 1 23 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.587 0.108 17919 9155 1 23 . 1 1 21 21 ASP C C 21 176.360 176.360 176.039 0.321 17919 9156 1 23 . 1 1 21 21 ASP CA C 21 55.700 55.700 56.336 -0.636 17919 9157 1 23 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.959 -1.159 17919 9158 1 23 . 1 1 21 21 ASP H H 21 8.030 8.030 7.816 0.214 17919 9159 1 23 . 1 1 22 22 THR N N 22 108.800 108.800 113.924 -5.124 17919 9160 1 23 . 1 1 22 22 THR HA H 22 4.920 4.920 4.774 0.146 17919 9161 1 23 . 1 1 22 22 THR C C 22 176.750 176.750 176.392 0.358 17919 9162 1 23 . 1 1 22 22 THR CA C 22 59.690 59.690 60.884 -1.194 17919 9163 1 23 . 1 1 22 22 THR CB C 22 71.200 71.200 69.983 1.217 17919 9164 1 23 . 1 1 22 22 THR H H 22 7.900 7.900 8.500 -0.600 17919 9165 1 23 . 1 1 23 23 ILE N N 23 121.190 121.190 122.380 -1.190 17919 9166 1 23 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.676 -0.019 17919 9167 1 23 . 1 1 23 23 ILE C C 23 179.040 179.040 177.904 1.136 17919 9168 1 23 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.494 -1.234 17919 9169 1 23 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.020 -1.670 17919 9170 1 23 . 1 1 23 23 ILE H H 23 8.560 8.560 8.910 -0.350 17919 9171 1 23 . 1 1 24 24 GLU N N 24 120.830 120.830 119.957 0.873 17919 9172 1 23 . 1 1 24 24 GLU HA H 24 3.917 3.917 4.048 -0.131 17919 9173 1 23 . 1 1 24 24 GLU C C 24 178.640 178.640 178.492 0.148 17919 9174 1 23 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.288 0.932 17919 9175 1 23 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.623 -1.343 17919 9176 1 23 . 1 1 24 24 GLU H H 24 9.760 9.760 8.429 1.331 17919 9177 1 23 . 1 1 25 25 ASN N N 25 120.570 120.570 119.034 1.536 17919 9178 1 23 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.456 0.069 17919 9179 1 23 . 1 1 25 25 ASN C C 25 178.380 178.380 177.941 0.439 17919 9180 1 23 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.173 -0.113 17919 9181 1 23 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.450 0.000 17919 9182 1 23 . 1 1 25 25 ASN H H 25 7.920 7.920 8.046 -0.126 17919 9183 1 23 . 1 1 26 26 VAL N N 26 121.710 121.710 121.300 0.410 17919 9184 1 23 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.485 -0.088 17919 9185 1 23 . 1 1 26 26 VAL C C 26 177.950 177.950 177.310 0.640 17919 9186 1 23 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.694 0.966 17919 9187 1 23 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.313 -0.473 17919 9188 1 23 . 1 1 26 26 VAL H H 26 8.070 8.070 8.285 -0.215 17919 9189 1 23 . 1 1 27 27 LYS N N 27 118.860 118.860 119.262 -0.402 17919 9190 1 23 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.117 0.463 17919 9191 1 23 . 1 1 27 27 LYS C C 27 180.550 180.550 179.194 1.356 17919 9192 1 23 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.454 -0.204 17919 9193 1 23 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.343 1.387 17919 9194 1 23 . 1 1 27 27 LYS H H 27 8.560 8.560 7.719 0.841 17919 9195 1 23 . 1 1 28 28 ALA N N 28 123.440 123.440 120.536 2.904 17919 9196 1 23 . 1 1 28 28 ALA HA H 28 4.160 4.160 3.962 0.198 17919 9197 1 23 . 1 1 28 28 ALA C C 28 180.300 180.300 179.252 1.048 17919 9198 1 23 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.371 -0.001 17919 9199 1 23 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.334 -0.624 17919 9200 1 23 . 1 1 28 28 ALA H H 28 8.060 8.060 8.453 -0.393 17919 9201 1 23 . 1 1 29 29 LYS N N 29 119.940 119.940 118.251 1.689 17919 9202 1 23 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.035 0.172 17919 9203 1 23 . 1 1 29 29 LYS C C 29 180.320 180.320 179.035 1.285 17919 9204 1 23 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.107 0.543 17919 9205 1 23 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.173 1.117 17919 9206 1 23 . 1 1 29 29 LYS H H 29 7.850 7.850 7.563 0.287 17919 9207 1 23 . 1 1 30 30 ILE N N 30 121.080 121.080 120.802 0.278 17919 9208 1 23 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.637 -0.130 17919 9209 1 23 . 1 1 30 30 ILE C C 30 178.310 178.310 177.395 0.915 17919 9210 1 23 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.242 0.908 17919 9211 1 23 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.681 -0.881 17919 9212 1 23 . 1 1 30 30 ILE H H 30 8.280 8.280 7.578 0.702 17919 9213 1 23 . 1 1 31 31 GLN N N 31 123.490 123.490 120.195 3.295 17919 9214 1 23 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.088 -0.259 17919 9215 1 23 . 1 1 31 31 GLN C C 31 178.890 178.890 178.091 0.799 17919 9216 1 23 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.189 0.811 17919 9217 1 23 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.495 -0.775 17919 9218 1 23 . 1 1 31 31 GLN H H 31 8.580 8.580 8.064 0.516 17919 9219 1 23 . 1 1 32 32 ASP N N 32 119.360 119.360 119.184 0.176 17919 9220 1 23 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.404 -0.050 17919 9221 1 23 . 1 1 32 32 ASP C C 32 177.250 177.250 177.988 -0.738 17919 9222 1 23 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.785 0.405 17919 9223 1 23 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.924 -0.344 17919 9224 1 23 . 1 1 32 32 ASP H H 32 8.010 8.010 8.133 -0.123 17919 9225 1 23 . 1 1 33 33 LYS N N 33 115.130 115.130 119.205 -4.075 17919 9226 1 23 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.225 0.112 17919 9227 1 23 . 1 1 33 33 LYS C C 33 177.870 177.870 178.034 -0.164 17919 9228 1 23 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.800 0.250 17919 9229 1 23 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.452 0.718 17919 9230 1 23 . 1 1 33 33 LYS H H 33 7.430 7.430 7.566 -0.136 17919 9231 1 23 . 1 1 34 34 GLU N N 34 113.870 113.870 115.059 -1.189 17919 9232 1 23 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.532 0.093 17919 9233 1 23 . 1 1 34 34 GLU C C 34 177.840 177.840 176.097 1.743 17919 9234 1 23 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.722 -0.552 17919 9235 1 23 . 1 1 34 34 GLU CB C 34 32.660 32.660 30.747 1.913 17919 9236 1 23 . 1 1 34 34 GLU H H 34 8.740 8.740 8.085 0.655 17919 9237 1 23 . 1 1 35 35 GLY N N 35 108.650 108.650 109.290 -0.640 17919 9238 1 23 . 1 1 35 35 GLY C C 35 173.960 173.960 174.617 -0.657 17919 9239 1 23 . 1 1 35 35 GLY CA C 35 46.080 46.080 46.165 -0.085 17919 9240 1 23 . 1 1 35 35 GLY H H 35 8.530 8.530 7.966 0.564 17919 9241 1 23 . 1 1 36 36 ILE N N 36 119.880 119.880 121.073 -1.193 17919 9242 1 23 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.460 -0.015 17919 9243 1 23 . 1 1 36 36 ILE C C 36 173.590 173.590 174.208 -0.618 17919 9244 1 23 . 1 1 36 36 ILE CA C 36 57.750 57.750 56.626 1.124 17919 9245 1 23 . 1 1 36 36 ILE CB C 36 40.580 40.580 37.493 3.087 17919 9246 1 23 . 1 1 36 36 ILE H H 36 6.150 6.150 7.631 -1.481 17919 9247 1 23 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.864 -0.230 17919 9248 1 23 . 1 1 37 37 PRO C C 37 176.940 176.940 176.175 0.765 17919 9249 1 23 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.080 0.580 17919 9250 1 23 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.512 0.338 17919 9251 1 23 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.115 0.002 17919 9252 1 23 . 1 1 38 38 PRO C C 38 178.320 178.320 178.154 0.166 17919 9253 1 23 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.719 0.541 17919 9254 1 23 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.592 1.298 17919 9255 1 23 . 1 1 39 39 ASP N N 39 113.380 113.380 117.186 -3.806 17919 9256 1 23 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.181 0.249 17919 9257 1 23 . 1 1 39 39 ASP C C 39 177.090 177.090 177.692 -0.602 17919 9258 1 23 . 1 1 39 39 ASP CA C 39 55.640 55.640 57.430 -1.790 17919 9259 1 23 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.539 -0.999 17919 9260 1 23 . 1 1 39 39 ASP H H 39 8.550 8.550 8.575 -0.025 17919 9261 1 23 . 1 1 40 40 GLN N N 40 116.780 116.780 116.886 -0.106 17919 9262 1 23 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.270 0.194 17919 9263 1 23 . 1 1 40 40 GLN C C 40 175.380 175.380 176.291 -0.911 17919 9264 1 23 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.989 -0.349 17919 9265 1 23 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.284 0.856 17919 9266 1 23 . 1 1 40 40 GLN H H 40 7.820 7.820 7.713 0.107 17919 9267 1 23 . 1 1 41 41 GLN N N 41 117.720 117.720 119.540 -1.820 17919 9268 1 23 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.272 -0.028 17919 9269 1 23 . 1 1 41 41 GLN C C 41 176.300 176.300 175.268 1.032 17919 9270 1 23 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.584 -0.114 17919 9271 1 23 . 1 1 41 41 GLN CB C 41 31.650 31.650 28.834 2.816 17919 9272 1 23 . 1 1 41 41 GLN H H 41 7.480 7.480 7.365 0.115 17919 9273 1 23 . 1 1 42 42 ARG N N 42 122.680 122.680 123.182 -0.502 17919 9274 1 23 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.548 -0.048 17919 9275 1 23 . 1 1 42 42 ARG C C 42 174.050 174.050 174.846 -0.796 17919 9276 1 23 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.149 -0.099 17919 9277 1 23 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.484 -0.734 17919 9278 1 23 . 1 1 42 42 ARG H H 42 8.530 8.530 8.292 0.238 17919 9279 1 23 . 1 1 43 43 LEU N N 43 124.040 124.040 124.942 -0.902 17919 9280 1 23 . 1 1 43 43 LEU C C 43 175.290 175.290 175.451 -0.161 17919 9281 1 23 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.786 -0.806 17919 9282 1 23 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.155 1.635 17919 9283 1 23 . 1 1 43 43 LEU H H 43 8.820 8.820 8.836 -0.016 17919 9284 1 23 . 1 1 44 44 ILE N N 44 121.920 121.920 122.538 -0.618 17919 9285 1 23 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.125 -0.133 17919 9286 1 23 . 1 1 44 44 ILE C C 44 176.060 176.060 174.448 1.612 17919 9287 1 23 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.491 -1.511 17919 9288 1 23 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.977 -0.557 17919 9289 1 23 . 1 1 44 44 ILE H H 44 9.030 9.030 8.151 0.879 17919 9290 1 23 . 1 1 45 45 PHE N N 45 125.390 125.390 127.096 -1.706 17919 9291 1 23 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.035 0.010 17919 9292 1 23 . 1 1 45 45 PHE C C 45 174.470 174.470 174.397 0.073 17919 9293 1 23 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.416 0.605 17919 9294 1 23 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.155 0.605 17919 9295 1 23 . 1 1 45 45 PHE H H 45 8.830 8.830 9.211 -0.381 17919 9296 1 23 . 1 1 46 46 ALA N N 46 132.200 132.200 130.414 1.786 17919 9297 1 23 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.695 -0.005 17919 9298 1 23 . 1 1 46 46 ALA C C 46 177.290 177.290 177.952 -0.662 17919 9299 1 23 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.199 0.341 17919 9300 1 23 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.441 0.129 17919 9301 1 23 . 1 1 46 46 ALA H H 46 8.810 8.810 8.625 0.185 17919 9302 1 23 . 1 1 47 47 GLY N N 47 102.340 102.340 105.125 -2.785 17919 9303 1 23 . 1 1 47 47 GLY C C 47 173.810 173.810 174.164 -0.354 17919 9304 1 23 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.326 0.024 17919 9305 1 23 . 1 1 47 47 GLY H H 47 8.130 8.130 8.601 -0.471 17919 9306 1 23 . 1 1 48 48 LYS N N 48 121.570 121.570 119.470 2.100 17919 9307 1 23 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.539 0.083 17919 9308 1 23 . 1 1 48 48 LYS C C 48 174.700 174.700 174.722 -0.022 17919 9309 1 23 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.708 -0.158 17919 9310 1 23 . 1 1 48 48 LYS CB C 48 34.530 34.530 35.687 -1.157 17919 9311 1 23 . 1 1 48 48 LYS H H 48 7.980 7.980 7.829 0.151 17919 9312 1 23 . 1 1 49 49 GLN N N 49 122.410 122.410 123.612 -1.202 17919 9313 1 23 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.854 -0.294 17919 9314 1 23 . 1 1 49 49 GLN C C 49 175.670 175.670 175.690 -0.020 17919 9315 1 23 . 1 1 49 49 GLN CA C 49 55.740 55.740 54.874 0.866 17919 9316 1 23 . 1 1 49 49 GLN CB C 49 29.000 29.000 30.202 -1.202 17919 9317 1 23 . 1 1 49 49 GLN H H 49 8.600 8.600 8.567 0.033 17919 9318 1 23 . 1 1 50 50 LEU N N 50 125.520 125.520 129.041 -3.521 17919 9319 1 23 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.158 -0.068 17919 9320 1 23 . 1 1 50 50 LEU C C 50 176.660 176.660 176.524 0.136 17919 9321 1 23 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.675 -0.435 17919 9322 1 23 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.208 0.362 17919 9323 1 23 . 1 1 50 50 LEU H H 50 8.530 8.530 8.683 -0.153 17919 9324 1 23 . 1 1 51 51 GLU N N 51 122.940 122.940 124.357 -1.417 17919 9325 1 23 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.553 -0.065 17919 9326 1 23 . 1 1 51 51 GLU C C 51 175.870 175.870 176.417 -0.547 17919 9327 1 23 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.099 0.861 17919 9328 1 23 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.816 -0.246 17919 9329 1 23 . 1 1 51 51 GLU H H 51 8.400 8.400 8.920 -0.520 17919 9330 1 23 . 1 1 52 52 ASP N N 52 120.030 120.030 122.055 -2.025 17919 9331 1 23 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.516 -0.157 17919 9332 1 23 . 1 1 52 52 ASP C C 52 177.330 177.330 177.294 0.036 17919 9333 1 23 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.451 -0.491 17919 9334 1 23 . 1 1 52 52 ASP CB C 52 40.850 40.850 41.091 -0.241 17919 9335 1 23 . 1 1 52 52 ASP H H 52 8.160 8.160 8.817 -0.657 17919 9336 1 23 . 1 1 53 53 GLY N N 53 106.660 106.660 105.746 0.914 17919 9337 1 23 . 1 1 53 53 GLY C C 53 174.870 174.870 174.096 0.774 17919 9338 1 23 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.484 0.686 17919 9339 1 23 . 1 1 53 53 GLY H H 53 9.390 9.390 8.217 1.173 17919 9340 1 23 . 1 1 54 54 ARG N N 54 119.050 119.050 121.162 -2.112 17919 9341 1 23 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.694 0.001 17919 9342 1 23 . 1 1 54 54 ARG C C 54 175.350 175.350 174.940 0.410 17919 9343 1 23 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.923 -0.533 17919 9344 1 23 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.248 0.403 17919 9345 1 23 . 1 1 54 54 ARG H H 54 7.460 7.460 7.810 -0.350 17919 9346 1 23 . 1 1 55 55 THR N N 55 108.400 108.400 113.949 -5.549 17919 9347 1 23 . 1 1 55 55 THR HA H 55 5.240 5.240 5.220 0.020 17919 9348 1 23 . 1 1 55 55 THR C C 55 176.560 176.560 175.856 0.704 17919 9349 1 23 . 1 1 55 55 THR CA C 55 59.690 59.690 60.420 -0.730 17919 9350 1 23 . 1 1 55 55 THR CB C 55 72.260 72.260 70.957 1.303 17919 9351 1 23 . 1 1 55 55 THR H H 55 8.730 8.730 8.143 0.587 17919 9352 1 23 . 1 1 56 56 LEU N N 56 117.920 117.920 121.969 -4.049 17919 9353 1 23 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.033 0.027 17919 9354 1 23 . 1 1 56 56 LEU C C 56 180.810 180.810 178.587 2.223 17919 9355 1 23 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.279 0.431 17919 9356 1 23 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.019 -0.649 17919 9357 1 23 . 1 1 56 56 LEU H H 56 8.140 8.140 8.583 -0.443 17919 9358 1 23 . 1 1 57 57 SER N N 57 113.330 113.330 113.338 -0.008 17919 9359 1 23 . 1 1 57 57 SER HA H 57 4.370 4.370 4.204 0.166 17919 9360 1 23 . 1 1 57 57 SER C C 57 178.310 178.310 177.010 1.300 17919 9361 1 23 . 1 1 57 57 SER CA C 57 61.080 61.080 61.172 -0.092 17919 9362 1 23 . 1 1 57 57 SER CB C 57 62.530 62.530 62.590 -0.060 17919 9363 1 23 . 1 1 57 57 SER H H 57 8.470 8.470 8.010 0.460 17919 9364 1 23 . 1 1 58 58 ASP N N 58 124.190 124.190 123.802 0.388 17919 9365 1 23 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.361 -0.065 17919 9366 1 23 . 1 1 58 58 ASP C C 58 177.400 177.400 177.197 0.203 17919 9367 1 23 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.672 0.508 17919 9368 1 23 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.766 -0.666 17919 9369 1 23 . 1 1 58 58 ASP H H 58 7.930 7.930 7.880 0.050 17919 9370 1 23 . 1 1 59 59 TYR N N 59 115.510 115.510 116.130 -0.620 17919 9371 1 23 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.594 0.076 17919 9372 1 23 . 1 1 59 59 TYR C C 59 174.700 174.700 174.874 -0.174 17919 9373 1 23 . 1 1 59 59 TYR CA C 59 58.250 58.250 58.127 0.123 17919 9374 1 23 . 1 1 59 59 TYR CB C 59 40.070 40.070 37.924 2.146 17919 9375 1 23 . 1 1 59 59 TYR H H 59 7.250 7.250 7.776 -0.526 17919 9376 1 23 . 1 1 60 60 ASN N N 60 115.900 115.900 113.994 1.906 17919 9377 1 23 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.365 -0.010 17919 9378 1 23 . 1 1 60 60 ASN C C 60 174.340 174.340 174.837 -0.497 17919 9379 1 23 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.154 -0.034 17919 9380 1 23 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.480 -0.070 17919 9381 1 23 . 1 1 60 60 ASN H H 60 8.150 8.150 7.786 0.364 17919 9382 1 23 . 1 1 61 61 ILE N N 61 118.600 118.600 119.088 -0.488 17919 9383 1 23 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.669 -0.276 17919 9384 1 23 . 1 1 61 61 ILE C C 61 174.610 174.610 175.946 -1.336 17919 9385 1 23 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.290 0.130 17919 9386 1 23 . 1 1 61 61 ILE CB C 61 36.740 36.740 36.901 -0.161 17919 9387 1 23 . 1 1 61 61 ILE H H 61 7.250 7.250 7.545 -0.295 17919 9388 1 23 . 1 1 62 62 GLN N N 62 124.740 124.740 125.332 -0.592 17919 9389 1 23 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.703 -0.197 17919 9390 1 23 . 1 1 62 62 GLN C C 62 175.970 175.970 175.653 0.317 17919 9391 1 23 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.876 -0.216 17919 9392 1 23 . 1 1 62 62 GLN CB C 62 31.650 31.650 32.616 -0.966 17919 9393 1 23 . 1 1 62 62 GLN H H 62 7.610 7.610 7.854 -0.244 17919 9394 1 23 . 1 1 63 63 LYS N N 63 120.300 120.300 120.566 -0.266 17919 9395 1 23 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.909 0.092 17919 9396 1 23 . 1 1 63 63 LYS C C 63 175.810 175.810 176.410 -0.600 17919 9397 1 23 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.634 0.156 17919 9398 1 23 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.819 0.831 17919 9399 1 23 . 1 1 63 63 LYS H H 63 8.490 8.490 8.681 -0.191 17919 9400 1 23 . 1 1 64 64 GLU N N 64 113.950 113.950 118.134 -4.184 17919 9401 1 23 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.036 0.429 17919 9402 1 23 . 1 1 64 64 GLU C C 64 175.250 175.250 175.457 -0.207 17919 9403 1 23 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.581 0.309 17919 9404 1 23 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.660 -2.760 17919 9405 1 23 . 1 1 64 64 GLU H H 64 9.280 9.280 8.776 0.504 17919 9406 1 23 . 1 1 65 65 SER N N 65 114.730 114.730 115.192 -0.462 17919 9407 1 23 . 1 1 65 65 SER HA H 65 4.640 4.640 4.514 0.126 17919 9408 1 23 . 1 1 65 65 SER C C 65 172.160 172.160 174.379 -2.219 17919 9409 1 23 . 1 1 65 65 SER CA C 65 60.890 60.890 59.165 1.725 17919 9410 1 23 . 1 1 65 65 SER CB C 65 64.910 64.910 63.572 1.338 17919 9411 1 23 . 1 1 65 65 SER H H 65 7.670 7.670 7.429 0.241 17919 9412 1 23 . 1 1 66 66 THR N N 66 117.110 117.110 121.858 -4.748 17919 9413 1 23 . 1 1 66 66 THR HA H 66 5.270 5.270 4.430 0.840 17919 9414 1 23 . 1 1 66 66 THR C C 66 173.950 173.950 174.309 -0.359 17919 9415 1 23 . 1 1 66 66 THR CA C 66 62.340 62.340 63.922 -1.583 17919 9416 1 23 . 1 1 66 66 THR CB C 66 70.080 70.080 68.941 1.139 17919 9417 1 23 . 1 1 66 66 THR H H 66 8.730 8.730 8.425 0.305 17919 9418 1 23 . 1 1 67 67 LEU N N 67 127.110 127.110 127.033 0.077 17919 9419 1 23 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.994 0.066 17919 9420 1 23 . 1 1 67 67 LEU C C 67 175.770 175.770 175.581 0.189 17919 9421 1 23 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.488 0.412 17919 9422 1 23 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.554 -0.294 17919 9423 1 23 . 1 1 67 67 LEU H H 67 9.410 9.410 9.093 0.317 17919 9424 1 23 . 1 1 68 68 HIS N N 68 118.380 118.380 123.127 -4.747 17919 9425 1 23 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.309 -0.069 17919 9426 1 23 . 1 1 68 68 HIS C C 68 173.150 173.150 174.537 -1.387 17919 9427 1 23 . 1 1 68 68 HIS CA C 68 55.000 55.000 53.911 1.089 17919 9428 1 23 . 1 1 68 68 HIS CB C 68 30.530 30.530 30.689 -0.159 17919 9429 1 23 . 1 1 68 68 HIS H H 68 9.230 9.230 8.645 0.585 17919 9430 1 23 . 1 1 69 69 LEU N N 69 124.460 124.460 131.234 -6.774 17919 9431 1 23 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.961 0.229 17919 9432 1 23 . 1 1 69 69 LEU C C 69 175.270 175.270 174.797 0.473 17919 9433 1 23 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.830 -0.940 17919 9434 1 23 . 1 1 69 69 LEU CB C 69 44.380 44.380 42.770 1.610 17919 9435 1 23 . 1 1 69 69 LEU H H 69 8.340 8.340 8.264 0.076 17919 9436 1 23 . 1 1 70 70 VAL N N 70 126.940 126.940 127.291 -0.351 17919 9437 1 23 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.368 -0.018 17919 9438 1 23 . 1 1 70 70 VAL C C 70 174.000 174.000 174.559 -0.559 17919 9439 1 23 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.208 0.592 17919 9440 1 23 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.115 -0.206 17919 9441 1 23 . 1 1 70 70 VAL H H 70 9.200 9.200 8.564 0.636 17919 9442 1 23 . 1 1 71 71 LEU N N 71 123.130 123.130 121.111 2.019 17919 9443 1 23 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.226 -0.166 17919 9444 1 23 . 1 1 71 71 LEU C C 71 177.830 177.830 176.763 1.067 17919 9445 1 23 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.107 0.833 17919 9446 1 23 . 1 1 71 71 LEU CB C 71 42.850 42.850 45.883 -3.033 17919 9447 1 23 . 1 1 71 71 LEU H H 71 8.120 8.120 8.302 -0.182 17919 9448 1 23 . 1 1 72 72 ARG N N 72 123.490 123.490 121.710 1.780 17919 9449 1 23 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.461 -0.160 17919 9450 1 23 . 1 1 72 72 ARG C C 72 175.350 175.350 175.104 0.246 17919 9451 1 23 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.578 0.032 17919 9452 1 23 . 1 1 72 72 ARG CB C 72 31.350 31.350 29.902 1.448 17919 9453 1 23 . 1 1 72 72 ARG H H 72 8.580 8.580 8.456 0.124 17919 9454 1 24 . 1 1 2 2 GLN N N 2 123.220 123.220 119.771 3.449 17919 9455 1 24 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.559 -0.310 17919 9456 1 24 . 1 1 2 2 GLN C C 2 175.920 175.920 176.032 -0.112 17919 9457 1 24 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.484 0.596 17919 9458 1 24 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.493 0.267 17919 9459 1 24 . 1 1 2 2 GLN H H 2 8.900 8.900 8.354 0.546 17919 9460 1 24 . 1 1 3 3 ILE N N 3 115.340 115.340 115.980 -0.640 17919 9461 1 24 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.207 0.006 17919 9462 1 24 . 1 1 3 3 ILE C C 3 172.450 172.450 173.807 -1.357 17919 9463 1 24 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.434 0.136 17919 9464 1 24 . 1 1 3 3 ILE CB C 3 42.210 42.210 40.653 1.557 17919 9465 1 24 . 1 1 3 3 ILE H H 3 8.320 8.320 8.554 -0.234 17919 9466 1 24 . 1 1 4 4 PHE N N 4 118.110 118.110 120.114 -2.004 17919 9467 1 24 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.243 0.387 17919 9468 1 24 . 1 1 4 4 PHE C C 4 175.320 175.320 175.186 0.134 17919 9469 1 24 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.506 -0.296 17919 9470 1 24 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.725 -0.245 17919 9471 1 24 . 1 1 4 4 PHE H H 4 8.610 8.610 8.075 0.535 17919 9472 1 24 . 1 1 5 5 VAL N N 5 121.000 121.000 122.591 -1.591 17919 9473 1 24 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.859 -0.134 17919 9474 1 24 . 1 1 5 5 VAL C C 5 174.870 174.870 175.699 -0.829 17919 9475 1 24 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.055 -0.435 17919 9476 1 24 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.181 1.049 17919 9477 1 24 . 1 1 5 5 VAL H H 5 9.300 9.300 8.653 0.647 17919 9478 1 24 . 1 1 6 6 LYS N N 6 127.520 127.520 129.548 -2.028 17919 9479 1 24 . 1 1 6 6 LYS HA H 6 5.367 5.367 4.777 0.590 17919 9480 1 24 . 1 1 6 6 LYS C C 6 177.140 177.140 176.260 0.880 17919 9481 1 24 . 1 1 6 6 LYS CA C 6 54.520 54.520 55.281 -0.761 17919 9482 1 24 . 1 1 6 6 LYS CB C 6 35.050 35.050 32.491 2.559 17919 9483 1 24 . 1 1 6 6 LYS H H 6 8.820 8.820 8.676 0.144 17919 9484 1 24 . 1 1 7 7 THR N N 7 115.400 115.400 115.466 -0.066 17919 9485 1 24 . 1 1 7 7 THR HA H 7 4.970 4.970 4.869 0.101 17919 9486 1 24 . 1 1 7 7 THR C C 7 176.910 176.910 176.344 0.566 17919 9487 1 24 . 1 1 7 7 THR CA C 7 60.470 60.470 60.031 0.440 17919 9488 1 24 . 1 1 7 7 THR CB C 7 70.630 70.630 71.290 -0.660 17919 9489 1 24 . 1 1 7 7 THR H H 7 8.730 8.730 8.374 0.356 17919 9490 1 24 . 1 1 8 8 LEU N N 8 121.330 121.330 125.330 -4.000 17919 9491 1 24 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.106 0.204 17919 9492 1 24 . 1 1 8 8 LEU C C 8 178.800 178.800 177.201 1.599 17919 9493 1 24 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.649 -0.069 17919 9494 1 24 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.131 -0.161 17919 9495 1 24 . 1 1 8 8 LEU H H 8 9.100 9.100 8.328 0.772 17919 9496 1 24 . 1 1 9 9 THR N N 9 105.590 105.590 107.251 -1.661 17919 9497 1 24 . 1 1 9 9 THR HA H 9 4.428 4.428 4.272 0.156 17919 9498 1 24 . 1 1 9 9 THR C C 9 175.520 175.520 175.532 -0.012 17919 9499 1 24 . 1 1 9 9 THR CA C 9 61.400 61.400 62.831 -1.431 17919 9500 1 24 . 1 1 9 9 THR CB C 9 69.140 69.140 68.688 0.452 17919 9501 1 24 . 1 1 9 9 THR H H 9 7.630 7.630 8.126 -0.496 17919 9502 1 24 . 1 1 10 10 GLY N N 10 108.890 108.890 110.472 -1.582 17919 9503 1 24 . 1 1 10 10 GLY C C 10 174.070 174.070 173.292 0.778 17919 9504 1 24 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.069 0.391 17919 9505 1 24 . 1 1 10 10 GLY H H 10 7.810 7.810 7.773 0.037 17919 9506 1 24 . 1 1 11 11 LYS N N 11 121.600 121.600 121.681 -0.081 17919 9507 1 24 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.715 -0.354 17919 9508 1 24 . 1 1 11 11 LYS C C 11 175.940 175.940 175.560 0.380 17919 9509 1 24 . 1 1 11 11 LYS CA C 11 56.280 56.280 54.679 1.601 17919 9510 1 24 . 1 1 11 11 LYS CB C 11 33.200 33.200 34.837 -1.637 17919 9511 1 24 . 1 1 11 11 LYS H H 11 7.280 7.280 8.019 -0.739 17919 9512 1 24 . 1 1 12 12 THR N N 12 120.440 120.440 120.271 0.169 17919 9513 1 24 . 1 1 12 12 THR HA H 12 5.046 5.046 4.605 0.441 17919 9514 1 24 . 1 1 12 12 THR C C 12 174.320 174.320 174.238 0.082 17919 9515 1 24 . 1 1 12 12 THR CA C 12 62.390 62.390 62.880 -0.490 17919 9516 1 24 . 1 1 12 12 THR CB C 12 69.910 69.910 69.308 0.602 17919 9517 1 24 . 1 1 12 12 THR H H 12 8.650 8.650 8.502 0.148 17919 9518 1 24 . 1 1 13 13 ILE N N 13 127.110 127.110 128.416 -1.306 17919 9519 1 24 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.534 0.010 17919 9520 1 24 . 1 1 13 13 ILE C C 13 175.220 175.220 175.296 -0.076 17919 9521 1 24 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.179 -0.200 17919 9522 1 24 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.837 0.113 17919 9523 1 24 . 1 1 13 13 ILE H H 13 9.450 9.450 8.704 0.746 17919 9524 1 24 . 1 1 14 14 THR N N 14 121.520 121.520 122.258 -0.738 17919 9525 1 24 . 1 1 14 14 THR HA H 14 4.964 4.964 5.193 -0.229 17919 9526 1 24 . 1 1 14 14 THR C C 14 173.790 173.790 174.176 -0.386 17919 9527 1 24 . 1 1 14 14 THR CA C 14 61.940 61.940 62.129 -0.189 17919 9528 1 24 . 1 1 14 14 THR CB C 14 69.650 69.650 69.983 -0.333 17919 9529 1 24 . 1 1 14 14 THR H H 14 8.710 8.710 8.481 0.229 17919 9530 1 24 . 1 1 15 15 LEU N N 15 124.800 124.800 127.417 -2.617 17919 9531 1 24 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.586 0.194 17919 9532 1 24 . 1 1 15 15 LEU C C 15 174.670 174.670 174.525 0.145 17919 9533 1 24 . 1 1 15 15 LEU CA C 15 52.830 52.830 54.576 -1.746 17919 9534 1 24 . 1 1 15 15 LEU CB C 15 47.070 47.070 46.177 0.893 17919 9535 1 24 . 1 1 15 15 LEU H H 15 8.710 8.710 8.306 0.405 17919 9536 1 24 . 1 1 16 16 GLU N N 16 122.160 122.160 124.788 -2.628 17919 9537 1 24 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.971 -0.054 17919 9538 1 24 . 1 1 16 16 GLU C C 16 175.860 175.860 175.919 -0.059 17919 9539 1 24 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.324 -0.504 17919 9540 1 24 . 1 1 16 16 GLU CB C 16 29.450 29.450 29.747 -0.297 17919 9541 1 24 . 1 1 16 16 GLU H H 16 8.140 8.140 8.710 -0.570 17919 9542 1 24 . 1 1 17 17 VAL N N 17 117.210 117.210 121.537 -4.327 17919 9543 1 24 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.747 -0.033 17919 9544 1 24 . 1 1 17 17 VAL C C 17 174.160 174.160 174.646 -0.486 17919 9545 1 24 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.256 -0.826 17919 9546 1 24 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.759 0.641 17919 9547 1 24 . 1 1 17 17 VAL H H 17 8.900 8.900 9.036 -0.136 17919 9548 1 24 . 1 1 18 18 GLU N N 18 118.990 118.990 119.150 -0.160 17919 9549 1 24 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.889 0.190 17919 9550 1 24 . 1 1 18 18 GLU C C 18 176.160 176.160 175.224 0.936 17919 9551 1 24 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.004 -0.284 17919 9552 1 24 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.453 -0.143 17919 9553 1 24 . 1 1 18 18 GLU H H 18 8.640 8.640 9.297 -0.657 17919 9554 1 24 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.186 -0.045 17919 9555 1 24 . 1 1 19 19 PRO C C 19 175.310 175.310 177.489 -2.179 17919 9556 1 24 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.786 -0.316 17919 9557 1 24 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.928 0.022 17919 9558 1 24 . 1 1 20 20 SER N N 20 103.400 103.400 107.983 -4.583 17919 9559 1 24 . 1 1 20 20 SER HA H 20 4.370 4.370 4.347 0.023 17919 9560 1 24 . 1 1 20 20 SER C C 20 174.660 174.660 174.586 0.074 17919 9561 1 24 . 1 1 20 20 SER CA C 20 57.400 57.400 58.601 -1.201 17919 9562 1 24 . 1 1 20 20 SER CB C 20 63.370 63.370 62.907 0.463 17919 9563 1 24 . 1 1 20 20 SER H H 20 7.040 7.040 8.027 -0.987 17919 9564 1 24 . 1 1 21 21 ASP N N 21 123.480 123.480 124.918 -1.438 17919 9565 1 24 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.618 0.077 17919 9566 1 24 . 1 1 21 21 ASP C C 21 176.360 176.360 175.418 0.942 17919 9567 1 24 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.827 -0.127 17919 9568 1 24 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.834 -1.034 17919 9569 1 24 . 1 1 21 21 ASP H H 21 8.030 8.030 7.620 0.410 17919 9570 1 24 . 1 1 22 22 THR N N 22 108.800 108.800 113.360 -4.560 17919 9571 1 24 . 1 1 22 22 THR HA H 22 4.920 4.920 4.784 0.136 17919 9572 1 24 . 1 1 22 22 THR C C 22 176.750 176.750 175.690 1.060 17919 9573 1 24 . 1 1 22 22 THR CA C 22 59.690 59.690 60.879 -1.189 17919 9574 1 24 . 1 1 22 22 THR CB C 22 71.200 71.200 70.184 1.016 17919 9575 1 24 . 1 1 22 22 THR H H 22 7.900 7.900 8.410 -0.510 17919 9576 1 24 . 1 1 23 23 ILE N N 23 121.190 121.190 122.704 -1.514 17919 9577 1 24 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.752 -0.095 17919 9578 1 24 . 1 1 23 23 ILE C C 23 179.040 179.040 177.623 1.417 17919 9579 1 24 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.901 -0.641 17919 9580 1 24 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.504 -2.154 17919 9581 1 24 . 1 1 23 23 ILE H H 23 8.560 8.560 8.730 -0.170 17919 9582 1 24 . 1 1 24 24 GLU N N 24 120.830 120.830 120.951 -0.121 17919 9583 1 24 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.772 0.145 17919 9584 1 24 . 1 1 24 24 GLU C C 24 178.640 178.640 178.597 0.043 17919 9585 1 24 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.252 -0.032 17919 9586 1 24 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.331 -1.051 17919 9587 1 24 . 1 1 24 24 GLU H H 24 9.760 9.760 8.128 1.632 17919 9588 1 24 . 1 1 25 25 ASN N N 25 120.570 120.570 116.935 3.635 17919 9589 1 24 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.567 -0.042 17919 9590 1 24 . 1 1 25 25 ASN C C 25 178.380 178.380 178.020 0.360 17919 9591 1 24 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.805 0.255 17919 9592 1 24 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.000 0.450 17919 9593 1 24 . 1 1 25 25 ASN H H 25 7.920 7.920 8.233 -0.313 17919 9594 1 24 . 1 1 26 26 VAL N N 26 121.710 121.710 120.502 1.208 17919 9595 1 24 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.541 -0.144 17919 9596 1 24 . 1 1 26 26 VAL C C 26 177.950 177.950 178.118 -0.168 17919 9597 1 24 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.407 1.253 17919 9598 1 24 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.065 -0.225 17919 9599 1 24 . 1 1 26 26 VAL H H 26 8.070 8.070 7.931 0.139 17919 9600 1 24 . 1 1 27 27 LYS N N 27 118.860 118.860 119.832 -0.972 17919 9601 1 24 . 1 1 27 27 LYS HA H 27 4.580 4.580 3.987 0.593 17919 9602 1 24 . 1 1 27 27 LYS C C 27 180.550 180.550 179.084 1.466 17919 9603 1 24 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.559 -0.309 17919 9604 1 24 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.123 1.607 17919 9605 1 24 . 1 1 27 27 LYS H H 27 8.560 8.560 7.671 0.889 17919 9606 1 24 . 1 1 28 28 ALA N N 28 123.440 123.440 121.804 1.636 17919 9607 1 24 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.362 -0.202 17919 9608 1 24 . 1 1 28 28 ALA C C 28 180.300 180.300 179.072 1.228 17919 9609 1 24 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.681 0.689 17919 9610 1 24 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.431 -0.721 17919 9611 1 24 . 1 1 28 28 ALA H H 28 8.060 8.060 7.884 0.176 17919 9612 1 24 . 1 1 29 29 LYS N N 29 119.940 119.940 119.762 0.178 17919 9613 1 24 . 1 1 29 29 LYS HA H 29 4.207 4.207 3.959 0.248 17919 9614 1 24 . 1 1 29 29 LYS C C 29 180.320 180.320 179.389 0.931 17919 9615 1 24 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.617 0.033 17919 9616 1 24 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.287 1.003 17919 9617 1 24 . 1 1 29 29 LYS H H 29 7.850 7.850 7.373 0.477 17919 9618 1 24 . 1 1 30 30 ILE N N 30 121.080 121.080 119.901 1.179 17919 9619 1 24 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.557 -0.050 17919 9620 1 24 . 1 1 30 30 ILE C C 30 178.310 178.310 177.479 0.831 17919 9621 1 24 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.422 0.728 17919 9622 1 24 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.740 -0.940 17919 9623 1 24 . 1 1 30 30 ILE H H 30 8.280 8.280 8.277 0.003 17919 9624 1 24 . 1 1 31 31 GLN N N 31 123.490 123.490 120.937 2.553 17919 9625 1 24 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.064 -0.235 17919 9626 1 24 . 1 1 31 31 GLN C C 31 178.890 178.890 178.224 0.666 17919 9627 1 24 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.020 0.980 17919 9628 1 24 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.635 -0.915 17919 9629 1 24 . 1 1 31 31 GLN H H 31 8.580 8.580 8.344 0.236 17919 9630 1 24 . 1 1 32 32 ASP N N 32 119.360 119.360 117.955 1.405 17919 9631 1 24 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.509 -0.155 17919 9632 1 24 . 1 1 32 32 ASP C C 32 177.250 177.250 177.125 0.125 17919 9633 1 24 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.150 1.040 17919 9634 1 24 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.349 0.231 17919 9635 1 24 . 1 1 32 32 ASP H H 32 8.010 8.010 8.200 -0.190 17919 9636 1 24 . 1 1 33 33 LYS N N 33 115.130 115.130 118.698 -3.568 17919 9637 1 24 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.456 -0.119 17919 9638 1 24 . 1 1 33 33 LYS C C 33 177.870 177.870 177.907 -0.037 17919 9639 1 24 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.204 0.846 17919 9640 1 24 . 1 1 33 33 LYS CB C 33 34.170 34.170 34.311 -0.141 17919 9641 1 24 . 1 1 33 33 LYS H H 33 7.430 7.430 7.483 -0.053 17919 9642 1 24 . 1 1 34 34 GLU N N 34 113.870 113.870 115.600 -1.730 17919 9643 1 24 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.479 0.146 17919 9644 1 24 . 1 1 34 34 GLU C C 34 177.840 177.840 177.528 0.312 17919 9645 1 24 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.458 -0.288 17919 9646 1 24 . 1 1 34 34 GLU CB C 34 32.660 32.660 30.904 1.756 17919 9647 1 24 . 1 1 34 34 GLU H H 34 8.740 8.740 8.428 0.312 17919 9648 1 24 . 1 1 35 35 GLY N N 35 108.650 108.650 108.594 0.056 17919 9649 1 24 . 1 1 35 35 GLY C C 35 173.960 173.960 174.644 -0.684 17919 9650 1 24 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.741 0.339 17919 9651 1 24 . 1 1 35 35 GLY H H 35 8.530 8.530 8.302 0.228 17919 9652 1 24 . 1 1 36 36 ILE N N 36 119.880 119.880 118.317 1.563 17919 9653 1 24 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.512 -0.067 17919 9654 1 24 . 1 1 36 36 ILE C C 36 173.590 173.590 173.850 -0.260 17919 9655 1 24 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.114 -0.364 17919 9656 1 24 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.030 2.550 17919 9657 1 24 . 1 1 36 36 ILE H H 36 6.150 6.150 7.600 -1.450 17919 9658 1 24 . 1 1 37 37 PRO HA H 37 4.634 4.634 5.067 -0.433 17919 9659 1 24 . 1 1 37 37 PRO C C 37 176.940 176.940 176.309 0.631 17919 9660 1 24 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.020 0.640 17919 9661 1 24 . 1 1 37 37 PRO CB C 37 31.850 31.850 30.852 0.998 17919 9662 1 24 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.260 -0.143 17919 9663 1 24 . 1 1 38 38 PRO C C 38 178.320 178.320 177.756 0.564 17919 9664 1 24 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.408 0.852 17919 9665 1 24 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.743 1.147 17919 9666 1 24 . 1 1 39 39 ASP N N 39 113.380 113.380 115.591 -2.211 17919 9667 1 24 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.480 -0.050 17919 9668 1 24 . 1 1 39 39 ASP C C 39 177.090 177.090 177.728 -0.638 17919 9669 1 24 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.316 -0.676 17919 9670 1 24 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.013 -0.473 17919 9671 1 24 . 1 1 39 39 ASP H H 39 8.550 8.550 8.796 -0.246 17919 9672 1 24 . 1 1 40 40 GLN N N 40 116.780 116.780 117.933 -1.153 17919 9673 1 24 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.441 0.023 17919 9674 1 24 . 1 1 40 40 GLN C C 40 175.380 175.380 175.847 -0.467 17919 9675 1 24 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.687 -1.047 17919 9676 1 24 . 1 1 40 40 GLN CB C 40 30.140 30.140 30.752 -0.612 17919 9677 1 24 . 1 1 40 40 GLN H H 40 7.820 7.820 7.779 0.041 17919 9678 1 24 . 1 1 41 41 GLN N N 41 117.720 117.720 119.309 -1.589 17919 9679 1 24 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.255 -0.011 17919 9680 1 24 . 1 1 41 41 GLN C C 41 176.300 176.300 175.452 0.848 17919 9681 1 24 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.376 0.094 17919 9682 1 24 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.586 2.064 17919 9683 1 24 . 1 1 41 41 GLN H H 41 7.480 7.480 7.596 -0.116 17919 9684 1 24 . 1 1 42 42 ARG N N 42 122.680 122.680 124.982 -2.302 17919 9685 1 24 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.608 -0.108 17919 9686 1 24 . 1 1 42 42 ARG C C 42 174.050 174.050 174.848 -0.798 17919 9687 1 24 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.828 0.223 17919 9688 1 24 . 1 1 42 42 ARG CB C 42 31.750 31.750 31.898 -0.148 17919 9689 1 24 . 1 1 42 42 ARG H H 42 8.530 8.530 8.379 0.151 17919 9690 1 24 . 1 1 43 43 LEU N N 43 124.040 124.040 127.762 -3.722 17919 9691 1 24 . 1 1 43 43 LEU C C 43 175.290 175.290 176.376 -1.086 17919 9692 1 24 . 1 1 43 43 LEU CA C 43 52.980 52.980 55.312 -2.332 17919 9693 1 24 . 1 1 43 43 LEU CB C 43 45.790 45.790 42.515 3.275 17919 9694 1 24 . 1 1 43 43 LEU H H 43 8.820 8.820 8.701 0.119 17919 9695 1 24 . 1 1 44 44 ILE N N 44 121.920 121.920 122.776 -0.856 17919 9696 1 24 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.222 -0.230 17919 9697 1 24 . 1 1 44 44 ILE C C 44 176.060 176.060 174.622 1.438 17919 9698 1 24 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.129 -1.149 17919 9699 1 24 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.758 -0.338 17919 9700 1 24 . 1 1 44 44 ILE H H 44 9.030 9.030 8.659 0.371 17919 9701 1 24 . 1 1 45 45 PHE N N 45 125.390 125.390 125.829 -0.439 17919 9702 1 24 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.984 0.061 17919 9703 1 24 . 1 1 45 45 PHE C C 45 174.470 174.470 174.408 0.062 17919 9704 1 24 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.684 0.336 17919 9705 1 24 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.115 0.645 17919 9706 1 24 . 1 1 45 45 PHE H H 45 8.830 8.830 8.873 -0.043 17919 9707 1 24 . 1 1 46 46 ALA N N 46 132.200 132.200 129.787 2.413 17919 9708 1 24 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.664 0.026 17919 9709 1 24 . 1 1 46 46 ALA C C 46 177.290 177.290 177.852 -0.562 17919 9710 1 24 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.706 -0.166 17919 9711 1 24 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.476 0.094 17919 9712 1 24 . 1 1 46 46 ALA H H 46 8.810 8.810 8.912 -0.102 17919 9713 1 24 . 1 1 47 47 GLY N N 47 102.340 102.340 104.611 -2.271 17919 9714 1 24 . 1 1 47 47 GLY C C 47 173.810 173.810 174.289 -0.479 17919 9715 1 24 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.063 0.287 17919 9716 1 24 . 1 1 47 47 GLY H H 47 8.130 8.130 8.385 -0.255 17919 9717 1 24 . 1 1 48 48 LYS N N 48 121.570 121.570 121.344 0.226 17919 9718 1 24 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.738 -0.116 17919 9719 1 24 . 1 1 48 48 LYS C C 48 174.700 174.700 175.650 -0.950 17919 9720 1 24 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.415 0.135 17919 9721 1 24 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.360 0.170 17919 9722 1 24 . 1 1 48 48 LYS H H 48 7.980 7.980 8.107 -0.127 17919 9723 1 24 . 1 1 49 49 GLN N N 49 122.410 122.410 122.070 0.340 17919 9724 1 24 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.535 0.025 17919 9725 1 24 . 1 1 49 49 GLN C C 49 175.670 175.670 175.700 -0.030 17919 9726 1 24 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.043 -0.303 17919 9727 1 24 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.271 -0.271 17919 9728 1 24 . 1 1 49 49 GLN H H 49 8.600 8.600 8.624 -0.024 17919 9729 1 24 . 1 1 50 50 LEU N N 50 125.520 125.520 125.271 0.249 17919 9730 1 24 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.152 -0.062 17919 9731 1 24 . 1 1 50 50 LEU C C 50 176.660 176.660 176.676 -0.016 17919 9732 1 24 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.123 0.117 17919 9733 1 24 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.302 0.268 17919 9734 1 24 . 1 1 50 50 LEU H H 50 8.530 8.530 8.630 -0.100 17919 9735 1 24 . 1 1 51 51 GLU N N 51 122.940 122.940 125.045 -2.105 17919 9736 1 24 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.397 0.091 17919 9737 1 24 . 1 1 51 51 GLU C C 51 175.870 175.870 177.112 -1.242 17919 9738 1 24 . 1 1 51 51 GLU CA C 51 55.960 55.960 56.615 -0.656 17919 9739 1 24 . 1 1 51 51 GLU CB C 51 31.570 31.570 30.601 0.970 17919 9740 1 24 . 1 1 51 51 GLU H H 51 8.400 8.400 8.805 -0.405 17919 9741 1 24 . 1 1 52 52 ASP N N 52 120.030 120.030 124.410 -4.380 17919 9742 1 24 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.451 -0.092 17919 9743 1 24 . 1 1 52 52 ASP C C 52 177.330 177.330 177.826 -0.496 17919 9744 1 24 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.311 -0.351 17919 9745 1 24 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.845 0.005 17919 9746 1 24 . 1 1 52 52 ASP H H 52 8.160 8.160 8.778 -0.618 17919 9747 1 24 . 1 1 53 53 GLY N N 53 106.660 106.660 105.019 1.641 17919 9748 1 24 . 1 1 53 53 GLY C C 53 174.870 174.870 174.186 0.684 17919 9749 1 24 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.787 0.383 17919 9750 1 24 . 1 1 53 53 GLY H H 53 9.390 9.390 8.285 1.105 17919 9751 1 24 . 1 1 54 54 ARG N N 54 119.050 119.050 119.641 -0.591 17919 9752 1 24 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.659 0.036 17919 9753 1 24 . 1 1 54 54 ARG C C 54 175.350 175.350 175.450 -0.100 17919 9754 1 24 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.111 0.279 17919 9755 1 24 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.291 -0.641 17919 9756 1 24 . 1 1 54 54 ARG H H 54 7.460 7.460 7.387 0.073 17919 9757 1 24 . 1 1 55 55 THR N N 55 108.400 108.400 113.025 -4.625 17919 9758 1 24 . 1 1 55 55 THR HA H 55 5.240 5.240 4.787 0.453 17919 9759 1 24 . 1 1 55 55 THR C C 55 176.560 176.560 176.158 0.402 17919 9760 1 24 . 1 1 55 55 THR CA C 55 59.690 59.690 61.253 -1.563 17919 9761 1 24 . 1 1 55 55 THR CB C 55 72.260 72.260 70.764 1.496 17919 9762 1 24 . 1 1 55 55 THR H H 55 8.730 8.730 8.974 -0.244 17919 9763 1 24 . 1 1 56 56 LEU N N 56 117.920 117.920 121.406 -3.486 17919 9764 1 24 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.928 0.132 17919 9765 1 24 . 1 1 56 56 LEU C C 56 180.810 180.810 178.801 2.009 17919 9766 1 24 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.360 0.350 17919 9767 1 24 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.437 -1.067 17919 9768 1 24 . 1 1 56 56 LEU H H 56 8.140 8.140 8.444 -0.304 17919 9769 1 24 . 1 1 57 57 SER N N 57 113.330 113.330 114.248 -0.918 17919 9770 1 24 . 1 1 57 57 SER HA H 57 4.370 4.370 4.190 0.180 17919 9771 1 24 . 1 1 57 57 SER C C 57 178.310 178.310 176.954 1.356 17919 9772 1 24 . 1 1 57 57 SER CA C 57 61.080 61.080 61.245 -0.165 17919 9773 1 24 . 1 1 57 57 SER CB C 57 62.530 62.530 62.482 0.048 17919 9774 1 24 . 1 1 57 57 SER H H 57 8.470 8.470 7.916 0.554 17919 9775 1 24 . 1 1 58 58 ASP N N 58 124.190 124.190 122.333 1.857 17919 9776 1 24 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.292 0.004 17919 9777 1 24 . 1 1 58 58 ASP C C 58 177.400 177.400 177.122 0.278 17919 9778 1 24 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.860 0.320 17919 9779 1 24 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.527 -0.427 17919 9780 1 24 . 1 1 58 58 ASP H H 58 7.930 7.930 7.740 0.190 17919 9781 1 24 . 1 1 59 59 TYR N N 59 115.510 115.510 114.245 1.265 17919 9782 1 24 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.793 -0.123 17919 9783 1 24 . 1 1 59 59 TYR C C 59 174.700 174.700 175.330 -0.630 17919 9784 1 24 . 1 1 59 59 TYR CA C 59 58.250 58.250 56.844 1.406 17919 9785 1 24 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.424 1.646 17919 9786 1 24 . 1 1 59 59 TYR H H 59 7.250 7.250 7.320 -0.070 17919 9787 1 24 . 1 1 60 60 ASN N N 60 115.900 115.900 116.228 -0.328 17919 9788 1 24 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.401 -0.046 17919 9789 1 24 . 1 1 60 60 ASN C C 60 174.340 174.340 174.951 -0.611 17919 9790 1 24 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.142 -0.022 17919 9791 1 24 . 1 1 60 60 ASN CB C 60 37.410 37.410 38.131 -0.721 17919 9792 1 24 . 1 1 60 60 ASN H H 60 8.150 8.150 7.816 0.334 17919 9793 1 24 . 1 1 61 61 ILE N N 61 118.600 118.600 118.625 -0.025 17919 9794 1 24 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.477 -0.084 17919 9795 1 24 . 1 1 61 61 ILE C C 61 174.610 174.610 175.775 -1.165 17919 9796 1 24 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.999 0.421 17919 9797 1 24 . 1 1 61 61 ILE CB C 61 36.740 36.740 36.412 0.328 17919 9798 1 24 . 1 1 61 61 ILE H H 61 7.250 7.250 7.439 -0.189 17919 9799 1 24 . 1 1 62 62 GLN N N 62 124.740 124.740 123.838 0.902 17919 9800 1 24 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.679 -0.173 17919 9801 1 24 . 1 1 62 62 GLN C C 62 175.970 175.970 175.744 0.226 17919 9802 1 24 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.872 -0.212 17919 9803 1 24 . 1 1 62 62 GLN CB C 62 31.650 31.650 32.233 -0.583 17919 9804 1 24 . 1 1 62 62 GLN H H 62 7.610 7.610 8.015 -0.405 17919 9805 1 24 . 1 1 63 63 LYS N N 63 120.300 120.300 121.035 -0.735 17919 9806 1 24 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.965 0.036 17919 9807 1 24 . 1 1 63 63 LYS C C 63 175.810 175.810 177.122 -1.312 17919 9808 1 24 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.791 -0.001 17919 9809 1 24 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.954 0.696 17919 9810 1 24 . 1 1 63 63 LYS H H 63 8.490 8.490 8.694 -0.204 17919 9811 1 24 . 1 1 64 64 GLU N N 64 113.950 113.950 118.506 -4.556 17919 9812 1 24 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.759 -0.294 17919 9813 1 24 . 1 1 64 64 GLU C C 64 175.250 175.250 175.989 -0.739 17919 9814 1 24 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.774 0.116 17919 9815 1 24 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.010 -2.110 17919 9816 1 24 . 1 1 64 64 GLU H H 64 9.280 9.280 8.663 0.617 17919 9817 1 24 . 1 1 65 65 SER N N 65 114.730 114.730 114.562 0.168 17919 9818 1 24 . 1 1 65 65 SER HA H 65 4.640 4.640 4.473 0.167 17919 9819 1 24 . 1 1 65 65 SER C C 65 172.160 172.160 174.305 -2.145 17919 9820 1 24 . 1 1 65 65 SER CA C 65 60.890 60.890 60.589 0.301 17919 9821 1 24 . 1 1 65 65 SER CB C 65 64.910 64.910 64.097 0.813 17919 9822 1 24 . 1 1 65 65 SER H H 65 7.670 7.670 7.627 0.043 17919 9823 1 24 . 1 1 66 66 THR N N 66 117.110 117.110 118.115 -1.005 17919 9824 1 24 . 1 1 66 66 THR HA H 66 5.270 5.270 5.119 0.151 17919 9825 1 24 . 1 1 66 66 THR C C 66 173.950 173.950 174.181 -0.231 17919 9826 1 24 . 1 1 66 66 THR CA C 66 62.340 62.340 62.252 0.088 17919 9827 1 24 . 1 1 66 66 THR CB C 66 70.080 70.080 70.266 -0.186 17919 9828 1 24 . 1 1 66 66 THR H H 66 8.730 8.730 8.563 0.167 17919 9829 1 24 . 1 1 67 67 LEU N N 67 127.110 127.110 127.433 -0.323 17919 9830 1 24 . 1 1 67 67 LEU HA H 67 5.060 5.060 5.158 -0.098 17919 9831 1 24 . 1 1 67 67 LEU C C 67 175.770 175.770 175.791 -0.021 17919 9832 1 24 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.847 0.053 17919 9833 1 24 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.706 0.554 17919 9834 1 24 . 1 1 67 67 LEU H H 67 9.410 9.410 8.511 0.899 17919 9835 1 24 . 1 1 68 68 HIS N N 68 118.380 118.380 118.784 -0.404 17919 9836 1 24 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.473 -0.233 17919 9837 1 24 . 1 1 68 68 HIS C C 68 173.150 173.150 173.785 -0.635 17919 9838 1 24 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.094 0.906 17919 9839 1 24 . 1 1 68 68 HIS CB C 68 30.530 30.530 34.207 -3.677 17919 9840 1 24 . 1 1 68 68 HIS H H 68 9.230 9.230 9.024 0.206 17919 9841 1 24 . 1 1 69 69 LEU N N 69 124.460 124.460 122.027 2.433 17919 9842 1 24 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.697 0.493 17919 9843 1 24 . 1 1 69 69 LEU C C 69 175.270 175.270 173.712 1.558 17919 9844 1 24 . 1 1 69 69 LEU CA C 69 53.890 53.890 55.147 -1.257 17919 9845 1 24 . 1 1 69 69 LEU CB C 69 44.380 44.380 45.406 -1.026 17919 9846 1 24 . 1 1 69 69 LEU H H 69 8.340 8.340 7.258 1.082 17919 9847 1 24 . 1 1 70 70 VAL N N 70 126.940 126.940 122.431 4.509 17919 9848 1 24 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.674 -0.324 17919 9849 1 24 . 1 1 70 70 VAL C C 70 174.000 174.000 173.549 0.451 17919 9850 1 24 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.677 1.123 17919 9851 1 24 . 1 1 70 70 VAL CB C 70 34.910 34.910 34.944 -0.034 17919 9852 1 24 . 1 1 70 70 VAL H H 70 9.200 9.200 7.976 1.224 17919 9853 1 24 . 1 1 71 71 LEU N N 71 123.130 123.130 122.262 0.868 17919 9854 1 24 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.805 0.255 17919 9855 1 24 . 1 1 71 71 LEU C C 71 177.830 177.830 175.767 2.063 17919 9856 1 24 . 1 1 71 71 LEU CA C 71 53.940 53.940 54.215 -0.275 17919 9857 1 24 . 1 1 71 71 LEU CB C 71 42.850 42.850 44.600 -1.750 17919 9858 1 24 . 1 1 71 71 LEU H H 71 8.120 8.120 8.218 -0.098 17919 9859 1 24 . 1 1 72 72 ARG N N 72 123.490 123.490 127.719 -4.229 17919 9860 1 24 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.573 -0.272 17919 9861 1 24 . 1 1 72 72 ARG C C 72 175.350 175.350 175.267 0.083 17919 9862 1 24 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.674 -0.064 17919 9863 1 24 . 1 1 72 72 ARG CB C 72 31.350 31.350 31.227 0.122 17919 9864 1 24 . 1 1 72 72 ARG H H 72 8.580 8.580 8.152 0.428 17919 9865 1 25 . 1 1 2 2 GLN N N 2 123.220 123.220 123.421 -0.201 17919 9866 1 25 . 1 1 2 2 GLN HA H 2 5.249 5.249 4.616 0.633 17919 9867 1 25 . 1 1 2 2 GLN C C 2 175.920 175.920 175.566 0.354 17919 9868 1 25 . 1 1 2 2 GLN CA C 2 55.080 55.080 56.303 -1.223 17919 9869 1 25 . 1 1 2 2 GLN CB C 2 30.760 30.760 29.532 1.228 17919 9870 1 25 . 1 1 2 2 GLN H H 2 8.900 8.900 8.520 0.380 17919 9871 1 25 . 1 1 3 3 ILE N N 3 115.340 115.340 115.341 -0.001 17919 9872 1 25 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.088 0.125 17919 9873 1 25 . 1 1 3 3 ILE C C 3 172.450 172.450 173.656 -1.206 17919 9874 1 25 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.652 -0.082 17919 9875 1 25 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.300 0.910 17919 9876 1 25 . 1 1 3 3 ILE H H 3 8.320 8.320 8.547 -0.227 17919 9877 1 25 . 1 1 4 4 PHE N N 4 118.110 118.110 118.067 0.043 17919 9878 1 25 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.781 -0.151 17919 9879 1 25 . 1 1 4 4 PHE C C 4 175.320 175.320 175.463 -0.143 17919 9880 1 25 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.302 -0.092 17919 9881 1 25 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.816 -0.336 17919 9882 1 25 . 1 1 4 4 PHE H H 4 8.610 8.610 7.854 0.756 17919 9883 1 25 . 1 1 5 5 VAL N N 5 121.000 121.000 122.960 -1.960 17919 9884 1 25 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.774 -0.049 17919 9885 1 25 . 1 1 5 5 VAL C C 5 174.870 174.870 174.837 0.033 17919 9886 1 25 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.549 -0.929 17919 9887 1 25 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.001 0.229 17919 9888 1 25 . 1 1 5 5 VAL H H 5 9.300 9.300 9.013 0.287 17919 9889 1 25 . 1 1 6 6 LYS N N 6 127.520 127.520 127.467 0.053 17919 9890 1 25 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.199 0.168 17919 9891 1 25 . 1 1 6 6 LYS C C 6 177.140 177.140 176.245 0.895 17919 9892 1 25 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.198 0.322 17919 9893 1 25 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.733 0.316 17919 9894 1 25 . 1 1 6 6 LYS H H 6 8.820 8.820 9.428 -0.608 17919 9895 1 25 . 1 1 7 7 THR N N 7 115.400 115.400 115.883 -0.483 17919 9896 1 25 . 1 1 7 7 THR HA H 7 4.970 4.970 4.816 0.154 17919 9897 1 25 . 1 1 7 7 THR C C 7 176.910 176.910 175.825 1.085 17919 9898 1 25 . 1 1 7 7 THR CA C 7 60.470 60.470 60.145 0.325 17919 9899 1 25 . 1 1 7 7 THR CB C 7 70.630 70.630 71.459 -0.829 17919 9900 1 25 . 1 1 7 7 THR H H 7 8.730 8.730 8.788 -0.058 17919 9901 1 25 . 1 1 8 8 LEU N N 8 121.330 121.330 125.080 -3.750 17919 9902 1 25 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.072 0.238 17919 9903 1 25 . 1 1 8 8 LEU C C 8 178.800 178.800 177.173 1.627 17919 9904 1 25 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.018 0.562 17919 9905 1 25 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.061 -0.091 17919 9906 1 25 . 1 1 8 8 LEU H H 8 9.100 9.100 8.682 0.418 17919 9907 1 25 . 1 1 9 9 THR N N 9 105.590 105.590 110.254 -4.664 17919 9908 1 25 . 1 1 9 9 THR HA H 9 4.428 4.428 4.309 0.119 17919 9909 1 25 . 1 1 9 9 THR C C 9 175.520 175.520 175.380 0.140 17919 9910 1 25 . 1 1 9 9 THR CA C 9 61.400 61.400 62.178 -0.778 17919 9911 1 25 . 1 1 9 9 THR CB C 9 69.140 69.140 69.274 -0.134 17919 9912 1 25 . 1 1 9 9 THR H H 9 7.630 7.630 7.547 0.083 17919 9913 1 25 . 1 1 10 10 GLY N N 10 108.890 108.890 111.299 -2.409 17919 9914 1 25 . 1 1 10 10 GLY C C 10 174.070 174.070 173.340 0.730 17919 9915 1 25 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.872 0.588 17919 9916 1 25 . 1 1 10 10 GLY H H 10 7.810 7.810 7.867 -0.057 17919 9917 1 25 . 1 1 11 11 LYS N N 11 121.600 121.600 120.857 0.743 17919 9918 1 25 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.758 -0.397 17919 9919 1 25 . 1 1 11 11 LYS C C 11 175.940 175.940 175.223 0.717 17919 9920 1 25 . 1 1 11 11 LYS CA C 11 56.280 56.280 54.668 1.612 17919 9921 1 25 . 1 1 11 11 LYS CB C 11 33.200 33.200 34.760 -1.560 17919 9922 1 25 . 1 1 11 11 LYS H H 11 7.280 7.280 7.622 -0.342 17919 9923 1 25 . 1 1 12 12 THR N N 12 120.440 120.440 118.181 2.259 17919 9924 1 25 . 1 1 12 12 THR HA H 12 5.046 5.046 5.268 -0.222 17919 9925 1 25 . 1 1 12 12 THR C C 12 174.320 174.320 174.461 -0.141 17919 9926 1 25 . 1 1 12 12 THR CA C 12 62.390 62.390 61.827 0.563 17919 9927 1 25 . 1 1 12 12 THR CB C 12 69.910 69.910 70.277 -0.367 17919 9928 1 25 . 1 1 12 12 THR H H 12 8.650 8.650 8.331 0.319 17919 9929 1 25 . 1 1 13 13 ILE N N 13 127.110 127.110 121.917 5.193 17919 9930 1 25 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.660 -0.116 17919 9931 1 25 . 1 1 13 13 ILE C C 13 175.220 175.220 174.941 0.279 17919 9932 1 25 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.761 0.219 17919 9933 1 25 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.203 -0.253 17919 9934 1 25 . 1 1 13 13 ILE H H 13 9.450 9.450 8.853 0.597 17919 9935 1 25 . 1 1 14 14 THR N N 14 121.520 121.520 122.392 -0.872 17919 9936 1 25 . 1 1 14 14 THR HA H 14 4.964 4.964 5.157 -0.193 17919 9937 1 25 . 1 1 14 14 THR C C 14 173.790 173.790 174.083 -0.293 17919 9938 1 25 . 1 1 14 14 THR CA C 14 61.940 61.940 62.373 -0.433 17919 9939 1 25 . 1 1 14 14 THR CB C 14 69.650 69.650 69.298 0.352 17919 9940 1 25 . 1 1 14 14 THR H H 14 8.710 8.710 8.540 0.170 17919 9941 1 25 . 1 1 15 15 LEU N N 15 124.800 124.800 126.547 -1.747 17919 9942 1 25 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.851 -0.071 17919 9943 1 25 . 1 1 15 15 LEU C C 15 174.670 174.670 175.151 -0.481 17919 9944 1 25 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.051 -0.221 17919 9945 1 25 . 1 1 15 15 LEU CB C 15 47.070 47.070 46.570 0.500 17919 9946 1 25 . 1 1 15 15 LEU H H 15 8.710 8.710 8.788 -0.078 17919 9947 1 25 . 1 1 16 16 GLU N N 16 122.160 122.160 121.801 0.359 17919 9948 1 25 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.528 0.389 17919 9949 1 25 . 1 1 16 16 GLU C C 16 175.860 175.860 174.904 0.956 17919 9950 1 25 . 1 1 16 16 GLU CA C 16 54.820 54.820 54.333 0.487 17919 9951 1 25 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.122 -0.672 17919 9952 1 25 . 1 1 16 16 GLU H H 16 8.140 8.140 8.553 -0.413 17919 9953 1 25 . 1 1 17 17 VAL N N 17 117.210 117.210 119.079 -1.869 17919 9954 1 25 . 1 1 17 17 VAL HA H 17 4.714 4.714 5.107 -0.393 17919 9955 1 25 . 1 1 17 17 VAL C C 17 174.160 174.160 175.034 -0.874 17919 9956 1 25 . 1 1 17 17 VAL CA C 17 58.430 58.430 60.124 -1.694 17919 9957 1 25 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.630 0.770 17919 9958 1 25 . 1 1 17 17 VAL H H 17 8.900 8.900 7.746 1.154 17919 9959 1 25 . 1 1 18 18 GLU N N 18 118.990 118.990 120.030 -1.040 17919 9960 1 25 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.958 0.121 17919 9961 1 25 . 1 1 18 18 GLU C C 18 176.160 176.160 175.440 0.720 17919 9962 1 25 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.525 0.195 17919 9963 1 25 . 1 1 18 18 GLU CB C 18 30.310 30.310 31.082 -0.772 17919 9964 1 25 . 1 1 18 18 GLU H H 18 8.640 8.640 9.133 -0.493 17919 9965 1 25 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.374 -0.233 17919 9966 1 25 . 1 1 19 19 PRO C C 19 175.310 175.310 177.813 -2.503 17919 9967 1 25 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.171 0.299 17919 9968 1 25 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.038 -0.088 17919 9969 1 25 . 1 1 20 20 SER N N 20 103.400 103.400 111.930 -8.530 17919 9970 1 25 . 1 1 20 20 SER HA H 20 4.370 4.370 4.224 0.146 17919 9971 1 25 . 1 1 20 20 SER C C 20 174.660 174.660 175.108 -0.448 17919 9972 1 25 . 1 1 20 20 SER CA C 20 57.400 57.400 60.156 -2.756 17919 9973 1 25 . 1 1 20 20 SER CB C 20 63.370 63.370 62.784 0.586 17919 9974 1 25 . 1 1 20 20 SER H H 20 7.040 7.040 7.972 -0.932 17919 9975 1 25 . 1 1 21 21 ASP N N 21 123.480 123.480 124.191 -0.711 17919 9976 1 25 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.671 0.024 17919 9977 1 25 . 1 1 21 21 ASP C C 21 176.360 176.360 176.295 0.065 17919 9978 1 25 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.269 0.431 17919 9979 1 25 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.528 -0.728 17919 9980 1 25 . 1 1 21 21 ASP H H 21 8.030 8.030 8.085 -0.055 17919 9981 1 25 . 1 1 22 22 THR N N 22 108.800 108.800 112.833 -4.033 17919 9982 1 25 . 1 1 22 22 THR HA H 22 4.920 4.920 4.468 0.452 17919 9983 1 25 . 1 1 22 22 THR C C 22 176.750 176.750 175.993 0.757 17919 9984 1 25 . 1 1 22 22 THR CA C 22 59.690 59.690 62.461 -2.771 17919 9985 1 25 . 1 1 22 22 THR CB C 22 71.200 71.200 70.127 1.073 17919 9986 1 25 . 1 1 22 22 THR H H 22 7.900 7.900 8.219 -0.319 17919 9987 1 25 . 1 1 23 23 ILE N N 23 121.190 121.190 121.010 0.180 17919 9988 1 25 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.902 -0.245 17919 9989 1 25 . 1 1 23 23 ILE C C 23 179.040 179.040 177.762 1.278 17919 9990 1 25 . 1 1 23 23 ILE CA C 23 62.260 62.260 60.647 1.613 17919 9991 1 25 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.341 -1.991 17919 9992 1 25 . 1 1 23 23 ILE H H 23 8.560 8.560 8.613 -0.053 17919 9993 1 25 . 1 1 24 24 GLU N N 24 120.830 120.830 120.724 0.106 17919 9994 1 25 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.930 -0.013 17919 9995 1 25 . 1 1 24 24 GLU C C 24 178.640 178.640 178.546 0.094 17919 9996 1 25 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.732 0.488 17919 9997 1 25 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.473 -1.193 17919 9998 1 25 . 1 1 24 24 GLU H H 24 9.760 9.760 8.174 1.586 17919 9999 1 25 . 1 1 25 25 ASN N N 25 120.570 120.570 118.319 2.251 17919 10000 1 25 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.465 0.060 17919 10001 1 25 . 1 1 25 25 ASN C C 25 178.380 178.380 177.831 0.549 17919 10002 1 25 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.209 -0.149 17919 10003 1 25 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.252 0.198 17919 10004 1 25 . 1 1 25 25 ASN H H 25 7.920 7.920 7.633 0.287 17919 10005 1 25 . 1 1 26 26 VAL N N 26 121.710 121.710 117.772 3.938 17919 10006 1 25 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.598 -0.201 17919 10007 1 25 . 1 1 26 26 VAL C C 26 177.950 177.950 177.979 -0.029 17919 10008 1 25 . 1 1 26 26 VAL CA C 26 67.660 67.660 65.905 1.755 17919 10009 1 25 . 1 1 26 26 VAL CB C 26 30.840 30.840 30.221 0.619 17919 10010 1 25 . 1 1 26 26 VAL H H 26 8.070 8.070 7.486 0.584 17919 10011 1 25 . 1 1 27 27 LYS N N 27 118.860 118.860 119.765 -0.905 17919 10012 1 25 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.194 0.386 17919 10013 1 25 . 1 1 27 27 LYS C C 27 180.550 180.550 179.032 1.518 17919 10014 1 25 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.468 -0.218 17919 10015 1 25 . 1 1 27 27 LYS CB C 27 33.730 33.730 31.973 1.757 17919 10016 1 25 . 1 1 27 27 LYS H H 27 8.560 8.560 7.482 1.078 17919 10017 1 25 . 1 1 28 28 ALA N N 28 123.440 123.440 120.132 3.308 17919 10018 1 25 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.212 -0.052 17919 10019 1 25 . 1 1 28 28 ALA C C 28 180.300 180.300 178.713 1.587 17919 10020 1 25 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.354 1.016 17919 10021 1 25 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.496 -0.786 17919 10022 1 25 . 1 1 28 28 ALA H H 28 8.060 8.060 7.930 0.130 17919 10023 1 25 . 1 1 29 29 LYS N N 29 119.940 119.940 120.091 -0.151 17919 10024 1 25 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.127 0.080 17919 10025 1 25 . 1 1 29 29 LYS C C 29 180.320 180.320 178.964 1.356 17919 10026 1 25 . 1 1 29 29 LYS CA C 29 59.650 59.650 58.878 0.772 17919 10027 1 25 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.497 0.793 17919 10028 1 25 . 1 1 29 29 LYS H H 29 7.850 7.850 7.643 0.207 17919 10029 1 25 . 1 1 30 30 ILE N N 30 121.080 121.080 120.942 0.138 17919 10030 1 25 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.585 -0.078 17919 10031 1 25 . 1 1 30 30 ILE C C 30 178.310 178.310 177.598 0.712 17919 10032 1 25 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.374 0.777 17919 10033 1 25 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.586 -0.786 17919 10034 1 25 . 1 1 30 30 ILE H H 30 8.280 8.280 8.477 -0.197 17919 10035 1 25 . 1 1 31 31 GLN N N 31 123.490 123.490 119.644 3.846 17919 10036 1 25 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.154 -0.325 17919 10037 1 25 . 1 1 31 31 GLN C C 31 178.890 178.890 178.019 0.871 17919 10038 1 25 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.028 0.972 17919 10039 1 25 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.605 -0.885 17919 10040 1 25 . 1 1 31 31 GLN H H 31 8.580 8.580 8.058 0.522 17919 10041 1 25 . 1 1 32 32 ASP N N 32 119.360 119.360 118.462 0.898 17919 10042 1 25 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.486 -0.132 17919 10043 1 25 . 1 1 32 32 ASP C C 32 177.250 177.250 178.030 -0.780 17919 10044 1 25 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.360 0.830 17919 10045 1 25 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.987 -0.407 17919 10046 1 25 . 1 1 32 32 ASP H H 32 8.010 8.010 7.788 0.222 17919 10047 1 25 . 1 1 33 33 LYS N N 33 115.130 115.130 118.748 -3.618 17919 10048 1 25 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.238 0.099 17919 10049 1 25 . 1 1 33 33 LYS C C 33 177.870 177.870 178.251 -0.381 17919 10050 1 25 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.368 -0.318 17919 10051 1 25 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.343 0.827 17919 10052 1 25 . 1 1 33 33 LYS H H 33 7.430 7.430 7.574 -0.144 17919 10053 1 25 . 1 1 34 34 GLU N N 34 113.870 113.870 115.372 -1.502 17919 10054 1 25 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.361 0.264 17919 10055 1 25 . 1 1 34 34 GLU C C 34 177.840 177.840 177.585 0.255 17919 10056 1 25 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.531 -1.361 17919 10057 1 25 . 1 1 34 34 GLU CB C 34 32.660 32.660 30.944 1.716 17919 10058 1 25 . 1 1 34 34 GLU H H 34 8.740 8.740 8.015 0.725 17919 10059 1 25 . 1 1 35 35 GLY N N 35 108.650 108.650 108.293 0.357 17919 10060 1 25 . 1 1 35 35 GLY C C 35 173.960 173.960 174.191 -0.231 17919 10061 1 25 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.406 0.674 17919 10062 1 25 . 1 1 35 35 GLY H H 35 8.530 8.530 7.830 0.700 17919 10063 1 25 . 1 1 36 36 ILE N N 36 119.880 119.880 122.535 -2.655 17919 10064 1 25 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.401 0.044 17919 10065 1 25 . 1 1 36 36 ILE C C 36 173.590 173.590 174.067 -0.477 17919 10066 1 25 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.008 -0.258 17919 10067 1 25 . 1 1 36 36 ILE CB C 36 40.580 40.580 39.000 1.580 17919 10068 1 25 . 1 1 36 36 ILE H H 36 6.150 6.150 7.480 -1.330 17919 10069 1 25 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.889 -0.255 17919 10070 1 25 . 1 1 37 37 PRO C C 37 176.940 176.940 175.853 1.087 17919 10071 1 25 . 1 1 37 37 PRO CA C 37 61.660 61.660 60.855 0.805 17919 10072 1 25 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.416 0.434 17919 10073 1 25 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.199 -0.082 17919 10074 1 25 . 1 1 38 38 PRO C C 38 178.320 178.320 178.043 0.277 17919 10075 1 25 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.611 0.650 17919 10076 1 25 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.758 1.132 17919 10077 1 25 . 1 1 39 39 ASP N N 39 113.380 113.380 116.769 -3.389 17919 10078 1 25 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.299 0.131 17919 10079 1 25 . 1 1 39 39 ASP C C 39 177.090 177.090 177.349 -0.259 17919 10080 1 25 . 1 1 39 39 ASP CA C 39 55.640 55.640 57.201 -1.561 17919 10081 1 25 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.129 -0.589 17919 10082 1 25 . 1 1 39 39 ASP H H 39 8.550 8.550 8.746 -0.196 17919 10083 1 25 . 1 1 40 40 GLN N N 40 116.780 116.780 116.910 -0.130 17919 10084 1 25 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.413 0.051 17919 10085 1 25 . 1 1 40 40 GLN C C 40 175.380 175.380 175.815 -0.435 17919 10086 1 25 . 1 1 40 40 GLN CA C 40 55.640 55.640 54.942 0.698 17919 10087 1 25 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.020 1.120 17919 10088 1 25 . 1 1 40 40 GLN H H 40 7.820 7.820 7.728 0.092 17919 10089 1 25 . 1 1 41 41 GLN N N 41 117.720 117.720 119.391 -1.671 17919 10090 1 25 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.473 -0.229 17919 10091 1 25 . 1 1 41 41 GLN C C 41 176.300 176.300 175.355 0.945 17919 10092 1 25 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.854 0.616 17919 10093 1 25 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.593 2.058 17919 10094 1 25 . 1 1 41 41 GLN H H 41 7.480 7.480 7.485 -0.005 17919 10095 1 25 . 1 1 42 42 ARG N N 42 122.680 122.680 123.368 -0.688 17919 10096 1 25 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.679 -0.179 17919 10097 1 25 . 1 1 42 42 ARG C C 42 174.050 174.050 174.433 -0.383 17919 10098 1 25 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.073 -0.023 17919 10099 1 25 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.447 -0.697 17919 10100 1 25 . 1 1 42 42 ARG H H 42 8.530 8.530 8.005 0.525 17919 10101 1 25 . 1 1 43 43 LEU N N 43 124.040 124.040 125.835 -1.795 17919 10102 1 25 . 1 1 43 43 LEU C C 43 175.290 175.290 174.876 0.414 17919 10103 1 25 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.148 -1.168 17919 10104 1 25 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.905 1.885 17919 10105 1 25 . 1 1 43 43 LEU H H 43 8.820 8.820 8.674 0.146 17919 10106 1 25 . 1 1 44 44 ILE N N 44 121.920 121.920 123.189 -1.269 17919 10107 1 25 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.917 0.075 17919 10108 1 25 . 1 1 44 44 ILE C C 44 176.060 176.060 175.004 1.056 17919 10109 1 25 . 1 1 44 44 ILE CA C 44 58.980 58.980 58.515 0.465 17919 10110 1 25 . 1 1 44 44 ILE CB C 44 41.420 41.420 38.295 3.125 17919 10111 1 25 . 1 1 44 44 ILE H H 44 9.030 9.030 8.129 0.901 17919 10112 1 25 . 1 1 45 45 PHE N N 45 125.390 125.390 128.389 -2.999 17919 10113 1 25 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.869 0.176 17919 10114 1 25 . 1 1 45 45 PHE C C 45 174.470 174.470 174.055 0.415 17919 10115 1 25 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.893 0.127 17919 10116 1 25 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.630 1.130 17919 10117 1 25 . 1 1 45 45 PHE H H 45 8.830 8.830 9.065 -0.235 17919 10118 1 25 . 1 1 46 46 ALA N N 46 132.200 132.200 130.658 1.542 17919 10119 1 25 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.634 0.056 17919 10120 1 25 . 1 1 46 46 ALA C C 46 177.290 177.290 177.640 -0.350 17919 10121 1 25 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.337 0.203 17919 10122 1 25 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.421 0.149 17919 10123 1 25 . 1 1 46 46 ALA H H 46 8.810 8.810 8.700 0.110 17919 10124 1 25 . 1 1 47 47 GLY N N 47 102.340 102.340 105.054 -2.714 17919 10125 1 25 . 1 1 47 47 GLY C C 47 173.810 173.810 174.055 -0.245 17919 10126 1 25 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.187 0.163 17919 10127 1 25 . 1 1 47 47 GLY H H 47 8.130 8.130 8.521 -0.392 17919 10128 1 25 . 1 1 48 48 LYS N N 48 121.570 121.570 119.635 1.935 17919 10129 1 25 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.622 -0.000 17919 10130 1 25 . 1 1 48 48 LYS C C 48 174.700 174.700 175.330 -0.630 17919 10131 1 25 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.669 -0.119 17919 10132 1 25 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.978 -0.448 17919 10133 1 25 . 1 1 48 48 LYS H H 48 7.980 7.980 7.671 0.309 17919 10134 1 25 . 1 1 49 49 GLN N N 49 122.410 122.410 121.807 0.603 17919 10135 1 25 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.677 -0.117 17919 10136 1 25 . 1 1 49 49 GLN C C 49 175.670 175.670 175.823 -0.153 17919 10137 1 25 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.225 -0.485 17919 10138 1 25 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.709 -0.709 17919 10139 1 25 . 1 1 49 49 GLN H H 49 8.600 8.600 8.557 0.043 17919 10140 1 25 . 1 1 50 50 LEU N N 50 125.520 125.520 121.872 3.648 17919 10141 1 25 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.605 -0.515 17919 10142 1 25 . 1 1 50 50 LEU C C 50 176.660 176.660 175.721 0.939 17919 10143 1 25 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.711 0.529 17919 10144 1 25 . 1 1 50 50 LEU CB C 50 41.570 41.570 43.540 -1.970 17919 10145 1 25 . 1 1 50 50 LEU H H 50 8.530 8.530 8.254 0.276 17919 10146 1 25 . 1 1 51 51 GLU N N 51 122.940 122.940 120.067 2.873 17919 10147 1 25 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.532 -0.044 17919 10148 1 25 . 1 1 51 51 GLU C C 51 175.870 175.870 176.406 -0.536 17919 10149 1 25 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.500 0.460 17919 10150 1 25 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.502 -0.932 17919 10151 1 25 . 1 1 51 51 GLU H H 51 8.400 8.400 8.531 -0.131 17919 10152 1 25 . 1 1 52 52 ASP N N 52 120.030 120.030 126.999 -6.969 17919 10153 1 25 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.497 -0.138 17919 10154 1 25 . 1 1 52 52 ASP C C 52 177.330 177.330 176.890 0.440 17919 10155 1 25 . 1 1 52 52 ASP CA C 52 56.960 56.960 56.384 0.576 17919 10156 1 25 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.857 -0.007 17919 10157 1 25 . 1 1 52 52 ASP H H 52 8.160 8.160 8.865 -0.705 17919 10158 1 25 . 1 1 53 53 GLY N N 53 106.660 106.660 106.266 0.394 17919 10159 1 25 . 1 1 53 53 GLY C C 53 174.870 174.870 174.595 0.275 17919 10160 1 25 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.954 0.216 17919 10161 1 25 . 1 1 53 53 GLY H H 53 9.390 9.390 8.272 1.118 17919 10162 1 25 . 1 1 54 54 ARG N N 54 119.050 119.050 120.954 -1.904 17919 10163 1 25 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.370 0.325 17919 10164 1 25 . 1 1 54 54 ARG C C 54 175.350 175.350 175.576 -0.226 17919 10165 1 25 . 1 1 54 54 ARG CA C 54 54.390 54.390 56.194 -1.804 17919 10166 1 25 . 1 1 54 54 ARG CB C 54 32.650 32.650 31.492 1.158 17919 10167 1 25 . 1 1 54 54 ARG H H 54 7.460 7.460 7.897 -0.437 17919 10168 1 25 . 1 1 55 55 THR N N 55 108.400 108.400 111.729 -3.329 17919 10169 1 25 . 1 1 55 55 THR HA H 55 5.240 5.240 4.829 0.411 17919 10170 1 25 . 1 1 55 55 THR C C 55 176.560 176.560 175.804 0.756 17919 10171 1 25 . 1 1 55 55 THR CA C 55 59.690 59.690 60.285 -0.596 17919 10172 1 25 . 1 1 55 55 THR CB C 55 72.260 72.260 71.624 0.636 17919 10173 1 25 . 1 1 55 55 THR H H 55 8.730 8.730 8.641 0.089 17919 10174 1 25 . 1 1 56 56 LEU N N 56 117.920 117.920 122.067 -4.147 17919 10175 1 25 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.955 0.105 17919 10176 1 25 . 1 1 56 56 LEU C C 56 180.810 180.810 178.664 2.146 17919 10177 1 25 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.140 0.570 17919 10178 1 25 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.438 -1.068 17919 10179 1 25 . 1 1 56 56 LEU H H 56 8.140 8.140 8.192 -0.052 17919 10180 1 25 . 1 1 57 57 SER N N 57 113.330 113.330 115.734 -2.404 17919 10181 1 25 . 1 1 57 57 SER HA H 57 4.370 4.370 3.919 0.451 17919 10182 1 25 . 1 1 57 57 SER C C 57 178.310 178.310 176.876 1.434 17919 10183 1 25 . 1 1 57 57 SER CA C 57 61.080 61.080 62.311 -1.231 17919 10184 1 25 . 1 1 57 57 SER CB C 57 62.530 62.530 62.823 -0.293 17919 10185 1 25 . 1 1 57 57 SER H H 57 8.470 8.470 7.963 0.507 17919 10186 1 25 . 1 1 58 58 ASP N N 58 124.190 124.190 121.599 2.591 17919 10187 1 25 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.245 0.051 17919 10188 1 25 . 1 1 58 58 ASP C C 58 177.400 177.400 177.802 -0.402 17919 10189 1 25 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.981 0.199 17919 10190 1 25 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.402 -0.302 17919 10191 1 25 . 1 1 58 58 ASP H H 58 7.930 7.930 7.577 0.353 17919 10192 1 25 . 1 1 59 59 TYR N N 59 115.510 115.510 115.110 0.400 17919 10193 1 25 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.705 -0.035 17919 10194 1 25 . 1 1 59 59 TYR C C 59 174.700 174.700 175.064 -0.364 17919 10195 1 25 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.043 1.207 17919 10196 1 25 . 1 1 59 59 TYR CB C 59 40.070 40.070 37.694 2.376 17919 10197 1 25 . 1 1 59 59 TYR H H 59 7.250 7.250 7.250 0.000 17919 10198 1 25 . 1 1 60 60 ASN N N 60 115.900 115.900 117.658 -1.758 17919 10199 1 25 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.320 0.035 17919 10200 1 25 . 1 1 60 60 ASN C C 60 174.340 174.340 174.472 -0.132 17919 10201 1 25 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.328 -0.208 17919 10202 1 25 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.826 -0.416 17919 10203 1 25 . 1 1 60 60 ASN H H 60 8.150 8.150 7.872 0.278 17919 10204 1 25 . 1 1 61 61 ILE N N 61 118.600 118.600 120.954 -2.354 17919 10205 1 25 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.958 -0.565 17919 10206 1 25 . 1 1 61 61 ILE C C 61 174.610 174.610 174.659 -0.049 17919 10207 1 25 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.600 0.820 17919 10208 1 25 . 1 1 61 61 ILE CB C 61 36.740 36.740 36.376 0.364 17919 10209 1 25 . 1 1 61 61 ILE H H 61 7.250 7.250 8.141 -0.891 17919 10210 1 25 . 1 1 62 62 GLN N N 62 124.740 124.740 127.550 -2.810 17919 10211 1 25 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.458 0.048 17919 10212 1 25 . 1 1 62 62 GLN C C 62 175.970 175.970 175.250 0.720 17919 10213 1 25 . 1 1 62 62 GLN CA C 62 53.660 53.660 54.306 -0.646 17919 10214 1 25 . 1 1 62 62 GLN CB C 62 31.650 31.650 29.583 2.067 17919 10215 1 25 . 1 1 62 62 GLN H H 62 7.610 7.610 7.860 -0.250 17919 10216 1 25 . 1 1 63 63 LYS N N 63 120.300 120.300 118.120 2.180 17919 10217 1 25 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.942 0.059 17919 10218 1 25 . 1 1 63 63 LYS C C 63 175.810 175.810 177.076 -1.266 17919 10219 1 25 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.783 0.007 17919 10220 1 25 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.366 0.284 17919 10221 1 25 . 1 1 63 63 LYS H H 63 8.490 8.490 8.207 0.283 17919 10222 1 25 . 1 1 64 64 GLU N N 64 113.950 113.950 119.055 -5.105 17919 10223 1 25 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.524 -0.059 17919 10224 1 25 . 1 1 64 64 GLU C C 64 175.250 175.250 175.336 -0.086 17919 10225 1 25 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.537 0.353 17919 10226 1 25 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.685 -2.785 17919 10227 1 25 . 1 1 64 64 GLU H H 64 9.280 9.280 8.999 0.281 17919 10228 1 25 . 1 1 65 65 SER N N 65 114.730 114.730 114.377 0.353 17919 10229 1 25 . 1 1 65 65 SER HA H 65 4.640 4.640 4.714 -0.074 17919 10230 1 25 . 1 1 65 65 SER C C 65 172.160 172.160 173.608 -1.448 17919 10231 1 25 . 1 1 65 65 SER CA C 65 60.890 60.890 59.388 1.502 17919 10232 1 25 . 1 1 65 65 SER CB C 65 64.910 64.910 64.548 0.362 17919 10233 1 25 . 1 1 65 65 SER H H 65 7.670 7.670 7.451 0.219 17919 10234 1 25 . 1 1 66 66 THR N N 66 117.110 117.110 119.678 -2.568 17919 10235 1 25 . 1 1 66 66 THR HA H 66 5.270 5.270 5.076 0.194 17919 10236 1 25 . 1 1 66 66 THR C C 66 173.950 173.950 173.982 -0.032 17919 10237 1 25 . 1 1 66 66 THR CA C 66 62.340 62.340 62.254 0.086 17919 10238 1 25 . 1 1 66 66 THR CB C 66 70.080 70.080 70.402 -0.322 17919 10239 1 25 . 1 1 66 66 THR H H 66 8.730 8.730 8.424 0.306 17919 10240 1 25 . 1 1 67 67 LEU N N 67 127.110 127.110 125.950 1.160 17919 10241 1 25 . 1 1 67 67 LEU HA H 67 5.060 5.060 5.112 -0.052 17919 10242 1 25 . 1 1 67 67 LEU C C 67 175.770 175.770 175.536 0.234 17919 10243 1 25 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.997 -0.097 17919 10244 1 25 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.537 -0.277 17919 10245 1 25 . 1 1 67 67 LEU H H 67 9.410 9.410 8.684 0.726 17919 10246 1 25 . 1 1 68 68 HIS N N 68 118.380 118.380 122.239 -3.859 17919 10247 1 25 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.238 0.002 17919 10248 1 25 . 1 1 68 68 HIS C C 68 173.150 173.150 175.235 -2.085 17919 10249 1 25 . 1 1 68 68 HIS CA C 68 55.000 55.000 53.778 1.222 17919 10250 1 25 . 1 1 68 68 HIS CB C 68 30.530 30.530 29.927 0.603 17919 10251 1 25 . 1 1 68 68 HIS H H 68 9.230 9.230 8.653 0.577 17919 10252 1 25 . 1 1 69 69 LEU N N 69 124.460 124.460 126.886 -2.426 17919 10253 1 25 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.494 0.696 17919 10254 1 25 . 1 1 69 69 LEU C C 69 175.270 175.270 174.942 0.328 17919 10255 1 25 . 1 1 69 69 LEU CA C 69 53.890 53.890 55.879 -1.989 17919 10256 1 25 . 1 1 69 69 LEU CB C 69 44.380 44.380 43.015 1.365 17919 10257 1 25 . 1 1 69 69 LEU H H 69 8.340 8.340 7.902 0.438 17919 10258 1 25 . 1 1 70 70 VAL N N 70 126.940 126.940 122.051 4.889 17919 10259 1 25 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.519 -0.169 17919 10260 1 25 . 1 1 70 70 VAL C C 70 174.000 174.000 173.905 0.095 17919 10261 1 25 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.532 1.268 17919 10262 1 25 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.605 -0.695 17919 10263 1 25 . 1 1 70 70 VAL H H 70 9.200 9.200 8.788 0.412 17919 10264 1 25 . 1 1 71 71 LEU N N 71 123.130 123.130 122.259 0.871 17919 10265 1 25 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.921 0.139 17919 10266 1 25 . 1 1 71 71 LEU C C 71 177.830 177.830 178.099 -0.269 17919 10267 1 25 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.885 0.055 17919 10268 1 25 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.335 -0.485 17919 10269 1 25 . 1 1 71 71 LEU H H 71 8.120 8.120 8.365 -0.245 17919 10270 1 25 . 1 1 72 72 ARG N N 72 123.490 123.490 124.801 -1.311 17919 10271 1 25 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.316 -0.015 17919 10272 1 25 . 1 1 72 72 ARG C C 72 175.350 175.350 175.112 0.238 17919 10273 1 25 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.372 0.238 17919 10274 1 25 . 1 1 72 72 ARG CB C 72 31.350 31.350 28.757 2.593 17919 10275 1 25 . 1 1 72 72 ARG H H 72 8.580 8.580 8.545 0.035 17919 10276 1 26 . 1 1 2 2 GLN N N 2 123.220 123.220 120.678 2.542 17919 10277 1 26 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.437 -0.188 17919 10278 1 26 . 1 1 2 2 GLN C C 2 175.920 175.920 175.563 0.357 17919 10279 1 26 . 1 1 2 2 GLN CA C 2 55.080 55.080 55.041 0.039 17919 10280 1 26 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.178 0.582 17919 10281 1 26 . 1 1 2 2 GLN H H 2 8.900 8.900 8.452 0.448 17919 10282 1 26 . 1 1 3 3 ILE N N 3 115.340 115.340 116.733 -1.393 17919 10283 1 26 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.261 -0.048 17919 10284 1 26 . 1 1 3 3 ILE C C 3 172.450 172.450 173.351 -0.901 17919 10285 1 26 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.815 -0.245 17919 10286 1 26 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.822 0.388 17919 10287 1 26 . 1 1 3 3 ILE H H 3 8.320 8.320 8.378 -0.058 17919 10288 1 26 . 1 1 4 4 PHE N N 4 118.110 118.110 121.146 -3.036 17919 10289 1 26 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.332 0.298 17919 10290 1 26 . 1 1 4 4 PHE C C 4 175.320 175.320 175.271 0.049 17919 10291 1 26 . 1 1 4 4 PHE CA C 4 55.210 55.210 54.692 0.518 17919 10292 1 26 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.980 -0.499 17919 10293 1 26 . 1 1 4 4 PHE H H 4 8.610 8.610 8.884 -0.274 17919 10294 1 26 . 1 1 5 5 VAL N N 5 121.000 121.000 121.968 -0.968 17919 10295 1 26 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.981 -0.256 17919 10296 1 26 . 1 1 5 5 VAL C C 5 174.870 174.870 174.532 0.338 17919 10297 1 26 . 1 1 5 5 VAL CA C 5 60.620 60.620 60.780 -0.160 17919 10298 1 26 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.771 -0.541 17919 10299 1 26 . 1 1 5 5 VAL H H 5 9.300 9.300 8.340 0.960 17919 10300 1 26 . 1 1 6 6 LYS N N 6 127.520 127.520 129.140 -1.620 17919 10301 1 26 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.184 0.183 17919 10302 1 26 . 1 1 6 6 LYS C C 6 177.140 177.140 176.696 0.444 17919 10303 1 26 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.869 -0.349 17919 10304 1 26 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.625 0.425 17919 10305 1 26 . 1 1 6 6 LYS H H 6 8.820 8.820 8.178 0.642 17919 10306 1 26 . 1 1 7 7 THR N N 7 115.400 115.400 119.838 -4.438 17919 10307 1 26 . 1 1 7 7 THR HA H 7 4.970 4.970 4.279 0.691 17919 10308 1 26 . 1 1 7 7 THR C C 7 176.910 176.910 176.498 0.412 17919 10309 1 26 . 1 1 7 7 THR CA C 7 60.470 60.470 60.891 -0.421 17919 10310 1 26 . 1 1 7 7 THR CB C 7 70.630 70.630 69.448 1.182 17919 10311 1 26 . 1 1 7 7 THR H H 7 8.730 8.730 8.233 0.497 17919 10312 1 26 . 1 1 8 8 LEU N N 8 121.330 121.330 120.771 0.559 17919 10313 1 26 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.156 0.154 17919 10314 1 26 . 1 1 8 8 LEU C C 8 178.800 178.800 177.673 1.127 17919 10315 1 26 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.602 -0.022 17919 10316 1 26 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.659 0.311 17919 10317 1 26 . 1 1 8 8 LEU H H 8 9.100 9.100 8.563 0.537 17919 10318 1 26 . 1 1 9 9 THR N N 9 105.590 105.590 107.756 -2.166 17919 10319 1 26 . 1 1 9 9 THR HA H 9 4.428 4.428 4.461 -0.033 17919 10320 1 26 . 1 1 9 9 THR C C 9 175.520 175.520 174.906 0.614 17919 10321 1 26 . 1 1 9 9 THR CA C 9 61.400 61.400 61.732 -0.332 17919 10322 1 26 . 1 1 9 9 THR CB C 9 69.140 69.140 68.853 0.287 17919 10323 1 26 . 1 1 9 9 THR H H 9 7.630 7.630 7.866 -0.236 17919 10324 1 26 . 1 1 10 10 GLY N N 10 108.890 108.890 110.560 -1.670 17919 10325 1 26 . 1 1 10 10 GLY C C 10 174.070 174.070 173.858 0.212 17919 10326 1 26 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.819 0.641 17919 10327 1 26 . 1 1 10 10 GLY H H 10 7.810 7.810 7.610 0.200 17919 10328 1 26 . 1 1 11 11 LYS N N 11 121.600 121.600 121.432 0.168 17919 10329 1 26 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.318 0.043 17919 10330 1 26 . 1 1 11 11 LYS C C 11 175.940 175.940 175.604 0.336 17919 10331 1 26 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.767 -0.486 17919 10332 1 26 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.394 -0.194 17919 10333 1 26 . 1 1 11 11 LYS H H 11 7.280 7.280 7.923 -0.643 17919 10334 1 26 . 1 1 12 12 THR N N 12 120.440 120.440 121.785 -1.345 17919 10335 1 26 . 1 1 12 12 THR HA H 12 5.046 5.046 4.928 0.118 17919 10336 1 26 . 1 1 12 12 THR C C 12 174.320 174.320 174.815 -0.495 17919 10337 1 26 . 1 1 12 12 THR CA C 12 62.390 62.390 62.109 0.281 17919 10338 1 26 . 1 1 12 12 THR CB C 12 69.910 69.910 69.459 0.452 17919 10339 1 26 . 1 1 12 12 THR H H 12 8.650 8.650 8.458 0.192 17919 10340 1 26 . 1 1 13 13 ILE N N 13 127.110 127.110 127.317 -0.207 17919 10341 1 26 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.361 0.183 17919 10342 1 26 . 1 1 13 13 ILE C C 13 175.220 175.220 175.635 -0.415 17919 10343 1 26 . 1 1 13 13 ILE CA C 13 59.980 59.980 61.175 -1.194 17919 10344 1 26 . 1 1 13 13 ILE CB C 13 40.950 40.950 38.886 2.063 17919 10345 1 26 . 1 1 13 13 ILE H H 13 9.450 9.450 8.926 0.524 17919 10346 1 26 . 1 1 14 14 THR N N 14 121.520 121.520 118.453 3.067 17919 10347 1 26 . 1 1 14 14 THR HA H 14 4.964 4.964 5.183 -0.219 17919 10348 1 26 . 1 1 14 14 THR C C 14 173.790 173.790 173.330 0.460 17919 10349 1 26 . 1 1 14 14 THR CA C 14 61.940 61.940 60.600 1.340 17919 10350 1 26 . 1 1 14 14 THR CB C 14 69.650 69.650 70.694 -1.044 17919 10351 1 26 . 1 1 14 14 THR H H 14 8.710 8.710 8.170 0.540 17919 10352 1 26 . 1 1 15 15 LEU N N 15 124.800 124.800 126.031 -1.231 17919 10353 1 26 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.788 -0.008 17919 10354 1 26 . 1 1 15 15 LEU C C 15 174.670 174.670 175.046 -0.376 17919 10355 1 26 . 1 1 15 15 LEU CA C 15 52.830 52.830 54.295 -1.465 17919 10356 1 26 . 1 1 15 15 LEU CB C 15 47.070 47.070 46.212 0.858 17919 10357 1 26 . 1 1 15 15 LEU H H 15 8.710 8.710 8.529 0.181 17919 10358 1 26 . 1 1 16 16 GLU N N 16 122.160 122.160 123.463 -1.303 17919 10359 1 26 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.217 -0.300 17919 10360 1 26 . 1 1 16 16 GLU C C 16 175.860 175.860 175.845 0.015 17919 10361 1 26 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.048 -0.228 17919 10362 1 26 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.810 -1.360 17919 10363 1 26 . 1 1 16 16 GLU H H 16 8.140 8.140 8.457 -0.317 17919 10364 1 26 . 1 1 17 17 VAL N N 17 117.210 117.210 119.423 -2.213 17919 10365 1 26 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.891 -0.177 17919 10366 1 26 . 1 1 17 17 VAL C C 17 174.160 174.160 175.023 -0.863 17919 10367 1 26 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.150 -0.720 17919 10368 1 26 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.470 0.930 17919 10369 1 26 . 1 1 17 17 VAL H H 17 8.900 8.900 8.804 0.096 17919 10370 1 26 . 1 1 18 18 GLU N N 18 118.990 118.990 119.225 -0.235 17919 10371 1 26 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.879 0.200 17919 10372 1 26 . 1 1 18 18 GLU C C 18 176.160 176.160 175.057 1.103 17919 10373 1 26 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.791 -0.071 17919 10374 1 26 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.479 -0.169 17919 10375 1 26 . 1 1 18 18 GLU H H 18 8.640 8.640 8.826 -0.186 17919 10376 1 26 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.220 -0.079 17919 10377 1 26 . 1 1 19 19 PRO C C 19 175.310 175.310 178.204 -2.894 17919 10378 1 26 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.860 -0.390 17919 10379 1 26 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.957 -0.007 17919 10380 1 26 . 1 1 20 20 SER N N 20 103.400 103.400 108.582 -5.182 17919 10381 1 26 . 1 1 20 20 SER HA H 20 4.370 4.370 4.275 0.095 17919 10382 1 26 . 1 1 20 20 SER C C 20 174.660 174.660 174.611 0.049 17919 10383 1 26 . 1 1 20 20 SER CA C 20 57.400 57.400 58.863 -1.463 17919 10384 1 26 . 1 1 20 20 SER CB C 20 63.370 63.370 62.780 0.590 17919 10385 1 26 . 1 1 20 20 SER H H 20 7.040 7.040 8.055 -1.015 17919 10386 1 26 . 1 1 21 21 ASP N N 21 123.480 123.480 123.969 -0.489 17919 10387 1 26 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.809 -0.114 17919 10388 1 26 . 1 1 21 21 ASP C C 21 176.360 176.360 175.534 0.826 17919 10389 1 26 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.221 0.479 17919 10390 1 26 . 1 1 21 21 ASP CB C 21 40.800 40.800 42.581 -1.782 17919 10391 1 26 . 1 1 21 21 ASP H H 21 8.030 8.030 7.986 0.044 17919 10392 1 26 . 1 1 22 22 THR N N 22 108.800 108.800 111.167 -2.367 17919 10393 1 26 . 1 1 22 22 THR HA H 22 4.920 4.920 4.927 -0.007 17919 10394 1 26 . 1 1 22 22 THR C C 22 176.750 176.750 175.814 0.936 17919 10395 1 26 . 1 1 22 22 THR CA C 22 59.690 59.690 60.580 -0.890 17919 10396 1 26 . 1 1 22 22 THR CB C 22 71.200 71.200 71.129 0.071 17919 10397 1 26 . 1 1 22 22 THR H H 22 7.900 7.900 8.188 -0.288 17919 10398 1 26 . 1 1 23 23 ILE N N 23 121.190 121.190 123.148 -1.958 17919 10399 1 26 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.741 -0.084 17919 10400 1 26 . 1 1 23 23 ILE C C 23 179.040 179.040 177.358 1.682 17919 10401 1 26 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.916 -0.656 17919 10402 1 26 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.808 -2.458 17919 10403 1 26 . 1 1 23 23 ILE H H 23 8.560 8.560 8.733 -0.173 17919 10404 1 26 . 1 1 24 24 GLU N N 24 120.830 120.830 119.806 1.024 17919 10405 1 26 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.853 0.064 17919 10406 1 26 . 1 1 24 24 GLU C C 24 178.640 178.640 178.297 0.343 17919 10407 1 26 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.125 0.095 17919 10408 1 26 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.465 -1.185 17919 10409 1 26 . 1 1 24 24 GLU H H 24 9.760 9.760 8.303 1.457 17919 10410 1 26 . 1 1 25 25 ASN N N 25 120.570 120.570 118.312 2.258 17919 10411 1 26 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.555 -0.030 17919 10412 1 26 . 1 1 25 25 ASN C C 25 178.380 178.380 177.743 0.637 17919 10413 1 26 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.794 0.266 17919 10414 1 26 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.165 0.285 17919 10415 1 26 . 1 1 25 25 ASN H H 25 7.920 7.920 7.542 0.378 17919 10416 1 26 . 1 1 26 26 VAL N N 26 121.710 121.710 119.900 1.810 17919 10417 1 26 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.615 -0.218 17919 10418 1 26 . 1 1 26 26 VAL C C 26 177.950 177.950 177.899 0.051 17919 10419 1 26 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.634 1.026 17919 10420 1 26 . 1 1 26 26 VAL CB C 26 30.840 30.840 30.833 0.007 17919 10421 1 26 . 1 1 26 26 VAL H H 26 8.070 8.070 8.343 -0.273 17919 10422 1 26 . 1 1 27 27 LYS N N 27 118.860 118.860 119.382 -0.522 17919 10423 1 26 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.243 0.337 17919 10424 1 26 . 1 1 27 27 LYS C C 27 180.550 180.550 179.132 1.418 17919 10425 1 26 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.370 -0.119 17919 10426 1 26 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.162 1.568 17919 10427 1 26 . 1 1 27 27 LYS H H 27 8.560 8.560 8.613 -0.053 17919 10428 1 26 . 1 1 28 28 ALA N N 28 123.440 123.440 122.729 0.711 17919 10429 1 26 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.107 0.053 17919 10430 1 26 . 1 1 28 28 ALA C C 28 180.300 180.300 178.956 1.344 17919 10431 1 26 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.877 0.493 17919 10432 1 26 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.469 -0.759 17919 10433 1 26 . 1 1 28 28 ALA H H 28 8.060 8.060 8.428 -0.368 17919 10434 1 26 . 1 1 29 29 LYS N N 29 119.940 119.940 120.190 -0.250 17919 10435 1 26 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.010 0.197 17919 10436 1 26 . 1 1 29 29 LYS C C 29 180.320 180.320 178.983 1.337 17919 10437 1 26 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.483 0.167 17919 10438 1 26 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.415 0.875 17919 10439 1 26 . 1 1 29 29 LYS H H 29 7.850 7.850 7.776 0.074 17919 10440 1 26 . 1 1 30 30 ILE N N 30 121.080 121.080 120.297 0.783 17919 10441 1 26 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.492 0.015 17919 10442 1 26 . 1 1 30 30 ILE C C 30 178.310 178.310 177.347 0.963 17919 10443 1 26 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.766 0.384 17919 10444 1 26 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.538 -0.738 17919 10445 1 26 . 1 1 30 30 ILE H H 30 8.280 8.280 8.333 -0.053 17919 10446 1 26 . 1 1 31 31 GLN N N 31 123.490 123.490 118.840 4.650 17919 10447 1 26 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.869 -0.040 17919 10448 1 26 . 1 1 31 31 GLN C C 31 178.890 178.890 177.813 1.077 17919 10449 1 26 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.084 0.916 17919 10450 1 26 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.291 -0.571 17919 10451 1 26 . 1 1 31 31 GLN H H 31 8.580 8.580 7.724 0.856 17919 10452 1 26 . 1 1 32 32 ASP N N 32 119.360 119.360 118.968 0.392 17919 10453 1 26 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.412 -0.058 17919 10454 1 26 . 1 1 32 32 ASP C C 32 177.250 177.250 178.100 -0.850 17919 10455 1 26 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.744 0.446 17919 10456 1 26 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.861 -0.281 17919 10457 1 26 . 1 1 32 32 ASP H H 32 8.010 8.010 7.823 0.187 17919 10458 1 26 . 1 1 33 33 LYS N N 33 115.130 115.130 118.551 -3.421 17919 10459 1 26 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.260 0.077 17919 10460 1 26 . 1 1 33 33 LYS C C 33 177.870 177.870 178.302 -0.432 17919 10461 1 26 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.386 -0.336 17919 10462 1 26 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.683 0.487 17919 10463 1 26 . 1 1 33 33 LYS H H 33 7.430 7.430 7.581 -0.151 17919 10464 1 26 . 1 1 34 34 GLU N N 34 113.870 113.870 114.609 -0.739 17919 10465 1 26 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.436 0.189 17919 10466 1 26 . 1 1 34 34 GLU C C 34 177.840 177.840 177.266 0.574 17919 10467 1 26 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.202 -1.032 17919 10468 1 26 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.421 1.239 17919 10469 1 26 . 1 1 34 34 GLU H H 34 8.740 8.740 8.334 0.406 17919 10470 1 26 . 1 1 35 35 GLY N N 35 108.650 108.650 108.532 0.118 17919 10471 1 26 . 1 1 35 35 GLY C C 35 173.960 173.960 174.205 -0.245 17919 10472 1 26 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.197 0.883 17919 10473 1 26 . 1 1 35 35 GLY H H 35 8.530 8.530 7.782 0.748 17919 10474 1 26 . 1 1 36 36 ILE N N 36 119.880 119.880 117.810 2.070 17919 10475 1 26 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.586 -0.141 17919 10476 1 26 . 1 1 36 36 ILE C C 36 173.590 173.590 173.636 -0.046 17919 10477 1 26 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.702 0.048 17919 10478 1 26 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.959 1.621 17919 10479 1 26 . 1 1 36 36 ILE H H 36 6.150 6.150 7.393 -1.243 17919 10480 1 26 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.605 0.029 17919 10481 1 26 . 1 1 37 37 PRO C C 37 176.940 176.940 176.079 0.861 17919 10482 1 26 . 1 1 37 37 PRO CA C 37 61.660 61.660 62.233 -0.572 17919 10483 1 26 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.424 0.426 17919 10484 1 26 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.345 -0.228 17919 10485 1 26 . 1 1 38 38 PRO C C 38 178.320 178.320 178.463 -0.143 17919 10486 1 26 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.016 1.244 17919 10487 1 26 . 1 1 38 38 PRO CB C 38 32.890 32.890 32.087 0.803 17919 10488 1 26 . 1 1 39 39 ASP N N 39 113.380 113.380 116.556 -3.176 17919 10489 1 26 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.365 0.065 17919 10490 1 26 . 1 1 39 39 ASP C C 39 177.090 177.090 177.415 -0.325 17919 10491 1 26 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.427 -0.787 17919 10492 1 26 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.295 -0.755 17919 10493 1 26 . 1 1 39 39 ASP H H 39 8.550 8.550 8.565 -0.015 17919 10494 1 26 . 1 1 40 40 GLN N N 40 116.780 116.780 116.302 0.478 17919 10495 1 26 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.191 0.273 17919 10496 1 26 . 1 1 40 40 GLN C C 40 175.380 175.380 176.039 -0.659 17919 10497 1 26 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.433 -0.793 17919 10498 1 26 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.070 1.070 17919 10499 1 26 . 1 1 40 40 GLN H H 40 7.820 7.820 7.689 0.131 17919 10500 1 26 . 1 1 41 41 GLN N N 41 117.720 117.720 118.962 -1.242 17919 10501 1 26 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.560 -0.316 17919 10502 1 26 . 1 1 41 41 GLN C C 41 176.300 176.300 174.754 1.546 17919 10503 1 26 . 1 1 41 41 GLN CA C 41 56.470 56.470 54.806 1.664 17919 10504 1 26 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.099 2.551 17919 10505 1 26 . 1 1 41 41 GLN H H 41 7.480 7.480 7.389 0.091 17919 10506 1 26 . 1 1 42 42 ARG N N 42 122.680 122.680 125.795 -3.115 17919 10507 1 26 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.301 0.199 17919 10508 1 26 . 1 1 42 42 ARG C C 42 174.050 174.050 174.343 -0.293 17919 10509 1 26 . 1 1 42 42 ARG CA C 42 55.050 55.050 56.532 -1.482 17919 10510 1 26 . 1 1 42 42 ARG CB C 42 31.750 31.750 31.157 0.593 17919 10511 1 26 . 1 1 42 42 ARG H H 42 8.530 8.530 8.130 0.400 17919 10512 1 26 . 1 1 43 43 LEU N N 43 124.040 124.040 125.663 -1.623 17919 10513 1 26 . 1 1 43 43 LEU C C 43 175.290 175.290 175.940 -0.650 17919 10514 1 26 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.868 -0.888 17919 10515 1 26 . 1 1 43 43 LEU CB C 43 45.790 45.790 45.373 0.416 17919 10516 1 26 . 1 1 43 43 LEU H H 43 8.820 8.820 8.609 0.211 17919 10517 1 26 . 1 1 44 44 ILE N N 44 121.920 121.920 121.309 0.611 17919 10518 1 26 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.805 0.187 17919 10519 1 26 . 1 1 44 44 ILE C C 44 176.060 176.060 174.285 1.775 17919 10520 1 26 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.483 -1.503 17919 10521 1 26 . 1 1 44 44 ILE CB C 44 41.420 41.420 40.967 0.453 17919 10522 1 26 . 1 1 44 44 ILE H H 44 9.030 9.030 8.266 0.764 17919 10523 1 26 . 1 1 45 45 PHE N N 45 125.390 125.390 128.114 -2.724 17919 10524 1 26 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.041 0.004 17919 10525 1 26 . 1 1 45 45 PHE C C 45 174.470 174.470 174.847 -0.377 17919 10526 1 26 . 1 1 45 45 PHE CA C 45 57.020 57.020 55.694 1.326 17919 10527 1 26 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.850 0.910 17919 10528 1 26 . 1 1 45 45 PHE H H 45 8.830 8.830 8.563 0.267 17919 10529 1 26 . 1 1 46 46 ALA N N 46 132.200 132.200 129.625 2.575 17919 10530 1 26 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.688 0.002 17919 10531 1 26 . 1 1 46 46 ALA C C 46 177.290 177.290 177.224 0.066 17919 10532 1 26 . 1 1 46 46 ALA CA C 46 52.540 52.540 53.093 -0.553 17919 10533 1 26 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.565 0.005 17919 10534 1 26 . 1 1 46 46 ALA H H 46 8.810 8.810 8.858 -0.048 17919 10535 1 26 . 1 1 47 47 GLY N N 47 102.340 102.340 104.264 -1.924 17919 10536 1 26 . 1 1 47 47 GLY C C 47 173.810 173.810 174.284 -0.474 17919 10537 1 26 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.199 0.151 17919 10538 1 26 . 1 1 47 47 GLY H H 47 8.130 8.130 8.393 -0.263 17919 10539 1 26 . 1 1 48 48 LYS N N 48 121.570 121.570 122.918 -1.348 17919 10540 1 26 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.541 0.081 17919 10541 1 26 . 1 1 48 48 LYS C C 48 174.700 174.700 175.266 -0.566 17919 10542 1 26 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.666 -0.116 17919 10543 1 26 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.079 0.451 17919 10544 1 26 . 1 1 48 48 LYS H H 48 7.980 7.980 7.782 0.198 17919 10545 1 26 . 1 1 49 49 GLN N N 49 122.410 122.410 127.056 -4.646 17919 10546 1 26 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.477 0.083 17919 10547 1 26 . 1 1 49 49 GLN C C 49 175.670 175.670 175.492 0.178 17919 10548 1 26 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.419 -0.679 17919 10549 1 26 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.147 -0.147 17919 10550 1 26 . 1 1 49 49 GLN H H 49 8.600 8.600 8.688 -0.088 17919 10551 1 26 . 1 1 50 50 LEU N N 50 125.520 125.520 128.810 -3.290 17919 10552 1 26 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.013 0.077 17919 10553 1 26 . 1 1 50 50 LEU C C 50 176.660 176.660 176.073 0.587 17919 10554 1 26 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.879 -0.639 17919 10555 1 26 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.566 -0.996 17919 10556 1 26 . 1 1 50 50 LEU H H 50 8.530 8.530 7.946 0.584 17919 10557 1 26 . 1 1 51 51 GLU N N 51 122.940 122.940 122.868 0.072 17919 10558 1 26 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.521 -0.033 17919 10559 1 26 . 1 1 51 51 GLU C C 51 175.870 175.870 176.393 -0.523 17919 10560 1 26 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.321 0.639 17919 10561 1 26 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.010 0.560 17919 10562 1 26 . 1 1 51 51 GLU H H 51 8.400 8.400 7.976 0.424 17919 10563 1 26 . 1 1 52 52 ASP N N 52 120.030 120.030 125.046 -5.016 17919 10564 1 26 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.401 -0.042 17919 10565 1 26 . 1 1 52 52 ASP C C 52 177.330 177.330 177.722 -0.392 17919 10566 1 26 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.502 -0.542 17919 10567 1 26 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.856 -0.006 17919 10568 1 26 . 1 1 52 52 ASP H H 52 8.160 8.160 8.861 -0.701 17919 10569 1 26 . 1 1 53 53 GLY N N 53 106.660 106.660 104.663 1.997 17919 10570 1 26 . 1 1 53 53 GLY C C 53 174.870 174.870 174.108 0.762 17919 10571 1 26 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.525 0.645 17919 10572 1 26 . 1 1 53 53 GLY H H 53 9.390 9.390 8.290 1.100 17919 10573 1 26 . 1 1 54 54 ARG N N 54 119.050 119.050 120.667 -1.617 17919 10574 1 26 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.641 0.054 17919 10575 1 26 . 1 1 54 54 ARG C C 54 175.350 175.350 175.727 -0.377 17919 10576 1 26 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.651 -0.261 17919 10577 1 26 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.295 0.355 17919 10578 1 26 . 1 1 54 54 ARG H H 54 7.460 7.460 7.823 -0.363 17919 10579 1 26 . 1 1 55 55 THR N N 55 108.400 108.400 112.717 -4.317 17919 10580 1 26 . 1 1 55 55 THR HA H 55 5.240 5.240 4.750 0.490 17919 10581 1 26 . 1 1 55 55 THR C C 55 176.560 176.560 176.812 -0.252 17919 10582 1 26 . 1 1 55 55 THR CA C 55 59.690 59.690 60.756 -1.066 17919 10583 1 26 . 1 1 55 55 THR CB C 55 72.260 72.260 70.358 1.903 17919 10584 1 26 . 1 1 55 55 THR H H 55 8.730 8.730 8.662 0.068 17919 10585 1 26 . 1 1 56 56 LEU N N 56 117.920 117.920 121.044 -3.124 17919 10586 1 26 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.077 -0.017 17919 10587 1 26 . 1 1 56 56 LEU C C 56 180.810 180.810 178.619 2.191 17919 10588 1 26 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.808 -0.098 17919 10589 1 26 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.509 -1.139 17919 10590 1 26 . 1 1 56 56 LEU H H 56 8.140 8.140 8.667 -0.527 17919 10591 1 26 . 1 1 57 57 SER N N 57 113.330 113.330 112.430 0.900 17919 10592 1 26 . 1 1 57 57 SER HA H 57 4.370 4.370 4.226 0.144 17919 10593 1 26 . 1 1 57 57 SER C C 57 178.310 178.310 175.882 2.428 17919 10594 1 26 . 1 1 57 57 SER CA C 57 61.080 61.080 61.435 -0.355 17919 10595 1 26 . 1 1 57 57 SER CB C 57 62.530 62.530 62.548 -0.019 17919 10596 1 26 . 1 1 57 57 SER H H 57 8.470 8.470 7.988 0.482 17919 10597 1 26 . 1 1 58 58 ASP N N 58 124.190 124.190 120.781 3.409 17919 10598 1 26 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.360 -0.064 17919 10599 1 26 . 1 1 58 58 ASP C C 58 177.400 177.400 175.637 1.763 17919 10600 1 26 . 1 1 58 58 ASP CA C 58 57.180 57.180 55.733 1.447 17919 10601 1 26 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.602 -0.502 17919 10602 1 26 . 1 1 58 58 ASP H H 58 7.930 7.930 7.787 0.143 17919 10603 1 26 . 1 1 59 59 TYR N N 59 115.510 115.510 115.103 0.407 17919 10604 1 26 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.727 -0.057 17919 10605 1 26 . 1 1 59 59 TYR C C 59 174.700 174.700 174.660 0.040 17919 10606 1 26 . 1 1 59 59 TYR CA C 59 58.250 58.250 56.051 2.199 17919 10607 1 26 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.520 1.550 17919 10608 1 26 . 1 1 59 59 TYR H H 59 7.250 7.250 6.930 0.320 17919 10609 1 26 . 1 1 60 60 ASN N N 60 115.900 115.900 118.313 -2.413 17919 10610 1 26 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.382 -0.027 17919 10611 1 26 . 1 1 60 60 ASN C C 60 174.340 174.340 174.671 -0.331 17919 10612 1 26 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.143 -0.023 17919 10613 1 26 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.389 0.021 17919 10614 1 26 . 1 1 60 60 ASN H H 60 8.150 8.150 7.708 0.442 17919 10615 1 26 . 1 1 61 61 ILE N N 61 118.600 118.600 119.715 -1.115 17919 10616 1 26 . 1 1 61 61 ILE HA H 61 3.393 3.393 4.039 -0.646 17919 10617 1 26 . 1 1 61 61 ILE C C 61 174.610 174.610 175.291 -0.681 17919 10618 1 26 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.882 0.538 17919 10619 1 26 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.969 -1.229 17919 10620 1 26 . 1 1 61 61 ILE H H 61 7.250 7.250 8.020 -0.770 17919 10621 1 26 . 1 1 62 62 GLN N N 62 124.740 124.740 125.752 -1.012 17919 10622 1 26 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.687 -0.181 17919 10623 1 26 . 1 1 62 62 GLN C C 62 175.970 175.970 175.461 0.509 17919 10624 1 26 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.329 0.331 17919 10625 1 26 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.576 0.074 17919 10626 1 26 . 1 1 62 62 GLN H H 62 7.610 7.610 8.280 -0.670 17919 10627 1 26 . 1 1 63 63 LYS N N 63 120.300 120.300 124.103 -3.803 17919 10628 1 26 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.912 0.089 17919 10629 1 26 . 1 1 63 63 LYS C C 63 175.810 175.810 176.608 -0.798 17919 10630 1 26 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.985 -0.195 17919 10631 1 26 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.884 0.766 17919 10632 1 26 . 1 1 63 63 LYS H H 63 8.490 8.490 8.704 -0.214 17919 10633 1 26 . 1 1 64 64 GLU N N 64 113.950 113.950 120.374 -6.424 17919 10634 1 26 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.353 0.112 17919 10635 1 26 . 1 1 64 64 GLU C C 64 175.250 175.250 175.192 0.058 17919 10636 1 26 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.614 0.276 17919 10637 1 26 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.597 -2.697 17919 10638 1 26 . 1 1 64 64 GLU H H 64 9.280 9.280 8.699 0.581 17919 10639 1 26 . 1 1 65 65 SER N N 65 114.730 114.730 114.747 -0.017 17919 10640 1 26 . 1 1 65 65 SER HA H 65 4.640 4.640 4.428 0.212 17919 10641 1 26 . 1 1 65 65 SER C C 65 172.160 172.160 173.796 -1.636 17919 10642 1 26 . 1 1 65 65 SER CA C 65 60.890 60.890 59.997 0.893 17919 10643 1 26 . 1 1 65 65 SER CB C 65 64.910 64.910 64.021 0.889 17919 10644 1 26 . 1 1 65 65 SER H H 65 7.670 7.670 7.701 -0.031 17919 10645 1 26 . 1 1 66 66 THR N N 66 117.110 117.110 118.457 -1.347 17919 10646 1 26 . 1 1 66 66 THR HA H 66 5.270 5.270 5.068 0.202 17919 10647 1 26 . 1 1 66 66 THR C C 66 173.950 173.950 173.697 0.253 17919 10648 1 26 . 1 1 66 66 THR CA C 66 62.340 62.340 61.497 0.843 17919 10649 1 26 . 1 1 66 66 THR CB C 66 70.080 70.080 70.251 -0.171 17919 10650 1 26 . 1 1 66 66 THR H H 66 8.730 8.730 8.404 0.326 17919 10651 1 26 . 1 1 67 67 LEU N N 67 127.110 127.110 128.258 -1.148 17919 10652 1 26 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.484 0.576 17919 10653 1 26 . 1 1 67 67 LEU C C 67 175.770 175.770 175.773 -0.003 17919 10654 1 26 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.366 -0.466 17919 10655 1 26 . 1 1 67 67 LEU CB C 67 44.260 44.260 42.726 1.534 17919 10656 1 26 . 1 1 67 67 LEU H H 67 9.410 9.410 8.989 0.421 17919 10657 1 26 . 1 1 68 68 HIS N N 68 118.380 118.380 123.537 -5.157 17919 10658 1 26 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.398 -0.158 17919 10659 1 26 . 1 1 68 68 HIS C C 68 173.150 173.150 174.117 -0.967 17919 10660 1 26 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.369 0.631 17919 10661 1 26 . 1 1 68 68 HIS CB C 68 30.530 30.530 33.215 -2.685 17919 10662 1 26 . 1 1 68 68 HIS H H 68 9.230 9.230 8.912 0.318 17919 10663 1 26 . 1 1 69 69 LEU N N 69 124.460 124.460 123.675 0.785 17919 10664 1 26 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.930 0.260 17919 10665 1 26 . 1 1 69 69 LEU C C 69 175.270 175.270 174.512 0.758 17919 10666 1 26 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.718 -0.828 17919 10667 1 26 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.771 -0.391 17919 10668 1 26 . 1 1 69 69 LEU H H 69 8.340 8.340 7.334 1.006 17919 10669 1 26 . 1 1 70 70 VAL N N 70 126.940 126.940 126.894 0.046 17919 10670 1 26 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.286 0.064 17919 10671 1 26 . 1 1 70 70 VAL C C 70 174.000 174.000 174.537 -0.537 17919 10672 1 26 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.945 -0.145 17919 10673 1 26 . 1 1 70 70 VAL CB C 70 34.910 34.910 33.744 1.166 17919 10674 1 26 . 1 1 70 70 VAL H H 70 9.200 9.200 8.563 0.636 17919 10675 1 26 . 1 1 71 71 LEU N N 71 123.130 123.130 127.987 -4.857 17919 10676 1 26 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.683 0.377 17919 10677 1 26 . 1 1 71 71 LEU C C 71 177.830 177.830 176.747 1.083 17919 10678 1 26 . 1 1 71 71 LEU CA C 71 53.940 53.940 54.200 -0.260 17919 10679 1 26 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.577 0.273 17919 10680 1 26 . 1 1 71 71 LEU H H 71 8.120 8.120 8.531 -0.411 17919 10681 1 26 . 1 1 72 72 ARG N N 72 123.490 123.490 125.750 -2.260 17919 10682 1 26 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.273 0.028 17919 10683 1 26 . 1 1 72 72 ARG C C 72 175.350 175.350 175.579 -0.229 17919 10684 1 26 . 1 1 72 72 ARG CA C 72 55.610 55.610 57.038 -1.428 17919 10685 1 26 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.969 0.381 17919 10686 1 26 . 1 1 72 72 ARG H H 72 8.580 8.580 8.060 0.520 17919 10687 1 27 . 1 1 2 2 GLN N N 2 123.220 123.220 125.566 -2.346 17919 10688 1 27 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.053 0.196 17919 10689 1 27 . 1 1 2 2 GLN C C 2 175.920 175.920 174.665 1.255 17919 10690 1 27 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.588 0.492 17919 10691 1 27 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.292 0.468 17919 10692 1 27 . 1 1 2 2 GLN H H 2 8.900 8.900 8.618 0.282 17919 10693 1 27 . 1 1 3 3 ILE N N 3 115.340 115.340 119.005 -3.665 17919 10694 1 27 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.382 -0.169 17919 10695 1 27 . 1 1 3 3 ILE C C 3 172.450 172.450 173.466 -1.016 17919 10696 1 27 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.085 0.485 17919 10697 1 27 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.056 1.154 17919 10698 1 27 . 1 1 3 3 ILE H H 3 8.320 8.320 8.085 0.235 17919 10699 1 27 . 1 1 4 4 PHE N N 4 118.110 118.110 119.585 -1.475 17919 10700 1 27 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.012 0.618 17919 10701 1 27 . 1 1 4 4 PHE C C 4 175.320 175.320 174.799 0.521 17919 10702 1 27 . 1 1 4 4 PHE CA C 4 55.210 55.210 56.055 -0.845 17919 10703 1 27 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.191 -0.711 17919 10704 1 27 . 1 1 4 4 PHE H H 4 8.610 8.610 8.767 -0.157 17919 10705 1 27 . 1 1 5 5 VAL N N 5 121.000 121.000 121.662 -0.662 17919 10706 1 27 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.643 0.082 17919 10707 1 27 . 1 1 5 5 VAL C C 5 174.870 174.870 175.311 -0.441 17919 10708 1 27 . 1 1 5 5 VAL CA C 5 60.620 60.620 60.857 -0.237 17919 10709 1 27 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.346 0.884 17919 10710 1 27 . 1 1 5 5 VAL H H 5 9.300 9.300 8.789 0.511 17919 10711 1 27 . 1 1 6 6 LYS N N 6 127.520 127.520 128.274 -0.754 17919 10712 1 27 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.086 0.281 17919 10713 1 27 . 1 1 6 6 LYS C C 6 177.140 177.140 176.748 0.392 17919 10714 1 27 . 1 1 6 6 LYS CA C 6 54.520 54.520 55.208 -0.688 17919 10715 1 27 . 1 1 6 6 LYS CB C 6 35.050 35.050 33.862 1.188 17919 10716 1 27 . 1 1 6 6 LYS H H 6 8.820 8.820 9.187 -0.367 17919 10717 1 27 . 1 1 7 7 THR N N 7 115.400 115.400 117.134 -1.734 17919 10718 1 27 . 1 1 7 7 THR HA H 7 4.970 4.970 4.653 0.317 17919 10719 1 27 . 1 1 7 7 THR C C 7 176.910 176.910 176.525 0.385 17919 10720 1 27 . 1 1 7 7 THR CA C 7 60.470 60.470 60.161 0.309 17919 10721 1 27 . 1 1 7 7 THR CB C 7 70.630 70.630 70.756 -0.126 17919 10722 1 27 . 1 1 7 7 THR H H 7 8.730 8.730 8.737 -0.007 17919 10723 1 27 . 1 1 8 8 LEU N N 8 121.330 121.330 121.056 0.274 17919 10724 1 27 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.122 0.188 17919 10725 1 27 . 1 1 8 8 LEU C C 8 178.800 178.800 178.417 0.383 17919 10726 1 27 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.710 -0.130 17919 10727 1 27 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.556 0.414 17919 10728 1 27 . 1 1 8 8 LEU H H 8 9.100 9.100 8.871 0.229 17919 10729 1 27 . 1 1 9 9 THR N N 9 105.590 105.590 108.414 -2.824 17919 10730 1 27 . 1 1 9 9 THR HA H 9 4.428 4.428 4.351 0.077 17919 10731 1 27 . 1 1 9 9 THR C C 9 175.520 175.520 175.488 0.032 17919 10732 1 27 . 1 1 9 9 THR CA C 9 61.400 61.400 61.801 -0.401 17919 10733 1 27 . 1 1 9 9 THR CB C 9 69.140 69.140 68.915 0.225 17919 10734 1 27 . 1 1 9 9 THR H H 9 7.630 7.630 7.811 -0.181 17919 10735 1 27 . 1 1 10 10 GLY N N 10 108.890 108.890 110.939 -2.049 17919 10736 1 27 . 1 1 10 10 GLY C C 10 174.070 174.070 173.967 0.103 17919 10737 1 27 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.855 0.605 17919 10738 1 27 . 1 1 10 10 GLY H H 10 7.810 7.810 8.038 -0.228 17919 10739 1 27 . 1 1 11 11 LYS N N 11 121.600 121.600 121.360 0.240 17919 10740 1 27 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.426 -0.065 17919 10741 1 27 . 1 1 11 11 LYS C C 11 175.940 175.940 175.947 -0.007 17919 10742 1 27 . 1 1 11 11 LYS CA C 11 56.280 56.280 55.904 0.376 17919 10743 1 27 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.552 -0.352 17919 10744 1 27 . 1 1 11 11 LYS H H 11 7.280 7.280 7.575 -0.295 17919 10745 1 27 . 1 1 12 12 THR N N 12 120.440 120.440 121.905 -1.465 17919 10746 1 27 . 1 1 12 12 THR HA H 12 5.046 5.046 5.171 -0.125 17919 10747 1 27 . 1 1 12 12 THR C C 12 174.320 174.320 174.366 -0.046 17919 10748 1 27 . 1 1 12 12 THR CA C 12 62.390 62.390 62.095 0.295 17919 10749 1 27 . 1 1 12 12 THR CB C 12 69.910 69.910 69.734 0.176 17919 10750 1 27 . 1 1 12 12 THR H H 12 8.650 8.650 8.443 0.207 17919 10751 1 27 . 1 1 13 13 ILE N N 13 127.110 127.110 124.597 2.513 17919 10752 1 27 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.714 -0.170 17919 10753 1 27 . 1 1 13 13 ILE C C 13 175.220 175.220 174.939 0.281 17919 10754 1 27 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.885 0.095 17919 10755 1 27 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.858 0.092 17919 10756 1 27 . 1 1 13 13 ILE H H 13 9.450 9.450 8.510 0.940 17919 10757 1 27 . 1 1 14 14 THR N N 14 121.520 121.520 123.200 -1.680 17919 10758 1 27 . 1 1 14 14 THR HA H 14 4.964 4.964 4.368 0.596 17919 10759 1 27 . 1 1 14 14 THR C C 14 173.790 173.790 174.058 -0.268 17919 10760 1 27 . 1 1 14 14 THR CA C 14 61.940 61.940 63.059 -1.119 17919 10761 1 27 . 1 1 14 14 THR CB C 14 69.650 69.650 69.588 0.062 17919 10762 1 27 . 1 1 14 14 THR H H 14 8.710 8.710 8.461 0.249 17919 10763 1 27 . 1 1 15 15 LEU N N 15 124.800 124.800 125.739 -0.939 17919 10764 1 27 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.833 -0.053 17919 10765 1 27 . 1 1 15 15 LEU C C 15 174.670 174.670 175.025 -0.355 17919 10766 1 27 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.455 -0.625 17919 10767 1 27 . 1 1 15 15 LEU CB C 15 47.070 47.070 44.903 2.167 17919 10768 1 27 . 1 1 15 15 LEU H H 15 8.710 8.710 8.511 0.199 17919 10769 1 27 . 1 1 16 16 GLU N N 16 122.160 122.160 121.056 1.104 17919 10770 1 27 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.309 -0.392 17919 10771 1 27 . 1 1 16 16 GLU C C 16 175.860 175.860 176.116 -0.256 17919 10772 1 27 . 1 1 16 16 GLU CA C 16 54.820 54.820 54.974 -0.154 17919 10773 1 27 . 1 1 16 16 GLU CB C 16 29.450 29.450 31.847 -2.397 17919 10774 1 27 . 1 1 16 16 GLU H H 16 8.140 8.140 8.442 -0.302 17919 10775 1 27 . 1 1 17 17 VAL N N 17 117.210 117.210 119.369 -2.159 17919 10776 1 27 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.385 0.329 17919 10777 1 27 . 1 1 17 17 VAL C C 17 174.160 174.160 174.762 -0.602 17919 10778 1 27 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.088 -0.658 17919 10779 1 27 . 1 1 17 17 VAL CB C 17 36.400 36.400 34.735 1.665 17919 10780 1 27 . 1 1 17 17 VAL H H 17 8.900 8.900 8.823 0.077 17919 10781 1 27 . 1 1 18 18 GLU N N 18 118.990 118.990 118.915 0.075 17919 10782 1 27 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.922 0.157 17919 10783 1 27 . 1 1 18 18 GLU C C 18 176.160 176.160 175.581 0.579 17919 10784 1 27 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.750 -0.030 17919 10785 1 27 . 1 1 18 18 GLU CB C 18 30.310 30.310 31.549 -1.239 17919 10786 1 27 . 1 1 18 18 GLU H H 18 8.640 8.640 8.774 -0.134 17919 10787 1 27 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.383 -0.242 17919 10788 1 27 . 1 1 19 19 PRO C C 19 175.310 175.310 177.189 -1.879 17919 10789 1 27 . 1 1 19 19 PRO CA C 19 65.470 65.470 64.942 0.528 17919 10790 1 27 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.973 -0.023 17919 10791 1 27 . 1 1 20 20 SER N N 20 103.400 103.400 109.695 -6.295 17919 10792 1 27 . 1 1 20 20 SER HA H 20 4.370 4.370 4.405 -0.035 17919 10793 1 27 . 1 1 20 20 SER C C 20 174.660 174.660 174.764 -0.104 17919 10794 1 27 . 1 1 20 20 SER CA C 20 57.400 57.400 57.804 -0.404 17919 10795 1 27 . 1 1 20 20 SER CB C 20 63.370 63.370 62.902 0.468 17919 10796 1 27 . 1 1 20 20 SER H H 20 7.040 7.040 7.859 -0.819 17919 10797 1 27 . 1 1 21 21 ASP N N 21 123.480 123.480 124.859 -1.379 17919 10798 1 27 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.609 0.086 17919 10799 1 27 . 1 1 21 21 ASP C C 21 176.360 176.360 175.587 0.773 17919 10800 1 27 . 1 1 21 21 ASP CA C 21 55.700 55.700 56.082 -0.382 17919 10801 1 27 . 1 1 21 21 ASP CB C 21 40.800 40.800 42.035 -1.235 17919 10802 1 27 . 1 1 21 21 ASP H H 21 8.030 8.030 7.881 0.149 17919 10803 1 27 . 1 1 22 22 THR N N 22 108.800 108.800 112.739 -3.939 17919 10804 1 27 . 1 1 22 22 THR HA H 22 4.920 4.920 4.808 0.112 17919 10805 1 27 . 1 1 22 22 THR C C 22 176.750 176.750 175.672 1.078 17919 10806 1 27 . 1 1 22 22 THR CA C 22 59.690 59.690 60.847 -1.157 17919 10807 1 27 . 1 1 22 22 THR CB C 22 71.200 71.200 70.327 0.873 17919 10808 1 27 . 1 1 22 22 THR H H 22 7.900 7.900 8.258 -0.358 17919 10809 1 27 . 1 1 23 23 ILE N N 23 121.190 121.190 122.229 -1.039 17919 10810 1 27 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.754 -0.097 17919 10811 1 27 . 1 1 23 23 ILE C C 23 179.040 179.040 177.740 1.300 17919 10812 1 27 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.757 -0.497 17919 10813 1 27 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.767 -2.417 17919 10814 1 27 . 1 1 23 23 ILE H H 23 8.560 8.560 9.020 -0.460 17919 10815 1 27 . 1 1 24 24 GLU N N 24 120.830 120.830 120.392 0.438 17919 10816 1 27 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.928 -0.011 17919 10817 1 27 . 1 1 24 24 GLU C C 24 178.640 178.640 178.534 0.106 17919 10818 1 27 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.781 0.439 17919 10819 1 27 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.390 -1.110 17919 10820 1 27 . 1 1 24 24 GLU H H 24 9.760 9.760 8.477 1.283 17919 10821 1 27 . 1 1 25 25 ASN N N 25 120.570 120.570 117.491 3.079 17919 10822 1 27 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.505 0.020 17919 10823 1 27 . 1 1 25 25 ASN C C 25 178.380 178.380 177.884 0.496 17919 10824 1 27 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.179 -0.119 17919 10825 1 27 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.222 0.228 17919 10826 1 27 . 1 1 25 25 ASN H H 25 7.920 7.920 7.534 0.386 17919 10827 1 27 . 1 1 26 26 VAL N N 26 121.710 121.710 119.937 1.773 17919 10828 1 27 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.439 -0.042 17919 10829 1 27 . 1 1 26 26 VAL C C 26 177.950 177.950 177.782 0.168 17919 10830 1 27 . 1 1 26 26 VAL CA C 26 67.660 67.660 67.022 0.639 17919 10831 1 27 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.250 -0.410 17919 10832 1 27 . 1 1 26 26 VAL H H 26 8.070 8.070 7.763 0.307 17919 10833 1 27 . 1 1 27 27 LYS N N 27 118.860 118.860 119.489 -0.629 17919 10834 1 27 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.215 0.365 17919 10835 1 27 . 1 1 27 27 LYS C C 27 180.550 180.550 179.047 1.503 17919 10836 1 27 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.400 -0.150 17919 10837 1 27 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.333 1.397 17919 10838 1 27 . 1 1 27 27 LYS H H 27 8.560 8.560 7.376 1.184 17919 10839 1 27 . 1 1 28 28 ALA N N 28 123.440 123.440 120.831 2.609 17919 10840 1 27 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.099 0.061 17919 10841 1 27 . 1 1 28 28 ALA C C 28 180.300 180.300 179.235 1.065 17919 10842 1 27 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.080 0.290 17919 10843 1 27 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.293 -0.583 17919 10844 1 27 . 1 1 28 28 ALA H H 28 8.060 8.060 8.458 -0.398 17919 10845 1 27 . 1 1 29 29 LYS N N 29 119.940 119.940 119.813 0.127 17919 10846 1 27 . 1 1 29 29 LYS HA H 29 4.207 4.207 3.997 0.210 17919 10847 1 27 . 1 1 29 29 LYS C C 29 180.320 180.320 179.039 1.281 17919 10848 1 27 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.349 0.302 17919 10849 1 27 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.223 1.067 17919 10850 1 27 . 1 1 29 29 LYS H H 29 7.850 7.850 7.506 0.344 17919 10851 1 27 . 1 1 30 30 ILE N N 30 121.080 121.080 121.344 -0.264 17919 10852 1 27 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.582 -0.075 17919 10853 1 27 . 1 1 30 30 ILE C C 30 178.310 178.310 177.416 0.894 17919 10854 1 27 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.790 0.360 17919 10855 1 27 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.574 -0.774 17919 10856 1 27 . 1 1 30 30 ILE H H 30 8.280 8.280 8.255 0.025 17919 10857 1 27 . 1 1 31 31 GLN N N 31 123.490 123.490 119.005 4.485 17919 10858 1 27 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.977 -0.148 17919 10859 1 27 . 1 1 31 31 GLN C C 31 178.890 178.890 178.326 0.564 17919 10860 1 27 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.011 0.989 17919 10861 1 27 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.355 -0.635 17919 10862 1 27 . 1 1 31 31 GLN H H 31 8.580 8.580 8.214 0.366 17919 10863 1 27 . 1 1 32 32 ASP N N 32 119.360 119.360 119.937 -0.577 17919 10864 1 27 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.451 -0.097 17919 10865 1 27 . 1 1 32 32 ASP C C 32 177.250 177.250 177.805 -0.555 17919 10866 1 27 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.501 0.689 17919 10867 1 27 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.972 -0.392 17919 10868 1 27 . 1 1 32 32 ASP H H 32 8.010 8.010 7.933 0.077 17919 10869 1 27 . 1 1 33 33 LYS N N 33 115.130 115.130 119.533 -4.403 17919 10870 1 27 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.196 0.141 17919 10871 1 27 . 1 1 33 33 LYS C C 33 177.870 177.870 177.943 -0.073 17919 10872 1 27 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.190 -0.140 17919 10873 1 27 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.270 0.900 17919 10874 1 27 . 1 1 33 33 LYS H H 33 7.430 7.430 7.780 -0.350 17919 10875 1 27 . 1 1 34 34 GLU N N 34 113.870 113.870 116.268 -2.398 17919 10876 1 27 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.531 0.094 17919 10877 1 27 . 1 1 34 34 GLU C C 34 177.840 177.840 176.760 1.080 17919 10878 1 27 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.515 -0.345 17919 10879 1 27 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.155 1.504 17919 10880 1 27 . 1 1 34 34 GLU H H 34 8.740 8.740 8.123 0.617 17919 10881 1 27 . 1 1 35 35 GLY N N 35 108.650 108.650 108.516 0.134 17919 10882 1 27 . 1 1 35 35 GLY C C 35 173.960 173.960 174.980 -1.020 17919 10883 1 27 . 1 1 35 35 GLY CA C 35 46.080 46.080 46.295 -0.215 17919 10884 1 27 . 1 1 35 35 GLY H H 35 8.530 8.530 8.252 0.278 17919 10885 1 27 . 1 1 36 36 ILE N N 36 119.880 119.880 122.117 -2.237 17919 10886 1 27 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.308 0.137 17919 10887 1 27 . 1 1 36 36 ILE C C 36 173.590 173.590 174.141 -0.551 17919 10888 1 27 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.561 -0.811 17919 10889 1 27 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.426 2.154 17919 10890 1 27 . 1 1 36 36 ILE H H 36 6.150 6.150 7.655 -1.505 17919 10891 1 27 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.967 -0.333 17919 10892 1 27 . 1 1 37 37 PRO C C 37 176.940 176.940 175.710 1.230 17919 10893 1 27 . 1 1 37 37 PRO CA C 37 61.660 61.660 60.432 1.228 17919 10894 1 27 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.812 0.038 17919 10895 1 27 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.126 -0.009 17919 10896 1 27 . 1 1 38 38 PRO C C 38 178.320 178.320 178.442 -0.122 17919 10897 1 27 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.936 0.324 17919 10898 1 27 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.882 1.008 17919 10899 1 27 . 1 1 39 39 ASP N N 39 113.380 113.380 116.219 -2.839 17919 10900 1 27 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.309 0.121 17919 10901 1 27 . 1 1 39 39 ASP C C 39 177.090 177.090 178.015 -0.925 17919 10902 1 27 . 1 1 39 39 ASP CA C 39 55.640 55.640 57.181 -1.541 17919 10903 1 27 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.637 -1.097 17919 10904 1 27 . 1 1 39 39 ASP H H 39 8.550 8.550 8.567 -0.017 17919 10905 1 27 . 1 1 40 40 GLN N N 40 116.780 116.780 117.248 -0.468 17919 10906 1 27 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.323 0.141 17919 10907 1 27 . 1 1 40 40 GLN C C 40 175.380 175.380 176.266 -0.886 17919 10908 1 27 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.234 -0.594 17919 10909 1 27 . 1 1 40 40 GLN CB C 40 30.140 30.140 30.262 -0.121 17919 10910 1 27 . 1 1 40 40 GLN H H 40 7.820 7.820 7.851 -0.031 17919 10911 1 27 . 1 1 41 41 GLN N N 41 117.720 117.720 119.242 -1.522 17919 10912 1 27 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.263 -0.019 17919 10913 1 27 . 1 1 41 41 GLN C C 41 176.300 176.300 175.978 0.322 17919 10914 1 27 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.619 -0.149 17919 10915 1 27 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.083 2.567 17919 10916 1 27 . 1 1 41 41 GLN H H 41 7.480 7.480 7.355 0.125 17919 10917 1 27 . 1 1 42 42 ARG N N 42 122.680 122.680 126.965 -4.285 17919 10918 1 27 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.473 0.027 17919 10919 1 27 . 1 1 42 42 ARG C C 42 174.050 174.050 174.888 -0.838 17919 10920 1 27 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.738 0.312 17919 10921 1 27 . 1 1 42 42 ARG CB C 42 31.750 31.750 30.334 1.416 17919 10922 1 27 . 1 1 42 42 ARG H H 42 8.530 8.530 8.292 0.238 17919 10923 1 27 . 1 1 43 43 LEU N N 43 124.040 124.040 128.294 -4.254 17919 10924 1 27 . 1 1 43 43 LEU C C 43 175.290 175.290 175.833 -0.543 17919 10925 1 27 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.590 -1.610 17919 10926 1 27 . 1 1 43 43 LEU CB C 43 45.790 45.790 41.039 4.751 17919 10927 1 27 . 1 1 43 43 LEU H H 43 8.820 8.820 8.602 0.218 17919 10928 1 27 . 1 1 44 44 ILE N N 44 121.920 121.920 120.534 1.386 17919 10929 1 27 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.051 -0.059 17919 10930 1 27 . 1 1 44 44 ILE C C 44 176.060 176.060 173.654 2.406 17919 10931 1 27 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.291 -0.311 17919 10932 1 27 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.891 -0.471 17919 10933 1 27 . 1 1 44 44 ILE H H 44 9.030 9.030 8.157 0.873 17919 10934 1 27 . 1 1 45 45 PHE N N 45 125.390 125.390 126.056 -0.666 17919 10935 1 27 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.098 -0.053 17919 10936 1 27 . 1 1 45 45 PHE C C 45 174.470 174.470 174.636 -0.166 17919 10937 1 27 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.847 0.173 17919 10938 1 27 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.901 0.859 17919 10939 1 27 . 1 1 45 45 PHE H H 45 8.830 8.830 8.717 0.113 17919 10940 1 27 . 1 1 46 46 ALA N N 46 132.200 132.200 130.115 2.085 17919 10941 1 27 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.636 0.054 17919 10942 1 27 . 1 1 46 46 ALA C C 46 177.290 177.290 178.486 -1.196 17919 10943 1 27 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.637 -0.097 17919 10944 1 27 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.157 0.413 17919 10945 1 27 . 1 1 46 46 ALA H H 46 8.810 8.810 8.874 -0.064 17919 10946 1 27 . 1 1 47 47 GLY N N 47 102.340 102.340 103.560 -1.220 17919 10947 1 27 . 1 1 47 47 GLY C C 47 173.810 173.810 174.497 -0.687 17919 10948 1 27 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.795 -0.445 17919 10949 1 27 . 1 1 47 47 GLY H H 47 8.130 8.130 8.820 -0.690 17919 10950 1 27 . 1 1 48 48 LYS N N 48 121.570 121.570 120.562 1.008 17919 10951 1 27 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.663 -0.041 17919 10952 1 27 . 1 1 48 48 LYS C C 48 174.700 174.700 175.385 -0.685 17919 10953 1 27 . 1 1 48 48 LYS CA C 48 54.550 54.550 53.604 0.946 17919 10954 1 27 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.067 0.463 17919 10955 1 27 . 1 1 48 48 LYS H H 48 7.980 7.980 7.991 -0.011 17919 10956 1 27 . 1 1 49 49 GLN N N 49 122.410 122.410 123.621 -1.211 17919 10957 1 27 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.207 0.353 17919 10958 1 27 . 1 1 49 49 GLN C C 49 175.670 175.670 175.060 0.610 17919 10959 1 27 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.197 -0.457 17919 10960 1 27 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.282 -0.282 17919 10961 1 27 . 1 1 49 49 GLN H H 49 8.600 8.600 8.705 -0.105 17919 10962 1 27 . 1 1 50 50 LEU N N 50 125.520 125.520 126.742 -1.222 17919 10963 1 27 . 1 1 50 50 LEU HA H 50 4.090 4.090 3.895 0.195 17919 10964 1 27 . 1 1 50 50 LEU C C 50 176.660 176.660 175.825 0.835 17919 10965 1 27 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.045 0.195 17919 10966 1 27 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.857 -1.287 17919 10967 1 27 . 1 1 50 50 LEU H H 50 8.530 8.530 7.664 0.866 17919 10968 1 27 . 1 1 51 51 GLU N N 51 122.940 122.940 119.646 3.294 17919 10969 1 27 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.528 -0.040 17919 10970 1 27 . 1 1 51 51 GLU C C 51 175.870 175.870 176.274 -0.404 17919 10971 1 27 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.228 0.732 17919 10972 1 27 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.523 -0.953 17919 10973 1 27 . 1 1 51 51 GLU H H 51 8.400 8.400 8.300 0.100 17919 10974 1 27 . 1 1 52 52 ASP N N 52 120.030 120.030 123.820 -3.790 17919 10975 1 27 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.427 -0.068 17919 10976 1 27 . 1 1 52 52 ASP C C 52 177.330 177.330 177.720 -0.390 17919 10977 1 27 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.710 -0.750 17919 10978 1 27 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.818 0.032 17919 10979 1 27 . 1 1 52 52 ASP H H 52 8.160 8.160 8.829 -0.669 17919 10980 1 27 . 1 1 53 53 GLY N N 53 106.660 106.660 104.710 1.950 17919 10981 1 27 . 1 1 53 53 GLY C C 53 174.870 174.870 174.506 0.364 17919 10982 1 27 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.709 0.461 17919 10983 1 27 . 1 1 53 53 GLY H H 53 9.390 9.390 8.307 1.083 17919 10984 1 27 . 1 1 54 54 ARG N N 54 119.050 119.050 121.519 -2.469 17919 10985 1 27 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.407 0.288 17919 10986 1 27 . 1 1 54 54 ARG C C 54 175.350 175.350 175.655 -0.305 17919 10987 1 27 . 1 1 54 54 ARG CA C 54 54.390 54.390 56.243 -1.853 17919 10988 1 27 . 1 1 54 54 ARG CB C 54 32.650 32.650 31.149 1.501 17919 10989 1 27 . 1 1 54 54 ARG H H 54 7.460 7.460 7.803 -0.343 17919 10990 1 27 . 1 1 55 55 THR N N 55 108.400 108.400 110.498 -2.098 17919 10991 1 27 . 1 1 55 55 THR HA H 55 5.240 5.240 5.053 0.187 17919 10992 1 27 . 1 1 55 55 THR C C 55 176.560 176.560 176.002 0.558 17919 10993 1 27 . 1 1 55 55 THR CA C 55 59.690 59.690 59.713 -0.023 17919 10994 1 27 . 1 1 55 55 THR CB C 55 72.260 72.260 72.407 -0.147 17919 10995 1 27 . 1 1 55 55 THR H H 55 8.730 8.730 8.284 0.446 17919 10996 1 27 . 1 1 56 56 LEU N N 56 117.920 117.920 121.538 -3.618 17919 10997 1 27 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.962 0.098 17919 10998 1 27 . 1 1 56 56 LEU C C 56 180.810 180.810 178.829 1.981 17919 10999 1 27 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.604 0.106 17919 11000 1 27 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.335 -0.965 17919 11001 1 27 . 1 1 56 56 LEU H H 56 8.140 8.140 8.157 -0.017 17919 11002 1 27 . 1 1 57 57 SER N N 57 113.330 113.330 115.575 -2.245 17919 11003 1 27 . 1 1 57 57 SER HA H 57 4.370 4.370 3.991 0.379 17919 11004 1 27 . 1 1 57 57 SER C C 57 178.310 178.310 176.798 1.512 17919 11005 1 27 . 1 1 57 57 SER CA C 57 61.080 61.080 62.193 -1.113 17919 11006 1 27 . 1 1 57 57 SER CB C 57 62.530 62.530 62.544 -0.014 17919 11007 1 27 . 1 1 57 57 SER H H 57 8.470 8.470 8.352 0.118 17919 11008 1 27 . 1 1 58 58 ASP N N 58 124.190 124.190 122.113 2.077 17919 11009 1 27 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.275 0.021 17919 11010 1 27 . 1 1 58 58 ASP C C 58 177.400 177.400 177.955 -0.555 17919 11011 1 27 . 1 1 58 58 ASP CA C 58 57.180 57.180 57.013 0.167 17919 11012 1 27 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.622 -0.522 17919 11013 1 27 . 1 1 58 58 ASP H H 58 7.930 7.930 7.654 0.276 17919 11014 1 27 . 1 1 59 59 TYR N N 59 115.510 115.510 115.804 -0.294 17919 11015 1 27 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.674 -0.004 17919 11016 1 27 . 1 1 59 59 TYR C C 59 174.700 174.700 175.176 -0.476 17919 11017 1 27 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.931 0.320 17919 11018 1 27 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.063 2.007 17919 11019 1 27 . 1 1 59 59 TYR H H 59 7.250 7.250 7.526 -0.276 17919 11020 1 27 . 1 1 60 60 ASN N N 60 115.900 115.900 117.159 -1.259 17919 11021 1 27 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.362 -0.007 17919 11022 1 27 . 1 1 60 60 ASN C C 60 174.340 174.340 174.400 -0.060 17919 11023 1 27 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.488 -0.368 17919 11024 1 27 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.689 -0.279 17919 11025 1 27 . 1 1 60 60 ASN H H 60 8.150 8.150 7.839 0.311 17919 11026 1 27 . 1 1 61 61 ILE N N 61 118.600 118.600 120.218 -1.618 17919 11027 1 27 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.689 -0.296 17919 11028 1 27 . 1 1 61 61 ILE C C 61 174.610 174.610 175.124 -0.514 17919 11029 1 27 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.366 1.054 17919 11030 1 27 . 1 1 61 61 ILE CB C 61 36.740 36.740 36.463 0.277 17919 11031 1 27 . 1 1 61 61 ILE H H 61 7.250 7.250 8.323 -1.073 17919 11032 1 27 . 1 1 62 62 GLN N N 62 124.740 124.740 126.401 -1.661 17919 11033 1 27 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.612 -0.106 17919 11034 1 27 . 1 1 62 62 GLN C C 62 175.970 175.970 175.991 -0.021 17919 11035 1 27 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.758 -0.098 17919 11036 1 27 . 1 1 62 62 GLN CB C 62 31.650 31.650 30.989 0.661 17919 11037 1 27 . 1 1 62 62 GLN H H 62 7.610 7.610 7.751 -0.141 17919 11038 1 27 . 1 1 63 63 LYS N N 63 120.300 120.300 121.046 -0.746 17919 11039 1 27 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.001 0.000 17919 11040 1 27 . 1 1 63 63 LYS C C 63 175.810 175.810 176.345 -0.535 17919 11041 1 27 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.850 -0.060 17919 11042 1 27 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.342 1.308 17919 11043 1 27 . 1 1 63 63 LYS H H 63 8.490 8.490 8.565 -0.075 17919 11044 1 27 . 1 1 64 64 GLU N N 64 113.950 113.950 116.310 -2.360 17919 11045 1 27 . 1 1 64 64 GLU HA H 64 3.465 3.465 4.149 -0.684 17919 11046 1 27 . 1 1 64 64 GLU C C 64 175.250 175.250 175.949 -0.699 17919 11047 1 27 . 1 1 64 64 GLU CA C 64 57.890 57.890 58.398 -0.508 17919 11048 1 27 . 1 1 64 64 GLU CB C 64 25.900 25.900 27.773 -1.873 17919 11049 1 27 . 1 1 64 64 GLU H H 64 9.280 9.280 8.761 0.519 17919 11050 1 27 . 1 1 65 65 SER N N 65 114.730 114.730 117.731 -3.001 17919 11051 1 27 . 1 1 65 65 SER HA H 65 4.640 4.640 4.364 0.276 17919 11052 1 27 . 1 1 65 65 SER C C 65 172.160 172.160 174.565 -2.405 17919 11053 1 27 . 1 1 65 65 SER CA C 65 60.890 60.890 60.329 0.561 17919 11054 1 27 . 1 1 65 65 SER CB C 65 64.910 64.910 63.431 1.479 17919 11055 1 27 . 1 1 65 65 SER H H 65 7.670 7.670 7.755 -0.085 17919 11056 1 27 . 1 1 66 66 THR N N 66 117.110 117.110 122.444 -5.334 17919 11057 1 27 . 1 1 66 66 THR HA H 66 5.270 5.270 4.491 0.779 17919 11058 1 27 . 1 1 66 66 THR C C 66 173.950 173.950 174.128 -0.178 17919 11059 1 27 . 1 1 66 66 THR CA C 66 62.340 62.340 64.043 -1.703 17919 11060 1 27 . 1 1 66 66 THR CB C 66 70.080 70.080 69.177 0.903 17919 11061 1 27 . 1 1 66 66 THR H H 66 8.730 8.730 8.379 0.351 17919 11062 1 27 . 1 1 67 67 LEU N N 67 127.110 127.110 126.928 0.182 17919 11063 1 27 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.685 0.375 17919 11064 1 27 . 1 1 67 67 LEU C C 67 175.770 175.770 175.543 0.227 17919 11065 1 27 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.677 0.223 17919 11066 1 27 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.977 -0.717 17919 11067 1 27 . 1 1 67 67 LEU H H 67 9.410 9.410 8.910 0.500 17919 11068 1 27 . 1 1 68 68 HIS N N 68 118.380 118.380 117.817 0.563 17919 11069 1 27 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.209 0.031 17919 11070 1 27 . 1 1 68 68 HIS C C 68 173.150 173.150 174.589 -1.439 17919 11071 1 27 . 1 1 68 68 HIS CA C 68 55.000 55.000 55.586 -0.586 17919 11072 1 27 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.255 -1.725 17919 11073 1 27 . 1 1 68 68 HIS H H 68 9.230 9.230 8.848 0.382 17919 11074 1 27 . 1 1 69 69 LEU N N 69 124.460 124.460 123.290 1.170 17919 11075 1 27 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.124 0.066 17919 11076 1 27 . 1 1 69 69 LEU C C 69 175.270 175.270 174.861 0.409 17919 11077 1 27 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.582 -0.692 17919 11078 1 27 . 1 1 69 69 LEU CB C 69 44.380 44.380 45.540 -1.160 17919 11079 1 27 . 1 1 69 69 LEU H H 69 8.340 8.340 8.143 0.197 17919 11080 1 27 . 1 1 70 70 VAL N N 70 126.940 126.940 125.166 1.774 17919 11081 1 27 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.406 -0.056 17919 11082 1 27 . 1 1 70 70 VAL C C 70 174.000 174.000 174.360 -0.360 17919 11083 1 27 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.742 0.058 17919 11084 1 27 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.703 -0.793 17919 11085 1 27 . 1 1 70 70 VAL H H 70 9.200 9.200 8.279 0.921 17919 11086 1 27 . 1 1 71 71 LEU N N 71 123.130 123.130 125.895 -2.765 17919 11087 1 27 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.664 0.396 17919 11088 1 27 . 1 1 71 71 LEU C C 71 177.830 177.830 176.763 1.067 17919 11089 1 27 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.216 0.724 17919 11090 1 27 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.418 0.432 17919 11091 1 27 . 1 1 71 71 LEU H H 71 8.120 8.120 8.320 -0.200 17919 11092 1 27 . 1 1 72 72 ARG N N 72 123.490 123.490 126.802 -3.312 17919 11093 1 27 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.149 0.152 17919 11094 1 27 . 1 1 72 72 ARG C C 72 175.350 175.350 175.136 0.214 17919 11095 1 27 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.579 -0.969 17919 11096 1 27 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.157 1.193 17919 11097 1 27 . 1 1 72 72 ARG H H 72 8.580 8.580 8.056 0.524 17919 11098 1 28 . 1 1 2 2 GLN N N 2 123.220 123.220 120.630 2.590 17919 11099 1 28 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.075 0.174 17919 11100 1 28 . 1 1 2 2 GLN C C 2 175.920 175.920 175.241 0.679 17919 11101 1 28 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.672 0.409 17919 11102 1 28 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.352 0.408 17919 11103 1 28 . 1 1 2 2 GLN H H 2 8.900 8.900 8.225 0.675 17919 11104 1 28 . 1 1 3 3 ILE N N 3 115.340 115.340 118.615 -3.275 17919 11105 1 28 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.571 -0.358 17919 11106 1 28 . 1 1 3 3 ILE C C 3 172.450 172.450 173.724 -1.274 17919 11107 1 28 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.315 0.255 17919 11108 1 28 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.304 0.906 17919 11109 1 28 . 1 1 3 3 ILE H H 3 8.320 8.320 8.110 0.210 17919 11110 1 28 . 1 1 4 4 PHE N N 4 118.110 118.110 118.899 -0.789 17919 11111 1 28 . 1 1 4 4 PHE HA H 4 5.630 5.630 4.998 0.632 17919 11112 1 28 . 1 1 4 4 PHE C C 4 175.320 175.320 175.407 -0.087 17919 11113 1 28 . 1 1 4 4 PHE CA C 4 55.210 55.210 56.909 -1.699 17919 11114 1 28 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.583 -0.103 17919 11115 1 28 . 1 1 4 4 PHE H H 4 8.610 8.610 8.068 0.542 17919 11116 1 28 . 1 1 5 5 VAL N N 5 121.000 121.000 121.509 -0.509 17919 11117 1 28 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.853 -0.128 17919 11118 1 28 . 1 1 5 5 VAL C C 5 174.870 174.870 174.600 0.270 17919 11119 1 28 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.372 -0.752 17919 11120 1 28 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.143 0.087 17919 11121 1 28 . 1 1 5 5 VAL H H 5 9.300 9.300 8.566 0.734 17919 11122 1 28 . 1 1 6 6 LYS N N 6 127.520 127.520 127.901 -0.381 17919 11123 1 28 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.072 0.295 17919 11124 1 28 . 1 1 6 6 LYS C C 6 177.140 177.140 176.107 1.033 17919 11125 1 28 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.335 0.185 17919 11126 1 28 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.216 -0.166 17919 11127 1 28 . 1 1 6 6 LYS H H 6 8.820 8.820 9.256 -0.436 17919 11128 1 28 . 1 1 7 7 THR N N 7 115.400 115.400 115.142 0.258 17919 11129 1 28 . 1 1 7 7 THR HA H 7 4.970 4.970 4.968 0.002 17919 11130 1 28 . 1 1 7 7 THR C C 7 176.910 176.910 177.023 -0.113 17919 11131 1 28 . 1 1 7 7 THR CA C 7 60.470 60.470 59.763 0.707 17919 11132 1 28 . 1 1 7 7 THR CB C 7 70.630 70.630 70.772 -0.142 17919 11133 1 28 . 1 1 7 7 THR H H 7 8.730 8.730 8.612 0.118 17919 11134 1 28 . 1 1 8 8 LEU N N 8 121.330 121.330 117.330 4.000 17919 11135 1 28 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.256 0.054 17919 11136 1 28 . 1 1 8 8 LEU C C 8 178.800 178.800 177.024 1.776 17919 11137 1 28 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.739 -0.159 17919 11138 1 28 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.367 0.603 17919 11139 1 28 . 1 1 8 8 LEU H H 8 9.100 9.100 8.553 0.547 17919 11140 1 28 . 1 1 9 9 THR N N 9 105.590 105.590 107.318 -1.728 17919 11141 1 28 . 1 1 9 9 THR HA H 9 4.428 4.428 4.340 0.088 17919 11142 1 28 . 1 1 9 9 THR C C 9 175.520 175.520 175.498 0.022 17919 11143 1 28 . 1 1 9 9 THR CA C 9 61.400 61.400 61.577 -0.177 17919 11144 1 28 . 1 1 9 9 THR CB C 9 69.140 69.140 69.288 -0.148 17919 11145 1 28 . 1 1 9 9 THR H H 9 7.630 7.630 7.567 0.063 17919 11146 1 28 . 1 1 10 10 GLY N N 10 108.890 108.890 111.138 -2.248 17919 11147 1 28 . 1 1 10 10 GLY C C 10 174.070 174.070 173.709 0.361 17919 11148 1 28 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.755 0.705 17919 11149 1 28 . 1 1 10 10 GLY H H 10 7.810 7.810 7.683 0.127 17919 11150 1 28 . 1 1 11 11 LYS N N 11 121.600 121.600 122.064 -0.464 17919 11151 1 28 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.431 -0.070 17919 11152 1 28 . 1 1 11 11 LYS C C 11 175.940 175.940 175.790 0.150 17919 11153 1 28 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.017 0.263 17919 11154 1 28 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.552 -0.352 17919 11155 1 28 . 1 1 11 11 LYS H H 11 7.280 7.280 8.000 -0.720 17919 11156 1 28 . 1 1 12 12 THR N N 12 120.440 120.440 117.143 3.297 17919 11157 1 28 . 1 1 12 12 THR HA H 12 5.046 5.046 4.985 0.061 17919 11158 1 28 . 1 1 12 12 THR C C 12 174.320 174.320 173.826 0.494 17919 11159 1 28 . 1 1 12 12 THR CA C 12 62.390 62.390 60.995 1.395 17919 11160 1 28 . 1 1 12 12 THR CB C 12 69.910 69.910 71.612 -1.702 17919 11161 1 28 . 1 1 12 12 THR H H 12 8.650 8.650 8.440 0.210 17919 11162 1 28 . 1 1 13 13 ILE N N 13 127.110 127.110 122.625 4.485 17919 11163 1 28 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.438 0.106 17919 11164 1 28 . 1 1 13 13 ILE C C 13 175.220 175.220 174.867 0.353 17919 11165 1 28 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.908 -0.929 17919 11166 1 28 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.427 -0.477 17919 11167 1 28 . 1 1 13 13 ILE H H 13 9.450 9.450 8.668 0.782 17919 11168 1 28 . 1 1 14 14 THR N N 14 121.520 121.520 123.501 -1.981 17919 11169 1 28 . 1 1 14 14 THR HA H 14 4.964 4.964 4.162 0.802 17919 11170 1 28 . 1 1 14 14 THR C C 14 173.790 173.790 173.645 0.145 17919 11171 1 28 . 1 1 14 14 THR CA C 14 61.940 61.940 63.516 -1.576 17919 11172 1 28 . 1 1 14 14 THR CB C 14 69.650 69.650 69.210 0.440 17919 11173 1 28 . 1 1 14 14 THR H H 14 8.710 8.710 8.467 0.243 17919 11174 1 28 . 1 1 15 15 LEU N N 15 124.800 124.800 129.974 -5.174 17919 11175 1 28 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.730 0.050 17919 11176 1 28 . 1 1 15 15 LEU C C 15 174.670 174.670 174.663 0.007 17919 11177 1 28 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.711 -0.881 17919 11178 1 28 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.643 1.427 17919 11179 1 28 . 1 1 15 15 LEU H H 15 8.710 8.710 8.146 0.564 17919 11180 1 28 . 1 1 16 16 GLU N N 16 122.160 122.160 125.442 -3.282 17919 11181 1 28 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.192 -0.275 17919 11182 1 28 . 1 1 16 16 GLU C C 16 175.860 175.860 176.297 -0.437 17919 11183 1 28 . 1 1 16 16 GLU CA C 16 54.820 54.820 54.996 -0.176 17919 11184 1 28 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.057 -0.607 17919 11185 1 28 . 1 1 16 16 GLU H H 16 8.140 8.140 8.438 -0.298 17919 11186 1 28 . 1 1 17 17 VAL N N 17 117.210 117.210 118.879 -1.669 17919 11187 1 28 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.764 -0.050 17919 11188 1 28 . 1 1 17 17 VAL C C 17 174.160 174.160 174.989 -0.829 17919 11189 1 28 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.986 -0.555 17919 11190 1 28 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.079 1.321 17919 11191 1 28 . 1 1 17 17 VAL H H 17 8.900 8.900 8.766 0.134 17919 11192 1 28 . 1 1 18 18 GLU N N 18 118.990 118.990 119.858 -0.868 17919 11193 1 28 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.991 0.088 17919 11194 1 28 . 1 1 18 18 GLU C C 18 176.160 176.160 175.547 0.613 17919 11195 1 28 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.522 0.198 17919 11196 1 28 . 1 1 18 18 GLU CB C 18 30.310 30.310 32.883 -2.572 17919 11197 1 28 . 1 1 18 18 GLU H H 18 8.640 8.640 9.113 -0.473 17919 11198 1 28 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.387 -0.246 17919 11199 1 28 . 1 1 19 19 PRO C C 19 175.310 175.310 177.853 -2.543 17919 11200 1 28 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.098 0.372 17919 11201 1 28 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.155 -0.205 17919 11202 1 28 . 1 1 20 20 SER N N 20 103.400 103.400 110.409 -7.009 17919 11203 1 28 . 1 1 20 20 SER HA H 20 4.370 4.370 4.303 0.067 17919 11204 1 28 . 1 1 20 20 SER C C 20 174.660 174.660 174.861 -0.201 17919 11205 1 28 . 1 1 20 20 SER CA C 20 57.400 57.400 58.589 -1.189 17919 11206 1 28 . 1 1 20 20 SER CB C 20 63.370 63.370 63.106 0.264 17919 11207 1 28 . 1 1 20 20 SER H H 20 7.040 7.040 8.003 -0.963 17919 11208 1 28 . 1 1 21 21 ASP N N 21 123.480 123.480 124.421 -0.941 17919 11209 1 28 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.758 -0.063 17919 11210 1 28 . 1 1 21 21 ASP C C 21 176.360 176.360 175.838 0.522 17919 11211 1 28 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.399 0.301 17919 11212 1 28 . 1 1 21 21 ASP CB C 21 40.800 40.800 42.134 -1.334 17919 11213 1 28 . 1 1 21 21 ASP H H 21 8.030 8.030 7.847 0.183 17919 11214 1 28 . 1 1 22 22 THR N N 22 108.800 108.800 111.926 -3.126 17919 11215 1 28 . 1 1 22 22 THR HA H 22 4.920 4.920 4.555 0.365 17919 11216 1 28 . 1 1 22 22 THR C C 22 176.750 176.750 176.228 0.522 17919 11217 1 28 . 1 1 22 22 THR CA C 22 59.690 59.690 61.702 -2.012 17919 11218 1 28 . 1 1 22 22 THR CB C 22 71.200 71.200 69.997 1.203 17919 11219 1 28 . 1 1 22 22 THR H H 22 7.900 7.900 8.372 -0.472 17919 11220 1 28 . 1 1 23 23 ILE N N 23 121.190 121.190 122.130 -0.940 17919 11221 1 28 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.683 -0.026 17919 11222 1 28 . 1 1 23 23 ILE C C 23 179.040 179.040 177.482 1.558 17919 11223 1 28 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.842 -1.582 17919 11224 1 28 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.471 -2.121 17919 11225 1 28 . 1 1 23 23 ILE H H 23 8.560 8.560 8.880 -0.320 17919 11226 1 28 . 1 1 24 24 GLU N N 24 120.830 120.830 119.636 1.194 17919 11227 1 28 . 1 1 24 24 GLU HA H 24 3.917 3.917 4.045 -0.129 17919 11228 1 28 . 1 1 24 24 GLU C C 24 178.640 178.640 178.498 0.142 17919 11229 1 28 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.026 1.194 17919 11230 1 28 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.560 -1.280 17919 11231 1 28 . 1 1 24 24 GLU H H 24 9.760 9.760 7.955 1.805 17919 11232 1 28 . 1 1 25 25 ASN N N 25 120.570 120.570 118.980 1.590 17919 11233 1 28 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.503 0.022 17919 11234 1 28 . 1 1 25 25 ASN C C 25 178.380 178.380 177.885 0.495 17919 11235 1 28 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.829 0.231 17919 11236 1 28 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.127 0.323 17919 11237 1 28 . 1 1 25 25 ASN H H 25 7.920 7.920 7.642 0.278 17919 11238 1 28 . 1 1 26 26 VAL N N 26 121.710 121.710 120.751 0.959 17919 11239 1 28 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.474 -0.077 17919 11240 1 28 . 1 1 26 26 VAL C C 26 177.950 177.950 177.733 0.217 17919 11241 1 28 . 1 1 26 26 VAL CA C 26 67.660 67.660 67.146 0.514 17919 11242 1 28 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.309 -0.469 17919 11243 1 28 . 1 1 26 26 VAL H H 26 8.070 8.070 7.633 0.437 17919 11244 1 28 . 1 1 27 27 LYS N N 27 118.860 118.860 118.838 0.022 17919 11245 1 28 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.245 0.335 17919 11246 1 28 . 1 1 27 27 LYS C C 27 180.550 180.550 178.774 1.776 17919 11247 1 28 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.319 -0.069 17919 11248 1 28 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.313 1.417 17919 11249 1 28 . 1 1 27 27 LYS H H 27 8.560 8.560 8.097 0.463 17919 11250 1 28 . 1 1 28 28 ALA N N 28 123.440 123.440 123.021 0.419 17919 11251 1 28 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.039 0.121 17919 11252 1 28 . 1 1 28 28 ALA C C 28 180.300 180.300 179.114 1.186 17919 11253 1 28 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.206 0.164 17919 11254 1 28 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.242 -0.532 17919 11255 1 28 . 1 1 28 28 ALA H H 28 8.060 8.060 7.623 0.437 17919 11256 1 28 . 1 1 29 29 LYS N N 29 119.940 119.940 119.584 0.356 17919 11257 1 28 . 1 1 29 29 LYS HA H 29 4.207 4.207 3.949 0.258 17919 11258 1 28 . 1 1 29 29 LYS C C 29 180.320 180.320 179.322 0.998 17919 11259 1 28 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.310 0.340 17919 11260 1 28 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.285 1.005 17919 11261 1 28 . 1 1 29 29 LYS H H 29 7.850 7.850 7.636 0.214 17919 11262 1 28 . 1 1 30 30 ILE N N 30 121.080 121.080 120.281 0.799 17919 11263 1 28 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.564 -0.057 17919 11264 1 28 . 1 1 30 30 ILE C C 30 178.310 178.310 177.359 0.951 17919 11265 1 28 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.367 0.783 17919 11266 1 28 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.658 -0.859 17919 11267 1 28 . 1 1 30 30 ILE H H 30 8.280 8.280 8.435 -0.155 17919 11268 1 28 . 1 1 31 31 GLN N N 31 123.490 123.490 120.159 3.331 17919 11269 1 28 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.921 -0.092 17919 11270 1 28 . 1 1 31 31 GLN C C 31 178.890 178.890 178.419 0.471 17919 11271 1 28 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.100 0.900 17919 11272 1 28 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.438 -0.718 17919 11273 1 28 . 1 1 31 31 GLN H H 31 8.580 8.580 8.017 0.563 17919 11274 1 28 . 1 1 32 32 ASP N N 32 119.360 119.360 119.371 -0.011 17919 11275 1 28 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.370 -0.016 17919 11276 1 28 . 1 1 32 32 ASP C C 32 177.250 177.250 177.389 -0.139 17919 11277 1 28 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.883 0.307 17919 11278 1 28 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.769 -0.189 17919 11279 1 28 . 1 1 32 32 ASP H H 32 8.010 8.010 8.155 -0.145 17919 11280 1 28 . 1 1 33 33 LYS N N 33 115.130 115.130 118.839 -3.709 17919 11281 1 28 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.305 0.032 17919 11282 1 28 . 1 1 33 33 LYS C C 33 177.870 177.870 178.385 -0.515 17919 11283 1 28 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.532 0.518 17919 11284 1 28 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.197 0.973 17919 11285 1 28 . 1 1 33 33 LYS H H 33 7.430 7.430 7.536 -0.106 17919 11286 1 28 . 1 1 34 34 GLU N N 34 113.870 113.870 115.850 -1.980 17919 11287 1 28 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.479 0.146 17919 11288 1 28 . 1 1 34 34 GLU C C 34 177.840 177.840 177.612 0.228 17919 11289 1 28 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.832 -0.662 17919 11290 1 28 . 1 1 34 34 GLU CB C 34 32.660 32.660 30.263 2.397 17919 11291 1 28 . 1 1 34 34 GLU H H 34 8.740 8.740 8.068 0.672 17919 11292 1 28 . 1 1 35 35 GLY N N 35 108.650 108.650 109.503 -0.853 17919 11293 1 28 . 1 1 35 35 GLY C C 35 173.960 173.960 174.305 -0.345 17919 11294 1 28 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.926 0.154 17919 11295 1 28 . 1 1 35 35 GLY H H 35 8.530 8.530 8.118 0.412 17919 11296 1 28 . 1 1 36 36 ILE N N 36 119.880 119.880 118.293 1.587 17919 11297 1 28 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.453 -0.008 17919 11298 1 28 . 1 1 36 36 ILE C C 36 173.590 173.590 173.920 -0.330 17919 11299 1 28 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.964 -0.214 17919 11300 1 28 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.137 2.443 17919 11301 1 28 . 1 1 36 36 ILE H H 36 6.150 6.150 7.592 -1.442 17919 11302 1 28 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.980 -0.346 17919 11303 1 28 . 1 1 37 37 PRO C C 37 176.940 176.940 176.879 0.061 17919 11304 1 28 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.053 0.607 17919 11305 1 28 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.193 0.657 17919 11306 1 28 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.148 -0.031 17919 11307 1 28 . 1 1 38 38 PRO C C 38 178.320 178.320 178.275 0.045 17919 11308 1 28 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.717 0.543 17919 11309 1 28 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.591 1.299 17919 11310 1 28 . 1 1 39 39 ASP N N 39 113.380 113.380 117.316 -3.936 17919 11311 1 28 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.395 0.035 17919 11312 1 28 . 1 1 39 39 ASP C C 39 177.090 177.090 177.946 -0.856 17919 11313 1 28 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.740 -1.100 17919 11314 1 28 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.539 -0.999 17919 11315 1 28 . 1 1 39 39 ASP H H 39 8.550 8.550 8.492 0.058 17919 11316 1 28 . 1 1 40 40 GLN N N 40 116.780 116.780 117.280 -0.500 17919 11317 1 28 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.039 0.425 17919 11318 1 28 . 1 1 40 40 GLN C C 40 175.380 175.380 176.301 -0.921 17919 11319 1 28 . 1 1 40 40 GLN CA C 40 55.640 55.640 57.790 -2.150 17919 11320 1 28 . 1 1 40 40 GLN CB C 40 30.140 30.140 28.860 1.280 17919 11321 1 28 . 1 1 40 40 GLN H H 40 7.820 7.820 7.952 -0.132 17919 11322 1 28 . 1 1 41 41 GLN N N 41 117.720 117.720 117.908 -0.188 17919 11323 1 28 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.477 -0.233 17919 11324 1 28 . 1 1 41 41 GLN C C 41 176.300 176.300 174.808 1.492 17919 11325 1 28 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.467 1.003 17919 11326 1 28 . 1 1 41 41 GLN CB C 41 31.650 31.650 30.596 1.054 17919 11327 1 28 . 1 1 41 41 GLN H H 41 7.480 7.480 7.597 -0.117 17919 11328 1 28 . 1 1 42 42 ARG N N 42 122.680 122.680 122.397 0.283 17919 11329 1 28 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.676 -0.176 17919 11330 1 28 . 1 1 42 42 ARG C C 42 174.050 174.050 174.525 -0.475 17919 11331 1 28 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.914 0.136 17919 11332 1 28 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.068 -1.318 17919 11333 1 28 . 1 1 42 42 ARG H H 42 8.530 8.530 8.085 0.445 17919 11334 1 28 . 1 1 43 43 LEU N N 43 124.040 124.040 125.469 -1.429 17919 11335 1 28 . 1 1 43 43 LEU C C 43 175.290 175.290 175.551 -0.261 17919 11336 1 28 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.402 -1.422 17919 11337 1 28 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.504 2.287 17919 11338 1 28 . 1 1 43 43 LEU H H 43 8.820 8.820 8.909 -0.089 17919 11339 1 28 . 1 1 44 44 ILE N N 44 121.920 121.920 121.986 -0.066 17919 11340 1 28 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.226 -0.234 17919 11341 1 28 . 1 1 44 44 ILE C C 44 176.060 176.060 174.528 1.532 17919 11342 1 28 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.200 -1.220 17919 11343 1 28 . 1 1 44 44 ILE CB C 44 41.420 41.420 42.076 -0.656 17919 11344 1 28 . 1 1 44 44 ILE H H 44 9.030 9.030 8.378 0.652 17919 11345 1 28 . 1 1 45 45 PHE N N 45 125.390 125.390 125.745 -0.355 17919 11346 1 28 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.942 0.103 17919 11347 1 28 . 1 1 45 45 PHE C C 45 174.470 174.470 174.195 0.275 17919 11348 1 28 . 1 1 45 45 PHE CA C 45 57.020 57.020 57.417 -0.397 17919 11349 1 28 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.772 0.988 17919 11350 1 28 . 1 1 45 45 PHE H H 45 8.830 8.830 9.065 -0.235 17919 11351 1 28 . 1 1 46 46 ALA N N 46 132.200 132.200 128.658 3.542 17919 11352 1 28 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.645 0.045 17919 11353 1 28 . 1 1 46 46 ALA C C 46 177.290 177.290 177.603 -0.313 17919 11354 1 28 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.582 -0.042 17919 11355 1 28 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.236 0.334 17919 11356 1 28 . 1 1 46 46 ALA H H 46 8.810 8.810 9.040 -0.230 17919 11357 1 28 . 1 1 47 47 GLY N N 47 102.340 102.340 103.922 -1.582 17919 11358 1 28 . 1 1 47 47 GLY C C 47 173.810 173.810 174.031 -0.221 17919 11359 1 28 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.849 0.501 17919 11360 1 28 . 1 1 47 47 GLY H H 47 8.130 8.130 8.447 -0.317 17919 11361 1 28 . 1 1 48 48 LYS N N 48 121.570 121.570 121.349 0.221 17919 11362 1 28 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.606 0.016 17919 11363 1 28 . 1 1 48 48 LYS C C 48 174.700 174.700 174.990 -0.290 17919 11364 1 28 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.974 -0.424 17919 11365 1 28 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.956 -0.426 17919 11366 1 28 . 1 1 48 48 LYS H H 48 7.980 7.980 7.662 0.318 17919 11367 1 28 . 1 1 49 49 GLN N N 49 122.410 122.410 125.368 -2.958 17919 11368 1 28 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.686 -0.126 17919 11369 1 28 . 1 1 49 49 GLN C C 49 175.670 175.670 175.531 0.139 17919 11370 1 28 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.036 -0.296 17919 11371 1 28 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.658 -0.658 17919 11372 1 28 . 1 1 49 49 GLN H H 49 8.600 8.600 8.574 0.026 17919 11373 1 28 . 1 1 50 50 LEU N N 50 125.520 125.520 127.721 -2.201 17919 11374 1 28 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.182 -0.092 17919 11375 1 28 . 1 1 50 50 LEU C C 50 176.660 176.660 176.473 0.187 17919 11376 1 28 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.297 -0.057 17919 11377 1 28 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.113 -0.543 17919 11378 1 28 . 1 1 50 50 LEU H H 50 8.530 8.530 8.813 -0.283 17919 11379 1 28 . 1 1 51 51 GLU N N 51 122.940 122.940 123.169 -0.229 17919 11380 1 28 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.587 -0.099 17919 11381 1 28 . 1 1 51 51 GLU C C 51 175.870 175.870 176.418 -0.548 17919 11382 1 28 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.381 0.579 17919 11383 1 28 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.285 0.285 17919 11384 1 28 . 1 1 51 51 GLU H H 51 8.400 8.400 8.520 -0.120 17919 11385 1 28 . 1 1 52 52 ASP N N 52 120.030 120.030 124.365 -4.335 17919 11386 1 28 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.520 -0.161 17919 11387 1 28 . 1 1 52 52 ASP C C 52 177.330 177.330 178.110 -0.780 17919 11388 1 28 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.644 -0.684 17919 11389 1 28 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.943 -0.093 17919 11390 1 28 . 1 1 52 52 ASP H H 52 8.160 8.160 8.805 -0.645 17919 11391 1 28 . 1 1 53 53 GLY N N 53 106.660 106.660 106.121 0.539 17919 11392 1 28 . 1 1 53 53 GLY C C 53 174.870 174.870 174.618 0.252 17919 11393 1 28 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.188 -0.018 17919 11394 1 28 . 1 1 53 53 GLY H H 53 9.390 9.390 8.329 1.061 17919 11395 1 28 . 1 1 54 54 ARG N N 54 119.050 119.050 121.286 -2.236 17919 11396 1 28 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.530 0.165 17919 11397 1 28 . 1 1 54 54 ARG C C 54 175.350 175.350 175.371 -0.021 17919 11398 1 28 . 1 1 54 54 ARG CA C 54 54.390 54.390 55.331 -0.941 17919 11399 1 28 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.258 0.392 17919 11400 1 28 . 1 1 54 54 ARG H H 54 7.460 7.460 7.689 -0.229 17919 11401 1 28 . 1 1 55 55 THR N N 55 108.400 108.400 112.382 -3.982 17919 11402 1 28 . 1 1 55 55 THR HA H 55 5.240 5.240 4.978 0.262 17919 11403 1 28 . 1 1 55 55 THR C C 55 176.560 176.560 176.168 0.392 17919 11404 1 28 . 1 1 55 55 THR CA C 55 59.690 59.690 60.643 -0.953 17919 11405 1 28 . 1 1 55 55 THR CB C 55 72.260 72.260 70.899 1.361 17919 11406 1 28 . 1 1 55 55 THR H H 55 8.730 8.730 8.542 0.188 17919 11407 1 28 . 1 1 56 56 LEU N N 56 117.920 117.920 123.324 -5.404 17919 11408 1 28 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.974 0.086 17919 11409 1 28 . 1 1 56 56 LEU C C 56 180.810 180.810 178.945 1.865 17919 11410 1 28 . 1 1 56 56 LEU CA C 56 58.710 58.710 59.074 -0.364 17919 11411 1 28 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.377 -1.007 17919 11412 1 28 . 1 1 56 56 LEU H H 56 8.140 8.140 8.498 -0.358 17919 11413 1 28 . 1 1 57 57 SER N N 57 113.330 113.330 114.974 -1.644 17919 11414 1 28 . 1 1 57 57 SER HA H 57 4.370 4.370 4.099 0.271 17919 11415 1 28 . 1 1 57 57 SER C C 57 178.310 178.310 176.725 1.585 17919 11416 1 28 . 1 1 57 57 SER CA C 57 61.080 61.080 62.078 -0.998 17919 11417 1 28 . 1 1 57 57 SER CB C 57 62.530 62.530 62.595 -0.065 17919 11418 1 28 . 1 1 57 57 SER H H 57 8.470 8.470 8.015 0.455 17919 11419 1 28 . 1 1 58 58 ASP N N 58 124.190 124.190 120.912 3.278 17919 11420 1 28 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.200 0.096 17919 11421 1 28 . 1 1 58 58 ASP C C 58 177.400 177.400 176.832 0.568 17919 11422 1 28 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.823 0.357 17919 11423 1 28 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.203 -0.103 17919 11424 1 28 . 1 1 58 58 ASP H H 58 7.930 7.930 7.863 0.067 17919 11425 1 28 . 1 1 59 59 TYR N N 59 115.510 115.510 114.723 0.787 17919 11426 1 28 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.649 0.021 17919 11427 1 28 . 1 1 59 59 TYR C C 59 174.700 174.700 175.228 -0.528 17919 11428 1 28 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.354 0.896 17919 11429 1 28 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.503 1.567 17919 11430 1 28 . 1 1 59 59 TYR H H 59 7.250 7.250 7.254 -0.004 17919 11431 1 28 . 1 1 60 60 ASN N N 60 115.900 115.900 116.170 -0.270 17919 11432 1 28 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.344 0.011 17919 11433 1 28 . 1 1 60 60 ASN C C 60 174.340 174.340 174.573 -0.233 17919 11434 1 28 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.565 -0.445 17919 11435 1 28 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.957 -0.547 17919 11436 1 28 . 1 1 60 60 ASN H H 60 8.150 8.150 8.247 -0.097 17919 11437 1 28 . 1 1 61 61 ILE N N 61 118.600 118.600 119.967 -1.367 17919 11438 1 28 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.881 -0.488 17919 11439 1 28 . 1 1 61 61 ILE C C 61 174.610 174.610 174.961 -0.351 17919 11440 1 28 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.503 -0.083 17919 11441 1 28 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.122 -0.382 17919 11442 1 28 . 1 1 61 61 ILE H H 61 7.250 7.250 8.038 -0.788 17919 11443 1 28 . 1 1 62 62 GLN N N 62 124.740 124.740 128.346 -3.606 17919 11444 1 28 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.678 -0.172 17919 11445 1 28 . 1 1 62 62 GLN C C 62 175.970 175.970 175.308 0.662 17919 11446 1 28 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.724 -0.063 17919 11447 1 28 . 1 1 62 62 GLN CB C 62 31.650 31.650 32.059 -0.409 17919 11448 1 28 . 1 1 62 62 GLN H H 62 7.610 7.610 8.530 -0.920 17919 11449 1 28 . 1 1 63 63 LYS N N 63 120.300 120.300 120.718 -0.418 17919 11450 1 28 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.106 -0.105 17919 11451 1 28 . 1 1 63 63 LYS C C 63 175.810 175.810 176.748 -0.938 17919 11452 1 28 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.042 -0.252 17919 11453 1 28 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.318 0.332 17919 11454 1 28 . 1 1 63 63 LYS H H 63 8.490 8.490 8.534 -0.044 17919 11455 1 28 . 1 1 64 64 GLU N N 64 113.950 113.950 119.363 -5.413 17919 11456 1 28 . 1 1 64 64 GLU HA H 64 3.465 3.465 4.102 -0.637 17919 11457 1 28 . 1 1 64 64 GLU C C 64 175.250 175.250 175.799 -0.549 17919 11458 1 28 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.738 0.152 17919 11459 1 28 . 1 1 64 64 GLU CB C 64 25.900 25.900 29.342 -3.442 17919 11460 1 28 . 1 1 64 64 GLU H H 64 9.280 9.280 8.837 0.443 17919 11461 1 28 . 1 1 65 65 SER N N 65 114.730 114.730 116.130 -1.400 17919 11462 1 28 . 1 1 65 65 SER HA H 65 4.640 4.640 4.494 0.146 17919 11463 1 28 . 1 1 65 65 SER C C 65 172.160 172.160 174.026 -1.866 17919 11464 1 28 . 1 1 65 65 SER CA C 65 60.890 60.890 60.076 0.814 17919 11465 1 28 . 1 1 65 65 SER CB C 65 64.910 64.910 63.929 0.981 17919 11466 1 28 . 1 1 65 65 SER H H 65 7.670 7.670 7.264 0.406 17919 11467 1 28 . 1 1 66 66 THR N N 66 117.110 117.110 121.851 -4.741 17919 11468 1 28 . 1 1 66 66 THR HA H 66 5.270 5.270 4.828 0.442 17919 11469 1 28 . 1 1 66 66 THR C C 66 173.950 173.950 174.056 -0.106 17919 11470 1 28 . 1 1 66 66 THR CA C 66 62.340 62.340 62.132 0.208 17919 11471 1 28 . 1 1 66 66 THR CB C 66 70.080 70.080 69.581 0.499 17919 11472 1 28 . 1 1 66 66 THR H H 66 8.730 8.730 8.493 0.237 17919 11473 1 28 . 1 1 67 67 LEU N N 67 127.110 127.110 127.360 -0.250 17919 11474 1 28 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.910 0.150 17919 11475 1 28 . 1 1 67 67 LEU C C 67 175.770 175.770 175.975 -0.205 17919 11476 1 28 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.687 0.213 17919 11477 1 28 . 1 1 67 67 LEU CB C 67 44.260 44.260 42.986 1.274 17919 11478 1 28 . 1 1 67 67 LEU H H 67 9.410 9.410 8.659 0.751 17919 11479 1 28 . 1 1 68 68 HIS N N 68 118.380 118.380 123.046 -4.666 17919 11480 1 28 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.212 0.028 17919 11481 1 28 . 1 1 68 68 HIS C C 68 173.150 173.150 174.841 -1.691 17919 11482 1 28 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.373 0.627 17919 11483 1 28 . 1 1 68 68 HIS CB C 68 30.530 30.530 30.244 0.286 17919 11484 1 28 . 1 1 68 68 HIS H H 68 9.230 9.230 9.139 0.091 17919 11485 1 28 . 1 1 69 69 LEU N N 69 124.460 124.460 129.442 -4.982 17919 11486 1 28 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.715 0.475 17919 11487 1 28 . 1 1 69 69 LEU C C 69 175.270 175.270 174.635 0.635 17919 11488 1 28 . 1 1 69 69 LEU CA C 69 53.890 53.890 55.211 -1.321 17919 11489 1 28 . 1 1 69 69 LEU CB C 69 44.380 44.380 43.097 1.283 17919 11490 1 28 . 1 1 69 69 LEU H H 69 8.340 8.340 8.352 -0.012 17919 11491 1 28 . 1 1 70 70 VAL N N 70 126.940 126.940 125.999 0.941 17919 11492 1 28 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.309 0.041 17919 11493 1 28 . 1 1 70 70 VAL C C 70 174.000 174.000 174.606 -0.606 17919 11494 1 28 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.740 0.060 17919 11495 1 28 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.053 -0.143 17919 11496 1 28 . 1 1 70 70 VAL H H 70 9.200 9.200 8.759 0.441 17919 11497 1 28 . 1 1 71 71 LEU N N 71 123.130 123.130 124.680 -1.550 17919 11498 1 28 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.844 0.216 17919 11499 1 28 . 1 1 71 71 LEU C C 71 177.830 177.830 177.854 -0.024 17919 11500 1 28 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.442 0.498 17919 11501 1 28 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.130 -0.280 17919 11502 1 28 . 1 1 71 71 LEU H H 71 8.120 8.120 8.371 -0.251 17919 11503 1 28 . 1 1 72 72 ARG N N 72 123.490 123.490 120.137 3.353 17919 11504 1 28 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.374 -0.073 17919 11505 1 28 . 1 1 72 72 ARG C C 72 175.350 175.350 176.588 -1.238 17919 11506 1 28 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.901 -1.291 17919 11507 1 28 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.905 0.445 17919 11508 1 28 . 1 1 72 72 ARG H H 72 8.580 8.580 7.948 0.632 17919 11509 1 29 . 1 1 2 2 GLN N N 2 123.220 123.220 121.731 1.489 17919 11510 1 29 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.116 0.133 17919 11511 1 29 . 1 1 2 2 GLN C C 2 175.920 175.920 174.956 0.964 17919 11512 1 29 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.814 0.266 17919 11513 1 29 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.825 -0.065 17919 11514 1 29 . 1 1 2 2 GLN H H 2 8.900 8.900 8.428 0.472 17919 11515 1 29 . 1 1 3 3 ILE N N 3 115.340 115.340 119.436 -4.096 17919 11516 1 29 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.558 -0.345 17919 11517 1 29 . 1 1 3 3 ILE C C 3 172.450 172.450 173.864 -1.414 17919 11518 1 29 . 1 1 3 3 ILE CA C 3 59.570 59.570 58.643 0.927 17919 11519 1 29 . 1 1 3 3 ILE CB C 3 42.210 42.210 40.621 1.589 17919 11520 1 29 . 1 1 3 3 ILE H H 3 8.320 8.320 8.528 -0.208 17919 11521 1 29 . 1 1 4 4 PHE N N 4 118.110 118.110 121.294 -3.184 17919 11522 1 29 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.422 0.208 17919 11523 1 29 . 1 1 4 4 PHE C C 4 175.320 175.320 175.215 0.105 17919 11524 1 29 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.735 -0.525 17919 11525 1 29 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.539 -1.059 17919 11526 1 29 . 1 1 4 4 PHE H H 4 8.610 8.610 8.349 0.261 17919 11527 1 29 . 1 1 5 5 VAL N N 5 121.000 121.000 121.547 -0.547 17919 11528 1 29 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.975 -0.250 17919 11529 1 29 . 1 1 5 5 VAL C C 5 174.870 174.870 174.633 0.237 17919 11530 1 29 . 1 1 5 5 VAL CA C 5 60.620 60.620 60.874 -0.254 17919 11531 1 29 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.436 -0.206 17919 11532 1 29 . 1 1 5 5 VAL H H 5 9.300 9.300 9.371 -0.071 17919 11533 1 29 . 1 1 6 6 LYS N N 6 127.520 127.520 128.894 -1.374 17919 11534 1 29 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.143 0.224 17919 11535 1 29 . 1 1 6 6 LYS C C 6 177.140 177.140 176.128 1.012 17919 11536 1 29 . 1 1 6 6 LYS CA C 6 54.520 54.520 53.703 0.817 17919 11537 1 29 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.456 0.594 17919 11538 1 29 . 1 1 6 6 LYS H H 6 8.820 8.820 8.429 0.391 17919 11539 1 29 . 1 1 7 7 THR N N 7 115.400 115.400 118.174 -2.774 17919 11540 1 29 . 1 1 7 7 THR HA H 7 4.970 4.970 4.870 0.100 17919 11541 1 29 . 1 1 7 7 THR C C 7 176.910 176.910 176.238 0.672 17919 11542 1 29 . 1 1 7 7 THR CA C 7 60.470 60.470 60.543 -0.073 17919 11543 1 29 . 1 1 7 7 THR CB C 7 70.630 70.630 70.745 -0.115 17919 11544 1 29 . 1 1 7 7 THR H H 7 8.730 8.730 8.880 -0.150 17919 11545 1 29 . 1 1 8 8 LEU N N 8 121.330 121.330 121.861 -0.531 17919 11546 1 29 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.207 0.103 17919 11547 1 29 . 1 1 8 8 LEU C C 8 178.800 178.800 177.658 1.142 17919 11548 1 29 . 1 1 8 8 LEU CA C 8 57.580 57.580 58.264 -0.684 17919 11549 1 29 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.197 -0.227 17919 11550 1 29 . 1 1 8 8 LEU H H 8 9.100 9.100 8.423 0.677 17919 11551 1 29 . 1 1 9 9 THR N N 9 105.590 105.590 108.006 -2.416 17919 11552 1 29 . 1 1 9 9 THR HA H 9 4.428 4.428 4.258 0.170 17919 11553 1 29 . 1 1 9 9 THR C C 9 175.520 175.520 175.449 0.071 17919 11554 1 29 . 1 1 9 9 THR CA C 9 61.400 61.400 62.365 -0.965 17919 11555 1 29 . 1 1 9 9 THR CB C 9 69.140 69.140 67.816 1.324 17919 11556 1 29 . 1 1 9 9 THR H H 9 7.630 7.630 7.872 -0.242 17919 11557 1 29 . 1 1 10 10 GLY N N 10 108.890 108.890 111.051 -2.161 17919 11558 1 29 . 1 1 10 10 GLY C C 10 174.070 174.070 173.842 0.228 17919 11559 1 29 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.121 0.339 17919 11560 1 29 . 1 1 10 10 GLY H H 10 7.810 7.810 7.981 -0.171 17919 11561 1 29 . 1 1 11 11 LYS N N 11 121.600 121.600 121.349 0.251 17919 11562 1 29 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.760 -0.399 17919 11563 1 29 . 1 1 11 11 LYS C C 11 175.940 175.940 174.504 1.436 17919 11564 1 29 . 1 1 11 11 LYS CA C 11 56.280 56.280 55.136 1.144 17919 11565 1 29 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.599 -0.399 17919 11566 1 29 . 1 1 11 11 LYS H H 11 7.280 7.280 7.535 -0.255 17919 11567 1 29 . 1 1 12 12 THR N N 12 120.440 120.440 116.869 3.571 17919 11568 1 29 . 1 1 12 12 THR HA H 12 5.046 5.046 5.424 -0.378 17919 11569 1 29 . 1 1 12 12 THR C C 12 174.320 174.320 174.109 0.211 17919 11570 1 29 . 1 1 12 12 THR CA C 12 62.390 62.390 61.761 0.629 17919 11571 1 29 . 1 1 12 12 THR CB C 12 69.910 69.910 70.081 -0.171 17919 11572 1 29 . 1 1 12 12 THR H H 12 8.650 8.650 8.320 0.330 17919 11573 1 29 . 1 1 13 13 ILE N N 13 127.110 127.110 123.498 3.612 17919 11574 1 29 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.802 -0.258 17919 11575 1 29 . 1 1 13 13 ILE C C 13 175.220 175.220 173.656 1.564 17919 11576 1 29 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.368 0.612 17919 11577 1 29 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.870 -0.920 17919 11578 1 29 . 1 1 13 13 ILE H H 13 9.450 9.450 9.161 0.289 17919 11579 1 29 . 1 1 14 14 THR N N 14 121.520 121.520 118.948 2.572 17919 11580 1 29 . 1 1 14 14 THR HA H 14 4.964 4.964 5.180 -0.216 17919 11581 1 29 . 1 1 14 14 THR C C 14 173.790 173.790 173.083 0.707 17919 11582 1 29 . 1 1 14 14 THR CA C 14 61.940 61.940 60.835 1.105 17919 11583 1 29 . 1 1 14 14 THR CB C 14 69.650 69.650 70.527 -0.877 17919 11584 1 29 . 1 1 14 14 THR H H 14 8.710 8.710 8.463 0.247 17919 11585 1 29 . 1 1 15 15 LEU N N 15 124.800 124.800 125.393 -0.593 17919 11586 1 29 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.763 0.017 17919 11587 1 29 . 1 1 15 15 LEU C C 15 174.670 174.670 174.375 0.295 17919 11588 1 29 . 1 1 15 15 LEU CA C 15 52.830 52.830 54.165 -1.335 17919 11589 1 29 . 1 1 15 15 LEU CB C 15 47.070 47.070 46.347 0.723 17919 11590 1 29 . 1 1 15 15 LEU H H 15 8.710 8.710 8.384 0.326 17919 11591 1 29 . 1 1 16 16 GLU N N 16 122.160 122.160 123.157 -0.997 17919 11592 1 29 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.090 -0.173 17919 11593 1 29 . 1 1 16 16 GLU C C 16 175.860 175.860 175.353 0.507 17919 11594 1 29 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.443 -0.623 17919 11595 1 29 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.284 -0.834 17919 11596 1 29 . 1 1 16 16 GLU H H 16 8.140 8.140 8.451 -0.311 17919 11597 1 29 . 1 1 17 17 VAL N N 17 117.210 117.210 120.882 -3.672 17919 11598 1 29 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.515 0.199 17919 11599 1 29 . 1 1 17 17 VAL C C 17 174.160 174.160 174.101 0.059 17919 11600 1 29 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.677 -1.247 17919 11601 1 29 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.215 1.185 17919 11602 1 29 . 1 1 17 17 VAL H H 17 8.900 8.900 8.733 0.167 17919 11603 1 29 . 1 1 18 18 GLU N N 18 118.990 118.990 117.940 1.050 17919 11604 1 29 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.682 0.397 17919 11605 1 29 . 1 1 18 18 GLU C C 18 176.160 176.160 174.919 1.241 17919 11606 1 29 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.340 -0.620 17919 11607 1 29 . 1 1 18 18 GLU CB C 18 30.310 30.310 32.233 -1.923 17919 11608 1 29 . 1 1 18 18 GLU H H 18 8.640 8.640 7.987 0.653 17919 11609 1 29 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.316 -0.175 17919 11610 1 29 . 1 1 19 19 PRO C C 19 175.310 175.310 178.054 -2.744 17919 11611 1 29 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.259 0.211 17919 11612 1 29 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.138 -0.188 17919 11613 1 29 . 1 1 20 20 SER N N 20 103.400 103.400 112.802 -9.402 17919 11614 1 29 . 1 1 20 20 SER HA H 20 4.370 4.370 4.192 0.178 17919 11615 1 29 . 1 1 20 20 SER C C 20 174.660 174.660 174.615 0.045 17919 11616 1 29 . 1 1 20 20 SER CA C 20 57.400 57.400 59.710 -2.310 17919 11617 1 29 . 1 1 20 20 SER CB C 20 63.370 63.370 62.815 0.555 17919 11618 1 29 . 1 1 20 20 SER H H 20 7.040 7.040 8.377 -1.337 17919 11619 1 29 . 1 1 21 21 ASP N N 21 123.480 123.480 123.154 0.326 17919 11620 1 29 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.674 0.021 17919 11621 1 29 . 1 1 21 21 ASP C C 21 176.360 176.360 175.462 0.898 17919 11622 1 29 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.704 0.996 17919 11623 1 29 . 1 1 21 21 ASP CB C 21 40.800 40.800 42.093 -1.293 17919 11624 1 29 . 1 1 21 21 ASP H H 21 8.030 8.030 7.888 0.142 17919 11625 1 29 . 1 1 22 22 THR N N 22 108.800 108.800 114.659 -5.859 17919 11626 1 29 . 1 1 22 22 THR HA H 22 4.920 4.920 4.431 0.489 17919 11627 1 29 . 1 1 22 22 THR C C 22 176.750 176.750 175.783 0.967 17919 11628 1 29 . 1 1 22 22 THR CA C 22 59.690 59.690 61.631 -1.941 17919 11629 1 29 . 1 1 22 22 THR CB C 22 71.200 71.200 69.900 1.300 17919 11630 1 29 . 1 1 22 22 THR H H 22 7.900 7.900 8.264 -0.364 17919 11631 1 29 . 1 1 23 23 ILE N N 23 121.190 121.190 121.942 -0.752 17919 11632 1 29 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.747 -0.090 17919 11633 1 29 . 1 1 23 23 ILE C C 23 179.040 179.040 177.924 1.116 17919 11634 1 29 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.319 -0.059 17919 11635 1 29 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.247 -1.897 17919 11636 1 29 . 1 1 23 23 ILE H H 23 8.560 8.560 8.937 -0.377 17919 11637 1 29 . 1 1 24 24 GLU N N 24 120.830 120.830 120.082 0.748 17919 11638 1 29 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.876 0.041 17919 11639 1 29 . 1 1 24 24 GLU C C 24 178.640 178.640 178.971 -0.331 17919 11640 1 29 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.927 0.293 17919 11641 1 29 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.343 -1.062 17919 11642 1 29 . 1 1 24 24 GLU H H 24 9.760 9.760 8.343 1.417 17919 11643 1 29 . 1 1 25 25 ASN N N 25 120.570 120.570 117.515 3.055 17919 11644 1 29 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.553 -0.028 17919 11645 1 29 . 1 1 25 25 ASN C C 25 178.380 178.380 178.206 0.174 17919 11646 1 29 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.900 0.160 17919 11647 1 29 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.685 -0.235 17919 11648 1 29 . 1 1 25 25 ASN H H 25 7.920 7.920 7.751 0.169 17919 11649 1 29 . 1 1 26 26 VAL N N 26 121.710 121.710 122.163 -0.453 17919 11650 1 29 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.673 -0.276 17919 11651 1 29 . 1 1 26 26 VAL C C 26 177.950 177.950 177.014 0.936 17919 11652 1 29 . 1 1 26 26 VAL CA C 26 67.660 67.660 65.793 1.867 17919 11653 1 29 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.826 -0.986 17919 11654 1 29 . 1 1 26 26 VAL H H 26 8.070 8.070 7.849 0.221 17919 11655 1 29 . 1 1 27 27 LYS N N 27 118.860 118.860 120.191 -1.331 17919 11656 1 29 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.006 0.574 17919 11657 1 29 . 1 1 27 27 LYS C C 27 180.550 180.550 178.487 2.063 17919 11658 1 29 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.727 -0.477 17919 11659 1 29 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.418 1.312 17919 11660 1 29 . 1 1 27 27 LYS H H 27 8.560 8.560 8.547 0.013 17919 11661 1 29 . 1 1 28 28 ALA N N 28 123.440 123.440 121.471 1.969 17919 11662 1 29 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.030 0.130 17919 11663 1 29 . 1 1 28 28 ALA C C 28 180.300 180.300 179.133 1.167 17919 11664 1 29 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.133 0.237 17919 11665 1 29 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.548 -0.838 17919 11666 1 29 . 1 1 28 28 ALA H H 28 8.060 8.060 7.736 0.324 17919 11667 1 29 . 1 1 29 29 LYS N N 29 119.940 119.940 119.209 0.731 17919 11668 1 29 . 1 1 29 29 LYS HA H 29 4.207 4.207 3.958 0.249 17919 11669 1 29 . 1 1 29 29 LYS C C 29 180.320 180.320 179.189 1.131 17919 11670 1 29 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.400 0.250 17919 11671 1 29 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.060 1.230 17919 11672 1 29 . 1 1 29 29 LYS H H 29 7.850 7.850 7.612 0.238 17919 11673 1 29 . 1 1 30 30 ILE N N 30 121.080 121.080 119.817 1.263 17919 11674 1 29 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.677 -0.170 17919 11675 1 29 . 1 1 30 30 ILE C C 30 178.310 178.310 177.541 0.769 17919 11676 1 29 . 1 1 30 30 ILE CA C 30 66.150 66.150 64.655 1.495 17919 11677 1 29 . 1 1 30 30 ILE CB C 30 36.800 36.800 36.965 -0.165 17919 11678 1 29 . 1 1 30 30 ILE H H 30 8.280 8.280 7.980 0.300 17919 11679 1 29 . 1 1 31 31 GLN N N 31 123.490 123.490 120.761 2.729 17919 11680 1 29 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.096 -0.267 17919 11681 1 29 . 1 1 31 31 GLN C C 31 178.890 178.890 178.170 0.720 17919 11682 1 29 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.130 0.870 17919 11683 1 29 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.604 -0.884 17919 11684 1 29 . 1 1 31 31 GLN H H 31 8.580 8.580 7.874 0.706 17919 11685 1 29 . 1 1 32 32 ASP N N 32 119.360 119.360 119.320 0.040 17919 11686 1 29 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.373 -0.019 17919 11687 1 29 . 1 1 32 32 ASP C C 32 177.250 177.250 178.004 -0.754 17919 11688 1 29 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.898 0.292 17919 11689 1 29 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.809 -0.229 17919 11690 1 29 . 1 1 32 32 ASP H H 32 8.010 8.010 8.142 -0.132 17919 11691 1 29 . 1 1 33 33 LYS N N 33 115.130 115.130 117.611 -2.481 17919 11692 1 29 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.278 0.059 17919 11693 1 29 . 1 1 33 33 LYS C C 33 177.870 177.870 177.978 -0.108 17919 11694 1 29 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.163 -0.113 17919 11695 1 29 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.505 0.665 17919 11696 1 29 . 1 1 33 33 LYS H H 33 7.430 7.430 7.679 -0.249 17919 11697 1 29 . 1 1 34 34 GLU N N 34 113.870 113.870 115.001 -1.131 17919 11698 1 29 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.499 0.126 17919 11699 1 29 . 1 1 34 34 GLU C C 34 177.840 177.840 177.027 0.813 17919 11700 1 29 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.905 -0.735 17919 11701 1 29 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.715 0.945 17919 11702 1 29 . 1 1 34 34 GLU H H 34 8.740 8.740 7.924 0.816 17919 11703 1 29 . 1 1 35 35 GLY N N 35 108.650 108.650 109.373 -0.723 17919 11704 1 29 . 1 1 35 35 GLY C C 35 173.960 173.960 174.670 -0.710 17919 11705 1 29 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.837 0.243 17919 11706 1 29 . 1 1 35 35 GLY H H 35 8.530 8.530 7.878 0.652 17919 11707 1 29 . 1 1 36 36 ILE N N 36 119.880 119.880 116.152 3.728 17919 11708 1 29 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.495 -0.050 17919 11709 1 29 . 1 1 36 36 ILE C C 36 173.590 173.590 174.095 -0.505 17919 11710 1 29 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.878 -0.128 17919 11711 1 29 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.469 2.111 17919 11712 1 29 . 1 1 36 36 ILE H H 36 6.150 6.150 7.482 -1.333 17919 11713 1 29 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.834 -0.200 17919 11714 1 29 . 1 1 37 37 PRO C C 37 176.940 176.940 176.404 0.536 17919 11715 1 29 . 1 1 37 37 PRO CA C 37 61.660 61.660 60.988 0.672 17919 11716 1 29 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.052 0.798 17919 11717 1 29 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.070 0.047 17919 11718 1 29 . 1 1 38 38 PRO C C 38 178.320 178.320 177.734 0.586 17919 11719 1 29 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.705 0.555 17919 11720 1 29 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.589 1.301 17919 11721 1 29 . 1 1 39 39 ASP N N 39 113.380 113.380 116.086 -2.706 17919 11722 1 29 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.372 0.058 17919 11723 1 29 . 1 1 39 39 ASP C C 39 177.090 177.090 177.138 -0.048 17919 11724 1 29 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.337 -0.697 17919 11725 1 29 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.230 -0.690 17919 11726 1 29 . 1 1 39 39 ASP H H 39 8.550 8.550 8.516 0.034 17919 11727 1 29 . 1 1 40 40 GLN N N 40 116.780 116.780 116.769 0.011 17919 11728 1 29 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.366 0.098 17919 11729 1 29 . 1 1 40 40 GLN C C 40 175.380 175.380 176.235 -0.855 17919 11730 1 29 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.971 -0.332 17919 11731 1 29 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.175 0.965 17919 11732 1 29 . 1 1 40 40 GLN H H 40 7.820 7.820 7.759 0.061 17919 11733 1 29 . 1 1 41 41 GLN N N 41 117.720 117.720 118.115 -0.395 17919 11734 1 29 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.388 -0.144 17919 11735 1 29 . 1 1 41 41 GLN C C 41 176.300 176.300 175.654 0.646 17919 11736 1 29 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.859 0.611 17919 11737 1 29 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.884 1.766 17919 11738 1 29 . 1 1 41 41 GLN H H 41 7.480 7.480 7.276 0.204 17919 11739 1 29 . 1 1 42 42 ARG N N 42 122.680 122.680 123.166 -0.486 17919 11740 1 29 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.621 -0.121 17919 11741 1 29 . 1 1 42 42 ARG C C 42 174.050 174.050 173.909 0.141 17919 11742 1 29 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.091 -0.041 17919 11743 1 29 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.816 -1.065 17919 11744 1 29 . 1 1 42 42 ARG H H 42 8.530 8.530 8.021 0.509 17919 11745 1 29 . 1 1 43 43 LEU N N 43 124.040 124.040 127.746 -3.706 17919 11746 1 29 . 1 1 43 43 LEU C C 43 175.290 175.290 176.042 -0.752 17919 11747 1 29 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.964 -0.984 17919 11748 1 29 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.554 2.236 17919 11749 1 29 . 1 1 43 43 LEU H H 43 8.820 8.820 8.672 0.148 17919 11750 1 29 . 1 1 44 44 ILE N N 44 121.920 121.920 121.265 0.655 17919 11751 1 29 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.086 -0.094 17919 11752 1 29 . 1 1 44 44 ILE C C 44 176.060 176.060 174.433 1.627 17919 11753 1 29 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.028 -1.048 17919 11754 1 29 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.900 -0.480 17919 11755 1 29 . 1 1 44 44 ILE H H 44 9.030 9.030 8.680 0.350 17919 11756 1 29 . 1 1 45 45 PHE N N 45 125.390 125.390 127.613 -2.223 17919 11757 1 29 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.024 0.021 17919 11758 1 29 . 1 1 45 45 PHE C C 45 174.470 174.470 174.575 -0.105 17919 11759 1 29 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.221 0.799 17919 11760 1 29 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.982 0.778 17919 11761 1 29 . 1 1 45 45 PHE H H 45 8.830 8.830 8.498 0.332 17919 11762 1 29 . 1 1 46 46 ALA N N 46 132.200 132.200 129.690 2.510 17919 11763 1 29 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.800 -0.110 17919 11764 1 29 . 1 1 46 46 ALA C C 46 177.290 177.290 178.178 -0.888 17919 11765 1 29 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.279 0.261 17919 11766 1 29 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.943 -0.373 17919 11767 1 29 . 1 1 46 46 ALA H H 46 8.810 8.810 8.848 -0.038 17919 11768 1 29 . 1 1 47 47 GLY N N 47 102.340 102.340 105.017 -2.677 17919 11769 1 29 . 1 1 47 47 GLY C C 47 173.810 173.810 174.306 -0.496 17919 11770 1 29 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.308 0.042 17919 11771 1 29 . 1 1 47 47 GLY H H 47 8.130 8.130 8.598 -0.468 17919 11772 1 29 . 1 1 48 48 LYS N N 48 121.570 121.570 121.016 0.554 17919 11773 1 29 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.658 -0.036 17919 11774 1 29 . 1 1 48 48 LYS C C 48 174.700 174.700 175.751 -1.051 17919 11775 1 29 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.850 -0.300 17919 11776 1 29 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.847 -0.317 17919 11777 1 29 . 1 1 48 48 LYS H H 48 7.980 7.980 8.044 -0.064 17919 11778 1 29 . 1 1 49 49 GLN N N 49 122.410 122.410 120.942 1.468 17919 11779 1 29 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.458 0.102 17919 11780 1 29 . 1 1 49 49 GLN C C 49 175.670 175.670 176.291 -0.621 17919 11781 1 29 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.569 -0.829 17919 11782 1 29 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.482 -0.482 17919 11783 1 29 . 1 1 49 49 GLN H H 49 8.600 8.600 8.546 0.054 17919 11784 1 29 . 1 1 50 50 LEU N N 50 125.520 125.520 124.500 1.020 17919 11785 1 29 . 1 1 50 50 LEU HA H 50 4.090 4.090 3.926 0.164 17919 11786 1 29 . 1 1 50 50 LEU C C 50 176.660 176.660 176.368 0.292 17919 11787 1 29 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.894 0.346 17919 11788 1 29 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.245 0.325 17919 11789 1 29 . 1 1 50 50 LEU H H 50 8.530 8.530 8.125 0.405 17919 11790 1 29 . 1 1 51 51 GLU N N 51 122.940 122.940 125.345 -2.405 17919 11791 1 29 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.201 0.287 17919 11792 1 29 . 1 1 51 51 GLU C C 51 175.870 175.870 177.675 -1.805 17919 11793 1 29 . 1 1 51 51 GLU CA C 51 55.960 55.960 57.374 -1.414 17919 11794 1 29 . 1 1 51 51 GLU CB C 51 31.570 31.570 30.017 1.553 17919 11795 1 29 . 1 1 51 51 GLU H H 51 8.400 8.400 8.228 0.172 17919 11796 1 29 . 1 1 52 52 ASP N N 52 120.030 120.030 125.543 -5.513 17919 11797 1 29 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.402 -0.043 17919 11798 1 29 . 1 1 52 52 ASP C C 52 177.330 177.330 177.980 -0.650 17919 11799 1 29 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.655 -0.695 17919 11800 1 29 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.888 -0.038 17919 11801 1 29 . 1 1 52 52 ASP H H 52 8.160 8.160 8.809 -0.649 17919 11802 1 29 . 1 1 53 53 GLY N N 53 106.660 106.660 104.233 2.427 17919 11803 1 29 . 1 1 53 53 GLY C C 53 174.870 174.870 174.179 0.691 17919 11804 1 29 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.553 0.617 17919 11805 1 29 . 1 1 53 53 GLY H H 53 9.390 9.390 8.382 1.008 17919 11806 1 29 . 1 1 54 54 ARG N N 54 119.050 119.050 120.373 -1.323 17919 11807 1 29 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.557 0.138 17919 11808 1 29 . 1 1 54 54 ARG C C 54 175.350 175.350 176.009 -0.659 17919 11809 1 29 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.992 -0.602 17919 11810 1 29 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.308 0.342 17919 11811 1 29 . 1 1 54 54 ARG H H 54 7.460 7.460 7.469 -0.009 17919 11812 1 29 . 1 1 55 55 THR N N 55 108.400 108.400 113.443 -5.043 17919 11813 1 29 . 1 1 55 55 THR HA H 55 5.240 5.240 4.672 0.568 17919 11814 1 29 . 1 1 55 55 THR C C 55 176.560 176.560 175.903 0.657 17919 11815 1 29 . 1 1 55 55 THR CA C 55 59.690 59.690 61.740 -2.050 17919 11816 1 29 . 1 1 55 55 THR CB C 55 72.260 72.260 70.098 2.162 17919 11817 1 29 . 1 1 55 55 THR H H 55 8.730 8.730 8.210 0.520 17919 11818 1 29 . 1 1 56 56 LEU N N 56 117.920 117.920 124.017 -6.097 17919 11819 1 29 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.876 0.184 17919 11820 1 29 . 1 1 56 56 LEU C C 56 180.810 180.810 178.893 1.917 17919 11821 1 29 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.809 -0.099 17919 11822 1 29 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.465 -1.095 17919 11823 1 29 . 1 1 56 56 LEU H H 56 8.140 8.140 8.160 -0.020 17919 11824 1 29 . 1 1 57 57 SER N N 57 113.330 113.330 114.156 -0.826 17919 11825 1 29 . 1 1 57 57 SER HA H 57 4.370 4.370 3.954 0.416 17919 11826 1 29 . 1 1 57 57 SER C C 57 178.310 178.310 175.810 2.500 17919 11827 1 29 . 1 1 57 57 SER CA C 57 61.080 61.080 61.345 -0.265 17919 11828 1 29 . 1 1 57 57 SER CB C 57 62.530 62.530 62.716 -0.186 17919 11829 1 29 . 1 1 57 57 SER H H 57 8.470 8.470 7.677 0.793 17919 11830 1 29 . 1 1 58 58 ASP N N 58 124.190 124.190 119.239 4.951 17919 11831 1 29 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.314 -0.018 17919 11832 1 29 . 1 1 58 58 ASP C C 58 177.400 177.400 176.983 0.417 17919 11833 1 29 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.492 0.688 17919 11834 1 29 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.760 -0.660 17919 11835 1 29 . 1 1 58 58 ASP H H 58 7.930 7.930 7.777 0.153 17919 11836 1 29 . 1 1 59 59 TYR N N 59 115.510 115.510 114.217 1.293 17919 11837 1 29 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.566 0.104 17919 11838 1 29 . 1 1 59 59 TYR C C 59 174.700 174.700 174.645 0.055 17919 11839 1 29 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.252 0.998 17919 11840 1 29 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.621 1.449 17919 11841 1 29 . 1 1 59 59 TYR H H 59 7.250 7.250 7.272 -0.022 17919 11842 1 29 . 1 1 60 60 ASN N N 60 115.900 115.900 117.515 -1.615 17919 11843 1 29 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.351 0.004 17919 11844 1 29 . 1 1 60 60 ASN C C 60 174.340 174.340 174.314 0.026 17919 11845 1 29 . 1 1 60 60 ASN CA C 60 54.120 54.120 53.692 0.428 17919 11846 1 29 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.140 0.270 17919 11847 1 29 . 1 1 60 60 ASN H H 60 8.150 8.150 7.465 0.685 17919 11848 1 29 . 1 1 61 61 ILE N N 61 118.600 118.600 120.221 -1.621 17919 11849 1 29 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.766 -0.373 17919 11850 1 29 . 1 1 61 61 ILE C C 61 174.610 174.610 175.595 -0.985 17919 11851 1 29 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.603 0.817 17919 11852 1 29 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.946 -1.206 17919 11853 1 29 . 1 1 61 61 ILE H H 61 7.250 7.250 7.836 -0.586 17919 11854 1 29 . 1 1 62 62 GLN N N 62 124.740 124.740 125.618 -0.878 17919 11855 1 29 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.609 -0.103 17919 11856 1 29 . 1 1 62 62 GLN C C 62 175.970 175.970 175.579 0.391 17919 11857 1 29 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.745 -0.085 17919 11858 1 29 . 1 1 62 62 GLN CB C 62 31.650 31.650 32.201 -0.551 17919 11859 1 29 . 1 1 62 62 GLN H H 62 7.610 7.610 8.079 -0.469 17919 11860 1 29 . 1 1 63 63 LYS N N 63 120.300 120.300 123.823 -3.523 17919 11861 1 29 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.809 0.192 17919 11862 1 29 . 1 1 63 63 LYS C C 63 175.810 175.810 176.774 -0.964 17919 11863 1 29 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.323 -0.533 17919 11864 1 29 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.054 0.596 17919 11865 1 29 . 1 1 63 63 LYS H H 63 8.490 8.490 8.909 -0.419 17919 11866 1 29 . 1 1 64 64 GLU N N 64 113.950 113.950 119.548 -5.598 17919 11867 1 29 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.825 -0.360 17919 11868 1 29 . 1 1 64 64 GLU C C 64 175.250 175.250 176.007 -0.757 17919 11869 1 29 . 1 1 64 64 GLU CA C 64 57.890 57.890 58.181 -0.291 17919 11870 1 29 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.872 -2.972 17919 11871 1 29 . 1 1 64 64 GLU H H 64 9.280 9.280 9.000 0.280 17919 11872 1 29 . 1 1 65 65 SER N N 65 114.730 114.730 115.207 -0.477 17919 11873 1 29 . 1 1 65 65 SER HA H 65 4.640 4.640 4.523 0.117 17919 11874 1 29 . 1 1 65 65 SER C C 65 172.160 172.160 173.983 -1.823 17919 11875 1 29 . 1 1 65 65 SER CA C 65 60.890 60.890 60.107 0.783 17919 11876 1 29 . 1 1 65 65 SER CB C 65 64.910 64.910 64.553 0.357 17919 11877 1 29 . 1 1 65 65 SER H H 65 7.670 7.670 7.799 -0.129 17919 11878 1 29 . 1 1 66 66 THR N N 66 117.110 117.110 116.079 1.031 17919 11879 1 29 . 1 1 66 66 THR HA H 66 5.270 5.270 5.402 -0.132 17919 11880 1 29 . 1 1 66 66 THR C C 66 173.950 173.950 174.123 -0.173 17919 11881 1 29 . 1 1 66 66 THR CA C 66 62.340 62.340 62.019 0.321 17919 11882 1 29 . 1 1 66 66 THR CB C 66 70.080 70.080 71.283 -1.203 17919 11883 1 29 . 1 1 66 66 THR H H 66 8.730 8.730 8.348 0.382 17919 11884 1 29 . 1 1 67 67 LEU N N 67 127.110 127.110 127.754 -0.644 17919 11885 1 29 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.961 0.099 17919 11886 1 29 . 1 1 67 67 LEU C C 67 175.770 175.770 176.001 -0.231 17919 11887 1 29 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.155 -0.255 17919 11888 1 29 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.642 0.618 17919 11889 1 29 . 1 1 67 67 LEU H H 67 9.410 9.410 9.200 0.210 17919 11890 1 29 . 1 1 68 68 HIS N N 68 118.380 118.380 123.449 -5.069 17919 11891 1 29 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.177 0.063 17919 11892 1 29 . 1 1 68 68 HIS C C 68 173.150 173.150 174.119 -0.969 17919 11893 1 29 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.838 0.162 17919 11894 1 29 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.594 -2.064 17919 11895 1 29 . 1 1 68 68 HIS H H 68 9.230 9.230 9.346 -0.116 17919 11896 1 29 . 1 1 69 69 LEU N N 69 124.460 124.460 126.554 -2.094 17919 11897 1 29 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.808 0.382 17919 11898 1 29 . 1 1 69 69 LEU C C 69 175.270 175.270 173.911 1.359 17919 11899 1 29 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.763 0.127 17919 11900 1 29 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.209 0.171 17919 11901 1 29 . 1 1 69 69 LEU H H 69 8.340 8.340 7.924 0.416 17919 11902 1 29 . 1 1 70 70 VAL N N 70 126.940 126.940 126.465 0.475 17919 11903 1 29 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.188 0.162 17919 11904 1 29 . 1 1 70 70 VAL C C 70 174.000 174.000 174.246 -0.246 17919 11905 1 29 . 1 1 70 70 VAL CA C 70 60.800 60.800 61.608 -0.808 17919 11906 1 29 . 1 1 70 70 VAL CB C 70 34.910 34.910 32.731 2.179 17919 11907 1 29 . 1 1 70 70 VAL H H 70 9.200 9.200 8.074 1.126 17919 11908 1 29 . 1 1 71 71 LEU N N 71 123.130 123.130 128.862 -5.732 17919 11909 1 29 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.542 0.518 17919 11910 1 29 . 1 1 71 71 LEU C C 71 177.830 177.830 176.711 1.119 17919 11911 1 29 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.720 0.220 17919 11912 1 29 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.799 0.051 17919 11913 1 29 . 1 1 71 71 LEU H H 71 8.120 8.120 8.480 -0.360 17919 11914 1 29 . 1 1 72 72 ARG N N 72 123.490 123.490 127.153 -3.663 17919 11915 1 29 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.418 -0.117 17919 11916 1 29 . 1 1 72 72 ARG C C 72 175.350 175.350 175.019 0.331 17919 11917 1 29 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.245 -0.635 17919 11918 1 29 . 1 1 72 72 ARG CB C 72 31.350 31.350 31.389 -0.039 17919 11919 1 29 . 1 1 72 72 ARG H H 72 8.580 8.580 8.261 0.319 17919 11920 1 30 . 1 1 2 2 GLN N N 2 123.220 123.220 119.970 3.250 17919 11921 1 30 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.426 -0.177 17919 11922 1 30 . 1 1 2 2 GLN C C 2 175.920 175.920 175.394 0.526 17919 11923 1 30 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.597 0.483 17919 11924 1 30 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.983 -0.223 17919 11925 1 30 . 1 1 2 2 GLN H H 2 8.900 8.900 8.464 0.436 17919 11926 1 30 . 1 1 3 3 ILE N N 3 115.340 115.340 114.806 0.534 17919 11927 1 30 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.176 0.037 17919 11928 1 30 . 1 1 3 3 ILE C C 3 172.450 172.450 173.445 -0.995 17919 11929 1 30 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.721 -0.151 17919 11930 1 30 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.371 0.839 17919 11931 1 30 . 1 1 3 3 ILE H H 3 8.320 8.320 8.782 -0.462 17919 11932 1 30 . 1 1 4 4 PHE N N 4 118.110 118.110 122.030 -3.920 17919 11933 1 30 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.431 0.199 17919 11934 1 30 . 1 1 4 4 PHE C C 4 175.320 175.320 175.366 -0.046 17919 11935 1 30 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.138 0.072 17919 11936 1 30 . 1 1 4 4 PHE CB C 4 41.480 41.480 40.746 0.734 17919 11937 1 30 . 1 1 4 4 PHE H H 4 8.610 8.610 7.717 0.893 17919 11938 1 30 . 1 1 5 5 VAL N N 5 121.000 121.000 125.032 -4.032 17919 11939 1 30 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.774 -0.049 17919 11940 1 30 . 1 1 5 5 VAL C C 5 174.870 174.870 175.021 -0.151 17919 11941 1 30 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.505 -0.885 17919 11942 1 30 . 1 1 5 5 VAL CB C 5 34.230 34.230 32.889 1.341 17919 11943 1 30 . 1 1 5 5 VAL H H 5 9.300 9.300 9.209 0.091 17919 11944 1 30 . 1 1 6 6 LYS N N 6 127.520 127.520 129.805 -2.285 17919 11945 1 30 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.218 0.149 17919 11946 1 30 . 1 1 6 6 LYS C C 6 177.140 177.140 176.365 0.775 17919 11947 1 30 . 1 1 6 6 LYS CA C 6 54.520 54.520 53.778 0.742 17919 11948 1 30 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.380 0.670 17919 11949 1 30 . 1 1 6 6 LYS H H 6 8.820 8.820 9.129 -0.309 17919 11950 1 30 . 1 1 7 7 THR N N 7 115.400 115.400 119.038 -3.638 17919 11951 1 30 . 1 1 7 7 THR HA H 7 4.970 4.970 4.601 0.369 17919 11952 1 30 . 1 1 7 7 THR C C 7 176.910 176.910 176.834 0.076 17919 11953 1 30 . 1 1 7 7 THR CA C 7 60.470 60.470 61.003 -0.533 17919 11954 1 30 . 1 1 7 7 THR CB C 7 70.630 70.630 70.030 0.600 17919 11955 1 30 . 1 1 7 7 THR H H 7 8.730 8.730 8.898 -0.168 17919 11956 1 30 . 1 1 8 8 LEU N N 8 121.330 121.330 122.372 -1.042 17919 11957 1 30 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.389 -0.079 17919 11958 1 30 . 1 1 8 8 LEU C C 8 178.800 178.800 177.203 1.597 17919 11959 1 30 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.422 0.159 17919 11960 1 30 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.109 0.861 17919 11961 1 30 . 1 1 8 8 LEU H H 8 9.100 9.100 8.473 0.627 17919 11962 1 30 . 1 1 9 9 THR N N 9 105.590 105.590 109.255 -3.665 17919 11963 1 30 . 1 1 9 9 THR HA H 9 4.428 4.428 4.278 0.150 17919 11964 1 30 . 1 1 9 9 THR C C 9 175.520 175.520 175.734 -0.214 17919 11965 1 30 . 1 1 9 9 THR CA C 9 61.400 61.400 62.417 -1.017 17919 11966 1 30 . 1 1 9 9 THR CB C 9 69.140 69.140 69.408 -0.268 17919 11967 1 30 . 1 1 9 9 THR H H 9 7.630 7.630 7.554 0.076 17919 11968 1 30 . 1 1 10 10 GLY N N 10 108.890 108.890 111.447 -2.557 17919 11969 1 30 . 1 1 10 10 GLY C C 10 174.070 174.070 173.269 0.801 17919 11970 1 30 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.689 0.771 17919 11971 1 30 . 1 1 10 10 GLY H H 10 7.810 7.810 8.353 -0.543 17919 11972 1 30 . 1 1 11 11 LYS N N 11 121.600 121.600 122.869 -1.269 17919 11973 1 30 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.392 -0.031 17919 11974 1 30 . 1 1 11 11 LYS C C 11 175.940 175.940 176.157 -0.217 17919 11975 1 30 . 1 1 11 11 LYS CA C 11 56.280 56.280 55.720 0.560 17919 11976 1 30 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.048 0.152 17919 11977 1 30 . 1 1 11 11 LYS H H 11 7.280 7.280 7.769 -0.489 17919 11978 1 30 . 1 1 12 12 THR N N 12 120.440 120.440 121.228 -0.788 17919 11979 1 30 . 1 1 12 12 THR HA H 12 5.046 5.046 4.113 0.933 17919 11980 1 30 . 1 1 12 12 THR C C 12 174.320 174.320 174.327 -0.007 17919 11981 1 30 . 1 1 12 12 THR CA C 12 62.390 62.390 64.227 -1.837 17919 11982 1 30 . 1 1 12 12 THR CB C 12 69.910 69.910 69.381 0.529 17919 11983 1 30 . 1 1 12 12 THR H H 12 8.650 8.650 8.430 0.220 17919 11984 1 30 . 1 1 13 13 ILE N N 13 127.110 127.110 125.653 1.457 17919 11985 1 30 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.585 -0.041 17919 11986 1 30 . 1 1 13 13 ILE C C 13 175.220 175.220 175.006 0.214 17919 11987 1 30 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.000 -0.020 17919 11988 1 30 . 1 1 13 13 ILE CB C 13 40.950 40.950 42.267 -1.317 17919 11989 1 30 . 1 1 13 13 ILE H H 13 9.450 9.450 8.956 0.494 17919 11990 1 30 . 1 1 14 14 THR N N 14 121.520 121.520 123.189 -1.669 17919 11991 1 30 . 1 1 14 14 THR HA H 14 4.964 4.964 5.213 -0.249 17919 11992 1 30 . 1 1 14 14 THR C C 14 173.790 173.790 174.079 -0.289 17919 11993 1 30 . 1 1 14 14 THR CA C 14 61.940 61.940 61.827 0.113 17919 11994 1 30 . 1 1 14 14 THR CB C 14 69.650 69.650 69.759 -0.109 17919 11995 1 30 . 1 1 14 14 THR H H 14 8.710 8.710 8.364 0.346 17919 11996 1 30 . 1 1 15 15 LEU N N 15 124.800 124.800 127.416 -2.616 17919 11997 1 30 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.720 0.060 17919 11998 1 30 . 1 1 15 15 LEU C C 15 174.670 174.670 175.560 -0.890 17919 11999 1 30 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.512 -0.682 17919 12000 1 30 . 1 1 15 15 LEU CB C 15 47.070 47.070 44.911 2.159 17919 12001 1 30 . 1 1 15 15 LEU H H 15 8.710 8.710 8.831 -0.121 17919 12002 1 30 . 1 1 16 16 GLU N N 16 122.160 122.160 124.021 -1.861 17919 12003 1 30 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.828 0.089 17919 12004 1 30 . 1 1 16 16 GLU C C 16 175.860 175.860 175.799 0.061 17919 12005 1 30 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.895 -1.075 17919 12006 1 30 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.084 -0.634 17919 12007 1 30 . 1 1 16 16 GLU H H 16 8.140 8.140 8.685 -0.545 17919 12008 1 30 . 1 1 17 17 VAL N N 17 117.210 117.210 118.406 -1.196 17919 12009 1 30 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.713 0.001 17919 12010 1 30 . 1 1 17 17 VAL C C 17 174.160 174.160 174.738 -0.578 17919 12011 1 30 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.503 -0.073 17919 12012 1 30 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.032 1.368 17919 12013 1 30 . 1 1 17 17 VAL H H 17 8.900 8.900 8.940 -0.040 17919 12014 1 30 . 1 1 18 18 GLU N N 18 118.990 118.990 120.311 -1.321 17919 12015 1 30 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.878 0.202 17919 12016 1 30 . 1 1 18 18 GLU C C 18 176.160 176.160 175.329 0.831 17919 12017 1 30 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.529 0.191 17919 12018 1 30 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.041 0.269 17919 12019 1 30 . 1 1 18 18 GLU H H 18 8.640 8.640 8.297 0.343 17919 12020 1 30 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.310 -0.169 17919 12021 1 30 . 1 1 19 19 PRO C C 19 175.310 175.310 177.780 -2.470 17919 12022 1 30 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.201 0.269 17919 12023 1 30 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.971 -0.021 17919 12024 1 30 . 1 1 20 20 SER N N 20 103.400 103.400 110.847 -7.447 17919 12025 1 30 . 1 1 20 20 SER HA H 20 4.370 4.370 4.302 0.068 17919 12026 1 30 . 1 1 20 20 SER C C 20 174.660 174.660 174.540 0.120 17919 12027 1 30 . 1 1 20 20 SER CA C 20 57.400 57.400 60.078 -2.678 17919 12028 1 30 . 1 1 20 20 SER CB C 20 63.370 63.370 62.898 0.472 17919 12029 1 30 . 1 1 20 20 SER H H 20 7.040 7.040 7.988 -0.948 17919 12030 1 30 . 1 1 21 21 ASP N N 21 123.480 123.480 122.547 0.933 17919 12031 1 30 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.721 -0.026 17919 12032 1 30 . 1 1 21 21 ASP C C 21 176.360 176.360 175.509 0.851 17919 12033 1 30 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.954 0.746 17919 12034 1 30 . 1 1 21 21 ASP CB C 21 40.800 40.800 42.031 -1.231 17919 12035 1 30 . 1 1 21 21 ASP H H 21 8.030 8.030 7.618 0.412 17919 12036 1 30 . 1 1 22 22 THR N N 22 108.800 108.800 112.325 -3.525 17919 12037 1 30 . 1 1 22 22 THR HA H 22 4.920 4.920 4.533 0.387 17919 12038 1 30 . 1 1 22 22 THR C C 22 176.750 176.750 175.620 1.130 17919 12039 1 30 . 1 1 22 22 THR CA C 22 59.690 59.690 60.882 -1.192 17919 12040 1 30 . 1 1 22 22 THR CB C 22 71.200 71.200 70.936 0.264 17919 12041 1 30 . 1 1 22 22 THR H H 22 7.900 7.900 8.123 -0.223 17919 12042 1 30 . 1 1 23 23 ILE N N 23 121.190 121.190 122.047 -0.857 17919 12043 1 30 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.796 -0.139 17919 12044 1 30 . 1 1 23 23 ILE C C 23 179.040 179.040 177.765 1.275 17919 12045 1 30 . 1 1 23 23 ILE CA C 23 62.260 62.260 61.377 0.883 17919 12046 1 30 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.360 -2.010 17919 12047 1 30 . 1 1 23 23 ILE H H 23 8.560 8.560 8.958 -0.398 17919 12048 1 30 . 1 1 24 24 GLU N N 24 120.830 120.830 120.222 0.608 17919 12049 1 30 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.824 0.093 17919 12050 1 30 . 1 1 24 24 GLU C C 24 178.640 178.640 178.653 -0.013 17919 12051 1 30 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.154 0.066 17919 12052 1 30 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.413 -1.133 17919 12053 1 30 . 1 1 24 24 GLU H H 24 9.760 9.760 8.753 1.007 17919 12054 1 30 . 1 1 25 25 ASN N N 25 120.570 120.570 117.722 2.848 17919 12055 1 30 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.520 0.005 17919 12056 1 30 . 1 1 25 25 ASN C C 25 178.380 178.380 177.938 0.442 17919 12057 1 30 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.868 0.192 17919 12058 1 30 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.087 0.363 17919 12059 1 30 . 1 1 25 25 ASN H H 25 7.920 7.920 7.530 0.390 17919 12060 1 30 . 1 1 26 26 VAL N N 26 121.710 121.710 119.827 1.883 17919 12061 1 30 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.618 -0.221 17919 12062 1 30 . 1 1 26 26 VAL C C 26 177.950 177.950 178.069 -0.119 17919 12063 1 30 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.010 1.650 17919 12064 1 30 . 1 1 26 26 VAL CB C 26 30.840 30.840 30.783 0.057 17919 12065 1 30 . 1 1 26 26 VAL H H 26 8.070 8.070 7.714 0.356 17919 12066 1 30 . 1 1 27 27 LYS N N 27 118.860 118.860 119.863 -1.003 17919 12067 1 30 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.046 0.534 17919 12068 1 30 . 1 1 27 27 LYS C C 27 180.550 180.550 179.016 1.534 17919 12069 1 30 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.802 -0.552 17919 12070 1 30 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.196 1.534 17919 12071 1 30 . 1 1 27 27 LYS H H 27 8.560 8.560 8.206 0.354 17919 12072 1 30 . 1 1 28 28 ALA N N 28 123.440 123.440 122.404 1.036 17919 12073 1 30 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.005 0.155 17919 12074 1 30 . 1 1 28 28 ALA C C 28 180.300 180.300 179.117 1.183 17919 12075 1 30 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.435 -0.065 17919 12076 1 30 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.336 -0.626 17919 12077 1 30 . 1 1 28 28 ALA H H 28 8.060 8.060 8.004 0.056 17919 12078 1 30 . 1 1 29 29 LYS N N 29 119.940 119.940 118.207 1.733 17919 12079 1 30 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.113 0.094 17919 12080 1 30 . 1 1 29 29 LYS C C 29 180.320 180.320 178.742 1.578 17919 12081 1 30 . 1 1 29 29 LYS CA C 29 59.650 59.650 58.949 0.702 17919 12082 1 30 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.300 0.990 17919 12083 1 30 . 1 1 29 29 LYS H H 29 7.850 7.850 7.490 0.360 17919 12084 1 30 . 1 1 30 30 ILE N N 30 121.080 121.080 120.660 0.420 17919 12085 1 30 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.743 -0.236 17919 12086 1 30 . 1 1 30 30 ILE C C 30 178.310 178.310 177.002 1.308 17919 12087 1 30 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.027 1.123 17919 12088 1 30 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.946 -1.146 17919 12089 1 30 . 1 1 30 30 ILE H H 30 8.280 8.280 7.788 0.492 17919 12090 1 30 . 1 1 31 31 GLN N N 31 123.490 123.490 120.665 2.825 17919 12091 1 30 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.851 -0.022 17919 12092 1 30 . 1 1 31 31 GLN C C 31 178.890 178.890 178.367 0.523 17919 12093 1 30 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.435 0.565 17919 12094 1 30 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.467 -0.747 17919 12095 1 30 . 1 1 31 31 GLN H H 31 8.580 8.580 8.583 -0.003 17919 12096 1 30 . 1 1 32 32 ASP N N 32 119.360 119.360 118.873 0.487 17919 12097 1 30 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.419 -0.065 17919 12098 1 30 . 1 1 32 32 ASP C C 32 177.250 177.250 177.669 -0.419 17919 12099 1 30 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.612 0.578 17919 12100 1 30 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.770 -0.190 17919 12101 1 30 . 1 1 32 32 ASP H H 32 8.010 8.010 8.329 -0.319 17919 12102 1 30 . 1 1 33 33 LYS N N 33 115.130 115.130 116.242 -1.112 17919 12103 1 30 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.480 -0.143 17919 12104 1 30 . 1 1 33 33 LYS C C 33 177.870 177.870 177.656 0.214 17919 12105 1 30 . 1 1 33 33 LYS CA C 33 58.050 58.050 56.985 1.065 17919 12106 1 30 . 1 1 33 33 LYS CB C 33 34.170 34.170 34.902 -0.732 17919 12107 1 30 . 1 1 33 33 LYS H H 33 7.430 7.430 7.536 -0.106 17919 12108 1 30 . 1 1 34 34 GLU N N 34 113.870 113.870 116.487 -2.617 17919 12109 1 30 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.448 0.177 17919 12110 1 30 . 1 1 34 34 GLU C C 34 177.840 177.840 177.469 0.371 17919 12111 1 30 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.758 -0.588 17919 12112 1 30 . 1 1 34 34 GLU CB C 34 32.660 32.660 30.747 1.913 17919 12113 1 30 . 1 1 34 34 GLU H H 34 8.740 8.740 8.259 0.481 17919 12114 1 30 . 1 1 35 35 GLY N N 35 108.650 108.650 109.757 -1.107 17919 12115 1 30 . 1 1 35 35 GLY C C 35 173.960 173.960 174.324 -0.364 17919 12116 1 30 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.977 0.103 17919 12117 1 30 . 1 1 35 35 GLY H H 35 8.530 8.530 8.352 0.178 17919 12118 1 30 . 1 1 36 36 ILE N N 36 119.880 119.880 122.133 -2.253 17919 12119 1 30 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.269 0.176 17919 12120 1 30 . 1 1 36 36 ILE C C 36 173.590 173.590 174.549 -0.959 17919 12121 1 30 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.058 -0.308 17919 12122 1 30 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.430 2.150 17919 12123 1 30 . 1 1 36 36 ILE H H 36 6.150 6.150 7.570 -1.420 17919 12124 1 30 . 1 1 37 37 PRO HA H 37 4.634 4.634 5.073 -0.439 17919 12125 1 30 . 1 1 37 37 PRO C C 37 176.940 176.940 175.938 1.002 17919 12126 1 30 . 1 1 37 37 PRO CA C 37 61.660 61.660 60.688 0.973 17919 12127 1 30 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.598 0.252 17919 12128 1 30 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.269 -0.152 17919 12129 1 30 . 1 1 38 38 PRO C C 38 178.320 178.320 177.278 1.042 17919 12130 1 30 . 1 1 38 38 PRO CA C 38 66.260 66.260 64.858 1.402 17919 12131 1 30 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.742 1.148 17919 12132 1 30 . 1 1 39 39 ASP N N 39 113.380 113.380 117.236 -3.856 17919 12133 1 30 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.229 0.201 17919 12134 1 30 . 1 1 39 39 ASP C C 39 177.090 177.090 178.070 -0.980 17919 12135 1 30 . 1 1 39 39 ASP CA C 39 55.640 55.640 57.196 -1.556 17919 12136 1 30 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.578 -1.038 17919 12137 1 30 . 1 1 39 39 ASP H H 39 8.550 8.550 8.375 0.175 17919 12138 1 30 . 1 1 40 40 GLN N N 40 116.780 116.780 117.138 -0.358 17919 12139 1 30 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.264 0.200 17919 12140 1 30 . 1 1 40 40 GLN C C 40 175.380 175.380 176.466 -1.086 17919 12141 1 30 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.844 -1.204 17919 12142 1 30 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.450 0.690 17919 12143 1 30 . 1 1 40 40 GLN H H 40 7.820 7.820 8.348 -0.528 17919 12144 1 30 . 1 1 41 41 GLN N N 41 117.720 117.720 117.891 -0.171 17919 12145 1 30 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.753 -0.509 17919 12146 1 30 . 1 1 41 41 GLN C C 41 176.300 176.300 175.329 0.971 17919 12147 1 30 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.221 1.249 17919 12148 1 30 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.618 2.032 17919 12149 1 30 . 1 1 41 41 GLN H H 41 7.480 7.480 7.390 0.090 17919 12150 1 30 . 1 1 42 42 ARG N N 42 122.680 122.680 122.583 0.097 17919 12151 1 30 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.623 -0.123 17919 12152 1 30 . 1 1 42 42 ARG C C 42 174.050 174.050 174.952 -0.902 17919 12153 1 30 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.979 0.071 17919 12154 1 30 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.377 -1.627 17919 12155 1 30 . 1 1 42 42 ARG H H 42 8.530 8.530 9.181 -0.651 17919 12156 1 30 . 1 1 43 43 LEU N N 43 124.040 124.040 123.064 0.976 17919 12157 1 30 . 1 1 43 43 LEU C C 43 175.290 175.290 175.699 -0.409 17919 12158 1 30 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.784 -0.804 17919 12159 1 30 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.456 1.334 17919 12160 1 30 . 1 1 43 43 LEU H H 43 8.820 8.820 8.748 0.072 17919 12161 1 30 . 1 1 44 44 ILE N N 44 121.920 121.920 122.448 -0.528 17919 12162 1 30 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.037 -0.045 17919 12163 1 30 . 1 1 44 44 ILE C C 44 176.060 176.060 174.340 1.720 17919 12164 1 30 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.053 -1.073 17919 12165 1 30 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.052 0.368 17919 12166 1 30 . 1 1 44 44 ILE H H 44 9.030 9.030 8.446 0.584 17919 12167 1 30 . 1 1 45 45 PHE N N 45 125.390 125.390 128.023 -2.633 17919 12168 1 30 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.083 -0.038 17919 12169 1 30 . 1 1 45 45 PHE C C 45 174.470 174.470 174.835 -0.365 17919 12170 1 30 . 1 1 45 45 PHE CA C 45 57.020 57.020 55.617 1.403 17919 12171 1 30 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.387 1.373 17919 12172 1 30 . 1 1 45 45 PHE H H 45 8.830 8.830 8.908 -0.078 17919 12173 1 30 . 1 1 46 46 ALA N N 46 132.200 132.200 130.179 2.021 17919 12174 1 30 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.709 -0.019 17919 12175 1 30 . 1 1 46 46 ALA C C 46 177.290 177.290 177.181 0.109 17919 12176 1 30 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.615 -0.075 17919 12177 1 30 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.226 0.344 17919 12178 1 30 . 1 1 46 46 ALA H H 46 8.810 8.810 8.906 -0.096 17919 12179 1 30 . 1 1 47 47 GLY N N 47 102.340 102.340 102.959 -0.619 17919 12180 1 30 . 1 1 47 47 GLY C C 47 173.810 173.810 174.139 -0.329 17919 12181 1 30 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.019 0.331 17919 12182 1 30 . 1 1 47 47 GLY H H 47 8.130 8.130 8.477 -0.347 17919 12183 1 30 . 1 1 48 48 LYS N N 48 121.570 121.570 122.295 -0.725 17919 12184 1 30 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.537 0.085 17919 12185 1 30 . 1 1 48 48 LYS C C 48 174.700 174.700 175.300 -0.600 17919 12186 1 30 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.940 -0.390 17919 12187 1 30 . 1 1 48 48 LYS CB C 48 34.530 34.530 33.695 0.835 17919 12188 1 30 . 1 1 48 48 LYS H H 48 7.980 7.980 7.460 0.520 17919 12189 1 30 . 1 1 49 49 GLN N N 49 122.410 122.410 125.826 -3.416 17919 12190 1 30 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.466 0.094 17919 12191 1 30 . 1 1 49 49 GLN C C 49 175.670 175.670 175.518 0.152 17919 12192 1 30 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.011 -0.271 17919 12193 1 30 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.446 -0.446 17919 12194 1 30 . 1 1 49 49 GLN H H 49 8.600 8.600 8.712 -0.112 17919 12195 1 30 . 1 1 50 50 LEU N N 50 125.520 125.520 127.872 -2.352 17919 12196 1 30 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.210 -0.120 17919 12197 1 30 . 1 1 50 50 LEU C C 50 176.660 176.660 175.373 1.287 17919 12198 1 30 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.085 0.155 17919 12199 1 30 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.634 -1.064 17919 12200 1 30 . 1 1 50 50 LEU H H 50 8.530 8.530 8.529 0.001 17919 12201 1 30 . 1 1 51 51 GLU N N 51 122.940 122.940 121.026 1.914 17919 12202 1 30 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.566 -0.078 17919 12203 1 30 . 1 1 51 51 GLU C C 51 175.870 175.870 176.529 -0.659 17919 12204 1 30 . 1 1 51 51 GLU CA C 51 55.960 55.960 54.885 1.075 17919 12205 1 30 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.805 -1.235 17919 12206 1 30 . 1 1 51 51 GLU H H 51 8.400 8.400 8.199 0.201 17919 12207 1 30 . 1 1 52 52 ASP N N 52 120.030 120.030 125.930 -5.900 17919 12208 1 30 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.572 -0.213 17919 12209 1 30 . 1 1 52 52 ASP C C 52 177.330 177.330 177.826 -0.496 17919 12210 1 30 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.307 -0.347 17919 12211 1 30 . 1 1 52 52 ASP CB C 52 40.850 40.850 41.018 -0.168 17919 12212 1 30 . 1 1 52 52 ASP H H 52 8.160 8.160 8.839 -0.679 17919 12213 1 30 . 1 1 53 53 GLY N N 53 106.660 106.660 106.897 -0.237 17919 12214 1 30 . 1 1 53 53 GLY C C 53 174.870 174.870 174.689 0.181 17919 12215 1 30 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.324 -0.154 17919 12216 1 30 . 1 1 53 53 GLY H H 53 9.390 9.390 8.377 1.013 17919 12217 1 30 . 1 1 54 54 ARG N N 54 119.050 119.050 121.356 -2.306 17919 12218 1 30 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.493 0.202 17919 12219 1 30 . 1 1 54 54 ARG C C 54 175.350 175.350 175.827 -0.477 17919 12220 1 30 . 1 1 54 54 ARG CA C 54 54.390 54.390 55.294 -0.904 17919 12221 1 30 . 1 1 54 54 ARG CB C 54 32.650 32.650 31.112 1.538 17919 12222 1 30 . 1 1 54 54 ARG H H 54 7.460 7.460 7.472 -0.012 17919 12223 1 30 . 1 1 55 55 THR N N 55 108.400 108.400 115.238 -6.838 17919 12224 1 30 . 1 1 55 55 THR HA H 55 5.240 5.240 5.082 0.158 17919 12225 1 30 . 1 1 55 55 THR C C 55 176.560 176.560 176.351 0.209 17919 12226 1 30 . 1 1 55 55 THR CA C 55 59.690 59.690 60.394 -0.704 17919 12227 1 30 . 1 1 55 55 THR CB C 55 72.260 72.260 70.996 1.264 17919 12228 1 30 . 1 1 55 55 THR H H 55 8.730 8.730 9.020 -0.290 17919 12229 1 30 . 1 1 56 56 LEU N N 56 117.920 117.920 122.021 -4.101 17919 12230 1 30 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.955 0.105 17919 12231 1 30 . 1 1 56 56 LEU C C 56 180.810 180.810 179.051 1.759 17919 12232 1 30 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.441 0.269 17919 12233 1 30 . 1 1 56 56 LEU CB C 56 40.370 40.370 39.956 0.414 17919 12234 1 30 . 1 1 56 56 LEU H H 56 8.140 8.140 8.290 -0.150 17919 12235 1 30 . 1 1 57 57 SER N N 57 113.330 113.330 115.081 -1.751 17919 12236 1 30 . 1 1 57 57 SER HA H 57 4.370 4.370 4.158 0.212 17919 12237 1 30 . 1 1 57 57 SER C C 57 178.310 178.310 176.895 1.415 17919 12238 1 30 . 1 1 57 57 SER CA C 57 61.080 61.080 61.690 -0.610 17919 12239 1 30 . 1 1 57 57 SER CB C 57 62.530 62.530 62.687 -0.157 17919 12240 1 30 . 1 1 57 57 SER H H 57 8.470 8.470 7.883 0.587 17919 12241 1 30 . 1 1 58 58 ASP N N 58 124.190 124.190 123.466 0.724 17919 12242 1 30 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.230 0.066 17919 12243 1 30 . 1 1 58 58 ASP C C 58 177.400 177.400 177.921 -0.521 17919 12244 1 30 . 1 1 58 58 ASP CA C 58 57.180 57.180 57.241 -0.061 17919 12245 1 30 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.249 -0.149 17919 12246 1 30 . 1 1 58 58 ASP H H 58 7.930 7.930 7.729 0.201 17919 12247 1 30 . 1 1 59 59 TYR N N 59 115.510 115.510 114.561 0.949 17919 12248 1 30 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.664 0.006 17919 12249 1 30 . 1 1 59 59 TYR C C 59 174.700 174.700 175.412 -0.712 17919 12250 1 30 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.433 0.817 17919 12251 1 30 . 1 1 59 59 TYR CB C 59 40.070 40.070 39.015 1.055 17919 12252 1 30 . 1 1 59 59 TYR H H 59 7.250 7.250 7.460 -0.210 17919 12253 1 30 . 1 1 60 60 ASN N N 60 115.900 115.900 117.428 -1.528 17919 12254 1 30 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.419 -0.064 17919 12255 1 30 . 1 1 60 60 ASN C C 60 174.340 174.340 174.147 0.193 17919 12256 1 30 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.017 0.103 17919 12257 1 30 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.121 0.289 17919 12258 1 30 . 1 1 60 60 ASN H H 60 8.150 8.150 7.686 0.464 17919 12259 1 30 . 1 1 61 61 ILE N N 61 118.600 118.600 119.994 -1.394 17919 12260 1 30 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.691 -0.298 17919 12261 1 30 . 1 1 61 61 ILE C C 61 174.610 174.610 175.435 -0.825 17919 12262 1 30 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.977 0.443 17919 12263 1 30 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.059 -0.319 17919 12264 1 30 . 1 1 61 61 ILE H H 61 7.250 7.250 8.351 -1.101 17919 12265 1 30 . 1 1 62 62 GLN N N 62 124.740 124.740 125.285 -0.545 17919 12266 1 30 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.725 -0.219 17919 12267 1 30 . 1 1 62 62 GLN C C 62 175.970 175.970 175.979 -0.009 17919 12268 1 30 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.475 0.185 17919 12269 1 30 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.872 -0.222 17919 12270 1 30 . 1 1 62 62 GLN H H 62 7.610 7.610 8.156 -0.546 17919 12271 1 30 . 1 1 63 63 LYS N N 63 120.300 120.300 120.484 -0.184 17919 12272 1 30 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.096 -0.095 17919 12273 1 30 . 1 1 63 63 LYS C C 63 175.810 175.810 176.759 -0.949 17919 12274 1 30 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.547 0.243 17919 12275 1 30 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.151 0.499 17919 12276 1 30 . 1 1 63 63 LYS H H 63 8.490 8.490 8.577 -0.087 17919 12277 1 30 . 1 1 64 64 GLU N N 64 113.950 113.950 118.399 -4.449 17919 12278 1 30 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.549 -0.084 17919 12279 1 30 . 1 1 64 64 GLU C C 64 175.250 175.250 175.584 -0.334 17919 12280 1 30 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.873 0.017 17919 12281 1 30 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.695 -2.795 17919 12282 1 30 . 1 1 64 64 GLU H H 64 9.280 9.280 8.482 0.798 17919 12283 1 30 . 1 1 65 65 SER N N 65 114.730 114.730 116.260 -1.530 17919 12284 1 30 . 1 1 65 65 SER HA H 65 4.640 4.640 4.409 0.231 17919 12285 1 30 . 1 1 65 65 SER C C 65 172.160 172.160 174.487 -2.327 17919 12286 1 30 . 1 1 65 65 SER CA C 65 60.890 60.890 59.543 1.347 17919 12287 1 30 . 1 1 65 65 SER CB C 65 64.910 64.910 63.106 1.804 17919 12288 1 30 . 1 1 65 65 SER H H 65 7.670 7.670 7.491 0.179 17919 12289 1 30 . 1 1 66 66 THR N N 66 117.110 117.110 121.766 -4.656 17919 12290 1 30 . 1 1 66 66 THR HA H 66 5.270 5.270 4.833 0.437 17919 12291 1 30 . 1 1 66 66 THR C C 66 173.950 173.950 174.738 -0.788 17919 12292 1 30 . 1 1 66 66 THR CA C 66 62.340 62.340 63.900 -1.560 17919 12293 1 30 . 1 1 66 66 THR CB C 66 70.080 70.080 69.471 0.609 17919 12294 1 30 . 1 1 66 66 THR H H 66 8.730 8.730 8.211 0.519 17919 12295 1 30 . 1 1 67 67 LEU N N 67 127.110 127.110 125.536 1.574 17919 12296 1 30 . 1 1 67 67 LEU HA H 67 5.060 5.060 5.003 0.057 17919 12297 1 30 . 1 1 67 67 LEU C C 67 175.770 175.770 174.951 0.819 17919 12298 1 30 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.243 -0.343 17919 12299 1 30 . 1 1 67 67 LEU CB C 67 44.260 44.260 45.674 -1.414 17919 12300 1 30 . 1 1 67 67 LEU H H 67 9.410 9.410 9.001 0.409 17919 12301 1 30 . 1 1 68 68 HIS N N 68 118.380 118.380 121.825 -3.445 17919 12302 1 30 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.330 -0.090 17919 12303 1 30 . 1 1 68 68 HIS C C 68 173.150 173.150 173.977 -0.827 17919 12304 1 30 . 1 1 68 68 HIS CA C 68 55.000 55.000 53.930 1.070 17919 12305 1 30 . 1 1 68 68 HIS CB C 68 30.530 30.530 31.467 -0.937 17919 12306 1 30 . 1 1 68 68 HIS H H 68 9.230 9.230 9.222 0.008 17919 12307 1 30 . 1 1 69 69 LEU N N 69 124.460 124.460 130.384 -5.924 17919 12308 1 30 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.923 0.267 17919 12309 1 30 . 1 1 69 69 LEU C C 69 175.270 175.270 174.598 0.672 17919 12310 1 30 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.257 -0.367 17919 12311 1 30 . 1 1 69 69 LEU CB C 69 44.380 44.380 43.863 0.517 17919 12312 1 30 . 1 1 69 69 LEU H H 69 8.340 8.340 8.524 -0.184 17919 12313 1 30 . 1 1 70 70 VAL N N 70 126.940 126.940 128.127 -1.187 17919 12314 1 30 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.239 0.111 17919 12315 1 30 . 1 1 70 70 VAL C C 70 174.000 174.000 174.086 -0.086 17919 12316 1 30 . 1 1 70 70 VAL CA C 70 60.800 60.800 61.078 -0.279 17919 12317 1 30 . 1 1 70 70 VAL CB C 70 34.910 34.910 33.519 1.391 17919 12318 1 30 . 1 1 70 70 VAL H H 70 9.200 9.200 8.971 0.229 17919 12319 1 30 . 1 1 71 71 LEU N N 71 123.130 123.130 129.468 -6.338 17919 12320 1 30 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.126 -0.066 17919 12321 1 30 . 1 1 71 71 LEU C C 71 177.830 177.830 176.350 1.480 17919 12322 1 30 . 1 1 71 71 LEU CA C 71 53.940 53.940 54.327 -0.387 17919 12323 1 30 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.526 -0.676 17919 12324 1 30 . 1 1 71 71 LEU H H 71 8.120 8.120 8.603 -0.483 17919 12325 1 30 . 1 1 72 72 ARG N N 72 123.490 123.490 124.691 -1.201 17919 12326 1 30 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.696 -0.395 17919 12327 1 30 . 1 1 72 72 ARG C C 72 175.350 175.350 174.915 0.435 17919 12328 1 30 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.383 0.227 17919 12329 1 30 . 1 1 72 72 ARG CB C 72 31.350 31.350 31.168 0.182 17919 12330 1 30 . 1 1 72 72 ARG H H 72 8.580 8.580 8.511 0.069 17919 12331 1 31 . 1 1 2 2 GLN N N 2 123.220 123.220 119.162 4.058 17919 12332 1 31 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.488 -0.239 17919 12333 1 31 . 1 1 2 2 GLN C C 2 175.920 175.920 175.016 0.904 17919 12334 1 31 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.168 0.912 17919 12335 1 31 . 1 1 2 2 GLN CB C 2 30.760 30.760 32.283 -1.523 17919 12336 1 31 . 1 1 2 2 GLN H H 2 8.900 8.900 8.299 0.601 17919 12337 1 31 . 1 1 3 3 ILE N N 3 115.340 115.340 115.534 -0.194 17919 12338 1 31 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.131 0.082 17919 12339 1 31 . 1 1 3 3 ILE C C 3 172.450 172.450 173.910 -1.460 17919 12340 1 31 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.663 -0.093 17919 12341 1 31 . 1 1 3 3 ILE CB C 3 42.210 42.210 40.727 1.484 17919 12342 1 31 . 1 1 3 3 ILE H H 3 8.320 8.320 8.404 -0.084 17919 12343 1 31 . 1 1 4 4 PHE N N 4 118.110 118.110 118.201 -0.091 17919 12344 1 31 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.527 0.103 17919 12345 1 31 . 1 1 4 4 PHE C C 4 175.320 175.320 175.471 -0.151 17919 12346 1 31 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.533 -0.323 17919 12347 1 31 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.406 0.074 17919 12348 1 31 . 1 1 4 4 PHE H H 4 8.610 8.610 7.778 0.832 17919 12349 1 31 . 1 1 5 5 VAL N N 5 121.000 121.000 124.063 -3.063 17919 12350 1 31 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.473 0.252 17919 12351 1 31 . 1 1 5 5 VAL C C 5 174.870 174.870 175.438 -0.568 17919 12352 1 31 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.507 -0.887 17919 12353 1 31 . 1 1 5 5 VAL CB C 5 34.230 34.230 32.648 1.581 17919 12354 1 31 . 1 1 5 5 VAL H H 5 9.300 9.300 8.560 0.740 17919 12355 1 31 . 1 1 6 6 LYS N N 6 127.520 127.520 127.707 -0.187 17919 12356 1 31 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.346 0.021 17919 12357 1 31 . 1 1 6 6 LYS C C 6 177.140 177.140 176.763 0.377 17919 12358 1 31 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.495 0.025 17919 12359 1 31 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.423 0.627 17919 12360 1 31 . 1 1 6 6 LYS H H 6 8.820 8.820 9.000 -0.180 17919 12361 1 31 . 1 1 7 7 THR N N 7 115.400 115.400 114.373 1.027 17919 12362 1 31 . 1 1 7 7 THR HA H 7 4.970 4.970 4.677 0.293 17919 12363 1 31 . 1 1 7 7 THR C C 7 176.910 176.910 176.941 -0.031 17919 12364 1 31 . 1 1 7 7 THR CA C 7 60.470 60.470 59.794 0.676 17919 12365 1 31 . 1 1 7 7 THR CB C 7 70.630 70.630 70.689 -0.059 17919 12366 1 31 . 1 1 7 7 THR H H 7 8.730 8.730 8.099 0.631 17919 12367 1 31 . 1 1 8 8 LEU N N 8 121.330 121.330 121.535 -0.205 17919 12368 1 31 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.111 0.199 17919 12369 1 31 . 1 1 8 8 LEU C C 8 178.800 178.800 177.901 0.899 17919 12370 1 31 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.713 -0.133 17919 12371 1 31 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.766 0.205 17919 12372 1 31 . 1 1 8 8 LEU H H 8 9.100 9.100 8.934 0.166 17919 12373 1 31 . 1 1 9 9 THR N N 9 105.590 105.590 108.663 -3.073 17919 12374 1 31 . 1 1 9 9 THR HA H 9 4.428 4.428 4.306 0.122 17919 12375 1 31 . 1 1 9 9 THR C C 9 175.520 175.520 175.468 0.052 17919 12376 1 31 . 1 1 9 9 THR CA C 9 61.400 61.400 62.085 -0.685 17919 12377 1 31 . 1 1 9 9 THR CB C 9 69.140 69.140 68.910 0.230 17919 12378 1 31 . 1 1 9 9 THR H H 9 7.630 7.630 7.643 -0.013 17919 12379 1 31 . 1 1 10 10 GLY N N 10 108.890 108.890 110.979 -2.089 17919 12380 1 31 . 1 1 10 10 GLY C C 10 174.070 174.070 173.819 0.251 17919 12381 1 31 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.040 0.420 17919 12382 1 31 . 1 1 10 10 GLY H H 10 7.810 7.810 8.041 -0.231 17919 12383 1 31 . 1 1 11 11 LYS N N 11 121.600 121.600 121.256 0.344 17919 12384 1 31 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.315 0.046 17919 12385 1 31 . 1 1 11 11 LYS C C 11 175.940 175.940 175.653 0.287 17919 12386 1 31 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.576 -0.296 17919 12387 1 31 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.255 -0.055 17919 12388 1 31 . 1 1 11 11 LYS H H 11 7.280 7.280 7.837 -0.557 17919 12389 1 31 . 1 1 12 12 THR N N 12 120.440 120.440 120.435 0.005 17919 12390 1 31 . 1 1 12 12 THR HA H 12 5.046 5.046 4.788 0.258 17919 12391 1 31 . 1 1 12 12 THR C C 12 174.320 174.320 174.286 0.034 17919 12392 1 31 . 1 1 12 12 THR CA C 12 62.390 62.390 62.141 0.249 17919 12393 1 31 . 1 1 12 12 THR CB C 12 69.910 69.910 69.853 0.057 17919 12394 1 31 . 1 1 12 12 THR H H 12 8.650 8.650 8.309 0.341 17919 12395 1 31 . 1 1 13 13 ILE N N 13 127.110 127.110 127.701 -0.591 17919 12396 1 31 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.360 0.184 17919 12397 1 31 . 1 1 13 13 ILE C C 13 175.220 175.220 174.474 0.746 17919 12398 1 31 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.571 -0.591 17919 12399 1 31 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.145 -0.195 17919 12400 1 31 . 1 1 13 13 ILE H H 13 9.450 9.450 8.901 0.549 17919 12401 1 31 . 1 1 14 14 THR N N 14 121.520 121.520 123.531 -2.011 17919 12402 1 31 . 1 1 14 14 THR HA H 14 4.964 4.964 4.707 0.257 17919 12403 1 31 . 1 1 14 14 THR C C 14 173.790 173.790 173.628 0.162 17919 12404 1 31 . 1 1 14 14 THR CA C 14 61.940 61.940 62.783 -0.843 17919 12405 1 31 . 1 1 14 14 THR CB C 14 69.650 69.650 69.306 0.344 17919 12406 1 31 . 1 1 14 14 THR H H 14 8.710 8.710 8.556 0.154 17919 12407 1 31 . 1 1 15 15 LEU N N 15 124.800 124.800 128.014 -3.214 17919 12408 1 31 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.784 -0.004 17919 12409 1 31 . 1 1 15 15 LEU C C 15 174.670 174.670 175.358 -0.688 17919 12410 1 31 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.601 -0.771 17919 12411 1 31 . 1 1 15 15 LEU CB C 15 47.070 47.070 43.840 3.230 17919 12412 1 31 . 1 1 15 15 LEU H H 15 8.710 8.710 8.532 0.178 17919 12413 1 31 . 1 1 16 16 GLU N N 16 122.160 122.160 124.563 -2.403 17919 12414 1 31 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.985 -0.068 17919 12415 1 31 . 1 1 16 16 GLU C C 16 175.860 175.860 175.554 0.306 17919 12416 1 31 . 1 1 16 16 GLU CA C 16 54.820 54.820 54.089 0.731 17919 12417 1 31 . 1 1 16 16 GLU CB C 16 29.450 29.450 29.425 0.024 17919 12418 1 31 . 1 1 16 16 GLU H H 16 8.140 8.140 8.772 -0.632 17919 12419 1 31 . 1 1 17 17 VAL N N 17 117.210 117.210 118.459 -1.249 17919 12420 1 31 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.848 -0.134 17919 12421 1 31 . 1 1 17 17 VAL C C 17 174.160 174.160 174.662 -0.502 17919 12422 1 31 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.585 -0.155 17919 12423 1 31 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.638 0.762 17919 12424 1 31 . 1 1 17 17 VAL H H 17 8.900 8.900 8.735 0.166 17919 12425 1 31 . 1 1 18 18 GLU N N 18 118.990 118.990 121.064 -2.074 17919 12426 1 31 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.840 0.239 17919 12427 1 31 . 1 1 18 18 GLU C C 18 176.160 176.160 174.823 1.337 17919 12428 1 31 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.674 0.046 17919 12429 1 31 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.961 -0.651 17919 12430 1 31 . 1 1 18 18 GLU H H 18 8.640 8.640 8.211 0.429 17919 12431 1 31 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.361 -0.220 17919 12432 1 31 . 1 1 19 19 PRO C C 19 175.310 175.310 177.231 -1.921 17919 12433 1 31 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.129 0.341 17919 12434 1 31 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.986 -0.036 17919 12435 1 31 . 1 1 20 20 SER N N 20 103.400 103.400 109.463 -6.063 17919 12436 1 31 . 1 1 20 20 SER HA H 20 4.370 4.370 4.371 -0.001 17919 12437 1 31 . 1 1 20 20 SER C C 20 174.660 174.660 174.741 -0.081 17919 12438 1 31 . 1 1 20 20 SER CA C 20 57.400 57.400 58.425 -1.025 17919 12439 1 31 . 1 1 20 20 SER CB C 20 63.370 63.370 62.931 0.439 17919 12440 1 31 . 1 1 20 20 SER H H 20 7.040 7.040 7.909 -0.869 17919 12441 1 31 . 1 1 21 21 ASP N N 21 123.480 123.480 125.185 -1.705 17919 12442 1 31 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.724 -0.029 17919 12443 1 31 . 1 1 21 21 ASP C C 21 176.360 176.360 175.990 0.370 17919 12444 1 31 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.285 0.416 17919 12445 1 31 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.487 -0.687 17919 12446 1 31 . 1 1 21 21 ASP H H 21 8.030 8.030 8.017 0.013 17919 12447 1 31 . 1 1 22 22 THR N N 22 108.800 108.800 112.919 -4.119 17919 12448 1 31 . 1 1 22 22 THR HA H 22 4.920 4.920 4.617 0.303 17919 12449 1 31 . 1 1 22 22 THR C C 22 176.750 176.750 175.968 0.782 17919 12450 1 31 . 1 1 22 22 THR CA C 22 59.690 59.690 61.266 -1.576 17919 12451 1 31 . 1 1 22 22 THR CB C 22 71.200 71.200 70.490 0.710 17919 12452 1 31 . 1 1 22 22 THR H H 22 7.900 7.900 8.125 -0.225 17919 12453 1 31 . 1 1 23 23 ILE N N 23 121.190 121.190 123.450 -2.260 17919 12454 1 31 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.682 -0.025 17919 12455 1 31 . 1 1 23 23 ILE C C 23 179.040 179.040 177.732 1.308 17919 12456 1 31 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.087 -0.827 17919 12457 1 31 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.193 -1.843 17919 12458 1 31 . 1 1 23 23 ILE H H 23 8.560 8.560 9.099 -0.539 17919 12459 1 31 . 1 1 24 24 GLU N N 24 120.830 120.830 119.825 1.005 17919 12460 1 31 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.876 0.041 17919 12461 1 31 . 1 1 24 24 GLU C C 24 178.640 178.640 178.794 -0.154 17919 12462 1 31 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.978 0.242 17919 12463 1 31 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.370 -1.090 17919 12464 1 31 . 1 1 24 24 GLU H H 24 9.760 9.760 8.461 1.299 17919 12465 1 31 . 1 1 25 25 ASN N N 25 120.570 120.570 117.665 2.905 17919 12466 1 31 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.519 0.006 17919 12467 1 31 . 1 1 25 25 ASN C C 25 178.380 178.380 177.867 0.513 17919 12468 1 31 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.067 -0.007 17919 12469 1 31 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.914 -0.464 17919 12470 1 31 . 1 1 25 25 ASN H H 25 7.920 7.920 7.599 0.321 17919 12471 1 31 . 1 1 26 26 VAL N N 26 121.710 121.710 120.500 1.210 17919 12472 1 31 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.891 -0.494 17919 12473 1 31 . 1 1 26 26 VAL C C 26 177.950 177.950 177.637 0.313 17919 12474 1 31 . 1 1 26 26 VAL CA C 26 67.660 67.660 64.140 3.520 17919 12475 1 31 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.454 -0.614 17919 12476 1 31 . 1 1 26 26 VAL H H 26 8.070 8.070 8.028 0.042 17919 12477 1 31 . 1 1 27 27 LYS N N 27 118.860 118.860 120.567 -1.707 17919 12478 1 31 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.070 0.510 17919 12479 1 31 . 1 1 27 27 LYS C C 27 180.550 180.550 178.974 1.576 17919 12480 1 31 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.649 -0.399 17919 12481 1 31 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.296 1.434 17919 12482 1 31 . 1 1 27 27 LYS H H 27 8.560 8.560 8.215 0.345 17919 12483 1 31 . 1 1 28 28 ALA N N 28 123.440 123.440 122.098 1.342 17919 12484 1 31 . 1 1 28 28 ALA HA H 28 4.160 4.160 3.991 0.169 17919 12485 1 31 . 1 1 28 28 ALA C C 28 180.300 180.300 179.106 1.194 17919 12486 1 31 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.352 0.018 17919 12487 1 31 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.276 -0.567 17919 12488 1 31 . 1 1 28 28 ALA H H 28 8.060 8.060 8.164 -0.104 17919 12489 1 31 . 1 1 29 29 LYS N N 29 119.940 119.940 118.411 1.529 17919 12490 1 31 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.076 0.131 17919 12491 1 31 . 1 1 29 29 LYS C C 29 180.320 180.320 178.974 1.346 17919 12492 1 31 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.215 0.435 17919 12493 1 31 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.246 1.044 17919 12494 1 31 . 1 1 29 29 LYS H H 29 7.850 7.850 7.500 0.350 17919 12495 1 31 . 1 1 30 30 ILE N N 30 121.080 121.080 120.153 0.927 17919 12496 1 31 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.615 -0.108 17919 12497 1 31 . 1 1 30 30 ILE C C 30 178.310 178.310 177.554 0.756 17919 12498 1 31 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.346 0.804 17919 12499 1 31 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.006 -0.206 17919 12500 1 31 . 1 1 30 30 ILE H H 30 8.280 8.280 7.544 0.736 17919 12501 1 31 . 1 1 31 31 GLN N N 31 123.490 123.490 120.014 3.476 17919 12502 1 31 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.123 -0.294 17919 12503 1 31 . 1 1 31 31 GLN C C 31 178.890 178.890 178.416 0.474 17919 12504 1 31 . 1 1 31 31 GLN CA C 31 60.000 60.000 58.982 1.018 17919 12505 1 31 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.484 -0.764 17919 12506 1 31 . 1 1 31 31 GLN H H 31 8.580 8.580 7.973 0.607 17919 12507 1 31 . 1 1 32 32 ASP N N 32 119.360 119.360 120.224 -0.864 17919 12508 1 31 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.385 -0.030 17919 12509 1 31 . 1 1 32 32 ASP C C 32 177.250 177.250 178.232 -0.982 17919 12510 1 31 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.881 0.309 17919 12511 1 31 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.891 -0.311 17919 12512 1 31 . 1 1 32 32 ASP H H 32 8.010 8.010 8.238 -0.228 17919 12513 1 31 . 1 1 33 33 LYS N N 33 115.130 115.130 117.132 -2.002 17919 12514 1 31 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.325 0.012 17919 12515 1 31 . 1 1 33 33 LYS C C 33 177.870 177.870 178.359 -0.489 17919 12516 1 31 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.696 -0.646 17919 12517 1 31 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.467 0.703 17919 12518 1 31 . 1 1 33 33 LYS H H 33 7.430 7.430 7.478 -0.048 17919 12519 1 31 . 1 1 34 34 GLU N N 34 113.870 113.870 115.418 -1.548 17919 12520 1 31 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.414 0.211 17919 12521 1 31 . 1 1 34 34 GLU C C 34 177.840 177.840 177.465 0.375 17919 12522 1 31 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.531 -1.361 17919 12523 1 31 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.434 1.226 17919 12524 1 31 . 1 1 34 34 GLU H H 34 8.740 8.740 8.345 0.395 17919 12525 1 31 . 1 1 35 35 GLY N N 35 108.650 108.650 108.169 0.481 17919 12526 1 31 . 1 1 35 35 GLY C C 35 173.960 173.960 174.333 -0.373 17919 12527 1 31 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.367 0.713 17919 12528 1 31 . 1 1 35 35 GLY H H 35 8.530 8.530 7.918 0.612 17919 12529 1 31 . 1 1 36 36 ILE N N 36 119.880 119.880 122.069 -2.189 17919 12530 1 31 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.271 0.174 17919 12531 1 31 . 1 1 36 36 ILE C C 36 173.590 173.590 174.060 -0.470 17919 12532 1 31 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.333 -0.583 17919 12533 1 31 . 1 1 36 36 ILE CB C 36 40.580 40.580 37.929 2.651 17919 12534 1 31 . 1 1 36 36 ILE H H 36 6.150 6.150 7.746 -1.596 17919 12535 1 31 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.741 -0.107 17919 12536 1 31 . 1 1 37 37 PRO C C 37 176.940 176.940 176.277 0.663 17919 12537 1 31 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.409 0.251 17919 12538 1 31 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.177 0.673 17919 12539 1 31 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.159 -0.042 17919 12540 1 31 . 1 1 38 38 PRO C C 38 178.320 178.320 178.236 0.084 17919 12541 1 31 . 1 1 38 38 PRO CA C 38 66.260 66.260 66.087 0.173 17919 12542 1 31 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.884 1.006 17919 12543 1 31 . 1 1 39 39 ASP N N 39 113.380 113.380 114.061 -0.681 17919 12544 1 31 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.331 0.099 17919 12545 1 31 . 1 1 39 39 ASP C C 39 177.090 177.090 177.032 0.058 17919 12546 1 31 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.143 -0.503 17919 12547 1 31 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.234 -0.694 17919 12548 1 31 . 1 1 39 39 ASP H H 39 8.550 8.550 8.751 -0.201 17919 12549 1 31 . 1 1 40 40 GLN N N 40 116.780 116.780 115.815 0.965 17919 12550 1 31 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.295 0.169 17919 12551 1 31 . 1 1 40 40 GLN C C 40 175.380 175.380 176.172 -0.792 17919 12552 1 31 . 1 1 40 40 GLN CA C 40 55.640 55.640 57.230 -1.590 17919 12553 1 31 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.778 0.362 17919 12554 1 31 . 1 1 40 40 GLN H H 40 7.820 7.820 7.479 0.341 17919 12555 1 31 . 1 1 41 41 GLN N N 41 117.720 117.720 118.497 -0.777 17919 12556 1 31 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.529 -0.285 17919 12557 1 31 . 1 1 41 41 GLN C C 41 176.300 176.300 174.722 1.578 17919 12558 1 31 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.471 0.999 17919 12559 1 31 . 1 1 41 41 GLN CB C 41 31.650 31.650 30.356 1.294 17919 12560 1 31 . 1 1 41 41 GLN H H 41 7.480 7.480 7.384 0.096 17919 12561 1 31 . 1 1 42 42 ARG N N 42 122.680 122.680 124.821 -2.141 17919 12562 1 31 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.570 -0.070 17919 12563 1 31 . 1 1 42 42 ARG C C 42 174.050 174.050 174.402 -0.352 17919 12564 1 31 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.601 0.449 17919 12565 1 31 . 1 1 42 42 ARG CB C 42 31.750 31.750 31.561 0.189 17919 12566 1 31 . 1 1 42 42 ARG H H 42 8.530 8.530 8.302 0.228 17919 12567 1 31 . 1 1 43 43 LEU N N 43 124.040 124.040 127.646 -3.606 17919 12568 1 31 . 1 1 43 43 LEU C C 43 175.290 175.290 175.816 -0.526 17919 12569 1 31 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.472 -1.492 17919 12570 1 31 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.348 2.442 17919 12571 1 31 . 1 1 43 43 LEU H H 43 8.820 8.820 8.618 0.202 17919 12572 1 31 . 1 1 44 44 ILE N N 44 121.920 121.920 123.645 -1.725 17919 12573 1 31 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.780 0.212 17919 12574 1 31 . 1 1 44 44 ILE C C 44 176.060 176.060 174.237 1.823 17919 12575 1 31 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.238 -1.258 17919 12576 1 31 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.880 -0.460 17919 12577 1 31 . 1 1 44 44 ILE H H 44 9.030 9.030 8.236 0.794 17919 12578 1 31 . 1 1 45 45 PHE N N 45 125.390 125.390 127.774 -2.384 17919 12579 1 31 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.182 -0.137 17919 12580 1 31 . 1 1 45 45 PHE C C 45 174.470 174.470 174.350 0.120 17919 12581 1 31 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.570 0.450 17919 12582 1 31 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.167 0.593 17919 12583 1 31 . 1 1 45 45 PHE H H 45 8.830 8.830 8.823 0.007 17919 12584 1 31 . 1 1 46 46 ALA N N 46 132.200 132.200 130.032 2.168 17919 12585 1 31 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.712 -0.022 17919 12586 1 31 . 1 1 46 46 ALA C C 46 177.290 177.290 178.035 -0.745 17919 12587 1 31 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.821 -0.281 17919 12588 1 31 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.428 0.142 17919 12589 1 31 . 1 1 46 46 ALA H H 46 8.810 8.810 8.925 -0.115 17919 12590 1 31 . 1 1 47 47 GLY N N 47 102.340 102.340 101.765 0.575 17919 12591 1 31 . 1 1 47 47 GLY C C 47 173.810 173.810 174.610 -0.800 17919 12592 1 31 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.324 0.026 17919 12593 1 31 . 1 1 47 47 GLY H H 47 8.130 8.130 8.691 -0.561 17919 12594 1 31 . 1 1 48 48 LYS N N 48 121.570 121.570 120.760 0.810 17919 12595 1 31 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.636 -0.014 17919 12596 1 31 . 1 1 48 48 LYS C C 48 174.700 174.700 174.776 -0.076 17919 12597 1 31 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.657 -0.107 17919 12598 1 31 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.821 -0.291 17919 12599 1 31 . 1 1 48 48 LYS H H 48 7.980 7.980 7.853 0.127 17919 12600 1 31 . 1 1 49 49 GLN N N 49 122.410 122.410 122.931 -0.521 17919 12601 1 31 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.655 -0.095 17919 12602 1 31 . 1 1 49 49 GLN C C 49 175.670 175.670 175.881 -0.211 17919 12603 1 31 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.064 0.676 17919 12604 1 31 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.593 -0.593 17919 12605 1 31 . 1 1 49 49 GLN H H 49 8.600 8.600 8.609 -0.009 17919 12606 1 31 . 1 1 50 50 LEU N N 50 125.520 125.520 127.594 -2.074 17919 12607 1 31 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.176 -0.086 17919 12608 1 31 . 1 1 50 50 LEU C C 50 176.660 176.660 177.034 -0.374 17919 12609 1 31 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.844 -0.604 17919 12610 1 31 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.388 0.182 17919 12611 1 31 . 1 1 50 50 LEU H H 50 8.530 8.530 8.094 0.436 17919 12612 1 31 . 1 1 51 51 GLU N N 51 122.940 122.940 124.877 -1.937 17919 12613 1 31 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.235 0.253 17919 12614 1 31 . 1 1 51 51 GLU C C 51 175.870 175.870 177.132 -1.262 17919 12615 1 31 . 1 1 51 51 GLU CA C 51 55.960 55.960 57.209 -1.249 17919 12616 1 31 . 1 1 51 51 GLU CB C 51 31.570 31.570 30.195 1.375 17919 12617 1 31 . 1 1 51 51 GLU H H 51 8.400 8.400 8.374 0.026 17919 12618 1 31 . 1 1 52 52 ASP N N 52 120.030 120.030 125.340 -5.310 17919 12619 1 31 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.596 -0.237 17919 12620 1 31 . 1 1 52 52 ASP C C 52 177.330 177.330 177.874 -0.544 17919 12621 1 31 . 1 1 52 52 ASP CA C 52 56.960 56.960 56.689 0.271 17919 12622 1 31 . 1 1 52 52 ASP CB C 52 40.850 40.850 41.165 -0.315 17919 12623 1 31 . 1 1 52 52 ASP H H 52 8.160 8.160 8.880 -0.720 17919 12624 1 31 . 1 1 53 53 GLY N N 53 106.660 106.660 106.551 0.109 17919 12625 1 31 . 1 1 53 53 GLY C C 53 174.870 174.870 174.424 0.446 17919 12626 1 31 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.866 0.304 17919 12627 1 31 . 1 1 53 53 GLY H H 53 9.390 9.390 8.339 1.051 17919 12628 1 31 . 1 1 54 54 ARG N N 54 119.050 119.050 120.202 -1.152 17919 12629 1 31 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.487 0.208 17919 12630 1 31 . 1 1 54 54 ARG C C 54 175.350 175.350 175.951 -0.601 17919 12631 1 31 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.884 -0.494 17919 12632 1 31 . 1 1 54 54 ARG CB C 54 32.650 32.650 31.421 1.229 17919 12633 1 31 . 1 1 54 54 ARG H H 54 7.460 7.460 7.390 0.070 17919 12634 1 31 . 1 1 55 55 THR N N 55 108.400 108.400 112.969 -4.569 17919 12635 1 31 . 1 1 55 55 THR HA H 55 5.240 5.240 4.818 0.422 17919 12636 1 31 . 1 1 55 55 THR C C 55 176.560 176.560 176.713 -0.153 17919 12637 1 31 . 1 1 55 55 THR CA C 55 59.690 59.690 60.991 -1.301 17919 12638 1 31 . 1 1 55 55 THR CB C 55 72.260 72.260 70.543 1.717 17919 12639 1 31 . 1 1 55 55 THR H H 55 8.730 8.730 8.645 0.085 17919 12640 1 31 . 1 1 56 56 LEU N N 56 117.920 117.920 122.172 -4.252 17919 12641 1 31 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.981 0.079 17919 12642 1 31 . 1 1 56 56 LEU C C 56 180.810 180.810 178.607 2.203 17919 12643 1 31 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.169 0.541 17919 12644 1 31 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.194 -0.824 17919 12645 1 31 . 1 1 56 56 LEU H H 56 8.140 8.140 8.563 -0.423 17919 12646 1 31 . 1 1 57 57 SER N N 57 113.330 113.330 114.341 -1.011 17919 12647 1 31 . 1 1 57 57 SER HA H 57 4.370 4.370 4.153 0.217 17919 12648 1 31 . 1 1 57 57 SER C C 57 178.310 178.310 176.816 1.494 17919 12649 1 31 . 1 1 57 57 SER CA C 57 61.080 61.080 61.412 -0.332 17919 12650 1 31 . 1 1 57 57 SER CB C 57 62.530 62.530 62.785 -0.255 17919 12651 1 31 . 1 1 57 57 SER H H 57 8.470 8.470 7.842 0.628 17919 12652 1 31 . 1 1 58 58 ASP N N 58 124.190 124.190 122.008 2.182 17919 12653 1 31 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.271 0.025 17919 12654 1 31 . 1 1 58 58 ASP C C 58 177.400 177.400 177.193 0.207 17919 12655 1 31 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.653 0.527 17919 12656 1 31 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.438 -0.338 17919 12657 1 31 . 1 1 58 58 ASP H H 58 7.930 7.930 7.682 0.248 17919 12658 1 31 . 1 1 59 59 TYR N N 59 115.510 115.510 115.467 0.043 17919 12659 1 31 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.685 -0.015 17919 12660 1 31 . 1 1 59 59 TYR C C 59 174.700 174.700 174.853 -0.153 17919 12661 1 31 . 1 1 59 59 TYR CA C 59 58.250 58.250 56.895 1.355 17919 12662 1 31 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.665 1.405 17919 12663 1 31 . 1 1 59 59 TYR H H 59 7.250 7.250 7.418 -0.168 17919 12664 1 31 . 1 1 60 60 ASN N N 60 115.900 115.900 117.237 -1.337 17919 12665 1 31 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.331 0.024 17919 12666 1 31 . 1 1 60 60 ASN C C 60 174.340 174.340 174.578 -0.238 17919 12667 1 31 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.142 -0.022 17919 12668 1 31 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.917 -0.507 17919 12669 1 31 . 1 1 60 60 ASN H H 60 8.150 8.150 7.778 0.372 17919 12670 1 31 . 1 1 61 61 ILE N N 61 118.600 118.600 119.390 -0.790 17919 12671 1 31 . 1 1 61 61 ILE HA H 61 3.393 3.393 4.007 -0.614 17919 12672 1 31 . 1 1 61 61 ILE C C 61 174.610 174.610 174.996 -0.386 17919 12673 1 31 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.315 1.105 17919 12674 1 31 . 1 1 61 61 ILE CB C 61 36.740 36.740 38.135 -1.395 17919 12675 1 31 . 1 1 61 61 ILE H H 61 7.250 7.250 7.531 -0.281 17919 12676 1 31 . 1 1 62 62 GLN N N 62 124.740 124.740 125.456 -0.716 17919 12677 1 31 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.710 -0.204 17919 12678 1 31 . 1 1 62 62 GLN C C 62 175.970 175.970 175.398 0.572 17919 12679 1 31 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.516 0.144 17919 12680 1 31 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.310 0.340 17919 12681 1 31 . 1 1 62 62 GLN H H 62 7.610 7.610 7.897 -0.287 17919 12682 1 31 . 1 1 63 63 LYS N N 63 120.300 120.300 121.346 -1.046 17919 12683 1 31 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.934 0.067 17919 12684 1 31 . 1 1 63 63 LYS C C 63 175.810 175.810 176.809 -0.999 17919 12685 1 31 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.950 -0.161 17919 12686 1 31 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.066 1.584 17919 12687 1 31 . 1 1 63 63 LYS H H 63 8.490 8.490 8.545 -0.055 17919 12688 1 31 . 1 1 64 64 GLU N N 64 113.950 113.950 118.682 -4.732 17919 12689 1 31 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.273 0.192 17919 12690 1 31 . 1 1 64 64 GLU C C 64 175.250 175.250 175.512 -0.262 17919 12691 1 31 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.227 0.663 17919 12692 1 31 . 1 1 64 64 GLU CB C 64 25.900 25.900 27.287 -1.387 17919 12693 1 31 . 1 1 64 64 GLU H H 64 9.280 9.280 8.477 0.803 17919 12694 1 31 . 1 1 65 65 SER N N 65 114.730 114.730 115.466 -0.736 17919 12695 1 31 . 1 1 65 65 SER HA H 65 4.640 4.640 4.412 0.228 17919 12696 1 31 . 1 1 65 65 SER C C 65 172.160 172.160 174.461 -2.301 17919 12697 1 31 . 1 1 65 65 SER CA C 65 60.890 60.890 60.129 0.761 17919 12698 1 31 . 1 1 65 65 SER CB C 65 64.910 64.910 63.639 1.271 17919 12699 1 31 . 1 1 65 65 SER H H 65 7.670 7.670 7.535 0.135 17919 12700 1 31 . 1 1 66 66 THR N N 66 117.110 117.110 121.875 -4.765 17919 12701 1 31 . 1 1 66 66 THR HA H 66 5.270 5.270 4.650 0.620 17919 12702 1 31 . 1 1 66 66 THR C C 66 173.950 173.950 174.185 -0.235 17919 12703 1 31 . 1 1 66 66 THR CA C 66 62.340 62.340 62.739 -0.399 17919 12704 1 31 . 1 1 66 66 THR CB C 66 70.080 70.080 69.580 0.500 17919 12705 1 31 . 1 1 66 66 THR H H 66 8.730 8.730 8.235 0.495 17919 12706 1 31 . 1 1 67 67 LEU N N 67 127.110 127.110 127.112 -0.002 17919 12707 1 31 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.660 0.400 17919 12708 1 31 . 1 1 67 67 LEU C C 67 175.770 175.770 175.479 0.291 17919 12709 1 31 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.625 0.275 17919 12710 1 31 . 1 1 67 67 LEU CB C 67 44.260 44.260 45.899 -1.639 17919 12711 1 31 . 1 1 67 67 LEU H H 67 9.410 9.410 8.894 0.516 17919 12712 1 31 . 1 1 68 68 HIS N N 68 118.380 118.380 117.486 0.894 17919 12713 1 31 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.519 -0.279 17919 12714 1 31 . 1 1 68 68 HIS C C 68 173.150 173.150 174.629 -1.479 17919 12715 1 31 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.967 0.033 17919 12716 1 31 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.969 -2.439 17919 12717 1 31 . 1 1 68 68 HIS H H 68 9.230 9.230 8.786 0.444 17919 12718 1 31 . 1 1 69 69 LEU N N 69 124.460 124.460 121.330 3.130 17919 12719 1 31 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.073 0.117 17919 12720 1 31 . 1 1 69 69 LEU C C 69 175.270 175.270 174.338 0.932 17919 12721 1 31 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.755 -0.866 17919 12722 1 31 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.935 -0.555 17919 12723 1 31 . 1 1 69 69 LEU H H 69 8.340 8.340 8.225 0.115 17919 12724 1 31 . 1 1 70 70 VAL N N 70 126.940 126.940 123.885 3.055 17919 12725 1 31 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.414 -0.064 17919 12726 1 31 . 1 1 70 70 VAL C C 70 174.000 174.000 174.869 -0.869 17919 12727 1 31 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.542 0.258 17919 12728 1 31 . 1 1 70 70 VAL CB C 70 34.910 34.910 34.153 0.757 17919 12729 1 31 . 1 1 70 70 VAL H H 70 9.200 9.200 8.393 0.807 17919 12730 1 31 . 1 1 71 71 LEU N N 71 123.130 123.130 121.126 2.004 17919 12731 1 31 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.850 0.210 17919 12732 1 31 . 1 1 71 71 LEU C C 71 177.830 177.830 176.251 1.579 17919 12733 1 31 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.526 0.414 17919 12734 1 31 . 1 1 71 71 LEU CB C 71 42.850 42.850 45.189 -2.339 17919 12735 1 31 . 1 1 71 71 LEU H H 71 8.120 8.120 8.275 -0.155 17919 12736 1 31 . 1 1 72 72 ARG N N 72 123.490 123.490 122.081 1.409 17919 12737 1 31 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.706 -0.405 17919 12738 1 31 . 1 1 72 72 ARG C C 72 175.350 175.350 174.966 0.384 17919 12739 1 31 . 1 1 72 72 ARG CA C 72 55.610 55.610 54.148 1.462 17919 12740 1 31 . 1 1 72 72 ARG CB C 72 31.350 31.350 32.454 -1.104 17919 12741 1 31 . 1 1 72 72 ARG H H 72 8.580 8.580 8.801 -0.221 17919 12742 1 32 . 1 1 2 2 GLN N N 2 123.220 123.220 118.498 4.722 17919 12743 1 32 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.361 -0.112 17919 12744 1 32 . 1 1 2 2 GLN C C 2 175.920 175.920 175.239 0.681 17919 12745 1 32 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.438 0.642 17919 12746 1 32 . 1 1 2 2 GLN CB C 2 30.760 30.760 31.564 -0.804 17919 12747 1 32 . 1 1 2 2 GLN H H 2 8.900 8.900 8.294 0.605 17919 12748 1 32 . 1 1 3 3 ILE N N 3 115.340 115.340 115.392 -0.052 17919 12749 1 32 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.068 0.145 17919 12750 1 32 . 1 1 3 3 ILE C C 3 172.450 172.450 173.152 -0.702 17919 12751 1 32 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.267 0.303 17919 12752 1 32 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.063 1.147 17919 12753 1 32 . 1 1 3 3 ILE H H 3 8.320 8.320 8.641 -0.321 17919 12754 1 32 . 1 1 4 4 PHE N N 4 118.110 118.110 118.736 -0.626 17919 12755 1 32 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.403 0.227 17919 12756 1 32 . 1 1 4 4 PHE C C 4 175.320 175.320 175.429 -0.109 17919 12757 1 32 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.602 -0.392 17919 12758 1 32 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.438 0.042 17919 12759 1 32 . 1 1 4 4 PHE H H 4 8.610 8.610 7.717 0.893 17919 12760 1 32 . 1 1 5 5 VAL N N 5 121.000 121.000 121.915 -0.915 17919 12761 1 32 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.797 -0.072 17919 12762 1 32 . 1 1 5 5 VAL C C 5 174.870 174.870 174.899 -0.029 17919 12763 1 32 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.324 -0.704 17919 12764 1 32 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.106 1.124 17919 12765 1 32 . 1 1 5 5 VAL H H 5 9.300 9.300 8.904 0.396 17919 12766 1 32 . 1 1 6 6 LYS N N 6 127.520 127.520 129.649 -2.129 17919 12767 1 32 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.277 0.090 17919 12768 1 32 . 1 1 6 6 LYS C C 6 177.140 177.140 177.174 -0.034 17919 12769 1 32 . 1 1 6 6 LYS CA C 6 54.520 54.520 55.078 -0.558 17919 12770 1 32 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.943 0.107 17919 12771 1 32 . 1 1 6 6 LYS H H 6 8.820 8.820 9.110 -0.290 17919 12772 1 32 . 1 1 7 7 THR N N 7 115.400 115.400 118.912 -3.512 17919 12773 1 32 . 1 1 7 7 THR HA H 7 4.970 4.970 4.372 0.598 17919 12774 1 32 . 1 1 7 7 THR C C 7 176.910 176.910 176.234 0.676 17919 12775 1 32 . 1 1 7 7 THR CA C 7 60.470 60.470 62.224 -1.754 17919 12776 1 32 . 1 1 7 7 THR CB C 7 70.630 70.630 69.916 0.714 17919 12777 1 32 . 1 1 7 7 THR H H 7 8.730 8.730 8.770 -0.040 17919 12778 1 32 . 1 1 8 8 LEU N N 8 121.330 121.330 122.190 -0.860 17919 12779 1 32 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.288 0.022 17919 12780 1 32 . 1 1 8 8 LEU C C 8 178.800 178.800 177.996 0.804 17919 12781 1 32 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.542 0.038 17919 12782 1 32 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.146 -0.176 17919 12783 1 32 . 1 1 8 8 LEU H H 8 9.100 9.100 8.643 0.457 17919 12784 1 32 . 1 1 9 9 THR N N 9 105.590 105.590 107.694 -2.104 17919 12785 1 32 . 1 1 9 9 THR HA H 9 4.428 4.428 4.389 0.039 17919 12786 1 32 . 1 1 9 9 THR C C 9 175.520 175.520 176.084 -0.564 17919 12787 1 32 . 1 1 9 9 THR CA C 9 61.400 61.400 61.611 -0.211 17919 12788 1 32 . 1 1 9 9 THR CB C 9 69.140 69.140 68.838 0.302 17919 12789 1 32 . 1 1 9 9 THR H H 9 7.630 7.630 7.778 -0.148 17919 12790 1 32 . 1 1 10 10 GLY N N 10 108.890 108.890 110.959 -2.069 17919 12791 1 32 . 1 1 10 10 GLY C C 10 174.070 174.070 174.148 -0.078 17919 12792 1 32 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.246 0.214 17919 12793 1 32 . 1 1 10 10 GLY H H 10 7.810 7.810 7.838 -0.028 17919 12794 1 32 . 1 1 11 11 LYS N N 11 121.600 121.600 121.294 0.306 17919 12795 1 32 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.545 -0.184 17919 12796 1 32 . 1 1 11 11 LYS C C 11 175.940 175.940 175.431 0.509 17919 12797 1 32 . 1 1 11 11 LYS CA C 11 56.280 56.280 55.877 0.403 17919 12798 1 32 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.885 -0.685 17919 12799 1 32 . 1 1 11 11 LYS H H 11 7.280 7.280 8.150 -0.870 17919 12800 1 32 . 1 1 12 12 THR N N 12 120.440 120.440 119.270 1.170 17919 12801 1 32 . 1 1 12 12 THR HA H 12 5.046 5.046 5.261 -0.215 17919 12802 1 32 . 1 1 12 12 THR C C 12 174.320 174.320 174.337 -0.017 17919 12803 1 32 . 1 1 12 12 THR CA C 12 62.390 62.390 61.864 0.526 17919 12804 1 32 . 1 1 12 12 THR CB C 12 69.910 69.910 70.228 -0.317 17919 12805 1 32 . 1 1 12 12 THR H H 12 8.650 8.650 8.386 0.264 17919 12806 1 32 . 1 1 13 13 ILE N N 13 127.110 127.110 126.228 0.882 17919 12807 1 32 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.406 0.138 17919 12808 1 32 . 1 1 13 13 ILE C C 13 175.220 175.220 174.585 0.635 17919 12809 1 32 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.672 -0.693 17919 12810 1 32 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.124 -0.174 17919 12811 1 32 . 1 1 13 13 ILE H H 13 9.450 9.450 8.873 0.577 17919 12812 1 32 . 1 1 14 14 THR N N 14 121.520 121.520 124.086 -2.566 17919 12813 1 32 . 1 1 14 14 THR HA H 14 4.964 4.964 4.644 0.320 17919 12814 1 32 . 1 1 14 14 THR C C 14 173.790 173.790 173.508 0.282 17919 12815 1 32 . 1 1 14 14 THR CA C 14 61.940 61.940 63.134 -1.194 17919 12816 1 32 . 1 1 14 14 THR CB C 14 69.650 69.650 69.284 0.366 17919 12817 1 32 . 1 1 14 14 THR H H 14 8.710 8.710 8.594 0.117 17919 12818 1 32 . 1 1 15 15 LEU N N 15 124.800 124.800 127.194 -2.394 17919 12819 1 32 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.730 0.050 17919 12820 1 32 . 1 1 15 15 LEU C C 15 174.670 174.670 174.370 0.300 17919 12821 1 32 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.324 -0.494 17919 12822 1 32 . 1 1 15 15 LEU CB C 15 47.070 47.070 46.356 0.714 17919 12823 1 32 . 1 1 15 15 LEU H H 15 8.710 8.710 8.305 0.405 17919 12824 1 32 . 1 1 16 16 GLU N N 16 122.160 122.160 124.657 -2.497 17919 12825 1 32 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.889 0.028 17919 12826 1 32 . 1 1 16 16 GLU C C 16 175.860 175.860 174.976 0.884 17919 12827 1 32 . 1 1 16 16 GLU CA C 16 54.820 54.820 54.651 0.169 17919 12828 1 32 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.691 -1.241 17919 12829 1 32 . 1 1 16 16 GLU H H 16 8.140 8.140 8.509 -0.369 17919 12830 1 32 . 1 1 17 17 VAL N N 17 117.210 117.210 118.516 -1.306 17919 12831 1 32 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.678 0.036 17919 12832 1 32 . 1 1 17 17 VAL C C 17 174.160 174.160 174.243 -0.083 17919 12833 1 32 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.779 -1.349 17919 12834 1 32 . 1 1 17 17 VAL CB C 17 36.400 36.400 34.927 1.473 17919 12835 1 32 . 1 1 17 17 VAL H H 17 8.900 8.900 8.653 0.247 17919 12836 1 32 . 1 1 18 18 GLU N N 18 118.990 118.990 124.172 -5.182 17919 12837 1 32 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.827 0.252 17919 12838 1 32 . 1 1 18 18 GLU C C 18 176.160 176.160 175.779 0.381 17919 12839 1 32 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.951 -0.231 17919 12840 1 32 . 1 1 18 18 GLU CB C 18 30.310 30.310 31.064 -0.754 17919 12841 1 32 . 1 1 18 18 GLU H H 18 8.640 8.640 8.093 0.547 17919 12842 1 32 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.211 -0.070 17919 12843 1 32 . 1 1 19 19 PRO C C 19 175.310 175.310 178.111 -2.801 17919 12844 1 32 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.629 -0.159 17919 12845 1 32 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.969 -0.019 17919 12846 1 32 . 1 1 20 20 SER N N 20 103.400 103.400 110.754 -7.354 17919 12847 1 32 . 1 1 20 20 SER HA H 20 4.370 4.370 4.317 0.053 17919 12848 1 32 . 1 1 20 20 SER C C 20 174.660 174.660 174.551 0.109 17919 12849 1 32 . 1 1 20 20 SER CA C 20 57.400 57.400 58.424 -1.024 17919 12850 1 32 . 1 1 20 20 SER CB C 20 63.370 63.370 62.970 0.400 17919 12851 1 32 . 1 1 20 20 SER H H 20 7.040 7.040 7.910 -0.870 17919 12852 1 32 . 1 1 21 21 ASP N N 21 123.480 123.480 123.623 -0.143 17919 12853 1 32 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.563 0.132 17919 12854 1 32 . 1 1 21 21 ASP C C 21 176.360 176.360 175.687 0.673 17919 12855 1 32 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.677 0.023 17919 12856 1 32 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.361 -0.561 17919 12857 1 32 . 1 1 21 21 ASP H H 21 8.030 8.030 7.911 0.119 17919 12858 1 32 . 1 1 22 22 THR N N 22 108.800 108.800 110.733 -1.933 17919 12859 1 32 . 1 1 22 22 THR HA H 22 4.920 4.920 4.844 0.076 17919 12860 1 32 . 1 1 22 22 THR C C 22 176.750 176.750 175.897 0.853 17919 12861 1 32 . 1 1 22 22 THR CA C 22 59.690 59.690 60.220 -0.530 17919 12862 1 32 . 1 1 22 22 THR CB C 22 71.200 71.200 71.434 -0.234 17919 12863 1 32 . 1 1 22 22 THR H H 22 7.900 7.900 8.166 -0.266 17919 12864 1 32 . 1 1 23 23 ILE N N 23 121.190 121.190 122.104 -0.914 17919 12865 1 32 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.713 -0.056 17919 12866 1 32 . 1 1 23 23 ILE C C 23 179.040 179.040 177.747 1.293 17919 12867 1 32 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.164 -0.904 17919 12868 1 32 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.539 -2.189 17919 12869 1 32 . 1 1 23 23 ILE H H 23 8.560 8.560 8.998 -0.438 17919 12870 1 32 . 1 1 24 24 GLU N N 24 120.830 120.830 119.713 1.117 17919 12871 1 32 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.890 0.027 17919 12872 1 32 . 1 1 24 24 GLU C C 24 178.640 178.640 178.939 -0.299 17919 12873 1 32 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.728 0.492 17919 12874 1 32 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.107 -0.827 17919 12875 1 32 . 1 1 24 24 GLU H H 24 9.760 9.760 7.850 1.910 17919 12876 1 32 . 1 1 25 25 ASN N N 25 120.570 120.570 117.832 2.738 17919 12877 1 32 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.517 0.008 17919 12878 1 32 . 1 1 25 25 ASN C C 25 178.380 178.380 177.891 0.489 17919 12879 1 32 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.902 0.158 17919 12880 1 32 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.202 0.248 17919 12881 1 32 . 1 1 25 25 ASN H H 25 7.920 7.920 7.622 0.298 17919 12882 1 32 . 1 1 26 26 VAL N N 26 121.710 121.710 119.411 2.299 17919 12883 1 32 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.579 -0.182 17919 12884 1 32 . 1 1 26 26 VAL C C 26 177.950 177.950 177.868 0.082 17919 12885 1 32 . 1 1 26 26 VAL CA C 26 67.660 67.660 67.057 0.603 17919 12886 1 32 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.396 -0.556 17919 12887 1 32 . 1 1 26 26 VAL H H 26 8.070 8.070 7.927 0.143 17919 12888 1 32 . 1 1 27 27 LYS N N 27 118.860 118.860 119.458 -0.598 17919 12889 1 32 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.182 0.398 17919 12890 1 32 . 1 1 27 27 LYS C C 27 180.550 180.550 179.028 1.522 17919 12891 1 32 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.213 0.037 17919 12892 1 32 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.178 1.552 17919 12893 1 32 . 1 1 27 27 LYS H H 27 8.560 8.560 7.457 1.103 17919 12894 1 32 . 1 1 28 28 ALA N N 28 123.440 123.440 123.274 0.166 17919 12895 1 32 . 1 1 28 28 ALA HA H 28 4.160 4.160 3.997 0.163 17919 12896 1 32 . 1 1 28 28 ALA C C 28 180.300 180.300 179.097 1.203 17919 12897 1 32 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.459 -0.089 17919 12898 1 32 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.309 -0.599 17919 12899 1 32 . 1 1 28 28 ALA H H 28 8.060 8.060 8.729 -0.669 17919 12900 1 32 . 1 1 29 29 LYS N N 29 119.940 119.940 119.146 0.794 17919 12901 1 32 . 1 1 29 29 LYS HA H 29 4.207 4.207 3.974 0.233 17919 12902 1 32 . 1 1 29 29 LYS C C 29 180.320 180.320 179.330 0.990 17919 12903 1 32 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.415 0.235 17919 12904 1 32 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.298 0.992 17919 12905 1 32 . 1 1 29 29 LYS H H 29 7.850 7.850 7.537 0.313 17919 12906 1 32 . 1 1 30 30 ILE N N 30 121.080 121.080 120.212 0.868 17919 12907 1 32 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.610 -0.103 17919 12908 1 32 . 1 1 30 30 ILE C C 30 178.310 178.310 177.337 0.973 17919 12909 1 32 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.421 0.729 17919 12910 1 32 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.787 -0.987 17919 12911 1 32 . 1 1 30 30 ILE H H 30 8.280 8.280 8.197 0.083 17919 12912 1 32 . 1 1 31 31 GLN N N 31 123.490 123.490 120.569 2.921 17919 12913 1 32 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.034 -0.205 17919 12914 1 32 . 1 1 31 31 GLN C C 31 178.890 178.890 178.237 0.653 17919 12915 1 32 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.049 0.951 17919 12916 1 32 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.477 -0.757 17919 12917 1 32 . 1 1 31 31 GLN H H 31 8.580 8.580 8.152 0.428 17919 12918 1 32 . 1 1 32 32 ASP N N 32 119.360 119.360 119.337 0.023 17919 12919 1 32 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.416 -0.062 17919 12920 1 32 . 1 1 32 32 ASP C C 32 177.250 177.250 177.716 -0.466 17919 12921 1 32 . 1 1 32 32 ASP CA C 32 57.190 57.190 57.039 0.151 17919 12922 1 32 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.722 -0.142 17919 12923 1 32 . 1 1 32 32 ASP H H 32 8.010 8.010 8.448 -0.438 17919 12924 1 32 . 1 1 33 33 LYS N N 33 115.130 115.130 118.401 -3.271 17919 12925 1 32 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.256 0.081 17919 12926 1 32 . 1 1 33 33 LYS C C 33 177.870 177.870 178.189 -0.319 17919 12927 1 32 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.529 -0.479 17919 12928 1 32 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.275 0.895 17919 12929 1 32 . 1 1 33 33 LYS H H 33 7.430 7.430 7.522 -0.092 17919 12930 1 32 . 1 1 34 34 GLU N N 34 113.870 113.870 115.039 -1.169 17919 12931 1 32 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.452 0.173 17919 12932 1 32 . 1 1 34 34 GLU C C 34 177.840 177.840 177.771 0.069 17919 12933 1 32 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.956 -0.786 17919 12934 1 32 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.174 1.486 17919 12935 1 32 . 1 1 34 34 GLU H H 34 8.740 8.740 7.901 0.839 17919 12936 1 32 . 1 1 35 35 GLY N N 35 108.650 108.650 109.185 -0.535 17919 12937 1 32 . 1 1 35 35 GLY C C 35 173.960 173.960 174.121 -0.161 17919 12938 1 32 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.432 0.648 17919 12939 1 32 . 1 1 35 35 GLY H H 35 8.530 8.530 8.272 0.258 17919 12940 1 32 . 1 1 36 36 ILE N N 36 119.880 119.880 122.404 -2.524 17919 12941 1 32 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.432 0.013 17919 12942 1 32 . 1 1 36 36 ILE C C 36 173.590 173.590 174.184 -0.594 17919 12943 1 32 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.505 0.245 17919 12944 1 32 . 1 1 36 36 ILE CB C 36 40.580 40.580 39.981 0.599 17919 12945 1 32 . 1 1 36 36 ILE H H 36 6.150 6.150 7.578 -1.428 17919 12946 1 32 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.887 -0.253 17919 12947 1 32 . 1 1 37 37 PRO C C 37 176.940 176.940 175.659 1.281 17919 12948 1 32 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.107 0.553 17919 12949 1 32 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.192 0.658 17919 12950 1 32 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.372 -0.255 17919 12951 1 32 . 1 1 38 38 PRO C C 38 178.320 178.320 177.957 0.363 17919 12952 1 32 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.370 0.890 17919 12953 1 32 . 1 1 38 38 PRO CB C 38 32.890 32.890 32.114 0.776 17919 12954 1 32 . 1 1 39 39 ASP N N 39 113.380 113.380 117.217 -3.837 17919 12955 1 32 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.247 0.183 17919 12956 1 32 . 1 1 39 39 ASP C C 39 177.090 177.090 177.883 -0.793 17919 12957 1 32 . 1 1 39 39 ASP CA C 39 55.640 55.640 57.224 -1.584 17919 12958 1 32 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.368 -0.828 17919 12959 1 32 . 1 1 39 39 ASP H H 39 8.550 8.550 8.553 -0.003 17919 12960 1 32 . 1 1 40 40 GLN N N 40 116.780 116.780 116.451 0.329 17919 12961 1 32 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.277 0.187 17919 12962 1 32 . 1 1 40 40 GLN C C 40 175.380 175.380 176.080 -0.700 17919 12963 1 32 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.043 -0.403 17919 12964 1 32 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.325 0.815 17919 12965 1 32 . 1 1 40 40 GLN H H 40 7.820 7.820 8.000 -0.180 17919 12966 1 32 . 1 1 41 41 GLN N N 41 117.720 117.720 118.021 -0.301 17919 12967 1 32 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.413 -0.169 17919 12968 1 32 . 1 1 41 41 GLN C C 41 176.300 176.300 175.604 0.696 17919 12969 1 32 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.252 0.218 17919 12970 1 32 . 1 1 41 41 GLN CB C 41 31.650 31.650 30.029 1.621 17919 12971 1 32 . 1 1 41 41 GLN H H 41 7.480 7.480 7.309 0.171 17919 12972 1 32 . 1 1 42 42 ARG N N 42 122.680 122.680 119.448 3.232 17919 12973 1 32 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.603 -0.103 17919 12974 1 32 . 1 1 42 42 ARG C C 42 174.050 174.050 174.533 -0.483 17919 12975 1 32 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.936 0.114 17919 12976 1 32 . 1 1 42 42 ARG CB C 42 31.750 31.750 34.160 -2.410 17919 12977 1 32 . 1 1 42 42 ARG H H 42 8.530 8.530 8.141 0.389 17919 12978 1 32 . 1 1 43 43 LEU N N 43 124.040 124.040 122.966 1.074 17919 12979 1 32 . 1 1 43 43 LEU C C 43 175.290 175.290 175.555 -0.265 17919 12980 1 32 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.732 -0.752 17919 12981 1 32 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.516 2.274 17919 12982 1 32 . 1 1 43 43 LEU H H 43 8.820 8.820 8.772 0.048 17919 12983 1 32 . 1 1 44 44 ILE N N 44 121.920 121.920 121.319 0.601 17919 12984 1 32 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.893 0.099 17919 12985 1 32 . 1 1 44 44 ILE C C 44 176.060 176.060 174.870 1.190 17919 12986 1 32 . 1 1 44 44 ILE CA C 44 58.980 58.980 58.740 0.240 17919 12987 1 32 . 1 1 44 44 ILE CB C 44 41.420 41.420 39.498 1.922 17919 12988 1 32 . 1 1 44 44 ILE H H 44 9.030 9.030 8.497 0.533 17919 12989 1 32 . 1 1 45 45 PHE N N 45 125.390 125.390 127.799 -2.409 17919 12990 1 32 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.866 0.179 17919 12991 1 32 . 1 1 45 45 PHE C C 45 174.470 174.470 174.171 0.299 17919 12992 1 32 . 1 1 45 45 PHE CA C 45 57.020 57.020 57.274 -0.254 17919 12993 1 32 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.859 0.901 17919 12994 1 32 . 1 1 45 45 PHE H H 45 8.830 8.830 8.807 0.023 17919 12995 1 32 . 1 1 46 46 ALA N N 46 132.200 132.200 129.898 2.302 17919 12996 1 32 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.654 0.036 17919 12997 1 32 . 1 1 46 46 ALA C C 46 177.290 177.290 177.855 -0.565 17919 12998 1 32 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.581 -0.041 17919 12999 1 32 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.417 0.153 17919 13000 1 32 . 1 1 46 46 ALA H H 46 8.810 8.810 8.738 0.072 17919 13001 1 32 . 1 1 47 47 GLY N N 47 102.340 102.340 105.143 -2.803 17919 13002 1 32 . 1 1 47 47 GLY C C 47 173.810 173.810 173.940 -0.130 17919 13003 1 32 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.967 0.383 17919 13004 1 32 . 1 1 47 47 GLY H H 47 8.130 8.130 8.586 -0.456 17919 13005 1 32 . 1 1 48 48 LYS N N 48 121.570 121.570 121.119 0.451 17919 13006 1 32 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.600 0.022 17919 13007 1 32 . 1 1 48 48 LYS C C 48 174.700 174.700 174.966 -0.266 17919 13008 1 32 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.011 -0.461 17919 13009 1 32 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.921 -0.391 17919 13010 1 32 . 1 1 48 48 LYS H H 48 7.980 7.980 7.737 0.243 17919 13011 1 32 . 1 1 49 49 GLN N N 49 122.410 122.410 126.076 -3.666 17919 13012 1 32 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.506 0.054 17919 13013 1 32 . 1 1 49 49 GLN C C 49 175.670 175.670 175.229 0.441 17919 13014 1 32 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.242 -0.502 17919 13015 1 32 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.400 -0.400 17919 13016 1 32 . 1 1 49 49 GLN H H 49 8.600 8.600 8.564 0.036 17919 13017 1 32 . 1 1 50 50 LEU N N 50 125.520 125.520 128.474 -2.954 17919 13018 1 32 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.190 -0.100 17919 13019 1 32 . 1 1 50 50 LEU C C 50 176.660 176.660 176.159 0.501 17919 13020 1 32 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.092 0.148 17919 13021 1 32 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.369 -0.799 17919 13022 1 32 . 1 1 50 50 LEU H H 50 8.530 8.530 8.716 -0.186 17919 13023 1 32 . 1 1 51 51 GLU N N 51 122.940 122.940 122.624 0.316 17919 13024 1 32 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.584 -0.096 17919 13025 1 32 . 1 1 51 51 GLU C C 51 175.870 175.870 176.402 -0.532 17919 13026 1 32 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.279 0.681 17919 13027 1 32 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.875 -0.305 17919 13028 1 32 . 1 1 51 51 GLU H H 51 8.400 8.400 8.141 0.259 17919 13029 1 32 . 1 1 52 52 ASP N N 52 120.030 120.030 125.198 -5.168 17919 13030 1 32 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.545 -0.186 17919 13031 1 32 . 1 1 52 52 ASP C C 52 177.330 177.330 177.960 -0.630 17919 13032 1 32 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.691 -0.730 17919 13033 1 32 . 1 1 52 52 ASP CB C 52 40.850 40.850 41.200 -0.350 17919 13034 1 32 . 1 1 52 52 ASP H H 52 8.160 8.160 8.947 -0.787 17919 13035 1 32 . 1 1 53 53 GLY N N 53 106.660 106.660 107.237 -0.577 17919 13036 1 32 . 1 1 53 53 GLY C C 53 174.870 174.870 174.527 0.343 17919 13037 1 32 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.081 0.089 17919 13038 1 32 . 1 1 53 53 GLY H H 53 9.390 9.390 8.409 0.981 17919 13039 1 32 . 1 1 54 54 ARG N N 54 119.050 119.050 121.202 -2.152 17919 13040 1 32 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.444 0.251 17919 13041 1 32 . 1 1 54 54 ARG C C 54 175.350 175.350 175.359 -0.009 17919 13042 1 32 . 1 1 54 54 ARG CA C 54 54.390 54.390 55.431 -1.042 17919 13043 1 32 . 1 1 54 54 ARG CB C 54 32.650 32.650 31.685 0.965 17919 13044 1 32 . 1 1 54 54 ARG H H 54 7.460 7.460 7.467 -0.007 17919 13045 1 32 . 1 1 55 55 THR N N 55 108.400 108.400 111.982 -3.582 17919 13046 1 32 . 1 1 55 55 THR HA H 55 5.240 5.240 4.837 0.403 17919 13047 1 32 . 1 1 55 55 THR C C 55 176.560 176.560 176.288 0.272 17919 13048 1 32 . 1 1 55 55 THR CA C 55 59.690 59.690 60.682 -0.992 17919 13049 1 32 . 1 1 55 55 THR CB C 55 72.260 72.260 70.474 1.786 17919 13050 1 32 . 1 1 55 55 THR H H 55 8.730 8.730 9.104 -0.374 17919 13051 1 32 . 1 1 56 56 LEU N N 56 117.920 117.920 121.313 -3.393 17919 13052 1 32 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.062 -0.002 17919 13053 1 32 . 1 1 56 56 LEU C C 56 180.810 180.810 179.108 1.702 17919 13054 1 32 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.210 0.500 17919 13055 1 32 . 1 1 56 56 LEU CB C 56 40.370 40.370 40.511 -0.141 17919 13056 1 32 . 1 1 56 56 LEU H H 56 8.140 8.140 8.134 0.006 17919 13057 1 32 . 1 1 57 57 SER N N 57 113.330 113.330 112.531 0.799 17919 13058 1 32 . 1 1 57 57 SER HA H 57 4.370 4.370 4.297 0.073 17919 13059 1 32 . 1 1 57 57 SER C C 57 178.310 178.310 175.620 2.690 17919 13060 1 32 . 1 1 57 57 SER CA C 57 61.080 61.080 61.100 -0.020 17919 13061 1 32 . 1 1 57 57 SER CB C 57 62.530 62.530 62.950 -0.420 17919 13062 1 32 . 1 1 57 57 SER H H 57 8.470 8.470 8.213 0.257 17919 13063 1 32 . 1 1 58 58 ASP N N 58 124.190 124.190 121.933 2.257 17919 13064 1 32 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.247 0.049 17919 13065 1 32 . 1 1 58 58 ASP C C 58 177.400 177.400 176.649 0.751 17919 13066 1 32 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.785 0.395 17919 13067 1 32 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.643 -0.543 17919 13068 1 32 . 1 1 58 58 ASP H H 58 7.930 7.930 7.741 0.189 17919 13069 1 32 . 1 1 59 59 TYR N N 59 115.510 115.510 114.439 1.071 17919 13070 1 32 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.702 -0.032 17919 13071 1 32 . 1 1 59 59 TYR C C 59 174.700 174.700 175.013 -0.313 17919 13072 1 32 . 1 1 59 59 TYR CA C 59 58.250 58.250 56.744 1.506 17919 13073 1 32 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.548 1.522 17919 13074 1 32 . 1 1 59 59 TYR H H 59 7.250 7.250 7.141 0.109 17919 13075 1 32 . 1 1 60 60 ASN N N 60 115.900 115.900 115.250 0.650 17919 13076 1 32 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.347 0.008 17919 13077 1 32 . 1 1 60 60 ASN C C 60 174.340 174.340 174.237 0.103 17919 13078 1 32 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.112 0.008 17919 13079 1 32 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.754 -0.344 17919 13080 1 32 . 1 1 60 60 ASN H H 60 8.150 8.150 7.624 0.526 17919 13081 1 32 . 1 1 61 61 ILE N N 61 118.600 118.600 119.574 -0.974 17919 13082 1 32 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.872 -0.479 17919 13083 1 32 . 1 1 61 61 ILE C C 61 174.610 174.610 175.105 -0.495 17919 13084 1 32 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.589 0.831 17919 13085 1 32 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.082 -0.342 17919 13086 1 32 . 1 1 61 61 ILE H H 61 7.250 7.250 7.903 -0.653 17919 13087 1 32 . 1 1 62 62 GLN N N 62 124.740 124.740 126.877 -2.137 17919 13088 1 32 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.666 -0.160 17919 13089 1 32 . 1 1 62 62 GLN C C 62 175.970 175.970 175.669 0.301 17919 13090 1 32 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.721 -0.061 17919 13091 1 32 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.394 0.256 17919 13092 1 32 . 1 1 62 62 GLN H H 62 7.610 7.610 7.863 -0.253 17919 13093 1 32 . 1 1 63 63 LYS N N 63 120.300 120.300 120.055 0.245 17919 13094 1 32 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.947 0.054 17919 13095 1 32 . 1 1 63 63 LYS C C 63 175.810 175.810 177.208 -1.398 17919 13096 1 32 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.966 -0.176 17919 13097 1 32 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.676 0.974 17919 13098 1 32 . 1 1 63 63 LYS H H 63 8.490 8.490 8.509 -0.019 17919 13099 1 32 . 1 1 64 64 GLU N N 64 113.950 113.950 119.878 -5.928 17919 13100 1 32 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.818 -0.353 17919 13101 1 32 . 1 1 64 64 GLU C C 64 175.250 175.250 175.701 -0.451 17919 13102 1 32 . 1 1 64 64 GLU CA C 64 57.890 57.890 58.517 -0.627 17919 13103 1 32 . 1 1 64 64 GLU CB C 64 25.900 25.900 29.001 -3.101 17919 13104 1 32 . 1 1 64 64 GLU H H 64 9.280 9.280 9.142 0.138 17919 13105 1 32 . 1 1 65 65 SER N N 65 114.730 114.730 117.041 -2.311 17919 13106 1 32 . 1 1 65 65 SER HA H 65 4.640 4.640 4.478 0.162 17919 13107 1 32 . 1 1 65 65 SER C C 65 172.160 172.160 174.666 -2.506 17919 13108 1 32 . 1 1 65 65 SER CA C 65 60.890 60.890 58.798 2.092 17919 13109 1 32 . 1 1 65 65 SER CB C 65 64.910 64.910 63.637 1.273 17919 13110 1 32 . 1 1 65 65 SER H H 65 7.670 7.670 7.778 -0.108 17919 13111 1 32 . 1 1 66 66 THR N N 66 117.110 117.110 121.877 -4.767 17919 13112 1 32 . 1 1 66 66 THR HA H 66 5.270 5.270 4.474 0.796 17919 13113 1 32 . 1 1 66 66 THR C C 66 173.950 173.950 174.567 -0.617 17919 13114 1 32 . 1 1 66 66 THR CA C 66 62.340 62.340 63.720 -1.380 17919 13115 1 32 . 1 1 66 66 THR CB C 66 70.080 70.080 69.475 0.605 17919 13116 1 32 . 1 1 66 66 THR H H 66 8.730 8.730 8.447 0.283 17919 13117 1 32 . 1 1 67 67 LEU N N 67 127.110 127.110 127.775 -0.665 17919 13118 1 32 . 1 1 67 67 LEU HA H 67 5.060 5.060 5.012 0.048 17919 13119 1 32 . 1 1 67 67 LEU C C 67 175.770 175.770 175.363 0.407 17919 13120 1 32 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.208 0.692 17919 13121 1 32 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.953 -0.693 17919 13122 1 32 . 1 1 67 67 LEU H H 67 9.410 9.410 9.086 0.324 17919 13123 1 32 . 1 1 68 68 HIS N N 68 118.380 118.380 122.290 -3.910 17919 13124 1 32 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.108 0.132 17919 13125 1 32 . 1 1 68 68 HIS C C 68 173.150 173.150 173.954 -0.804 17919 13126 1 32 . 1 1 68 68 HIS CA C 68 55.000 55.000 53.680 1.320 17919 13127 1 32 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.184 -1.653 17919 13128 1 32 . 1 1 68 68 HIS H H 68 9.230 9.230 8.548 0.682 17919 13129 1 32 . 1 1 69 69 LEU N N 69 124.460 124.460 131.245 -6.785 17919 13130 1 32 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.744 0.446 17919 13131 1 32 . 1 1 69 69 LEU C C 69 175.270 175.270 174.366 0.904 17919 13132 1 32 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.709 -0.819 17919 13133 1 32 . 1 1 69 69 LEU CB C 69 44.380 44.380 42.838 1.542 17919 13134 1 32 . 1 1 69 69 LEU H H 69 8.340 8.340 7.968 0.372 17919 13135 1 32 . 1 1 70 70 VAL N N 70 126.940 126.940 126.201 0.739 17919 13136 1 32 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.086 0.264 17919 13137 1 32 . 1 1 70 70 VAL C C 70 174.000 174.000 174.210 -0.210 17919 13138 1 32 . 1 1 70 70 VAL CA C 70 60.800 60.800 61.547 -0.747 17919 13139 1 32 . 1 1 70 70 VAL CB C 70 34.910 34.910 33.838 1.072 17919 13140 1 32 . 1 1 70 70 VAL H H 70 9.200 9.200 8.090 1.110 17919 13141 1 32 . 1 1 71 71 LEU N N 71 123.130 123.130 123.216 -0.086 17919 13142 1 32 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.080 -0.020 17919 13143 1 32 . 1 1 71 71 LEU C C 71 177.830 177.830 177.329 0.501 17919 13144 1 32 . 1 1 71 71 LEU CA C 71 53.940 53.940 52.451 1.489 17919 13145 1 32 . 1 1 71 71 LEU CB C 71 42.850 42.850 44.383 -1.533 17919 13146 1 32 . 1 1 71 71 LEU H H 71 8.120 8.120 8.398 -0.278 17919 13147 1 32 . 1 1 72 72 ARG N N 72 123.490 123.490 120.904 2.586 17919 13148 1 32 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.522 -0.221 17919 13149 1 32 . 1 1 72 72 ARG C C 72 175.350 175.350 175.632 -0.282 17919 13150 1 32 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.808 -0.198 17919 13151 1 32 . 1 1 72 72 ARG CB C 72 31.350 31.350 29.888 1.462 17919 13152 1 32 . 1 1 72 72 ARG H H 72 8.580 8.580 8.228 0.352 17919 13153 1 33 . 1 1 2 2 GLN N N 2 123.220 123.220 121.069 2.151 17919 13154 1 33 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.037 0.212 17919 13155 1 33 . 1 1 2 2 GLN C C 2 175.920 175.920 174.526 1.394 17919 13156 1 33 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.735 0.345 17919 13157 1 33 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.243 0.517 17919 13158 1 33 . 1 1 2 2 GLN H H 2 8.900 8.900 8.448 0.452 17919 13159 1 33 . 1 1 3 3 ILE N N 3 115.340 115.340 118.797 -3.457 17919 13160 1 33 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.114 0.099 17919 13161 1 33 . 1 1 3 3 ILE C C 3 172.450 172.450 173.615 -1.165 17919 13162 1 33 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.819 -0.249 17919 13163 1 33 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.463 0.747 17919 13164 1 33 . 1 1 3 3 ILE H H 3 8.320 8.320 8.202 0.118 17919 13165 1 33 . 1 1 4 4 PHE N N 4 118.110 118.110 122.275 -4.165 17919 13166 1 33 . 1 1 4 4 PHE HA H 4 5.630 5.630 4.777 0.853 17919 13167 1 33 . 1 1 4 4 PHE C C 4 175.320 175.320 175.152 0.168 17919 13168 1 33 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.569 -0.359 17919 13169 1 33 . 1 1 4 4 PHE CB C 4 41.480 41.480 40.098 1.382 17919 13170 1 33 . 1 1 4 4 PHE H H 4 8.610 8.610 7.965 0.645 17919 13171 1 33 . 1 1 5 5 VAL N N 5 121.000 121.000 122.091 -1.091 17919 13172 1 33 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.960 -0.235 17919 13173 1 33 . 1 1 5 5 VAL C C 5 174.870 174.870 174.815 0.055 17919 13174 1 33 . 1 1 5 5 VAL CA C 5 60.620 60.620 60.923 -0.303 17919 13175 1 33 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.236 -0.006 17919 13176 1 33 . 1 1 5 5 VAL H H 5 9.300 9.300 8.732 0.568 17919 13177 1 33 . 1 1 6 6 LYS N N 6 127.520 127.520 128.509 -0.989 17919 13178 1 33 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.042 0.325 17919 13179 1 33 . 1 1 6 6 LYS C C 6 177.140 177.140 176.155 0.985 17919 13180 1 33 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.516 0.004 17919 13181 1 33 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.592 -0.542 17919 13182 1 33 . 1 1 6 6 LYS H H 6 8.820 8.820 8.762 0.058 17919 13183 1 33 . 1 1 7 7 THR N N 7 115.400 115.400 116.686 -1.286 17919 13184 1 33 . 1 1 7 7 THR HA H 7 4.970 4.970 5.081 -0.111 17919 13185 1 33 . 1 1 7 7 THR C C 7 176.910 176.910 176.446 0.464 17919 13186 1 33 . 1 1 7 7 THR CA C 7 60.470 60.470 60.205 0.265 17919 13187 1 33 . 1 1 7 7 THR CB C 7 70.630 70.630 71.293 -0.663 17919 13188 1 33 . 1 1 7 7 THR H H 7 8.730 8.730 8.454 0.276 17919 13189 1 33 . 1 1 8 8 LEU N N 8 121.330 121.330 118.348 2.982 17919 13190 1 33 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.433 -0.123 17919 13191 1 33 . 1 1 8 8 LEU C C 8 178.800 178.800 178.629 0.171 17919 13192 1 33 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.654 -0.074 17919 13193 1 33 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.685 0.285 17919 13194 1 33 . 1 1 8 8 LEU H H 8 9.100 9.100 8.581 0.519 17919 13195 1 33 . 1 1 9 9 THR N N 9 105.590 105.590 111.145 -5.555 17919 13196 1 33 . 1 1 9 9 THR HA H 9 4.428 4.428 4.153 0.275 17919 13197 1 33 . 1 1 9 9 THR C C 9 175.520 175.520 175.526 -0.006 17919 13198 1 33 . 1 1 9 9 THR CA C 9 61.400 61.400 63.160 -1.760 17919 13199 1 33 . 1 1 9 9 THR CB C 9 69.140 69.140 67.108 2.032 17919 13200 1 33 . 1 1 9 9 THR H H 9 7.630 7.630 7.871 -0.241 17919 13201 1 33 . 1 1 10 10 GLY N N 10 108.890 108.890 109.978 -1.088 17919 13202 1 33 . 1 1 10 10 GLY C C 10 174.070 174.070 173.916 0.154 17919 13203 1 33 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.215 0.245 17919 13204 1 33 . 1 1 10 10 GLY H H 10 7.810 7.810 7.776 0.034 17919 13205 1 33 . 1 1 11 11 LYS N N 11 121.600 121.600 121.141 0.459 17919 13206 1 33 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.658 -0.297 17919 13207 1 33 . 1 1 11 11 LYS C C 11 175.940 175.940 175.330 0.610 17919 13208 1 33 . 1 1 11 11 LYS CA C 11 56.280 56.280 55.128 1.152 17919 13209 1 33 . 1 1 11 11 LYS CB C 11 33.200 33.200 34.647 -1.447 17919 13210 1 33 . 1 1 11 11 LYS H H 11 7.280 7.280 7.566 -0.286 17919 13211 1 33 . 1 1 12 12 THR N N 12 120.440 120.440 114.407 6.033 17919 13212 1 33 . 1 1 12 12 THR HA H 12 5.046 5.046 5.199 -0.153 17919 13213 1 33 . 1 1 12 12 THR C C 12 174.320 174.320 173.461 0.859 17919 13214 1 33 . 1 1 12 12 THR CA C 12 62.390 62.390 61.384 1.006 17919 13215 1 33 . 1 1 12 12 THR CB C 12 69.910 69.910 71.716 -1.806 17919 13216 1 33 . 1 1 12 12 THR H H 12 8.650 8.650 8.319 0.331 17919 13217 1 33 . 1 1 13 13 ILE N N 13 127.110 127.110 125.467 1.643 17919 13218 1 33 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.428 0.116 17919 13219 1 33 . 1 1 13 13 ILE C C 13 175.220 175.220 174.738 0.482 17919 13220 1 33 . 1 1 13 13 ILE CA C 13 59.980 59.980 61.110 -1.130 17919 13221 1 33 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.746 -0.796 17919 13222 1 33 . 1 1 13 13 ILE H H 13 9.450 9.450 9.207 0.243 17919 13223 1 33 . 1 1 14 14 THR N N 14 121.520 121.520 122.886 -1.366 17919 13224 1 33 . 1 1 14 14 THR HA H 14 4.964 4.964 4.519 0.445 17919 13225 1 33 . 1 1 14 14 THR C C 14 173.790 173.790 174.145 -0.355 17919 13226 1 33 . 1 1 14 14 THR CA C 14 61.940 61.940 63.704 -1.764 17919 13227 1 33 . 1 1 14 14 THR CB C 14 69.650 69.650 69.404 0.246 17919 13228 1 33 . 1 1 14 14 THR H H 14 8.710 8.710 8.484 0.226 17919 13229 1 33 . 1 1 15 15 LEU N N 15 124.800 124.800 128.427 -3.627 17919 13230 1 33 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.760 0.020 17919 13231 1 33 . 1 1 15 15 LEU C C 15 174.670 174.670 176.265 -1.595 17919 13232 1 33 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.545 -0.715 17919 13233 1 33 . 1 1 15 15 LEU CB C 15 47.070 47.070 44.963 2.107 17919 13234 1 33 . 1 1 15 15 LEU H H 15 8.710 8.710 8.429 0.281 17919 13235 1 33 . 1 1 16 16 GLU N N 16 122.160 122.160 122.344 -0.184 17919 13236 1 33 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.716 0.201 17919 13237 1 33 . 1 1 16 16 GLU C C 16 175.860 175.860 175.917 -0.057 17919 13238 1 33 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.558 -0.738 17919 13239 1 33 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.828 -1.378 17919 13240 1 33 . 1 1 16 16 GLU H H 16 8.140 8.140 8.461 -0.321 17919 13241 1 33 . 1 1 17 17 VAL N N 17 117.210 117.210 116.832 0.378 17919 13242 1 33 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.715 -0.001 17919 13243 1 33 . 1 1 17 17 VAL C C 17 174.160 174.160 174.889 -0.729 17919 13244 1 33 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.400 -0.970 17919 13245 1 33 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.189 1.211 17919 13246 1 33 . 1 1 17 17 VAL H H 17 8.900 8.900 8.830 0.070 17919 13247 1 33 . 1 1 18 18 GLU N N 18 118.990 118.990 121.464 -2.474 17919 13248 1 33 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.959 0.120 17919 13249 1 33 . 1 1 18 18 GLU C C 18 176.160 176.160 175.696 0.464 17919 13250 1 33 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.408 0.312 17919 13251 1 33 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.663 -0.353 17919 13252 1 33 . 1 1 18 18 GLU H H 18 8.640 8.640 8.507 0.133 17919 13253 1 33 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.144 -0.003 17919 13254 1 33 . 1 1 19 19 PRO C C 19 175.310 175.310 178.528 -3.218 17919 13255 1 33 . 1 1 19 19 PRO CA C 19 65.470 65.470 66.142 -0.672 17919 13256 1 33 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.885 0.065 17919 13257 1 33 . 1 1 20 20 SER N N 20 103.400 103.400 110.122 -6.722 17919 13258 1 33 . 1 1 20 20 SER HA H 20 4.370 4.370 4.314 0.056 17919 13259 1 33 . 1 1 20 20 SER C C 20 174.660 174.660 174.193 0.467 17919 13260 1 33 . 1 1 20 20 SER CA C 20 57.400 57.400 58.538 -1.138 17919 13261 1 33 . 1 1 20 20 SER CB C 20 63.370 63.370 62.892 0.478 17919 13262 1 33 . 1 1 20 20 SER H H 20 7.040 7.040 8.095 -1.055 17919 13263 1 33 . 1 1 21 21 ASP N N 21 123.480 123.480 123.401 0.079 17919 13264 1 33 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.728 -0.033 17919 13265 1 33 . 1 1 21 21 ASP C C 21 176.360 176.360 175.824 0.536 17919 13266 1 33 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.869 0.831 17919 13267 1 33 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.572 -0.772 17919 13268 1 33 . 1 1 21 21 ASP H H 21 8.030 8.030 7.631 0.399 17919 13269 1 33 . 1 1 22 22 THR N N 22 108.800 108.800 112.978 -4.178 17919 13270 1 33 . 1 1 22 22 THR HA H 22 4.920 4.920 4.512 0.408 17919 13271 1 33 . 1 1 22 22 THR C C 22 176.750 176.750 175.874 0.876 17919 13272 1 33 . 1 1 22 22 THR CA C 22 59.690 59.690 61.574 -1.884 17919 13273 1 33 . 1 1 22 22 THR CB C 22 71.200 71.200 70.230 0.970 17919 13274 1 33 . 1 1 22 22 THR H H 22 7.900 7.900 8.418 -0.518 17919 13275 1 33 . 1 1 23 23 ILE N N 23 121.190 121.190 123.625 -2.435 17919 13276 1 33 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.732 -0.075 17919 13277 1 33 . 1 1 23 23 ILE C C 23 179.040 179.040 177.641 1.399 17919 13278 1 33 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.886 -0.626 17919 13279 1 33 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.993 -2.643 17919 13280 1 33 . 1 1 23 23 ILE H H 23 8.560 8.560 8.994 -0.434 17919 13281 1 33 . 1 1 24 24 GLU N N 24 120.830 120.830 120.064 0.766 17919 13282 1 33 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.811 0.106 17919 13283 1 33 . 1 1 24 24 GLU C C 24 178.640 178.640 178.275 0.365 17919 13284 1 33 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.064 0.156 17919 13285 1 33 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.374 -1.094 17919 13286 1 33 . 1 1 24 24 GLU H H 24 9.760 9.760 8.695 1.065 17919 13287 1 33 . 1 1 25 25 ASN N N 25 120.570 120.570 118.055 2.515 17919 13288 1 33 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.474 0.051 17919 13289 1 33 . 1 1 25 25 ASN C C 25 178.380 178.380 177.855 0.525 17919 13290 1 33 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.186 -0.126 17919 13291 1 33 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.285 0.165 17919 13292 1 33 . 1 1 25 25 ASN H H 25 7.920 7.920 7.499 0.421 17919 13293 1 33 . 1 1 26 26 VAL N N 26 121.710 121.710 119.833 1.877 17919 13294 1 33 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.601 -0.204 17919 13295 1 33 . 1 1 26 26 VAL C C 26 177.950 177.950 178.031 -0.081 17919 13296 1 33 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.845 0.815 17919 13297 1 33 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.482 -0.642 17919 13298 1 33 . 1 1 26 26 VAL H H 26 8.070 8.070 7.744 0.326 17919 13299 1 33 . 1 1 27 27 LYS N N 27 118.860 118.860 119.689 -0.829 17919 13300 1 33 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.258 0.322 17919 13301 1 33 . 1 1 27 27 LYS C C 27 180.550 180.550 179.000 1.550 17919 13302 1 33 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.333 -0.083 17919 13303 1 33 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.373 1.357 17919 13304 1 33 . 1 1 27 27 LYS H H 27 8.560 8.560 7.992 0.568 17919 13305 1 33 . 1 1 28 28 ALA N N 28 123.440 123.440 123.074 0.366 17919 13306 1 33 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.065 0.095 17919 13307 1 33 . 1 1 28 28 ALA C C 28 180.300 180.300 179.069 1.231 17919 13308 1 33 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.031 0.340 17919 13309 1 33 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.364 -0.654 17919 13310 1 33 . 1 1 28 28 ALA H H 28 8.060 8.060 8.601 -0.541 17919 13311 1 33 . 1 1 29 29 LYS N N 29 119.940 119.940 119.813 0.127 17919 13312 1 33 . 1 1 29 29 LYS HA H 29 4.207 4.207 3.872 0.335 17919 13313 1 33 . 1 1 29 29 LYS C C 29 180.320 180.320 178.774 1.546 17919 13314 1 33 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.762 -0.112 17919 13315 1 33 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.211 1.079 17919 13316 1 33 . 1 1 29 29 LYS H H 29 7.850 7.850 7.817 0.033 17919 13317 1 33 . 1 1 30 30 ILE N N 30 121.080 121.080 119.354 1.726 17919 13318 1 33 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.555 -0.048 17919 13319 1 33 . 1 1 30 30 ILE C C 30 178.310 178.310 178.029 0.281 17919 13320 1 33 . 1 1 30 30 ILE CA C 30 66.150 66.150 64.963 1.188 17919 13321 1 33 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.520 -0.720 17919 13322 1 33 . 1 1 30 30 ILE H H 30 8.280 8.280 7.640 0.640 17919 13323 1 33 . 1 1 31 31 GLN N N 31 123.490 123.490 119.857 3.633 17919 13324 1 33 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.134 -0.305 17919 13325 1 33 . 1 1 31 31 GLN C C 31 178.890 178.890 177.999 0.891 17919 13326 1 33 . 1 1 31 31 GLN CA C 31 60.000 60.000 58.976 1.024 17919 13327 1 33 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.562 -0.842 17919 13328 1 33 . 1 1 31 31 GLN H H 31 8.580 8.580 8.228 0.352 17919 13329 1 33 . 1 1 32 32 ASP N N 32 119.360 119.360 118.507 0.853 17919 13330 1 33 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.493 -0.139 17919 13331 1 33 . 1 1 32 32 ASP C C 32 177.250 177.250 178.430 -1.180 17919 13332 1 33 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.602 0.588 17919 13333 1 33 . 1 1 32 32 ASP CB C 32 40.580 40.580 41.180 -0.600 17919 13334 1 33 . 1 1 32 32 ASP H H 32 8.010 8.010 8.103 -0.093 17919 13335 1 33 . 1 1 33 33 LYS N N 33 115.130 115.130 118.283 -3.153 17919 13336 1 33 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.317 0.019 17919 13337 1 33 . 1 1 33 33 LYS C C 33 177.870 177.870 178.097 -0.227 17919 13338 1 33 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.956 0.094 17919 13339 1 33 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.691 0.478 17919 13340 1 33 . 1 1 33 33 LYS H H 33 7.430 7.430 8.000 -0.570 17919 13341 1 33 . 1 1 34 34 GLU N N 34 113.870 113.870 116.047 -2.177 17919 13342 1 33 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.514 0.111 17919 13343 1 33 . 1 1 34 34 GLU C C 34 177.840 177.840 176.786 1.054 17919 13344 1 33 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.672 -0.502 17919 13345 1 33 . 1 1 34 34 GLU CB C 34 32.660 32.660 30.989 1.671 17919 13346 1 33 . 1 1 34 34 GLU H H 34 8.740 8.740 8.049 0.691 17919 13347 1 33 . 1 1 35 35 GLY N N 35 108.650 108.650 107.297 1.353 17919 13348 1 33 . 1 1 35 35 GLY C C 35 173.960 173.960 174.048 -0.088 17919 13349 1 33 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.131 0.949 17919 13350 1 33 . 1 1 35 35 GLY H H 35 8.530 8.530 7.899 0.631 17919 13351 1 33 . 1 1 36 36 ILE N N 36 119.880 119.880 122.020 -2.140 17919 13352 1 33 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.432 0.013 17919 13353 1 33 . 1 1 36 36 ILE C C 36 173.590 173.590 173.937 -0.347 17919 13354 1 33 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.740 0.010 17919 13355 1 33 . 1 1 36 36 ILE CB C 36 40.580 40.580 39.823 0.757 17919 13356 1 33 . 1 1 36 36 ILE H H 36 6.150 6.150 7.505 -1.355 17919 13357 1 33 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.618 0.016 17919 13358 1 33 . 1 1 37 37 PRO C C 37 176.940 176.940 176.023 0.917 17919 13359 1 33 . 1 1 37 37 PRO CA C 37 61.660 61.660 62.268 -0.608 17919 13360 1 33 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.553 0.297 17919 13361 1 33 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.136 -0.019 17919 13362 1 33 . 1 1 38 38 PRO C C 38 178.320 178.320 178.372 -0.052 17919 13363 1 33 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.769 0.491 17919 13364 1 33 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.940 0.950 17919 13365 1 33 . 1 1 39 39 ASP N N 39 113.380 113.380 115.361 -1.981 17919 13366 1 33 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.214 0.216 17919 13367 1 33 . 1 1 39 39 ASP C C 39 177.090 177.090 177.462 -0.372 17919 13368 1 33 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.858 -1.218 17919 13369 1 33 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.416 -0.876 17919 13370 1 33 . 1 1 39 39 ASP H H 39 8.550 8.550 8.742 -0.192 17919 13371 1 33 . 1 1 40 40 GLN N N 40 116.780 116.780 115.087 1.693 17919 13372 1 33 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.260 0.204 17919 13373 1 33 . 1 1 40 40 GLN C C 40 175.380 175.380 176.641 -1.261 17919 13374 1 33 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.098 -0.458 17919 13375 1 33 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.212 0.928 17919 13376 1 33 . 1 1 40 40 GLN H H 40 7.820 7.820 7.742 0.078 17919 13377 1 33 . 1 1 41 41 GLN N N 41 117.720 117.720 120.069 -2.349 17919 13378 1 33 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.262 -0.018 17919 13379 1 33 . 1 1 41 41 GLN C C 41 176.300 176.300 175.322 0.978 17919 13380 1 33 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.612 -0.142 17919 13381 1 33 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.126 2.524 17919 13382 1 33 . 1 1 41 41 GLN H H 41 7.480 7.480 7.691 -0.211 17919 13383 1 33 . 1 1 42 42 ARG N N 42 122.680 122.680 124.120 -1.440 17919 13384 1 33 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.590 -0.090 17919 13385 1 33 . 1 1 42 42 ARG C C 42 174.050 174.050 174.103 -0.053 17919 13386 1 33 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.958 0.092 17919 13387 1 33 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.523 -0.773 17919 13388 1 33 . 1 1 42 42 ARG H H 42 8.530 8.530 8.505 0.025 17919 13389 1 33 . 1 1 43 43 LEU N N 43 124.040 124.040 126.573 -2.533 17919 13390 1 33 . 1 1 43 43 LEU C C 43 175.290 175.290 174.910 0.380 17919 13391 1 33 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.861 -0.881 17919 13392 1 33 . 1 1 43 43 LEU CB C 43 45.790 45.790 42.502 3.288 17919 13393 1 33 . 1 1 43 43 LEU H H 43 8.820 8.820 8.871 -0.051 17919 13394 1 33 . 1 1 44 44 ILE N N 44 121.920 121.920 125.387 -3.467 17919 13395 1 33 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.062 -0.070 17919 13396 1 33 . 1 1 44 44 ILE C C 44 176.060 176.060 174.614 1.446 17919 13397 1 33 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.213 -0.233 17919 13398 1 33 . 1 1 44 44 ILE CB C 44 41.420 41.420 39.029 2.391 17919 13399 1 33 . 1 1 44 44 ILE H H 44 9.030 9.030 8.734 0.296 17919 13400 1 33 . 1 1 45 45 PHE N N 45 125.390 125.390 128.317 -2.927 17919 13401 1 33 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.961 0.084 17919 13402 1 33 . 1 1 45 45 PHE C C 45 174.470 174.470 174.310 0.160 17919 13403 1 33 . 1 1 45 45 PHE CA C 45 57.020 57.020 55.733 1.287 17919 13404 1 33 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.224 0.536 17919 13405 1 33 . 1 1 45 45 PHE H H 45 8.830 8.830 8.989 -0.159 17919 13406 1 33 . 1 1 46 46 ALA N N 46 132.200 132.200 129.322 2.878 17919 13407 1 33 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.540 0.150 17919 13408 1 33 . 1 1 46 46 ALA C C 46 177.290 177.290 177.431 -0.141 17919 13409 1 33 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.897 -0.357 17919 13410 1 33 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.303 0.267 17919 13411 1 33 . 1 1 46 46 ALA H H 46 8.810 8.810 8.331 0.479 17919 13412 1 33 . 1 1 47 47 GLY N N 47 102.340 102.340 105.103 -2.763 17919 13413 1 33 . 1 1 47 47 GLY C C 47 173.810 173.810 174.362 -0.552 17919 13414 1 33 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.548 -0.198 17919 13415 1 33 . 1 1 47 47 GLY H H 47 8.130 8.130 8.447 -0.317 17919 13416 1 33 . 1 1 48 48 LYS N N 48 121.570 121.570 121.951 -0.381 17919 13417 1 33 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.672 -0.050 17919 13418 1 33 . 1 1 48 48 LYS C C 48 174.700 174.700 174.966 -0.266 17919 13419 1 33 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.982 -0.432 17919 13420 1 33 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.665 -0.135 17919 13421 1 33 . 1 1 48 48 LYS H H 48 7.980 7.980 7.874 0.106 17919 13422 1 33 . 1 1 49 49 GLN N N 49 122.410 122.410 124.121 -1.711 17919 13423 1 33 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.897 -0.337 17919 13424 1 33 . 1 1 49 49 GLN C C 49 175.670 175.670 174.955 0.715 17919 13425 1 33 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.582 0.158 17919 13426 1 33 . 1 1 49 49 GLN CB C 49 29.000 29.000 28.955 0.045 17919 13427 1 33 . 1 1 49 49 GLN H H 49 8.600 8.600 8.493 0.107 17919 13428 1 33 . 1 1 50 50 LEU N N 50 125.520 125.520 127.363 -1.843 17919 13429 1 33 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.172 -0.082 17919 13430 1 33 . 1 1 50 50 LEU C C 50 176.660 176.660 175.760 0.900 17919 13431 1 33 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.802 0.438 17919 13432 1 33 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.494 -0.924 17919 13433 1 33 . 1 1 50 50 LEU H H 50 8.530 8.530 8.470 0.060 17919 13434 1 33 . 1 1 51 51 GLU N N 51 122.940 122.940 123.696 -0.756 17919 13435 1 33 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.489 -0.001 17919 13436 1 33 . 1 1 51 51 GLU C C 51 175.870 175.870 176.896 -1.026 17919 13437 1 33 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.696 0.264 17919 13438 1 33 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.524 0.046 17919 13439 1 33 . 1 1 51 51 GLU H H 51 8.400 8.400 8.411 -0.011 17919 13440 1 33 . 1 1 52 52 ASP N N 52 120.030 120.030 121.265 -1.235 17919 13441 1 33 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.607 -0.248 17919 13442 1 33 . 1 1 52 52 ASP C C 52 177.330 177.330 177.413 -0.083 17919 13443 1 33 . 1 1 52 52 ASP CA C 52 56.960 56.960 56.361 0.599 17919 13444 1 33 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.885 -0.035 17919 13445 1 33 . 1 1 52 52 ASP H H 52 8.160 8.160 8.711 -0.551 17919 13446 1 33 . 1 1 53 53 GLY N N 53 106.660 106.660 106.014 0.646 17919 13447 1 33 . 1 1 53 53 GLY C C 53 174.870 174.870 174.330 0.540 17919 13448 1 33 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.983 0.187 17919 13449 1 33 . 1 1 53 53 GLY H H 53 9.390 9.390 8.608 0.782 17919 13450 1 33 . 1 1 54 54 ARG N N 54 119.050 119.050 121.887 -2.837 17919 13451 1 33 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.712 -0.017 17919 13452 1 33 . 1 1 54 54 ARG C C 54 175.350 175.350 175.618 -0.268 17919 13453 1 33 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.628 -0.238 17919 13454 1 33 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.160 0.490 17919 13455 1 33 . 1 1 54 54 ARG H H 54 7.460 7.460 7.487 -0.027 17919 13456 1 33 . 1 1 55 55 THR N N 55 108.400 108.400 113.399 -4.999 17919 13457 1 33 . 1 1 55 55 THR HA H 55 5.240 5.240 5.099 0.141 17919 13458 1 33 . 1 1 55 55 THR C C 55 176.560 176.560 176.141 0.419 17919 13459 1 33 . 1 1 55 55 THR CA C 55 59.690 59.690 60.271 -0.581 17919 13460 1 33 . 1 1 55 55 THR CB C 55 72.260 72.260 71.206 1.054 17919 13461 1 33 . 1 1 55 55 THR H H 55 8.730 8.730 9.254 -0.524 17919 13462 1 33 . 1 1 56 56 LEU N N 56 117.920 117.920 120.787 -2.867 17919 13463 1 33 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.116 -0.056 17919 13464 1 33 . 1 1 56 56 LEU C C 56 180.810 180.810 179.028 1.782 17919 13465 1 33 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.480 0.230 17919 13466 1 33 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.343 -0.973 17919 13467 1 33 . 1 1 56 56 LEU H H 56 8.140 8.140 8.392 -0.252 17919 13468 1 33 . 1 1 57 57 SER N N 57 113.330 113.330 113.446 -0.116 17919 13469 1 33 . 1 1 57 57 SER HA H 57 4.370 4.370 4.329 0.041 17919 13470 1 33 . 1 1 57 57 SER C C 57 178.310 178.310 176.403 1.907 17919 13471 1 33 . 1 1 57 57 SER CA C 57 61.080 61.080 61.922 -0.842 17919 13472 1 33 . 1 1 57 57 SER CB C 57 62.530 62.530 62.857 -0.327 17919 13473 1 33 . 1 1 57 57 SER H H 57 8.470 8.470 8.414 0.056 17919 13474 1 33 . 1 1 58 58 ASP N N 58 124.190 124.190 122.119 2.071 17919 13475 1 33 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.427 -0.131 17919 13476 1 33 . 1 1 58 58 ASP C C 58 177.400 177.400 177.017 0.383 17919 13477 1 33 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.776 0.404 17919 13478 1 33 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.667 -0.567 17919 13479 1 33 . 1 1 58 58 ASP H H 58 7.930 7.930 7.670 0.260 17919 13480 1 33 . 1 1 59 59 TYR N N 59 115.510 115.510 115.653 -0.143 17919 13481 1 33 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.688 -0.018 17919 13482 1 33 . 1 1 59 59 TYR C C 59 174.700 174.700 174.803 -0.103 17919 13483 1 33 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.214 1.036 17919 13484 1 33 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.390 1.680 17919 13485 1 33 . 1 1 59 59 TYR H H 59 7.250 7.250 7.466 -0.216 17919 13486 1 33 . 1 1 60 60 ASN N N 60 115.900 115.900 117.346 -1.446 17919 13487 1 33 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.409 -0.054 17919 13488 1 33 . 1 1 60 60 ASN C C 60 174.340 174.340 175.156 -0.816 17919 13489 1 33 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.516 -0.396 17919 13490 1 33 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.582 -0.172 17919 13491 1 33 . 1 1 60 60 ASN H H 60 8.150 8.150 7.891 0.259 17919 13492 1 33 . 1 1 61 61 ILE N N 61 118.600 118.600 119.816 -1.216 17919 13493 1 33 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.703 -0.310 17919 13494 1 33 . 1 1 61 61 ILE C C 61 174.610 174.610 175.729 -1.119 17919 13495 1 33 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.310 0.110 17919 13496 1 33 . 1 1 61 61 ILE CB C 61 36.740 36.740 36.585 0.155 17919 13497 1 33 . 1 1 61 61 ILE H H 61 7.250 7.250 8.413 -1.163 17919 13498 1 33 . 1 1 62 62 GLN N N 62 124.740 124.740 126.165 -1.425 17919 13499 1 33 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.553 -0.047 17919 13500 1 33 . 1 1 62 62 GLN C C 62 175.970 175.970 174.937 1.033 17919 13501 1 33 . 1 1 62 62 GLN CA C 62 53.660 53.660 52.886 0.774 17919 13502 1 33 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.821 -0.171 17919 13503 1 33 . 1 1 62 62 GLN H H 62 7.610 7.610 8.141 -0.531 17919 13504 1 33 . 1 1 63 63 LYS N N 63 120.300 120.300 120.601 -0.301 17919 13505 1 33 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.788 0.213 17919 13506 1 33 . 1 1 63 63 LYS C C 63 175.810 175.810 176.658 -0.848 17919 13507 1 33 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.048 -0.258 17919 13508 1 33 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.374 1.276 17919 13509 1 33 . 1 1 63 63 LYS H H 63 8.490 8.490 8.670 -0.180 17919 13510 1 33 . 1 1 64 64 GLU N N 64 113.950 113.950 116.799 -2.849 17919 13511 1 33 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.084 0.381 17919 13512 1 33 . 1 1 64 64 GLU C C 64 175.250 175.250 175.116 0.134 17919 13513 1 33 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.376 0.514 17919 13514 1 33 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.359 -2.459 17919 13515 1 33 . 1 1 64 64 GLU H H 64 9.280 9.280 8.457 0.823 17919 13516 1 33 . 1 1 65 65 SER N N 65 114.730 114.730 115.709 -0.979 17919 13517 1 33 . 1 1 65 65 SER HA H 65 4.640 4.640 4.265 0.375 17919 13518 1 33 . 1 1 65 65 SER C C 65 172.160 172.160 174.300 -2.140 17919 13519 1 33 . 1 1 65 65 SER CA C 65 60.890 60.890 60.051 0.839 17919 13520 1 33 . 1 1 65 65 SER CB C 65 64.910 64.910 63.214 1.696 17919 13521 1 33 . 1 1 65 65 SER H H 65 7.670 7.670 7.425 0.245 17919 13522 1 33 . 1 1 66 66 THR N N 66 117.110 117.110 122.401 -5.291 17919 13523 1 33 . 1 1 66 66 THR HA H 66 5.270 5.270 4.880 0.390 17919 13524 1 33 . 1 1 66 66 THR C C 66 173.950 173.950 174.110 -0.160 17919 13525 1 33 . 1 1 66 66 THR CA C 66 62.340 62.340 62.621 -0.281 17919 13526 1 33 . 1 1 66 66 THR CB C 66 70.080 70.080 69.840 0.240 17919 13527 1 33 . 1 1 66 66 THR H H 66 8.730 8.730 8.338 0.392 17919 13528 1 33 . 1 1 67 67 LEU N N 67 127.110 127.110 127.416 -0.306 17919 13529 1 33 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.969 0.091 17919 13530 1 33 . 1 1 67 67 LEU C C 67 175.770 175.770 175.464 0.306 17919 13531 1 33 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.492 0.408 17919 13532 1 33 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.502 0.758 17919 13533 1 33 . 1 1 67 67 LEU H H 67 9.410 9.410 9.028 0.382 17919 13534 1 33 . 1 1 68 68 HIS N N 68 118.380 118.380 124.494 -6.114 17919 13535 1 33 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.112 0.128 17919 13536 1 33 . 1 1 68 68 HIS C C 68 173.150 173.150 174.204 -1.054 17919 13537 1 33 . 1 1 68 68 HIS CA C 68 55.000 55.000 53.629 1.371 17919 13538 1 33 . 1 1 68 68 HIS CB C 68 30.530 30.530 30.839 -0.309 17919 13539 1 33 . 1 1 68 68 HIS H H 68 9.230 9.230 9.170 0.060 17919 13540 1 33 . 1 1 69 69 LEU N N 69 124.460 124.460 131.326 -6.866 17919 13541 1 33 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.624 0.566 17919 13542 1 33 . 1 1 69 69 LEU C C 69 175.270 175.270 174.950 0.320 17919 13543 1 33 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.693 -0.803 17919 13544 1 33 . 1 1 69 69 LEU CB C 69 44.380 44.380 42.189 2.191 17919 13545 1 33 . 1 1 69 69 LEU H H 69 8.340 8.340 7.883 0.457 17919 13546 1 33 . 1 1 70 70 VAL N N 70 126.940 126.940 127.297 -0.357 17919 13547 1 33 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.020 0.330 17919 13548 1 33 . 1 1 70 70 VAL C C 70 174.000 174.000 174.885 -0.885 17919 13549 1 33 . 1 1 70 70 VAL CA C 70 60.800 60.800 61.403 -0.603 17919 13550 1 33 . 1 1 70 70 VAL CB C 70 34.910 34.910 32.456 2.454 17919 13551 1 33 . 1 1 70 70 VAL H H 70 9.200 9.200 8.963 0.237 17919 13552 1 33 . 1 1 71 71 LEU N N 71 123.130 123.130 127.158 -4.028 17919 13553 1 33 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.340 0.720 17919 13554 1 33 . 1 1 71 71 LEU C C 71 177.830 177.830 176.827 1.003 17919 13555 1 33 . 1 1 71 71 LEU CA C 71 53.940 53.940 54.348 -0.408 17919 13556 1 33 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.742 0.108 17919 13557 1 33 . 1 1 71 71 LEU H H 71 8.120 8.120 8.656 -0.536 17919 13558 1 33 . 1 1 72 72 ARG N N 72 123.490 123.490 124.042 -0.552 17919 13559 1 33 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.342 -0.041 17919 13560 1 33 . 1 1 72 72 ARG C C 72 175.350 175.350 175.700 -0.350 17919 13561 1 33 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.749 -0.139 17919 13562 1 33 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.780 0.570 17919 13563 1 33 . 1 1 72 72 ARG H H 72 8.580 8.580 8.110 0.470 17919 13564 1 34 . 1 1 2 2 GLN N N 2 123.220 123.220 121.419 1.801 17919 13565 1 34 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.007 0.242 17919 13566 1 34 . 1 1 2 2 GLN C C 2 175.920 175.920 175.829 0.091 17919 13567 1 34 . 1 1 2 2 GLN CA C 2 55.080 55.080 55.592 -0.512 17919 13568 1 34 . 1 1 2 2 GLN CB C 2 30.760 30.760 29.432 1.328 17919 13569 1 34 . 1 1 2 2 GLN H H 2 8.900 8.900 8.587 0.313 17919 13570 1 34 . 1 1 3 3 ILE N N 3 115.340 115.340 117.220 -1.880 17919 13571 1 34 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.725 -0.512 17919 13572 1 34 . 1 1 3 3 ILE C C 3 172.450 172.450 174.267 -1.817 17919 13573 1 34 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.033 0.537 17919 13574 1 34 . 1 1 3 3 ILE CB C 3 42.210 42.210 40.577 1.633 17919 13575 1 34 . 1 1 3 3 ILE H H 3 8.320 8.320 8.530 -0.210 17919 13576 1 34 . 1 1 4 4 PHE N N 4 118.110 118.110 120.742 -2.632 17919 13577 1 34 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.296 0.334 17919 13578 1 34 . 1 1 4 4 PHE C C 4 175.320 175.320 175.232 0.088 17919 13579 1 34 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.712 -0.502 17919 13580 1 34 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.757 -0.277 17919 13581 1 34 . 1 1 4 4 PHE H H 4 8.610 8.610 8.592 0.018 17919 13582 1 34 . 1 1 5 5 VAL N N 5 121.000 121.000 121.632 -0.632 17919 13583 1 34 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.884 -0.159 17919 13584 1 34 . 1 1 5 5 VAL C C 5 174.870 174.870 174.839 0.031 17919 13585 1 34 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.256 -0.636 17919 13586 1 34 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.854 0.376 17919 13587 1 34 . 1 1 5 5 VAL H H 5 9.300 9.300 9.093 0.207 17919 13588 1 34 . 1 1 6 6 LYS N N 6 127.520 127.520 129.131 -1.611 17919 13589 1 34 . 1 1 6 6 LYS HA H 6 5.367 5.367 4.699 0.668 17919 13590 1 34 . 1 1 6 6 LYS C C 6 177.140 177.140 176.129 1.011 17919 13591 1 34 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.602 -0.082 17919 13592 1 34 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.068 0.982 17919 13593 1 34 . 1 1 6 6 LYS H H 6 8.820 8.820 8.660 0.160 17919 13594 1 34 . 1 1 7 7 THR N N 7 115.400 115.400 117.761 -2.361 17919 13595 1 34 . 1 1 7 7 THR HA H 7 4.970 4.970 4.395 0.575 17919 13596 1 34 . 1 1 7 7 THR C C 7 176.910 176.910 176.044 0.866 17919 13597 1 34 . 1 1 7 7 THR CA C 7 60.470 60.470 59.986 0.484 17919 13598 1 34 . 1 1 7 7 THR CB C 7 70.630 70.630 70.067 0.563 17919 13599 1 34 . 1 1 7 7 THR H H 7 8.730 8.730 8.005 0.725 17919 13600 1 34 . 1 1 8 8 LEU N N 8 121.330 121.330 122.911 -1.581 17919 13601 1 34 . 1 1 8 8 LEU HA H 8 4.310 4.310 3.983 0.327 17919 13602 1 34 . 1 1 8 8 LEU C C 8 178.800 178.800 177.498 1.302 17919 13603 1 34 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.582 -0.002 17919 13604 1 34 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.752 0.218 17919 13605 1 34 . 1 1 8 8 LEU H H 8 9.100 9.100 8.406 0.694 17919 13606 1 34 . 1 1 9 9 THR N N 9 105.590 105.590 106.759 -1.169 17919 13607 1 34 . 1 1 9 9 THR HA H 9 4.428 4.428 4.286 0.142 17919 13608 1 34 . 1 1 9 9 THR C C 9 175.520 175.520 175.267 0.253 17919 13609 1 34 . 1 1 9 9 THR CA C 9 61.400 61.400 62.021 -0.621 17919 13610 1 34 . 1 1 9 9 THR CB C 9 69.140 69.140 68.618 0.521 17919 13611 1 34 . 1 1 9 9 THR H H 9 7.630 7.630 7.731 -0.101 17919 13612 1 34 . 1 1 10 10 GLY N N 10 108.890 108.890 110.340 -1.450 17919 13613 1 34 . 1 1 10 10 GLY C C 10 174.070 174.070 173.880 0.190 17919 13614 1 34 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.849 0.612 17919 13615 1 34 . 1 1 10 10 GLY H H 10 7.810 7.810 7.694 0.116 17919 13616 1 34 . 1 1 11 11 LYS N N 11 121.600 121.600 121.327 0.273 17919 13617 1 34 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.401 -0.040 17919 13618 1 34 . 1 1 11 11 LYS C C 11 175.940 175.940 175.143 0.797 17919 13619 1 34 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.197 0.083 17919 13620 1 34 . 1 1 11 11 LYS CB C 11 33.200 33.200 32.833 0.367 17919 13621 1 34 . 1 1 11 11 LYS H H 11 7.280 7.280 7.860 -0.580 17919 13622 1 34 . 1 1 12 12 THR N N 12 120.440 120.440 115.721 4.719 17919 13623 1 34 . 1 1 12 12 THR HA H 12 5.046 5.046 5.092 -0.046 17919 13624 1 34 . 1 1 12 12 THR C C 12 174.320 174.320 173.912 0.408 17919 13625 1 34 . 1 1 12 12 THR CA C 12 62.390 62.390 61.618 0.772 17919 13626 1 34 . 1 1 12 12 THR CB C 12 69.910 69.910 70.953 -1.043 17919 13627 1 34 . 1 1 12 12 THR H H 12 8.650 8.650 8.180 0.470 17919 13628 1 34 . 1 1 13 13 ILE N N 13 127.110 127.110 125.422 1.688 17919 13629 1 34 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.578 -0.034 17919 13630 1 34 . 1 1 13 13 ILE C C 13 175.220 175.220 174.760 0.460 17919 13631 1 34 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.451 -0.471 17919 13632 1 34 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.220 -0.270 17919 13633 1 34 . 1 1 13 13 ILE H H 13 9.450 9.450 8.666 0.784 17919 13634 1 34 . 1 1 14 14 THR N N 14 121.520 121.520 121.885 -0.365 17919 13635 1 34 . 1 1 14 14 THR HA H 14 4.964 4.964 5.123 -0.159 17919 13636 1 34 . 1 1 14 14 THR C C 14 173.790 173.790 174.145 -0.355 17919 13637 1 34 . 1 1 14 14 THR CA C 14 61.940 61.940 61.599 0.341 17919 13638 1 34 . 1 1 14 14 THR CB C 14 69.650 69.650 69.934 -0.284 17919 13639 1 34 . 1 1 14 14 THR H H 14 8.710 8.710 8.483 0.227 17919 13640 1 34 . 1 1 15 15 LEU N N 15 124.800 124.800 125.326 -0.526 17919 13641 1 34 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.803 -0.023 17919 13642 1 34 . 1 1 15 15 LEU C C 15 174.670 174.670 174.474 0.196 17919 13643 1 34 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.721 -0.891 17919 13644 1 34 . 1 1 15 15 LEU CB C 15 47.070 47.070 46.801 0.269 17919 13645 1 34 . 1 1 15 15 LEU H H 15 8.710 8.710 8.435 0.275 17919 13646 1 34 . 1 1 16 16 GLU N N 16 122.160 122.160 122.865 -0.705 17919 13647 1 34 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.944 -0.027 17919 13648 1 34 . 1 1 16 16 GLU C C 16 175.860 175.860 175.493 0.367 17919 13649 1 34 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.015 -0.195 17919 13650 1 34 . 1 1 16 16 GLU CB C 16 29.450 29.450 29.758 -0.307 17919 13651 1 34 . 1 1 16 16 GLU H H 16 8.140 8.140 8.556 -0.416 17919 13652 1 34 . 1 1 17 17 VAL N N 17 117.210 117.210 120.679 -3.469 17919 13653 1 34 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.997 -0.283 17919 13654 1 34 . 1 1 17 17 VAL C C 17 174.160 174.160 175.162 -1.002 17919 13655 1 34 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.187 -0.757 17919 13656 1 34 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.292 1.108 17919 13657 1 34 . 1 1 17 17 VAL H H 17 8.900 8.900 8.496 0.404 17919 13658 1 34 . 1 1 18 18 GLU N N 18 118.990 118.990 120.390 -1.400 17919 13659 1 34 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.658 0.421 17919 13660 1 34 . 1 1 18 18 GLU C C 18 176.160 176.160 174.914 1.246 17919 13661 1 34 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.820 -0.100 17919 13662 1 34 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.652 -0.342 17919 13663 1 34 . 1 1 18 18 GLU H H 18 8.640 8.640 8.112 0.528 17919 13664 1 34 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.473 -0.332 17919 13665 1 34 . 1 1 19 19 PRO C C 19 175.310 175.310 178.066 -2.756 17919 13666 1 34 . 1 1 19 19 PRO CA C 19 65.470 65.470 64.877 0.593 17919 13667 1 34 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.574 -0.624 17919 13668 1 34 . 1 1 20 20 SER N N 20 103.400 103.400 113.568 -10.168 17919 13669 1 34 . 1 1 20 20 SER HA H 20 4.370 4.370 4.207 0.163 17919 13670 1 34 . 1 1 20 20 SER C C 20 174.660 174.660 174.575 0.085 17919 13671 1 34 . 1 1 20 20 SER CA C 20 57.400 57.400 60.620 -3.220 17919 13672 1 34 . 1 1 20 20 SER CB C 20 63.370 63.370 62.903 0.467 17919 13673 1 34 . 1 1 20 20 SER H H 20 7.040 7.040 8.279 -1.239 17919 13674 1 34 . 1 1 21 21 ASP N N 21 123.480 123.480 121.757 1.723 17919 13675 1 34 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.732 -0.037 17919 13676 1 34 . 1 1 21 21 ASP C C 21 176.360 176.360 176.096 0.264 17919 13677 1 34 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.561 1.139 17919 13678 1 34 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.512 -0.712 17919 13679 1 34 . 1 1 21 21 ASP H H 21 8.030 8.030 7.959 0.071 17919 13680 1 34 . 1 1 22 22 THR N N 22 108.800 108.800 114.083 -5.283 17919 13681 1 34 . 1 1 22 22 THR HA H 22 4.920 4.920 4.603 0.317 17919 13682 1 34 . 1 1 22 22 THR C C 22 176.750 176.750 176.143 0.607 17919 13683 1 34 . 1 1 22 22 THR CA C 22 59.690 59.690 61.267 -1.577 17919 13684 1 34 . 1 1 22 22 THR CB C 22 71.200 71.200 70.859 0.341 17919 13685 1 34 . 1 1 22 22 THR H H 22 7.900 7.900 8.185 -0.285 17919 13686 1 34 . 1 1 23 23 ILE N N 23 121.190 121.190 121.830 -0.640 17919 13687 1 34 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.779 -0.122 17919 13688 1 34 . 1 1 23 23 ILE C C 23 179.040 179.040 177.922 1.118 17919 13689 1 34 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.603 -0.343 17919 13690 1 34 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.257 -1.907 17919 13691 1 34 . 1 1 23 23 ILE H H 23 8.560 8.560 9.280 -0.720 17919 13692 1 34 . 1 1 24 24 GLU N N 24 120.830 120.830 120.619 0.211 17919 13693 1 34 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.925 -0.008 17919 13694 1 34 . 1 1 24 24 GLU C C 24 178.640 178.640 178.672 -0.032 17919 13695 1 34 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.132 0.088 17919 13696 1 34 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.445 -1.165 17919 13697 1 34 . 1 1 24 24 GLU H H 24 9.760 9.760 8.084 1.676 17919 13698 1 34 . 1 1 25 25 ASN N N 25 120.570 120.570 118.674 1.896 17919 13699 1 34 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.471 0.054 17919 13700 1 34 . 1 1 25 25 ASN C C 25 178.380 178.380 178.003 0.377 17919 13701 1 34 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.962 0.098 17919 13702 1 34 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.034 0.416 17919 13703 1 34 . 1 1 25 25 ASN H H 25 7.920 7.920 7.850 0.070 17919 13704 1 34 . 1 1 26 26 VAL N N 26 121.710 121.710 120.774 0.936 17919 13705 1 34 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.529 -0.132 17919 13706 1 34 . 1 1 26 26 VAL C C 26 177.950 177.950 177.648 0.302 17919 13707 1 34 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.781 0.879 17919 13708 1 34 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.008 -0.168 17919 13709 1 34 . 1 1 26 26 VAL H H 26 8.070 8.070 8.229 -0.159 17919 13710 1 34 . 1 1 27 27 LYS N N 27 118.860 118.860 119.887 -1.027 17919 13711 1 34 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.232 0.348 17919 13712 1 34 . 1 1 27 27 LYS C C 27 180.550 180.550 179.268 1.282 17919 13713 1 34 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.752 -0.502 17919 13714 1 34 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.190 1.540 17919 13715 1 34 . 1 1 27 27 LYS H H 27 8.560 8.560 8.236 0.324 17919 13716 1 34 . 1 1 28 28 ALA N N 28 123.440 123.440 119.096 4.344 17919 13717 1 34 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.178 -0.018 17919 13718 1 34 . 1 1 28 28 ALA C C 28 180.300 180.300 179.062 1.238 17919 13719 1 34 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.304 1.066 17919 13720 1 34 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.490 -0.780 17919 13721 1 34 . 1 1 28 28 ALA H H 28 8.060 8.060 8.030 0.030 17919 13722 1 34 . 1 1 29 29 LYS N N 29 119.940 119.940 120.923 -0.983 17919 13723 1 34 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.064 0.143 17919 13724 1 34 . 1 1 29 29 LYS C C 29 180.320 180.320 178.770 1.550 17919 13725 1 34 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.336 0.314 17919 13726 1 34 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.468 0.822 17919 13727 1 34 . 1 1 29 29 LYS H H 29 7.850 7.850 7.493 0.357 17919 13728 1 34 . 1 1 30 30 ILE N N 30 121.080 121.080 119.651 1.429 17919 13729 1 34 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.574 -0.067 17919 13730 1 34 . 1 1 30 30 ILE C C 30 178.310 178.310 177.683 0.627 17919 13731 1 34 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.492 0.658 17919 13732 1 34 . 1 1 30 30 ILE CB C 30 36.800 36.800 36.703 0.097 17919 13733 1 34 . 1 1 30 30 ILE H H 30 8.280 8.280 8.591 -0.311 17919 13734 1 34 . 1 1 31 31 GLN N N 31 123.490 123.490 119.010 4.480 17919 13735 1 34 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.069 -0.240 17919 13736 1 34 . 1 1 31 31 GLN C C 31 178.890 178.890 178.006 0.884 17919 13737 1 34 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.198 0.802 17919 13738 1 34 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.458 -0.738 17919 13739 1 34 . 1 1 31 31 GLN H H 31 8.580 8.580 7.895 0.685 17919 13740 1 34 . 1 1 32 32 ASP N N 32 119.360 119.360 119.026 0.334 17919 13741 1 34 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.373 -0.019 17919 13742 1 34 . 1 1 32 32 ASP C C 32 177.250 177.250 178.321 -1.071 17919 13743 1 34 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.662 0.528 17919 13744 1 34 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.951 -0.371 17919 13745 1 34 . 1 1 32 32 ASP H H 32 8.010 8.010 7.724 0.286 17919 13746 1 34 . 1 1 33 33 LYS N N 33 115.130 115.130 118.539 -3.409 17919 13747 1 34 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.197 0.140 17919 13748 1 34 . 1 1 33 33 LYS C C 33 177.870 177.870 178.069 -0.199 17919 13749 1 34 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.454 0.596 17919 13750 1 34 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.147 1.023 17919 13751 1 34 . 1 1 33 33 LYS H H 33 7.430 7.430 7.925 -0.495 17919 13752 1 34 . 1 1 34 34 GLU N N 34 113.870 113.870 115.201 -1.331 17919 13753 1 34 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.525 0.100 17919 13754 1 34 . 1 1 34 34 GLU C C 34 177.840 177.840 175.669 2.171 17919 13755 1 34 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.694 -0.524 17919 13756 1 34 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.152 1.508 17919 13757 1 34 . 1 1 34 34 GLU H H 34 8.740 8.740 7.788 0.952 17919 13758 1 34 . 1 1 35 35 GLY N N 35 108.650 108.650 108.259 0.391 17919 13759 1 34 . 1 1 35 35 GLY C C 35 173.960 173.960 174.702 -0.742 17919 13760 1 34 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.853 0.227 17919 13761 1 34 . 1 1 35 35 GLY H H 35 8.530 8.530 7.906 0.624 17919 13762 1 34 . 1 1 36 36 ILE N N 36 119.880 119.880 121.590 -1.710 17919 13763 1 34 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.288 0.157 17919 13764 1 34 . 1 1 36 36 ILE C C 36 173.590 173.590 174.166 -0.576 17919 13765 1 34 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.446 -0.696 17919 13766 1 34 . 1 1 36 36 ILE CB C 36 40.580 40.580 37.782 2.798 17919 13767 1 34 . 1 1 36 36 ILE H H 36 6.150 6.150 7.625 -1.475 17919 13768 1 34 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.678 -0.044 17919 13769 1 34 . 1 1 37 37 PRO C C 37 176.940 176.940 176.182 0.758 17919 13770 1 34 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.524 0.136 17919 13771 1 34 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.520 0.330 17919 13772 1 34 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.160 -0.043 17919 13773 1 34 . 1 1 38 38 PRO C C 38 178.320 178.320 178.152 0.168 17919 13774 1 34 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.516 0.744 17919 13775 1 34 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.811 1.079 17919 13776 1 34 . 1 1 39 39 ASP N N 39 113.380 113.380 117.641 -4.261 17919 13777 1 34 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.243 0.187 17919 13778 1 34 . 1 1 39 39 ASP C C 39 177.090 177.090 178.033 -0.943 17919 13779 1 34 . 1 1 39 39 ASP CA C 39 55.640 55.640 57.123 -1.483 17919 13780 1 34 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.326 -0.786 17919 13781 1 34 . 1 1 39 39 ASP H H 39 8.550 8.550 8.569 -0.019 17919 13782 1 34 . 1 1 40 40 GLN N N 40 116.780 116.780 116.723 0.057 17919 13783 1 34 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.316 0.148 17919 13784 1 34 . 1 1 40 40 GLN C C 40 175.380 175.380 176.676 -1.296 17919 13785 1 34 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.153 -0.513 17919 13786 1 34 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.041 1.099 17919 13787 1 34 . 1 1 40 40 GLN H H 40 7.820 7.820 8.065 -0.245 17919 13788 1 34 . 1 1 41 41 GLN N N 41 117.720 117.720 119.496 -1.776 17919 13789 1 34 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.434 -0.190 17919 13790 1 34 . 1 1 41 41 GLN C C 41 176.300 176.300 174.895 1.405 17919 13791 1 34 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.676 0.794 17919 13792 1 34 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.218 2.433 17919 13793 1 34 . 1 1 41 41 GLN H H 41 7.480 7.480 7.435 0.045 17919 13794 1 34 . 1 1 42 42 ARG N N 42 122.680 122.680 125.185 -2.505 17919 13795 1 34 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.404 0.096 17919 13796 1 34 . 1 1 42 42 ARG C C 42 174.050 174.050 174.244 -0.194 17919 13797 1 34 . 1 1 42 42 ARG CA C 42 55.050 55.050 56.089 -1.039 17919 13798 1 34 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.113 -0.363 17919 13799 1 34 . 1 1 42 42 ARG H H 42 8.530 8.530 7.856 0.674 17919 13800 1 34 . 1 1 43 43 LEU N N 43 124.040 124.040 125.877 -1.837 17919 13801 1 34 . 1 1 43 43 LEU C C 43 175.290 175.290 176.005 -0.715 17919 13802 1 34 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.130 -1.150 17919 13803 1 34 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.582 2.208 17919 13804 1 34 . 1 1 43 43 LEU H H 43 8.820 8.820 8.657 0.163 17919 13805 1 34 . 1 1 44 44 ILE N N 44 121.920 121.920 123.620 -1.700 17919 13806 1 34 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.840 0.152 17919 13807 1 34 . 1 1 44 44 ILE C C 44 176.060 176.060 174.345 1.715 17919 13808 1 34 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.695 -1.715 17919 13809 1 34 . 1 1 44 44 ILE CB C 44 41.420 41.420 42.041 -0.621 17919 13810 1 34 . 1 1 44 44 ILE H H 44 9.030 9.030 8.293 0.737 17919 13811 1 34 . 1 1 45 45 PHE N N 45 125.390 125.390 127.545 -2.155 17919 13812 1 34 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.050 -0.005 17919 13813 1 34 . 1 1 45 45 PHE C C 45 174.470 174.470 174.849 -0.379 17919 13814 1 34 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.204 0.816 17919 13815 1 34 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.986 0.774 17919 13816 1 34 . 1 1 45 45 PHE H H 45 8.830 8.830 8.818 0.012 17919 13817 1 34 . 1 1 46 46 ALA N N 46 132.200 132.200 130.235 1.965 17919 13818 1 34 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.634 0.056 17919 13819 1 34 . 1 1 46 46 ALA C C 46 177.290 177.290 177.326 -0.036 17919 13820 1 34 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.721 -0.181 17919 13821 1 34 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.341 0.229 17919 13822 1 34 . 1 1 46 46 ALA H H 46 8.810 8.810 8.976 -0.166 17919 13823 1 34 . 1 1 47 47 GLY N N 47 102.340 102.340 104.297 -1.957 17919 13824 1 34 . 1 1 47 47 GLY C C 47 173.810 173.810 174.163 -0.353 17919 13825 1 34 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.485 -0.135 17919 13826 1 34 . 1 1 47 47 GLY H H 47 8.130 8.130 8.531 -0.401 17919 13827 1 34 . 1 1 48 48 LYS N N 48 121.570 121.570 121.041 0.529 17919 13828 1 34 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.628 -0.006 17919 13829 1 34 . 1 1 48 48 LYS C C 48 174.700 174.700 175.852 -1.152 17919 13830 1 34 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.859 -0.309 17919 13831 1 34 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.429 0.101 17919 13832 1 34 . 1 1 48 48 LYS H H 48 7.980 7.980 7.993 -0.013 17919 13833 1 34 . 1 1 49 49 GLN N N 49 122.410 122.410 123.682 -1.272 17919 13834 1 34 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.742 -0.182 17919 13835 1 34 . 1 1 49 49 GLN C C 49 175.670 175.670 176.137 -0.467 17919 13836 1 34 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.862 -0.122 17919 13837 1 34 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.369 -0.369 17919 13838 1 34 . 1 1 49 49 GLN H H 49 8.600 8.600 8.604 -0.004 17919 13839 1 34 . 1 1 50 50 LEU N N 50 125.520 125.520 125.927 -0.407 17919 13840 1 34 . 1 1 50 50 LEU HA H 50 4.090 4.090 3.875 0.215 17919 13841 1 34 . 1 1 50 50 LEU C C 50 176.660 176.660 176.103 0.557 17919 13842 1 34 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.221 0.019 17919 13843 1 34 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.618 -0.048 17919 13844 1 34 . 1 1 50 50 LEU H H 50 8.530 8.530 8.291 0.239 17919 13845 1 34 . 1 1 51 51 GLU N N 51 122.940 122.940 123.940 -1.000 17919 13846 1 34 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.574 -0.087 17919 13847 1 34 . 1 1 51 51 GLU C C 51 175.870 175.870 176.629 -0.759 17919 13848 1 34 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.291 0.669 17919 13849 1 34 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.460 0.110 17919 13850 1 34 . 1 1 51 51 GLU H H 51 8.400 8.400 8.813 -0.413 17919 13851 1 34 . 1 1 52 52 ASP N N 52 120.030 120.030 125.163 -5.133 17919 13852 1 34 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.380 -0.021 17919 13853 1 34 . 1 1 52 52 ASP C C 52 177.330 177.330 177.708 -0.378 17919 13854 1 34 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.365 -0.405 17919 13855 1 34 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.776 0.074 17919 13856 1 34 . 1 1 52 52 ASP H H 52 8.160 8.160 8.866 -0.706 17919 13857 1 34 . 1 1 53 53 GLY N N 53 106.660 106.660 104.910 1.750 17919 13858 1 34 . 1 1 53 53 GLY C C 53 174.870 174.870 174.157 0.713 17919 13859 1 34 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.958 0.212 17919 13860 1 34 . 1 1 53 53 GLY H H 53 9.390 9.390 8.446 0.944 17919 13861 1 34 . 1 1 54 54 ARG N N 54 119.050 119.050 120.148 -1.098 17919 13862 1 34 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.719 -0.024 17919 13863 1 34 . 1 1 54 54 ARG C C 54 175.350 175.350 174.831 0.519 17919 13864 1 34 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.096 0.294 17919 13865 1 34 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.730 -1.080 17919 13866 1 34 . 1 1 54 54 ARG H H 54 7.460 7.460 7.434 0.026 17919 13867 1 34 . 1 1 55 55 THR N N 55 108.400 108.400 112.343 -3.943 17919 13868 1 34 . 1 1 55 55 THR HA H 55 5.240 5.240 5.125 0.115 17919 13869 1 34 . 1 1 55 55 THR C C 55 176.560 176.560 176.163 0.397 17919 13870 1 34 . 1 1 55 55 THR CA C 55 59.690 59.690 60.122 -0.432 17919 13871 1 34 . 1 1 55 55 THR CB C 55 72.260 72.260 71.326 0.934 17919 13872 1 34 . 1 1 55 55 THR H H 55 8.730 8.730 8.655 0.075 17919 13873 1 34 . 1 1 56 56 LEU N N 56 117.920 117.920 122.167 -4.247 17919 13874 1 34 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.952 0.108 17919 13875 1 34 . 1 1 56 56 LEU C C 56 180.810 180.810 178.951 1.859 17919 13876 1 34 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.217 0.493 17919 13877 1 34 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.526 -1.156 17919 13878 1 34 . 1 1 56 56 LEU H H 56 8.140 8.140 8.896 -0.756 17919 13879 1 34 . 1 1 57 57 SER N N 57 113.330 113.330 114.569 -1.239 17919 13880 1 34 . 1 1 57 57 SER HA H 57 4.370 4.370 4.180 0.190 17919 13881 1 34 . 1 1 57 57 SER C C 57 178.310 178.310 176.884 1.426 17919 13882 1 34 . 1 1 57 57 SER CA C 57 61.080 61.080 61.629 -0.549 17919 13883 1 34 . 1 1 57 57 SER CB C 57 62.530 62.530 62.614 -0.084 17919 13884 1 34 . 1 1 57 57 SER H H 57 8.470 8.470 8.283 0.187 17919 13885 1 34 . 1 1 58 58 ASP N N 58 124.190 124.190 123.642 0.548 17919 13886 1 34 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.330 -0.034 17919 13887 1 34 . 1 1 58 58 ASP C C 58 177.400 177.400 177.183 0.217 17919 13888 1 34 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.932 0.248 17919 13889 1 34 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.306 -0.206 17919 13890 1 34 . 1 1 58 58 ASP H H 58 7.930 7.930 7.747 0.183 17919 13891 1 34 . 1 1 59 59 TYR N N 59 115.510 115.510 115.464 0.046 17919 13892 1 34 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.612 0.058 17919 13893 1 34 . 1 1 59 59 TYR C C 59 174.700 174.700 175.051 -0.351 17919 13894 1 34 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.484 0.766 17919 13895 1 34 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.025 2.045 17919 13896 1 34 . 1 1 59 59 TYR H H 59 7.250 7.250 7.359 -0.109 17919 13897 1 34 . 1 1 60 60 ASN N N 60 115.900 115.900 115.421 0.479 17919 13898 1 34 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.331 0.024 17919 13899 1 34 . 1 1 60 60 ASN C C 60 174.340 174.340 174.267 0.073 17919 13900 1 34 . 1 1 60 60 ASN CA C 60 54.120 54.120 53.958 0.162 17919 13901 1 34 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.901 -0.491 17919 13902 1 34 . 1 1 60 60 ASN H H 60 8.150 8.150 7.776 0.374 17919 13903 1 34 . 1 1 61 61 ILE N N 61 118.600 118.600 119.410 -0.810 17919 13904 1 34 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.714 -0.321 17919 13905 1 34 . 1 1 61 61 ILE C C 61 174.610 174.610 175.657 -1.047 17919 13906 1 34 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.738 0.682 17919 13907 1 34 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.773 -1.033 17919 13908 1 34 . 1 1 61 61 ILE H H 61 7.250 7.250 7.647 -0.397 17919 13909 1 34 . 1 1 62 62 GLN N N 62 124.740 124.740 126.145 -1.405 17919 13910 1 34 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.620 -0.114 17919 13911 1 34 . 1 1 62 62 GLN C C 62 175.970 175.970 176.094 -0.124 17919 13912 1 34 . 1 1 62 62 GLN CA C 62 53.660 53.660 52.954 0.706 17919 13913 1 34 . 1 1 62 62 GLN CB C 62 31.650 31.650 30.688 0.962 17919 13914 1 34 . 1 1 62 62 GLN H H 62 7.610 7.610 8.065 -0.455 17919 13915 1 34 . 1 1 63 63 LYS N N 63 120.300 120.300 125.412 -5.112 17919 13916 1 34 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.828 0.173 17919 13917 1 34 . 1 1 63 63 LYS C C 63 175.810 175.810 176.801 -0.991 17919 13918 1 34 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.172 -0.383 17919 13919 1 34 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.044 0.606 17919 13920 1 34 . 1 1 63 63 LYS H H 63 8.490 8.490 8.809 -0.319 17919 13921 1 34 . 1 1 64 64 GLU N N 64 113.950 113.950 120.194 -6.244 17919 13922 1 34 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.572 -0.107 17919 13923 1 34 . 1 1 64 64 GLU C C 64 175.250 175.250 175.775 -0.525 17919 13924 1 34 . 1 1 64 64 GLU CA C 64 57.890 57.890 58.066 -0.176 17919 13925 1 34 . 1 1 64 64 GLU CB C 64 25.900 25.900 29.215 -3.316 17919 13926 1 34 . 1 1 64 64 GLU H H 64 9.280 9.280 8.838 0.442 17919 13927 1 34 . 1 1 65 65 SER N N 65 114.730 114.730 114.998 -0.268 17919 13928 1 34 . 1 1 65 65 SER HA H 65 4.640 4.640 4.717 -0.077 17919 13929 1 34 . 1 1 65 65 SER C C 65 172.160 172.160 174.125 -1.965 17919 13930 1 34 . 1 1 65 65 SER CA C 65 60.890 60.890 59.248 1.642 17919 13931 1 34 . 1 1 65 65 SER CB C 65 64.910 64.910 65.125 -0.215 17919 13932 1 34 . 1 1 65 65 SER H H 65 7.670 7.670 7.895 -0.225 17919 13933 1 34 . 1 1 66 66 THR N N 66 117.110 117.110 117.414 -0.304 17919 13934 1 34 . 1 1 66 66 THR HA H 66 5.270 5.270 5.213 0.057 17919 13935 1 34 . 1 1 66 66 THR C C 66 173.950 173.950 174.197 -0.247 17919 13936 1 34 . 1 1 66 66 THR CA C 66 62.340 62.340 62.008 0.332 17919 13937 1 34 . 1 1 66 66 THR CB C 66 70.080 70.080 70.137 -0.057 17919 13938 1 34 . 1 1 66 66 THR H H 66 8.730 8.730 8.390 0.340 17919 13939 1 34 . 1 1 67 67 LEU N N 67 127.110 127.110 127.827 -0.717 17919 13940 1 34 . 1 1 67 67 LEU HA H 67 5.060 5.060 5.317 -0.257 17919 13941 1 34 . 1 1 67 67 LEU C C 67 175.770 175.770 175.810 -0.040 17919 13942 1 34 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.375 -0.475 17919 13943 1 34 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.692 0.568 17919 13944 1 34 . 1 1 67 67 LEU H H 67 9.410 9.410 9.004 0.406 17919 13945 1 34 . 1 1 68 68 HIS N N 68 118.380 118.380 118.352 0.028 17919 13946 1 34 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.478 -0.238 17919 13947 1 34 . 1 1 68 68 HIS C C 68 173.150 173.150 174.041 -0.891 17919 13948 1 34 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.203 0.797 17919 13949 1 34 . 1 1 68 68 HIS CB C 68 30.530 30.530 34.168 -3.638 17919 13950 1 34 . 1 1 68 68 HIS H H 68 9.230 9.230 9.121 0.109 17919 13951 1 34 . 1 1 69 69 LEU N N 69 124.460 124.460 122.213 2.247 17919 13952 1 34 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.972 0.218 17919 13953 1 34 . 1 1 69 69 LEU C C 69 175.270 175.270 174.376 0.894 17919 13954 1 34 . 1 1 69 69 LEU CA C 69 53.890 53.890 55.319 -1.429 17919 13955 1 34 . 1 1 69 69 LEU CB C 69 44.380 44.380 45.519 -1.139 17919 13956 1 34 . 1 1 69 69 LEU H H 69 8.340 8.340 7.473 0.867 17919 13957 1 34 . 1 1 70 70 VAL N N 70 126.940 126.940 125.348 1.592 17919 13958 1 34 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.478 -0.128 17919 13959 1 34 . 1 1 70 70 VAL C C 70 174.000 174.000 174.657 -0.657 17919 13960 1 34 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.652 0.148 17919 13961 1 34 . 1 1 70 70 VAL CB C 70 34.910 34.910 34.351 0.559 17919 13962 1 34 . 1 1 70 70 VAL H H 70 9.200 9.200 7.962 1.238 17919 13963 1 34 . 1 1 71 71 LEU N N 71 123.130 123.130 124.209 -1.079 17919 13964 1 34 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.730 0.330 17919 13965 1 34 . 1 1 71 71 LEU C C 71 177.830 177.830 177.173 0.657 17919 13966 1 34 . 1 1 71 71 LEU CA C 71 53.940 53.940 54.234 -0.294 17919 13967 1 34 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.210 0.640 17919 13968 1 34 . 1 1 71 71 LEU H H 71 8.120 8.120 8.363 -0.243 17919 13969 1 34 . 1 1 72 72 ARG N N 72 123.490 123.490 123.788 -0.298 17919 13970 1 34 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.361 -0.060 17919 13971 1 34 . 1 1 72 72 ARG C C 72 175.350 175.350 176.289 -0.939 17919 13972 1 34 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.648 -0.038 17919 13973 1 34 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.851 0.499 17919 13974 1 34 . 1 1 72 72 ARG H H 72 8.580 8.580 8.128 0.452 17919 13975 1 35 . 1 1 2 2 GLN N N 2 123.220 123.220 123.657 -0.437 17919 13976 1 35 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.270 -0.021 17919 13977 1 35 . 1 1 2 2 GLN C C 2 175.920 175.920 175.324 0.596 17919 13978 1 35 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.804 0.276 17919 13979 1 35 . 1 1 2 2 GLN CB C 2 30.760 30.760 29.834 0.926 17919 13980 1 35 . 1 1 2 2 GLN H H 2 8.900 8.900 8.703 0.197 17919 13981 1 35 . 1 1 3 3 ILE N N 3 115.340 115.340 116.606 -1.266 17919 13982 1 35 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.470 -0.257 17919 13983 1 35 . 1 1 3 3 ILE C C 3 172.450 172.450 173.036 -0.586 17919 13984 1 35 . 1 1 3 3 ILE CA C 3 59.570 59.570 60.062 -0.492 17919 13985 1 35 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.950 0.260 17919 13986 1 35 . 1 1 3 3 ILE H H 3 8.320 8.320 8.094 0.226 17919 13987 1 35 . 1 1 4 4 PHE N N 4 118.110 118.110 121.871 -3.761 17919 13988 1 35 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.412 0.218 17919 13989 1 35 . 1 1 4 4 PHE C C 4 175.320 175.320 175.211 0.109 17919 13990 1 35 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.530 -0.320 17919 13991 1 35 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.529 -1.049 17919 13992 1 35 . 1 1 4 4 PHE H H 4 8.610 8.610 9.018 -0.408 17919 13993 1 35 . 1 1 5 5 VAL N N 5 121.000 121.000 122.469 -1.469 17919 13994 1 35 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.813 -0.088 17919 13995 1 35 . 1 1 5 5 VAL C C 5 174.870 174.870 174.666 0.204 17919 13996 1 35 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.184 -0.563 17919 13997 1 35 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.026 0.204 17919 13998 1 35 . 1 1 5 5 VAL H H 5 9.300 9.300 8.732 0.568 17919 13999 1 35 . 1 1 6 6 LYS N N 6 127.520 127.520 129.175 -1.655 17919 14000 1 35 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.165 0.202 17919 14001 1 35 . 1 1 6 6 LYS C C 6 177.140 177.140 176.835 0.305 17919 14002 1 35 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.649 -0.129 17919 14003 1 35 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.035 0.015 17919 14004 1 35 . 1 1 6 6 LYS H H 6 8.820 8.820 8.812 0.008 17919 14005 1 35 . 1 1 7 7 THR N N 7 115.400 115.400 117.222 -1.822 17919 14006 1 35 . 1 1 7 7 THR HA H 7 4.970 4.970 4.478 0.492 17919 14007 1 35 . 1 1 7 7 THR C C 7 176.910 176.910 176.029 0.881 17919 14008 1 35 . 1 1 7 7 THR CA C 7 60.470 60.470 61.805 -1.335 17919 14009 1 35 . 1 1 7 7 THR CB C 7 70.630 70.630 69.789 0.841 17919 14010 1 35 . 1 1 7 7 THR H H 7 8.730 8.730 8.610 0.120 17919 14011 1 35 . 1 1 8 8 LEU N N 8 121.330 121.330 119.931 1.399 17919 14012 1 35 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.470 -0.160 17919 14013 1 35 . 1 1 8 8 LEU C C 8 178.800 178.800 178.338 0.462 17919 14014 1 35 . 1 1 8 8 LEU CA C 8 57.580 57.580 56.835 0.745 17919 14015 1 35 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.925 0.045 17919 14016 1 35 . 1 1 8 8 LEU H H 8 9.100 9.100 8.992 0.108 17919 14017 1 35 . 1 1 9 9 THR N N 9 105.590 105.590 107.288 -1.698 17919 14018 1 35 . 1 1 9 9 THR HA H 9 4.428 4.428 4.315 0.113 17919 14019 1 35 . 1 1 9 9 THR C C 9 175.520 175.520 175.713 -0.193 17919 14020 1 35 . 1 1 9 9 THR CA C 9 61.400 61.400 61.977 -0.577 17919 14021 1 35 . 1 1 9 9 THR CB C 9 69.140 69.140 69.317 -0.177 17919 14022 1 35 . 1 1 9 9 THR H H 9 7.630 7.630 7.645 -0.015 17919 14023 1 35 . 1 1 10 10 GLY N N 10 108.890 108.890 111.240 -2.350 17919 14024 1 35 . 1 1 10 10 GLY C C 10 174.070 174.070 173.817 0.253 17919 14025 1 35 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.805 0.655 17919 14026 1 35 . 1 1 10 10 GLY H H 10 7.810 7.810 7.677 0.133 17919 14027 1 35 . 1 1 11 11 LYS N N 11 121.600 121.600 122.265 -0.665 17919 14028 1 35 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.357 0.004 17919 14029 1 35 . 1 1 11 11 LYS C C 11 175.940 175.940 175.679 0.261 17919 14030 1 35 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.261 0.019 17919 14031 1 35 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.335 -0.135 17919 14032 1 35 . 1 1 11 11 LYS H H 11 7.280 7.280 7.968 -0.688 17919 14033 1 35 . 1 1 12 12 THR N N 12 120.440 120.440 121.882 -1.442 17919 14034 1 35 . 1 1 12 12 THR HA H 12 5.046 5.046 5.155 -0.109 17919 14035 1 35 . 1 1 12 12 THR C C 12 174.320 174.320 173.909 0.411 17919 14036 1 35 . 1 1 12 12 THR CA C 12 62.390 62.390 62.104 0.286 17919 14037 1 35 . 1 1 12 12 THR CB C 12 69.910 69.910 70.069 -0.159 17919 14038 1 35 . 1 1 12 12 THR H H 12 8.650 8.650 8.458 0.192 17919 14039 1 35 . 1 1 13 13 ILE N N 13 127.110 127.110 126.778 0.332 17919 14040 1 35 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.522 0.022 17919 14041 1 35 . 1 1 13 13 ILE C C 13 175.220 175.220 174.890 0.330 17919 14042 1 35 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.437 0.543 17919 14043 1 35 . 1 1 13 13 ILE CB C 13 40.950 40.950 39.647 1.303 17919 14044 1 35 . 1 1 13 13 ILE H H 13 9.450 9.450 9.199 0.251 17919 14045 1 35 . 1 1 14 14 THR N N 14 121.520 121.520 122.826 -1.306 17919 14046 1 35 . 1 1 14 14 THR HA H 14 4.964 4.964 4.496 0.468 17919 14047 1 35 . 1 1 14 14 THR C C 14 173.790 173.790 173.778 0.012 17919 14048 1 35 . 1 1 14 14 THR CA C 14 61.940 61.940 62.121 -0.181 17919 14049 1 35 . 1 1 14 14 THR CB C 14 69.650 69.650 69.937 -0.287 17919 14050 1 35 . 1 1 14 14 THR H H 14 8.710 8.710 8.469 0.241 17919 14051 1 35 . 1 1 15 15 LEU N N 15 124.800 124.800 126.492 -1.692 17919 14052 1 35 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.639 0.141 17919 14053 1 35 . 1 1 15 15 LEU C C 15 174.670 174.670 175.410 -0.740 17919 14054 1 35 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.248 -0.418 17919 14055 1 35 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.256 1.814 17919 14056 1 35 . 1 1 15 15 LEU H H 15 8.710 8.710 8.383 0.327 17919 14057 1 35 . 1 1 16 16 GLU N N 16 122.160 122.160 123.348 -1.188 17919 14058 1 35 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.100 -0.183 17919 14059 1 35 . 1 1 16 16 GLU C C 16 175.860 175.860 176.071 -0.211 17919 14060 1 35 . 1 1 16 16 GLU CA C 16 54.820 54.820 54.638 0.182 17919 14061 1 35 . 1 1 16 16 GLU CB C 16 29.450 29.450 29.193 0.257 17919 14062 1 35 . 1 1 16 16 GLU H H 16 8.140 8.140 8.559 -0.419 17919 14063 1 35 . 1 1 17 17 VAL N N 17 117.210 117.210 118.272 -1.062 17919 14064 1 35 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.896 -0.182 17919 14065 1 35 . 1 1 17 17 VAL C C 17 174.160 174.160 174.785 -0.625 17919 14066 1 35 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.749 -0.319 17919 14067 1 35 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.659 0.741 17919 14068 1 35 . 1 1 17 17 VAL H H 17 8.900 8.900 8.535 0.365 17919 14069 1 35 . 1 1 18 18 GLU N N 18 118.990 118.990 119.460 -0.470 17919 14070 1 35 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.820 0.259 17919 14071 1 35 . 1 1 18 18 GLU C C 18 176.160 176.160 174.971 1.189 17919 14072 1 35 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.968 -0.248 17919 14073 1 35 . 1 1 18 18 GLU CB C 18 30.310 30.310 31.138 -0.828 17919 14074 1 35 . 1 1 18 18 GLU H H 18 8.640 8.640 8.363 0.277 17919 14075 1 35 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.255 -0.114 17919 14076 1 35 . 1 1 19 19 PRO C C 19 175.310 175.310 178.363 -3.053 17919 14077 1 35 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.574 -0.104 17919 14078 1 35 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.961 -0.011 17919 14079 1 35 . 1 1 20 20 SER N N 20 103.400 103.400 109.741 -6.341 17919 14080 1 35 . 1 1 20 20 SER HA H 20 4.370 4.370 4.217 0.153 17919 14081 1 35 . 1 1 20 20 SER C C 20 174.660 174.660 174.748 -0.088 17919 14082 1 35 . 1 1 20 20 SER CA C 20 57.400 57.400 58.795 -1.395 17919 14083 1 35 . 1 1 20 20 SER CB C 20 63.370 63.370 62.792 0.578 17919 14084 1 35 . 1 1 20 20 SER H H 20 7.040 7.040 8.007 -0.967 17919 14085 1 35 . 1 1 21 21 ASP N N 21 123.480 123.480 124.408 -0.928 17919 14086 1 35 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.664 0.031 17919 14087 1 35 . 1 1 21 21 ASP C C 21 176.360 176.360 176.106 0.254 17919 14088 1 35 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.268 0.432 17919 14089 1 35 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.547 -0.748 17919 14090 1 35 . 1 1 21 21 ASP H H 21 8.030 8.030 7.598 0.432 17919 14091 1 35 . 1 1 22 22 THR N N 22 108.800 108.800 113.247 -4.447 17919 14092 1 35 . 1 1 22 22 THR HA H 22 4.920 4.920 4.762 0.158 17919 14093 1 35 . 1 1 22 22 THR C C 22 176.750 176.750 175.876 0.874 17919 14094 1 35 . 1 1 22 22 THR CA C 22 59.690 59.690 61.619 -1.929 17919 14095 1 35 . 1 1 22 22 THR CB C 22 71.200 71.200 70.403 0.797 17919 14096 1 35 . 1 1 22 22 THR H H 22 7.900 7.900 8.308 -0.408 17919 14097 1 35 . 1 1 23 23 ILE N N 23 121.190 121.190 121.743 -0.553 17919 14098 1 35 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.857 -0.200 17919 14099 1 35 . 1 1 23 23 ILE C C 23 179.040 179.040 177.601 1.439 17919 14100 1 35 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.217 0.043 17919 14101 1 35 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.333 -1.983 17919 14102 1 35 . 1 1 23 23 ILE H H 23 8.560 8.560 9.109 -0.549 17919 14103 1 35 . 1 1 24 24 GLU N N 24 120.830 120.830 120.644 0.186 17919 14104 1 35 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.992 -0.075 17919 14105 1 35 . 1 1 24 24 GLU C C 24 178.640 178.640 178.460 0.180 17919 14106 1 35 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.879 0.341 17919 14107 1 35 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.556 -1.276 17919 14108 1 35 . 1 1 24 24 GLU H H 24 9.760 9.760 8.533 1.227 17919 14109 1 35 . 1 1 25 25 ASN N N 25 120.570 120.570 118.680 1.890 17919 14110 1 35 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.533 -0.008 17919 14111 1 35 . 1 1 25 25 ASN C C 25 178.380 178.380 178.023 0.357 17919 14112 1 35 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.714 0.346 17919 14113 1 35 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.263 0.187 17919 14114 1 35 . 1 1 25 25 ASN H H 25 7.920 7.920 7.553 0.367 17919 14115 1 35 . 1 1 26 26 VAL N N 26 121.710 121.710 119.453 2.257 17919 14116 1 35 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.508 -0.111 17919 14117 1 35 . 1 1 26 26 VAL C C 26 177.950 177.950 177.753 0.197 17919 14118 1 35 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.426 1.234 17919 14119 1 35 . 1 1 26 26 VAL CB C 26 30.840 30.840 30.968 -0.128 17919 14120 1 35 . 1 1 26 26 VAL H H 26 8.070 8.070 7.794 0.276 17919 14121 1 35 . 1 1 27 27 LYS N N 27 118.860 118.860 119.865 -1.005 17919 14122 1 35 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.195 0.385 17919 14123 1 35 . 1 1 27 27 LYS C C 27 180.550 180.550 179.258 1.292 17919 14124 1 35 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.403 -0.153 17919 14125 1 35 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.215 1.515 17919 14126 1 35 . 1 1 27 27 LYS H H 27 8.560 8.560 7.765 0.795 17919 14127 1 35 . 1 1 28 28 ALA N N 28 123.440 123.440 119.805 3.635 17919 14128 1 35 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.138 0.022 17919 14129 1 35 . 1 1 28 28 ALA C C 28 180.300 180.300 178.627 1.673 17919 14130 1 35 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.638 0.732 17919 14131 1 35 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.474 -0.763 17919 14132 1 35 . 1 1 28 28 ALA H H 28 8.060 8.060 8.214 -0.154 17919 14133 1 35 . 1 1 29 29 LYS N N 29 119.940 119.940 119.663 0.277 17919 14134 1 35 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.161 0.046 17919 14135 1 35 . 1 1 29 29 LYS C C 29 180.320 180.320 178.766 1.554 17919 14136 1 35 . 1 1 29 29 LYS CA C 29 59.650 59.650 58.765 0.885 17919 14137 1 35 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.669 0.621 17919 14138 1 35 . 1 1 29 29 LYS H H 29 7.850 7.850 7.409 0.441 17919 14139 1 35 . 1 1 30 30 ILE N N 30 121.080 121.080 120.206 0.874 17919 14140 1 35 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.537 -0.030 17919 14141 1 35 . 1 1 30 30 ILE C C 30 178.310 178.310 177.350 0.960 17919 14142 1 35 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.991 0.159 17919 14143 1 35 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.794 -0.994 17919 14144 1 35 . 1 1 30 30 ILE H H 30 8.280 8.280 8.398 -0.118 17919 14145 1 35 . 1 1 31 31 GLN N N 31 123.490 123.490 118.697 4.793 17919 14146 1 35 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.028 -0.199 17919 14147 1 35 . 1 1 31 31 GLN C C 31 178.890 178.890 177.726 1.164 17919 14148 1 35 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.161 0.839 17919 14149 1 35 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.440 -0.720 17919 14150 1 35 . 1 1 31 31 GLN H H 31 8.580 8.580 7.802 0.778 17919 14151 1 35 . 1 1 32 32 ASP N N 32 119.360 119.360 119.310 0.050 17919 14152 1 35 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.416 -0.062 17919 14153 1 35 . 1 1 32 32 ASP C C 32 177.250 177.250 178.132 -0.882 17919 14154 1 35 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.609 0.581 17919 14155 1 35 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.706 -0.126 17919 14156 1 35 . 1 1 32 32 ASP H H 32 8.010 8.010 7.536 0.474 17919 14157 1 35 . 1 1 33 33 LYS N N 33 115.130 115.130 118.410 -3.280 17919 14158 1 35 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.216 0.121 17919 14159 1 35 . 1 1 33 33 LYS C C 33 177.870 177.870 178.343 -0.473 17919 14160 1 35 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.609 -0.559 17919 14161 1 35 . 1 1 33 33 LYS CB C 33 34.170 34.170 32.920 1.250 17919 14162 1 35 . 1 1 33 33 LYS H H 33 7.430 7.430 7.704 -0.274 17919 14163 1 35 . 1 1 34 34 GLU N N 34 113.870 113.870 113.700 0.170 17919 14164 1 35 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.539 0.086 17919 14165 1 35 . 1 1 34 34 GLU C C 34 177.840 177.840 176.981 0.859 17919 14166 1 35 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.683 -0.513 17919 14167 1 35 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.656 1.004 17919 14168 1 35 . 1 1 34 34 GLU H H 34 8.740 8.740 7.951 0.789 17919 14169 1 35 . 1 1 35 35 GLY N N 35 108.650 108.650 109.478 -0.828 17919 14170 1 35 . 1 1 35 35 GLY C C 35 173.960 173.960 174.579 -0.619 17919 14171 1 35 . 1 1 35 35 GLY CA C 35 46.080 46.080 46.006 0.074 17919 14172 1 35 . 1 1 35 35 GLY H H 35 8.530 8.530 7.974 0.556 17919 14173 1 35 . 1 1 36 36 ILE N N 36 119.880 119.880 121.968 -2.088 17919 14174 1 35 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.298 0.147 17919 14175 1 35 . 1 1 36 36 ILE C C 36 173.590 173.590 173.916 -0.326 17919 14176 1 35 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.395 -0.645 17919 14177 1 35 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.293 2.287 17919 14178 1 35 . 1 1 36 36 ILE H H 36 6.150 6.150 7.676 -1.526 17919 14179 1 35 . 1 1 37 37 PRO HA H 37 4.634 4.634 5.040 -0.406 17919 14180 1 35 . 1 1 37 37 PRO C C 37 176.940 176.940 176.029 0.911 17919 14181 1 35 . 1 1 37 37 PRO CA C 37 61.660 61.660 60.611 1.049 17919 14182 1 35 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.317 0.533 17919 14183 1 35 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.136 -0.019 17919 14184 1 35 . 1 1 38 38 PRO C C 38 178.320 178.320 178.584 -0.264 17919 14185 1 35 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.829 0.431 17919 14186 1 35 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.767 1.123 17919 14187 1 35 . 1 1 39 39 ASP N N 39 113.380 113.380 115.681 -2.301 17919 14188 1 35 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.374 0.056 17919 14189 1 35 . 1 1 39 39 ASP C C 39 177.090 177.090 177.151 -0.061 17919 14190 1 35 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.469 -0.829 17919 14191 1 35 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.375 -0.835 17919 14192 1 35 . 1 1 39 39 ASP H H 39 8.550 8.550 8.565 -0.015 17919 14193 1 35 . 1 1 40 40 GLN N N 40 116.780 116.780 115.872 0.908 17919 14194 1 35 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.368 0.096 17919 14195 1 35 . 1 1 40 40 GLN C C 40 175.380 175.380 175.930 -0.550 17919 14196 1 35 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.373 -0.733 17919 14197 1 35 . 1 1 40 40 GLN CB C 40 30.140 30.140 28.752 1.388 17919 14198 1 35 . 1 1 40 40 GLN H H 40 7.820 7.820 7.935 -0.115 17919 14199 1 35 . 1 1 41 41 GLN N N 41 117.720 117.720 118.891 -1.171 17919 14200 1 35 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.616 -0.372 17919 14201 1 35 . 1 1 41 41 GLN C C 41 176.300 176.300 174.978 1.322 17919 14202 1 35 . 1 1 41 41 GLN CA C 41 56.470 56.470 54.956 1.514 17919 14203 1 35 . 1 1 41 41 GLN CB C 41 31.650 31.650 30.280 1.370 17919 14204 1 35 . 1 1 41 41 GLN H H 41 7.480 7.480 7.425 0.055 17919 14205 1 35 . 1 1 42 42 ARG N N 42 122.680 122.680 125.489 -2.809 17919 14206 1 35 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.554 -0.054 17919 14207 1 35 . 1 1 42 42 ARG C C 42 174.050 174.050 174.212 -0.162 17919 14208 1 35 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.589 -0.539 17919 14209 1 35 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.376 -0.626 17919 14210 1 35 . 1 1 42 42 ARG H H 42 8.530 8.530 8.107 0.423 17919 14211 1 35 . 1 1 43 43 LEU N N 43 124.040 124.040 127.564 -3.524 17919 14212 1 35 . 1 1 43 43 LEU C C 43 175.290 175.290 174.752 0.538 17919 14213 1 35 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.688 -0.708 17919 14214 1 35 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.640 1.150 17919 14215 1 35 . 1 1 43 43 LEU H H 43 8.820 8.820 8.726 0.094 17919 14216 1 35 . 1 1 44 44 ILE N N 44 121.920 121.920 123.580 -1.660 17919 14217 1 35 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.328 -0.336 17919 14218 1 35 . 1 1 44 44 ILE C C 44 176.060 176.060 174.544 1.516 17919 14219 1 35 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.651 -0.671 17919 14220 1 35 . 1 1 44 44 ILE CB C 44 41.420 41.420 42.187 -0.767 17919 14221 1 35 . 1 1 44 44 ILE H H 44 9.030 9.030 8.303 0.727 17919 14222 1 35 . 1 1 45 45 PHE N N 45 125.390 125.390 125.481 -0.091 17919 14223 1 35 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.064 -0.019 17919 14224 1 35 . 1 1 45 45 PHE C C 45 174.470 174.470 174.354 0.116 17919 14225 1 35 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.933 0.087 17919 14226 1 35 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.888 0.872 17919 14227 1 35 . 1 1 45 45 PHE H H 45 8.830 8.830 8.532 0.298 17919 14228 1 35 . 1 1 46 46 ALA N N 46 132.200 132.200 130.159 2.041 17919 14229 1 35 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.649 0.041 17919 14230 1 35 . 1 1 46 46 ALA C C 46 177.290 177.290 177.247 0.043 17919 14231 1 35 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.938 -0.398 17919 14232 1 35 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.347 0.223 17919 14233 1 35 . 1 1 46 46 ALA H H 46 8.810 8.810 8.940 -0.130 17919 14234 1 35 . 1 1 47 47 GLY N N 47 102.340 102.340 103.680 -1.340 17919 14235 1 35 . 1 1 47 47 GLY C C 47 173.810 173.810 174.650 -0.840 17919 14236 1 35 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.499 -0.149 17919 14237 1 35 . 1 1 47 47 GLY H H 47 8.130 8.130 8.469 -0.339 17919 14238 1 35 . 1 1 48 48 LYS N N 48 121.570 121.570 121.748 -0.178 17919 14239 1 35 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.402 0.220 17919 14240 1 35 . 1 1 48 48 LYS C C 48 174.700 174.700 175.930 -1.230 17919 14241 1 35 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.995 -0.445 17919 14242 1 35 . 1 1 48 48 LYS CB C 48 34.530 34.530 33.331 1.199 17919 14243 1 35 . 1 1 48 48 LYS H H 48 7.980 7.980 7.692 0.288 17919 14244 1 35 . 1 1 49 49 GLN N N 49 122.410 122.410 123.902 -1.492 17919 14245 1 35 . 1 1 49 49 GLN HA H 49 4.560 4.560 3.972 0.588 17919 14246 1 35 . 1 1 49 49 GLN C C 49 175.670 175.670 175.213 0.457 17919 14247 1 35 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.910 -1.170 17919 14248 1 35 . 1 1 49 49 GLN CB C 49 29.000 29.000 28.687 0.313 17919 14249 1 35 . 1 1 49 49 GLN H H 49 8.600 8.600 8.559 0.041 17919 14250 1 35 . 1 1 50 50 LEU N N 50 125.520 125.520 129.430 -3.910 17919 14251 1 35 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.250 -0.160 17919 14252 1 35 . 1 1 50 50 LEU C C 50 176.660 176.660 175.722 0.938 17919 14253 1 35 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.971 0.269 17919 14254 1 35 . 1 1 50 50 LEU CB C 50 41.570 41.570 43.477 -1.907 17919 14255 1 35 . 1 1 50 50 LEU H H 50 8.530 8.530 8.098 0.432 17919 14256 1 35 . 1 1 51 51 GLU N N 51 122.940 122.940 121.675 1.265 17919 14257 1 35 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.615 -0.127 17919 14258 1 35 . 1 1 51 51 GLU C C 51 175.870 175.870 176.042 -0.172 17919 14259 1 35 . 1 1 51 51 GLU CA C 51 55.960 55.960 54.907 1.053 17919 14260 1 35 . 1 1 51 51 GLU CB C 51 31.570 31.570 33.387 -1.817 17919 14261 1 35 . 1 1 51 51 GLU H H 51 8.400 8.400 8.667 -0.267 17919 14262 1 35 . 1 1 52 52 ASP N N 52 120.030 120.030 122.559 -2.529 17919 14263 1 35 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.482 -0.123 17919 14264 1 35 . 1 1 52 52 ASP C C 52 177.330 177.330 177.653 -0.323 17919 14265 1 35 . 1 1 52 52 ASP CA C 52 56.960 56.960 56.779 0.181 17919 14266 1 35 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.734 0.116 17919 14267 1 35 . 1 1 52 52 ASP H H 52 8.160 8.160 8.805 -0.645 17919 14268 1 35 . 1 1 53 53 GLY N N 53 106.660 106.660 105.794 0.866 17919 14269 1 35 . 1 1 53 53 GLY C C 53 174.870 174.870 174.659 0.211 17919 14270 1 35 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.120 0.050 17919 14271 1 35 . 1 1 53 53 GLY H H 53 9.390 9.390 8.427 0.963 17919 14272 1 35 . 1 1 54 54 ARG N N 54 119.050 119.050 121.307 -2.257 17919 14273 1 35 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.528 0.167 17919 14274 1 35 . 1 1 54 54 ARG C C 54 175.350 175.350 175.450 -0.100 17919 14275 1 35 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.546 -0.156 17919 14276 1 35 . 1 1 54 54 ARG CB C 54 32.650 32.650 31.486 1.163 17919 14277 1 35 . 1 1 54 54 ARG H H 54 7.460 7.460 7.541 -0.081 17919 14278 1 35 . 1 1 55 55 THR N N 55 108.400 108.400 112.107 -3.707 17919 14279 1 35 . 1 1 55 55 THR HA H 55 5.240 5.240 5.004 0.236 17919 14280 1 35 . 1 1 55 55 THR C C 55 176.560 176.560 176.530 0.030 17919 14281 1 35 . 1 1 55 55 THR CA C 55 59.690 59.690 60.117 -0.427 17919 14282 1 35 . 1 1 55 55 THR CB C 55 72.260 72.260 71.210 1.050 17919 14283 1 35 . 1 1 55 55 THR H H 55 8.730 8.730 8.754 -0.024 17919 14284 1 35 . 1 1 56 56 LEU N N 56 117.920 117.920 121.539 -3.619 17919 14285 1 35 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.828 0.232 17919 14286 1 35 . 1 1 56 56 LEU C C 56 180.810 180.810 178.852 1.958 17919 14287 1 35 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.484 0.226 17919 14288 1 35 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.472 -1.102 17919 14289 1 35 . 1 1 56 56 LEU H H 56 8.140 8.140 8.220 -0.080 17919 14290 1 35 . 1 1 57 57 SER N N 57 113.330 113.330 114.767 -1.437 17919 14291 1 35 . 1 1 57 57 SER HA H 57 4.370 4.370 4.229 0.141 17919 14292 1 35 . 1 1 57 57 SER C C 57 178.310 178.310 176.956 1.354 17919 14293 1 35 . 1 1 57 57 SER CA C 57 61.080 61.080 61.962 -0.882 17919 14294 1 35 . 1 1 57 57 SER CB C 57 62.530 62.530 62.570 -0.040 17919 14295 1 35 . 1 1 57 57 SER H H 57 8.470 8.470 8.134 0.336 17919 14296 1 35 . 1 1 58 58 ASP N N 58 124.190 124.190 123.126 1.064 17919 14297 1 35 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.289 0.007 17919 14298 1 35 . 1 1 58 58 ASP C C 58 177.400 177.400 177.615 -0.215 17919 14299 1 35 . 1 1 58 58 ASP CA C 58 57.180 57.180 57.127 0.053 17919 14300 1 35 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.277 -0.177 17919 14301 1 35 . 1 1 58 58 ASP H H 58 7.930 7.930 7.792 0.138 17919 14302 1 35 . 1 1 59 59 TYR N N 59 115.510 115.510 114.446 1.064 17919 14303 1 35 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.698 -0.028 17919 14304 1 35 . 1 1 59 59 TYR C C 59 174.700 174.700 175.486 -0.786 17919 14305 1 35 . 1 1 59 59 TYR CA C 59 58.250 58.250 55.340 2.910 17919 14306 1 35 . 1 1 59 59 TYR CB C 59 40.070 40.070 37.815 2.255 17919 14307 1 35 . 1 1 59 59 TYR H H 59 7.250 7.250 7.358 -0.108 17919 14308 1 35 . 1 1 60 60 ASN N N 60 115.900 115.900 119.079 -3.179 17919 14309 1 35 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.381 -0.026 17919 14310 1 35 . 1 1 60 60 ASN C C 60 174.340 174.340 174.487 -0.147 17919 14311 1 35 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.376 -0.256 17919 14312 1 35 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.177 0.233 17919 14313 1 35 . 1 1 60 60 ASN H H 60 8.150 8.150 8.086 0.064 17919 14314 1 35 . 1 1 61 61 ILE N N 61 118.600 118.600 118.845 -0.245 17919 14315 1 35 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.954 -0.561 17919 14316 1 35 . 1 1 61 61 ILE C C 61 174.610 174.610 175.777 -1.167 17919 14317 1 35 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.018 0.402 17919 14318 1 35 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.552 -0.812 17919 14319 1 35 . 1 1 61 61 ILE H H 61 7.250 7.250 8.217 -0.967 17919 14320 1 35 . 1 1 62 62 GLN N N 62 124.740 124.740 126.168 -1.428 17919 14321 1 35 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.693 -0.187 17919 14322 1 35 . 1 1 62 62 GLN C C 62 175.970 175.970 176.082 -0.112 17919 14323 1 35 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.722 -0.062 17919 14324 1 35 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.017 0.633 17919 14325 1 35 . 1 1 62 62 GLN H H 62 7.610 7.610 8.081 -0.471 17919 14326 1 35 . 1 1 63 63 LYS N N 63 120.300 120.300 121.505 -1.205 17919 14327 1 35 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.880 0.121 17919 14328 1 35 . 1 1 63 63 LYS C C 63 175.810 175.810 176.342 -0.532 17919 14329 1 35 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.841 -0.051 17919 14330 1 35 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.148 1.502 17919 14331 1 35 . 1 1 63 63 LYS H H 63 8.490 8.490 8.745 -0.255 17919 14332 1 35 . 1 1 64 64 GLU N N 64 113.950 113.950 119.147 -5.197 17919 14333 1 35 . 1 1 64 64 GLU HA H 64 3.465 3.465 4.141 -0.676 17919 14334 1 35 . 1 1 64 64 GLU C C 64 175.250 175.250 175.293 -0.043 17919 14335 1 35 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.342 0.548 17919 14336 1 35 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.054 -2.154 17919 14337 1 35 . 1 1 64 64 GLU H H 64 9.280 9.280 8.667 0.613 17919 14338 1 35 . 1 1 65 65 SER N N 65 114.730 114.730 115.540 -0.810 17919 14339 1 35 . 1 1 65 65 SER HA H 65 4.640 4.640 4.456 0.184 17919 14340 1 35 . 1 1 65 65 SER C C 65 172.160 172.160 174.763 -2.603 17919 14341 1 35 . 1 1 65 65 SER CA C 65 60.890 60.890 59.498 1.392 17919 14342 1 35 . 1 1 65 65 SER CB C 65 64.910 64.910 63.501 1.409 17919 14343 1 35 . 1 1 65 65 SER H H 65 7.670 7.670 7.580 0.090 17919 14344 1 35 . 1 1 66 66 THR N N 66 117.110 117.110 123.921 -6.811 17919 14345 1 35 . 1 1 66 66 THR HA H 66 5.270 5.270 4.469 0.801 17919 14346 1 35 . 1 1 66 66 THR C C 66 173.950 173.950 174.039 -0.089 17919 14347 1 35 . 1 1 66 66 THR CA C 66 62.340 62.340 63.505 -1.165 17919 14348 1 35 . 1 1 66 66 THR CB C 66 70.080 70.080 69.037 1.043 17919 14349 1 35 . 1 1 66 66 THR H H 66 8.730 8.730 8.675 0.055 17919 14350 1 35 . 1 1 67 67 LEU N N 67 127.110 127.110 127.619 -0.509 17919 14351 1 35 . 1 1 67 67 LEU HA H 67 5.060 5.060 5.281 -0.221 17919 14352 1 35 . 1 1 67 67 LEU C C 67 175.770 175.770 176.353 -0.583 17919 14353 1 35 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.248 0.652 17919 14354 1 35 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.580 -0.320 17919 14355 1 35 . 1 1 67 67 LEU H H 67 9.410 9.410 9.108 0.302 17919 14356 1 35 . 1 1 68 68 HIS N N 68 118.380 118.380 117.133 1.247 17919 14357 1 35 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.493 -0.253 17919 14358 1 35 . 1 1 68 68 HIS C C 68 173.150 173.150 174.660 -1.510 17919 14359 1 35 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.912 0.088 17919 14360 1 35 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.425 -1.895 17919 14361 1 35 . 1 1 68 68 HIS H H 68 9.230 9.230 8.769 0.461 17919 14362 1 35 . 1 1 69 69 LEU N N 69 124.460 124.460 121.573 2.887 17919 14363 1 35 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.367 -0.177 17919 14364 1 35 . 1 1 69 69 LEU C C 69 175.270 175.270 174.394 0.876 17919 14365 1 35 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.882 -0.992 17919 14366 1 35 . 1 1 69 69 LEU CB C 69 44.380 44.380 45.447 -1.067 17919 14367 1 35 . 1 1 69 69 LEU H H 69 8.340 8.340 8.080 0.260 17919 14368 1 35 . 1 1 70 70 VAL N N 70 126.940 126.940 126.476 0.464 17919 14369 1 35 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.474 -0.124 17919 14370 1 35 . 1 1 70 70 VAL C C 70 174.000 174.000 174.619 -0.619 17919 14371 1 35 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.120 0.680 17919 14372 1 35 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.011 -0.101 17919 14373 1 35 . 1 1 70 70 VAL H H 70 9.200 9.200 8.404 0.796 17919 14374 1 35 . 1 1 71 71 LEU N N 71 123.130 123.130 126.762 -3.632 17919 14375 1 35 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.793 0.267 17919 14376 1 35 . 1 1 71 71 LEU C C 71 177.830 177.830 177.170 0.660 17919 14377 1 35 . 1 1 71 71 LEU CA C 71 53.940 53.940 54.610 -0.670 17919 14378 1 35 . 1 1 71 71 LEU CB C 71 42.850 42.850 41.810 1.040 17919 14379 1 35 . 1 1 71 71 LEU H H 71 8.120 8.120 8.413 -0.293 17919 14380 1 35 . 1 1 72 72 ARG N N 72 123.490 123.490 123.871 -0.381 17919 14381 1 35 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.685 -0.384 17919 14382 1 35 . 1 1 72 72 ARG C C 72 175.350 175.350 176.005 -0.655 17919 14383 1 35 . 1 1 72 72 ARG CA C 72 55.610 55.610 54.070 1.540 17919 14384 1 35 . 1 1 72 72 ARG CB C 72 31.350 31.350 32.434 -1.084 17919 14385 1 35 . 1 1 72 72 ARG H H 72 8.580 8.580 8.137 0.443 17919 14386 1 36 . 1 1 2 2 GLN N N 2 123.220 123.220 120.011 3.209 17919 14387 1 36 . 1 1 2 2 GLN HA H 2 5.249 5.249 4.867 0.382 17919 14388 1 36 . 1 1 2 2 GLN C C 2 175.920 175.920 175.428 0.492 17919 14389 1 36 . 1 1 2 2 GLN CA C 2 55.080 55.080 55.493 -0.413 17919 14390 1 36 . 1 1 2 2 GLN CB C 2 30.760 30.760 29.618 1.142 17919 14391 1 36 . 1 1 2 2 GLN H H 2 8.900 8.900 8.406 0.494 17919 14392 1 36 . 1 1 3 3 ILE N N 3 115.340 115.340 118.052 -2.712 17919 14393 1 36 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.288 -0.075 17919 14394 1 36 . 1 1 3 3 ILE C C 3 172.450 172.450 173.473 -1.023 17919 14395 1 36 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.445 0.125 17919 14396 1 36 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.513 0.697 17919 14397 1 36 . 1 1 3 3 ILE H H 3 8.320 8.320 8.507 -0.187 17919 14398 1 36 . 1 1 4 4 PHE N N 4 118.110 118.110 120.880 -2.770 17919 14399 1 36 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.568 0.062 17919 14400 1 36 . 1 1 4 4 PHE C C 4 175.320 175.320 175.311 0.009 17919 14401 1 36 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.102 0.108 17919 14402 1 36 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.831 -0.351 17919 14403 1 36 . 1 1 4 4 PHE H H 4 8.610 8.610 8.416 0.194 17919 14404 1 36 . 1 1 5 5 VAL N N 5 121.000 121.000 122.562 -1.562 17919 14405 1 36 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.912 -0.187 17919 14406 1 36 . 1 1 5 5 VAL C C 5 174.870 174.870 175.046 -0.176 17919 14407 1 36 . 1 1 5 5 VAL CA C 5 60.620 60.620 60.975 -0.355 17919 14408 1 36 . 1 1 5 5 VAL CB C 5 34.230 34.230 32.791 1.438 17919 14409 1 36 . 1 1 5 5 VAL H H 5 9.300 9.300 8.460 0.840 17919 14410 1 36 . 1 1 6 6 LYS N N 6 127.520 127.520 129.304 -1.784 17919 14411 1 36 . 1 1 6 6 LYS HA H 6 5.367 5.367 4.600 0.767 17919 14412 1 36 . 1 1 6 6 LYS C C 6 177.140 177.140 175.917 1.223 17919 14413 1 36 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.931 -0.411 17919 14414 1 36 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.825 0.225 17919 14415 1 36 . 1 1 6 6 LYS H H 6 8.820 8.820 9.238 -0.418 17919 14416 1 36 . 1 1 7 7 THR N N 7 115.400 115.400 117.599 -2.199 17919 14417 1 36 . 1 1 7 7 THR HA H 7 4.970 4.970 4.696 0.274 17919 14418 1 36 . 1 1 7 7 THR C C 7 176.910 176.910 176.530 0.380 17919 14419 1 36 . 1 1 7 7 THR CA C 7 60.470 60.470 60.921 -0.451 17919 14420 1 36 . 1 1 7 7 THR CB C 7 70.630 70.630 70.359 0.272 17919 14421 1 36 . 1 1 7 7 THR H H 7 8.730 8.730 8.515 0.215 17919 14422 1 36 . 1 1 8 8 LEU N N 8 121.330 121.330 123.235 -1.905 17919 14423 1 36 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.150 0.160 17919 14424 1 36 . 1 1 8 8 LEU C C 8 178.800 178.800 177.557 1.243 17919 14425 1 36 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.541 0.039 17919 14426 1 36 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.232 -0.262 17919 14427 1 36 . 1 1 8 8 LEU H H 8 9.100 9.100 8.914 0.186 17919 14428 1 36 . 1 1 9 9 THR N N 9 105.590 105.590 107.229 -1.639 17919 14429 1 36 . 1 1 9 9 THR HA H 9 4.428 4.428 4.270 0.158 17919 14430 1 36 . 1 1 9 9 THR C C 9 175.520 175.520 175.333 0.187 17919 14431 1 36 . 1 1 9 9 THR CA C 9 61.400 61.400 62.155 -0.755 17919 14432 1 36 . 1 1 9 9 THR CB C 9 69.140 69.140 68.472 0.668 17919 14433 1 36 . 1 1 9 9 THR H H 9 7.630 7.630 7.763 -0.133 17919 14434 1 36 . 1 1 10 10 GLY N N 10 108.890 108.890 111.379 -2.489 17919 14435 1 36 . 1 1 10 10 GLY C C 10 174.070 174.070 173.786 0.284 17919 14436 1 36 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.843 0.617 17919 14437 1 36 . 1 1 10 10 GLY H H 10 7.810 7.810 7.854 -0.044 17919 14438 1 36 . 1 1 11 11 LYS N N 11 121.600 121.600 122.973 -1.373 17919 14439 1 36 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.360 0.001 17919 14440 1 36 . 1 1 11 11 LYS C C 11 175.940 175.940 175.372 0.568 17919 14441 1 36 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.320 -0.040 17919 14442 1 36 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.394 -0.194 17919 14443 1 36 . 1 1 11 11 LYS H H 11 7.280 7.280 7.721 -0.441 17919 14444 1 36 . 1 1 12 12 THR N N 12 120.440 120.440 119.278 1.162 17919 14445 1 36 . 1 1 12 12 THR HA H 12 5.046 5.046 5.424 -0.378 17919 14446 1 36 . 1 1 12 12 THR C C 12 174.320 174.320 174.046 0.274 17919 14447 1 36 . 1 1 12 12 THR CA C 12 62.390 62.390 60.508 1.882 17919 14448 1 36 . 1 1 12 12 THR CB C 12 69.910 69.910 71.603 -1.693 17919 14449 1 36 . 1 1 12 12 THR H H 12 8.650 8.650 8.193 0.457 17919 14450 1 36 . 1 1 13 13 ILE N N 13 127.110 127.110 123.514 3.596 17919 14451 1 36 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.655 -0.111 17919 14452 1 36 . 1 1 13 13 ILE C C 13 175.220 175.220 174.587 0.633 17919 14453 1 36 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.337 -0.357 17919 14454 1 36 . 1 1 13 13 ILE CB C 13 40.950 40.950 42.034 -1.084 17919 14455 1 36 . 1 1 13 13 ILE H H 13 9.450 9.450 8.894 0.556 17919 14456 1 36 . 1 1 14 14 THR N N 14 121.520 121.520 121.318 0.202 17919 14457 1 36 . 1 1 14 14 THR HA H 14 4.964 4.964 5.096 -0.132 17919 14458 1 36 . 1 1 14 14 THR C C 14 173.790 173.790 173.682 0.108 17919 14459 1 36 . 1 1 14 14 THR CA C 14 61.940 61.940 61.631 0.309 17919 14460 1 36 . 1 1 14 14 THR CB C 14 69.650 69.650 69.795 -0.145 17919 14461 1 36 . 1 1 14 14 THR H H 14 8.710 8.710 8.345 0.365 17919 14462 1 36 . 1 1 15 15 LEU N N 15 124.800 124.800 125.093 -0.293 17919 14463 1 36 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.837 -0.057 17919 14464 1 36 . 1 1 15 15 LEU C C 15 174.670 174.670 174.908 -0.238 17919 14465 1 36 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.465 -0.634 17919 14466 1 36 . 1 1 15 15 LEU CB C 15 47.070 47.070 46.361 0.709 17919 14467 1 36 . 1 1 15 15 LEU H H 15 8.710 8.710 8.642 0.068 17919 14468 1 36 . 1 1 16 16 GLU N N 16 122.160 122.160 122.681 -0.521 17919 14469 1 36 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.194 -0.277 17919 14470 1 36 . 1 1 16 16 GLU C C 16 175.860 175.860 176.483 -0.623 17919 14471 1 36 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.010 -0.190 17919 14472 1 36 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.295 -0.845 17919 14473 1 36 . 1 1 16 16 GLU H H 16 8.140 8.140 8.558 -0.418 17919 14474 1 36 . 1 1 17 17 VAL N N 17 117.210 117.210 117.245 -0.035 17919 14475 1 36 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.747 -0.033 17919 14476 1 36 . 1 1 17 17 VAL C C 17 174.160 174.160 173.948 0.212 17919 14477 1 36 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.712 -1.282 17919 14478 1 36 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.754 0.646 17919 14479 1 36 . 1 1 17 17 VAL H H 17 8.900 8.900 8.848 0.052 17919 14480 1 36 . 1 1 18 18 GLU N N 18 118.990 118.990 120.983 -1.993 17919 14481 1 36 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.750 0.329 17919 14482 1 36 . 1 1 18 18 GLU C C 18 176.160 176.160 175.207 0.953 17919 14483 1 36 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.377 -0.657 17919 14484 1 36 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.803 -0.493 17919 14485 1 36 . 1 1 18 18 GLU H H 18 8.640 8.640 8.590 0.050 17919 14486 1 36 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.296 -0.155 17919 14487 1 36 . 1 1 19 19 PRO C C 19 175.310 175.310 177.214 -1.904 17919 14488 1 36 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.113 0.357 17919 14489 1 36 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.125 -0.175 17919 14490 1 36 . 1 1 20 20 SER N N 20 103.400 103.400 108.135 -4.735 17919 14491 1 36 . 1 1 20 20 SER HA H 20 4.370 4.370 4.425 -0.055 17919 14492 1 36 . 1 1 20 20 SER C C 20 174.660 174.660 174.184 0.476 17919 14493 1 36 . 1 1 20 20 SER CA C 20 57.400 57.400 57.532 -0.132 17919 14494 1 36 . 1 1 20 20 SER CB C 20 63.370 63.370 63.108 0.262 17919 14495 1 36 . 1 1 20 20 SER H H 20 7.040 7.040 7.940 -0.900 17919 14496 1 36 . 1 1 21 21 ASP N N 21 123.480 123.480 123.717 -0.237 17919 14497 1 36 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.673 0.022 17919 14498 1 36 . 1 1 21 21 ASP C C 21 176.360 176.360 175.783 0.577 17919 14499 1 36 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.537 1.163 17919 14500 1 36 . 1 1 21 21 ASP CB C 21 40.800 40.800 42.417 -1.617 17919 14501 1 36 . 1 1 21 21 ASP H H 21 8.030 8.030 7.706 0.324 17919 14502 1 36 . 1 1 22 22 THR N N 22 108.800 108.800 112.968 -4.168 17919 14503 1 36 . 1 1 22 22 THR HA H 22 4.920 4.920 4.645 0.275 17919 14504 1 36 . 1 1 22 22 THR C C 22 176.750 176.750 175.570 1.180 17919 14505 1 36 . 1 1 22 22 THR CA C 22 59.690 59.690 61.443 -1.753 17919 14506 1 36 . 1 1 22 22 THR CB C 22 71.200 71.200 70.882 0.318 17919 14507 1 36 . 1 1 22 22 THR H H 22 7.900 7.900 8.049 -0.149 17919 14508 1 36 . 1 1 23 23 ILE N N 23 121.190 121.190 124.167 -2.977 17919 14509 1 36 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.708 -0.051 17919 14510 1 36 . 1 1 23 23 ILE C C 23 179.040 179.040 177.565 1.475 17919 14511 1 36 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.702 -1.442 17919 14512 1 36 . 1 1 23 23 ILE CB C 23 34.350 34.350 37.468 -3.118 17919 14513 1 36 . 1 1 23 23 ILE H H 23 8.560 8.560 8.646 -0.086 17919 14514 1 36 . 1 1 24 24 GLU N N 24 120.830 120.830 119.394 1.436 17919 14515 1 36 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.830 0.087 17919 14516 1 36 . 1 1 24 24 GLU C C 24 178.640 178.640 178.710 -0.070 17919 14517 1 36 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.774 0.446 17919 14518 1 36 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.429 -1.149 17919 14519 1 36 . 1 1 24 24 GLU H H 24 9.760 9.760 8.535 1.225 17919 14520 1 36 . 1 1 25 25 ASN N N 25 120.570 120.570 115.724 4.846 17919 14521 1 36 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.622 -0.097 17919 14522 1 36 . 1 1 25 25 ASN C C 25 178.380 178.380 177.676 0.704 17919 14523 1 36 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.310 0.750 17919 14524 1 36 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.210 0.240 17919 14525 1 36 . 1 1 25 25 ASN H H 25 7.920 7.920 7.579 0.341 17919 14526 1 36 . 1 1 26 26 VAL N N 26 121.710 121.710 120.513 1.197 17919 14527 1 36 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.435 -0.038 17919 14528 1 36 . 1 1 26 26 VAL C C 26 177.950 177.950 177.841 0.109 17919 14529 1 36 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.510 1.150 17919 14530 1 36 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.218 -0.378 17919 14531 1 36 . 1 1 26 26 VAL H H 26 8.070 8.070 7.602 0.468 17919 14532 1 36 . 1 1 27 27 LYS N N 27 118.860 118.860 119.415 -0.555 17919 14533 1 36 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.132 0.448 17919 14534 1 36 . 1 1 27 27 LYS C C 27 180.550 180.550 178.879 1.671 17919 14535 1 36 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.549 -0.299 17919 14536 1 36 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.337 1.393 17919 14537 1 36 . 1 1 27 27 LYS H H 27 8.560 8.560 7.538 1.022 17919 14538 1 36 . 1 1 28 28 ALA N N 28 123.440 123.440 120.733 2.707 17919 14539 1 36 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.133 0.027 17919 14540 1 36 . 1 1 28 28 ALA C C 28 180.300 180.300 179.444 0.856 17919 14541 1 36 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.050 0.320 17919 14542 1 36 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.392 -0.682 17919 14543 1 36 . 1 1 28 28 ALA H H 28 8.060 8.060 7.649 0.411 17919 14544 1 36 . 1 1 29 29 LYS N N 29 119.940 119.940 119.131 0.809 17919 14545 1 36 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.056 0.151 17919 14546 1 36 . 1 1 29 29 LYS C C 29 180.320 180.320 179.242 1.078 17919 14547 1 36 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.067 0.583 17919 14548 1 36 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.363 0.927 17919 14549 1 36 . 1 1 29 29 LYS H H 29 7.850 7.850 7.710 0.140 17919 14550 1 36 . 1 1 30 30 ILE N N 30 121.080 121.080 120.937 0.143 17919 14551 1 36 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.615 -0.108 17919 14552 1 36 . 1 1 30 30 ILE C C 30 178.310 178.310 177.196 1.114 17919 14553 1 36 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.590 0.561 17919 14554 1 36 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.790 -0.990 17919 14555 1 36 . 1 1 30 30 ILE H H 30 8.280 8.280 8.399 -0.119 17919 14556 1 36 . 1 1 31 31 GLN N N 31 123.490 123.490 120.335 3.155 17919 14557 1 36 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.964 -0.135 17919 14558 1 36 . 1 1 31 31 GLN C C 31 178.890 178.890 178.442 0.448 17919 14559 1 36 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.232 0.768 17919 14560 1 36 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.296 -0.576 17919 14561 1 36 . 1 1 31 31 GLN H H 31 8.580 8.580 7.934 0.646 17919 14562 1 36 . 1 1 32 32 ASP N N 32 119.360 119.360 119.138 0.222 17919 14563 1 36 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.389 -0.035 17919 14564 1 36 . 1 1 32 32 ASP C C 32 177.250 177.250 177.446 -0.196 17919 14565 1 36 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.987 0.203 17919 14566 1 36 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.809 -0.228 17919 14567 1 36 . 1 1 32 32 ASP H H 32 8.010 8.010 7.991 0.019 17919 14568 1 36 . 1 1 33 33 LYS N N 33 115.130 115.130 118.297 -3.167 17919 14569 1 36 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.326 0.011 17919 14570 1 36 . 1 1 33 33 LYS C C 33 177.870 177.870 178.506 -0.636 17919 14571 1 36 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.858 0.192 17919 14572 1 36 . 1 1 33 33 LYS CB C 33 34.170 34.170 32.868 1.302 17919 14573 1 36 . 1 1 33 33 LYS H H 33 7.430 7.430 7.369 0.061 17919 14574 1 36 . 1 1 34 34 GLU N N 34 113.870 113.870 115.315 -1.445 17919 14575 1 36 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.478 0.147 17919 14576 1 36 . 1 1 34 34 GLU C C 34 177.840 177.840 177.651 0.189 17919 14577 1 36 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.034 -0.864 17919 14578 1 36 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.180 1.480 17919 14579 1 36 . 1 1 34 34 GLU H H 34 8.740 8.740 8.443 0.297 17919 14580 1 36 . 1 1 35 35 GLY N N 35 108.650 108.650 109.177 -0.527 17919 14581 1 36 . 1 1 35 35 GLY C C 35 173.960 173.960 174.513 -0.553 17919 14582 1 36 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.697 0.383 17919 14583 1 36 . 1 1 35 35 GLY H H 35 8.530 8.530 8.020 0.510 17919 14584 1 36 . 1 1 36 36 ILE N N 36 119.880 119.880 122.107 -2.227 17919 14585 1 36 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.247 0.198 17919 14586 1 36 . 1 1 36 36 ILE C C 36 173.590 173.590 174.398 -0.808 17919 14587 1 36 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.012 -0.262 17919 14588 1 36 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.235 2.345 17919 14589 1 36 . 1 1 36 36 ILE H H 36 6.150 6.150 7.456 -1.306 17919 14590 1 36 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.820 -0.186 17919 14591 1 36 . 1 1 37 37 PRO C C 37 176.940 176.940 176.273 0.667 17919 14592 1 36 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.092 0.568 17919 14593 1 36 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.302 0.548 17919 14594 1 36 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.064 0.053 17919 14595 1 36 . 1 1 38 38 PRO C C 38 178.320 178.320 178.794 -0.474 17919 14596 1 36 . 1 1 38 38 PRO CA C 38 66.260 66.260 66.305 -0.045 17919 14597 1 36 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.770 1.120 17919 14598 1 36 . 1 1 39 39 ASP N N 39 113.380 113.380 115.493 -2.113 17919 14599 1 36 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.341 0.088 17919 14600 1 36 . 1 1 39 39 ASP C C 39 177.090 177.090 177.527 -0.437 17919 14601 1 36 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.694 -1.054 17919 14602 1 36 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.510 -0.970 17919 14603 1 36 . 1 1 39 39 ASP H H 39 8.550 8.550 8.719 -0.169 17919 14604 1 36 . 1 1 40 40 GLN N N 40 116.780 116.780 116.143 0.637 17919 14605 1 36 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.368 0.096 17919 14606 1 36 . 1 1 40 40 GLN C C 40 175.380 175.380 176.142 -0.762 17919 14607 1 36 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.324 0.316 17919 14608 1 36 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.689 0.451 17919 14609 1 36 . 1 1 40 40 GLN H H 40 7.820 7.820 7.899 -0.079 17919 14610 1 36 . 1 1 41 41 GLN N N 41 117.720 117.720 119.787 -2.067 17919 14611 1 36 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.368 -0.124 17919 14612 1 36 . 1 1 41 41 GLN C C 41 176.300 176.300 175.484 0.816 17919 14613 1 36 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.713 0.757 17919 14614 1 36 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.333 2.317 17919 14615 1 36 . 1 1 41 41 GLN H H 41 7.480 7.480 7.553 -0.073 17919 14616 1 36 . 1 1 42 42 ARG N N 42 122.680 122.680 126.343 -3.663 17919 14617 1 36 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.506 -0.006 17919 14618 1 36 . 1 1 42 42 ARG C C 42 174.050 174.050 174.518 -0.468 17919 14619 1 36 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.008 0.042 17919 14620 1 36 . 1 1 42 42 ARG CB C 42 31.750 31.750 31.619 0.131 17919 14621 1 36 . 1 1 42 42 ARG H H 42 8.530 8.530 8.959 -0.429 17919 14622 1 36 . 1 1 43 43 LEU N N 43 124.040 124.040 127.289 -3.249 17919 14623 1 36 . 1 1 43 43 LEU C C 43 175.290 175.290 174.814 0.476 17919 14624 1 36 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.063 -1.083 17919 14625 1 36 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.348 1.442 17919 14626 1 36 . 1 1 43 43 LEU H H 43 8.820 8.820 8.771 0.049 17919 14627 1 36 . 1 1 44 44 ILE N N 44 121.920 121.920 124.206 -2.286 17919 14628 1 36 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.806 0.186 17919 14629 1 36 . 1 1 44 44 ILE C C 44 176.060 176.060 174.245 1.815 17919 14630 1 36 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.674 -0.694 17919 14631 1 36 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.504 -0.084 17919 14632 1 36 . 1 1 44 44 ILE H H 44 9.030 9.030 8.032 0.998 17919 14633 1 36 . 1 1 45 45 PHE N N 45 125.390 125.390 127.583 -2.193 17919 14634 1 36 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.043 0.002 17919 14635 1 36 . 1 1 45 45 PHE C C 45 174.470 174.470 174.701 -0.231 17919 14636 1 36 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.258 0.762 17919 14637 1 36 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.974 0.785 17919 14638 1 36 . 1 1 45 45 PHE H H 45 8.830 8.830 8.427 0.403 17919 14639 1 36 . 1 1 46 46 ALA N N 46 132.200 132.200 129.823 2.377 17919 14640 1 36 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.564 0.126 17919 14641 1 36 . 1 1 46 46 ALA C C 46 177.290 177.290 177.369 -0.079 17919 14642 1 36 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.741 -0.201 17919 14643 1 36 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.482 0.088 17919 14644 1 36 . 1 1 46 46 ALA H H 46 8.810 8.810 8.309 0.501 17919 14645 1 36 . 1 1 47 47 GLY N N 47 102.340 102.340 104.359 -2.019 17919 14646 1 36 . 1 1 47 47 GLY C C 47 173.810 173.810 174.211 -0.401 17919 14647 1 36 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.518 -0.168 17919 14648 1 36 . 1 1 47 47 GLY H H 47 8.130 8.130 8.485 -0.355 17919 14649 1 36 . 1 1 48 48 LYS N N 48 121.570 121.570 121.578 -0.008 17919 14650 1 36 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.570 0.052 17919 14651 1 36 . 1 1 48 48 LYS C C 48 174.700 174.700 175.228 -0.528 17919 14652 1 36 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.007 -0.457 17919 14653 1 36 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.519 0.011 17919 14654 1 36 . 1 1 48 48 LYS H H 48 7.980 7.980 7.524 0.456 17919 14655 1 36 . 1 1 49 49 GLN N N 49 122.410 122.410 126.244 -3.834 17919 14656 1 36 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.375 0.185 17919 14657 1 36 . 1 1 49 49 GLN C C 49 175.670 175.670 175.758 -0.088 17919 14658 1 36 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.450 -0.710 17919 14659 1 36 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.271 -0.271 17919 14660 1 36 . 1 1 49 49 GLN H H 49 8.600 8.600 8.596 0.004 17919 14661 1 36 . 1 1 50 50 LEU N N 50 125.520 125.520 127.775 -2.255 17919 14662 1 36 . 1 1 50 50 LEU HA H 50 4.090 4.090 3.962 0.128 17919 14663 1 36 . 1 1 50 50 LEU C C 50 176.660 176.660 175.961 0.699 17919 14664 1 36 . 1 1 50 50 LEU CA C 50 54.240 54.240 55.036 -0.796 17919 14665 1 36 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.125 -0.555 17919 14666 1 36 . 1 1 50 50 LEU H H 50 8.530 8.530 8.359 0.171 17919 14667 1 36 . 1 1 51 51 GLU N N 51 122.940 122.940 123.750 -0.810 17919 14668 1 36 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.565 -0.077 17919 14669 1 36 . 1 1 51 51 GLU C C 51 175.870 175.870 176.495 -0.625 17919 14670 1 36 . 1 1 51 51 GLU CA C 51 55.960 55.960 54.946 1.014 17919 14671 1 36 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.703 -1.133 17919 14672 1 36 . 1 1 51 51 GLU H H 51 8.400 8.400 8.377 0.023 17919 14673 1 36 . 1 1 52 52 ASP N N 52 120.030 120.030 127.218 -7.188 17919 14674 1 36 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.444 -0.085 17919 14675 1 36 . 1 1 52 52 ASP C C 52 177.330 177.330 177.828 -0.498 17919 14676 1 36 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.843 -0.883 17919 14677 1 36 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.728 0.122 17919 14678 1 36 . 1 1 52 52 ASP H H 52 8.160 8.160 8.847 -0.687 17919 14679 1 36 . 1 1 53 53 GLY N N 53 106.660 106.660 105.674 0.986 17919 14680 1 36 . 1 1 53 53 GLY C C 53 174.870 174.870 174.565 0.305 17919 14681 1 36 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.912 0.258 17919 14682 1 36 . 1 1 53 53 GLY H H 53 9.390 9.390 8.621 0.769 17919 14683 1 36 . 1 1 54 54 ARG N N 54 119.050 119.050 120.225 -1.175 17919 14684 1 36 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.472 0.223 17919 14685 1 36 . 1 1 54 54 ARG C C 54 175.350 175.350 175.789 -0.439 17919 14686 1 36 . 1 1 54 54 ARG CA C 54 54.390 54.390 55.599 -1.209 17919 14687 1 36 . 1 1 54 54 ARG CB C 54 32.650 32.650 31.413 1.236 17919 14688 1 36 . 1 1 54 54 ARG H H 54 7.460 7.460 7.368 0.092 17919 14689 1 36 . 1 1 55 55 THR N N 55 108.400 108.400 111.570 -3.170 17919 14690 1 36 . 1 1 55 55 THR HA H 55 5.240 5.240 4.982 0.258 17919 14691 1 36 . 1 1 55 55 THR C C 55 176.560 176.560 176.010 0.550 17919 14692 1 36 . 1 1 55 55 THR CA C 55 59.690 59.690 59.730 -0.040 17919 14693 1 36 . 1 1 55 55 THR CB C 55 72.260 72.260 71.820 0.440 17919 14694 1 36 . 1 1 55 55 THR H H 55 8.730 8.730 8.741 -0.011 17919 14695 1 36 . 1 1 56 56 LEU N N 56 117.920 117.920 122.057 -4.137 17919 14696 1 36 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.099 -0.039 17919 14697 1 36 . 1 1 56 56 LEU C C 56 180.810 180.810 179.126 1.684 17919 14698 1 36 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.375 0.335 17919 14699 1 36 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.370 -1.000 17919 14700 1 36 . 1 1 56 56 LEU H H 56 8.140 8.140 8.196 -0.056 17919 14701 1 36 . 1 1 57 57 SER N N 57 113.330 113.330 115.020 -1.690 17919 14702 1 36 . 1 1 57 57 SER HA H 57 4.370 4.370 4.215 0.155 17919 14703 1 36 . 1 1 57 57 SER C C 57 178.310 178.310 176.687 1.623 17919 14704 1 36 . 1 1 57 57 SER CA C 57 61.080 61.080 61.626 -0.546 17919 14705 1 36 . 1 1 57 57 SER CB C 57 62.530 62.530 62.626 -0.096 17919 14706 1 36 . 1 1 57 57 SER H H 57 8.470 8.470 8.002 0.468 17919 14707 1 36 . 1 1 58 58 ASP N N 58 124.190 124.190 122.472 1.718 17919 14708 1 36 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.354 -0.058 17919 14709 1 36 . 1 1 58 58 ASP C C 58 177.400 177.400 176.551 0.849 17919 14710 1 36 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.534 0.646 17919 14711 1 36 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.318 -0.218 17919 14712 1 36 . 1 1 58 58 ASP H H 58 7.930 7.930 8.116 -0.186 17919 14713 1 36 . 1 1 59 59 TYR N N 59 115.510 115.510 114.763 0.747 17919 14714 1 36 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.734 -0.064 17919 14715 1 36 . 1 1 59 59 TYR C C 59 174.700 174.700 175.087 -0.387 17919 14716 1 36 . 1 1 59 59 TYR CA C 59 58.250 58.250 56.717 1.533 17919 14717 1 36 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.227 1.843 17919 14718 1 36 . 1 1 59 59 TYR H H 59 7.250 7.250 7.281 -0.031 17919 14719 1 36 . 1 1 60 60 ASN N N 60 115.900 115.900 118.042 -2.142 17919 14720 1 36 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.365 -0.010 17919 14721 1 36 . 1 1 60 60 ASN C C 60 174.340 174.340 174.188 0.152 17919 14722 1 36 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.186 -0.066 17919 14723 1 36 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.176 0.234 17919 14724 1 36 . 1 1 60 60 ASN H H 60 8.150 8.150 7.838 0.312 17919 14725 1 36 . 1 1 61 61 ILE N N 61 118.600 118.600 119.595 -0.995 17919 14726 1 36 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.877 -0.484 17919 14727 1 36 . 1 1 61 61 ILE C C 61 174.610 174.610 175.112 -0.502 17919 14728 1 36 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.017 1.403 17919 14729 1 36 . 1 1 61 61 ILE CB C 61 36.740 36.740 38.209 -1.469 17919 14730 1 36 . 1 1 61 61 ILE H H 61 7.250 7.250 7.503 -0.253 17919 14731 1 36 . 1 1 62 62 GLN N N 62 124.740 124.740 125.565 -0.825 17919 14732 1 36 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.734 -0.228 17919 14733 1 36 . 1 1 62 62 GLN C C 62 175.970 175.970 175.274 0.696 17919 14734 1 36 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.463 0.197 17919 14735 1 36 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.449 0.201 17919 14736 1 36 . 1 1 62 62 GLN H H 62 7.610 7.610 7.970 -0.360 17919 14737 1 36 . 1 1 63 63 LYS N N 63 120.300 120.300 123.421 -3.121 17919 14738 1 36 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.925 0.076 17919 14739 1 36 . 1 1 63 63 LYS C C 63 175.810 175.810 176.873 -1.063 17919 14740 1 36 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.962 -0.172 17919 14741 1 36 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.490 0.160 17919 14742 1 36 . 1 1 63 63 LYS H H 63 8.490 8.490 8.703 -0.213 17919 14743 1 36 . 1 1 64 64 GLU N N 64 113.950 113.950 120.468 -6.518 17919 14744 1 36 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.603 -0.138 17919 14745 1 36 . 1 1 64 64 GLU C C 64 175.250 175.250 175.683 -0.433 17919 14746 1 36 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.292 0.598 17919 14747 1 36 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.744 -2.844 17919 14748 1 36 . 1 1 64 64 GLU H H 64 9.280 9.280 8.830 0.450 17919 14749 1 36 . 1 1 65 65 SER N N 65 114.730 114.730 114.816 -0.086 17919 14750 1 36 . 1 1 65 65 SER HA H 65 4.640 4.640 4.559 0.081 17919 14751 1 36 . 1 1 65 65 SER C C 65 172.160 172.160 173.923 -1.763 17919 14752 1 36 . 1 1 65 65 SER CA C 65 60.890 60.890 60.132 0.758 17919 14753 1 36 . 1 1 65 65 SER CB C 65 64.910 64.910 63.858 1.052 17919 14754 1 36 . 1 1 65 65 SER H H 65 7.670 7.670 7.484 0.186 17919 14755 1 36 . 1 1 66 66 THR N N 66 117.110 117.110 122.530 -5.420 17919 14756 1 36 . 1 1 66 66 THR HA H 66 5.270 5.270 4.951 0.319 17919 14757 1 36 . 1 1 66 66 THR C C 66 173.950 173.950 174.451 -0.501 17919 14758 1 36 . 1 1 66 66 THR CA C 66 62.340 62.340 62.831 -0.492 17919 14759 1 36 . 1 1 66 66 THR CB C 66 70.080 70.080 69.456 0.624 17919 14760 1 36 . 1 1 66 66 THR H H 66 8.730 8.730 8.703 0.027 17919 14761 1 36 . 1 1 67 67 LEU N N 67 127.110 127.110 127.869 -0.759 17919 14762 1 36 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.835 0.225 17919 14763 1 36 . 1 1 67 67 LEU C C 67 175.770 175.770 175.787 -0.017 17919 14764 1 36 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.507 -0.607 17919 14765 1 36 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.425 0.835 17919 14766 1 36 . 1 1 67 67 LEU H H 67 9.410 9.410 9.220 0.190 17919 14767 1 36 . 1 1 68 68 HIS N N 68 118.380 118.380 124.123 -5.743 17919 14768 1 36 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.182 0.058 17919 14769 1 36 . 1 1 68 68 HIS C C 68 173.150 173.150 175.140 -1.990 17919 14770 1 36 . 1 1 68 68 HIS CA C 68 55.000 55.000 53.203 1.797 17919 14771 1 36 . 1 1 68 68 HIS CB C 68 30.530 30.530 30.092 0.438 17919 14772 1 36 . 1 1 68 68 HIS H H 68 9.230 9.230 8.954 0.276 17919 14773 1 36 . 1 1 69 69 LEU N N 69 124.460 124.460 127.982 -3.522 17919 14774 1 36 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.198 0.992 17919 14775 1 36 . 1 1 69 69 LEU C C 69 175.270 175.270 174.604 0.666 17919 14776 1 36 . 1 1 69 69 LEU CA C 69 53.890 53.890 56.085 -2.195 17919 14777 1 36 . 1 1 69 69 LEU CB C 69 44.380 44.380 41.971 2.409 17919 14778 1 36 . 1 1 69 69 LEU H H 69 8.340 8.340 7.943 0.397 17919 14779 1 36 . 1 1 70 70 VAL N N 70 126.940 126.940 126.185 0.755 17919 14780 1 36 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.308 0.042 17919 14781 1 36 . 1 1 70 70 VAL C C 70 174.000 174.000 174.465 -0.465 17919 14782 1 36 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.658 0.142 17919 14783 1 36 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.010 -0.100 17919 14784 1 36 . 1 1 70 70 VAL H H 70 9.200 9.200 8.994 0.206 17919 14785 1 36 . 1 1 71 71 LEU N N 71 123.130 123.130 125.236 -2.106 17919 14786 1 36 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.851 0.209 17919 14787 1 36 . 1 1 71 71 LEU C C 71 177.830 177.830 175.939 1.891 17919 14788 1 36 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.398 0.542 17919 14789 1 36 . 1 1 71 71 LEU CB C 71 42.850 42.850 44.428 -1.578 17919 14790 1 36 . 1 1 71 71 LEU H H 71 8.120 8.120 8.492 -0.372 17919 14791 1 36 . 1 1 72 72 ARG N N 72 123.490 123.490 124.545 -1.055 17919 14792 1 36 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.460 -0.159 17919 14793 1 36 . 1 1 72 72 ARG C C 72 175.350 175.350 175.254 0.096 17919 14794 1 36 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.384 -0.774 17919 14795 1 36 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.483 0.868 17919 14796 1 36 . 1 1 72 72 ARG H H 72 8.580 8.580 8.140 0.440 17919 14797 1 37 . 1 1 2 2 GLN N N 2 123.220 123.220 126.996 -3.776 17919 14798 1 37 . 1 1 2 2 GLN HA H 2 5.249 5.249 4.858 0.391 17919 14799 1 37 . 1 1 2 2 GLN C C 2 175.920 175.920 173.886 2.034 17919 14800 1 37 . 1 1 2 2 GLN CA C 2 55.080 55.080 55.174 -0.094 17919 14801 1 37 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.528 0.232 17919 14802 1 37 . 1 1 2 2 GLN H H 2 8.900 8.900 8.743 0.157 17919 14803 1 37 . 1 1 3 3 ILE N N 3 115.340 115.340 119.563 -4.223 17919 14804 1 37 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.584 -0.371 17919 14805 1 37 . 1 1 3 3 ILE C C 3 172.450 172.450 173.364 -0.914 17919 14806 1 37 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.218 0.352 17919 14807 1 37 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.614 0.596 17919 14808 1 37 . 1 1 3 3 ILE H H 3 8.320 8.320 8.135 0.185 17919 14809 1 37 . 1 1 4 4 PHE N N 4 118.110 118.110 120.663 -2.553 17919 14810 1 37 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.371 0.259 17919 14811 1 37 . 1 1 4 4 PHE C C 4 175.320 175.320 174.906 0.414 17919 14812 1 37 . 1 1 4 4 PHE CA C 4 55.210 55.210 56.048 -0.838 17919 14813 1 37 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.192 -0.712 17919 14814 1 37 . 1 1 4 4 PHE H H 4 8.610 8.610 8.082 0.528 17919 14815 1 37 . 1 1 5 5 VAL N N 5 121.000 121.000 122.630 -1.630 17919 14816 1 37 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.851 -0.126 17919 14817 1 37 . 1 1 5 5 VAL C C 5 174.870 174.870 174.206 0.664 17919 14818 1 37 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.297 -0.677 17919 14819 1 37 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.153 0.077 17919 14820 1 37 . 1 1 5 5 VAL H H 5 9.300 9.300 9.306 -0.006 17919 14821 1 37 . 1 1 6 6 LYS N N 6 127.520 127.520 129.445 -1.925 17919 14822 1 37 . 1 1 6 6 LYS HA H 6 5.367 5.367 4.728 0.639 17919 14823 1 37 . 1 1 6 6 LYS C C 6 177.140 177.140 174.987 2.153 17919 14824 1 37 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.965 -0.445 17919 14825 1 37 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.245 -0.195 17919 14826 1 37 . 1 1 6 6 LYS H H 6 8.820 8.820 9.084 -0.264 17919 14827 1 37 . 1 1 7 7 THR N N 7 115.400 115.400 121.870 -6.470 17919 14828 1 37 . 1 1 7 7 THR HA H 7 4.970 4.970 4.545 0.425 17919 14829 1 37 . 1 1 7 7 THR C C 7 176.910 176.910 174.781 2.129 17919 14830 1 37 . 1 1 7 7 THR CA C 7 60.470 60.470 61.357 -0.887 17919 14831 1 37 . 1 1 7 7 THR CB C 7 70.630 70.630 70.710 -0.080 17919 14832 1 37 . 1 1 7 7 THR H H 7 8.730 8.730 8.335 0.395 17919 14833 1 37 . 1 1 8 8 LEU N N 8 121.330 121.330 126.281 -4.951 17919 14834 1 37 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.071 0.239 17919 14835 1 37 . 1 1 8 8 LEU C C 8 178.800 178.800 177.275 1.525 17919 14836 1 37 . 1 1 8 8 LEU CA C 8 57.580 57.580 58.169 -0.589 17919 14837 1 37 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.042 -0.072 17919 14838 1 37 . 1 1 8 8 LEU H H 8 9.100 9.100 8.427 0.673 17919 14839 1 37 . 1 1 9 9 THR N N 9 105.590 105.590 107.737 -2.147 17919 14840 1 37 . 1 1 9 9 THR HA H 9 4.428 4.428 4.299 0.129 17919 14841 1 37 . 1 1 9 9 THR C C 9 175.520 175.520 175.399 0.121 17919 14842 1 37 . 1 1 9 9 THR CA C 9 61.400 61.400 62.346 -0.946 17919 14843 1 37 . 1 1 9 9 THR CB C 9 69.140 69.140 68.189 0.951 17919 14844 1 37 . 1 1 9 9 THR H H 9 7.630 7.630 7.873 -0.243 17919 14845 1 37 . 1 1 10 10 GLY N N 10 108.890 108.890 110.986 -2.096 17919 14846 1 37 . 1 1 10 10 GLY C C 10 174.070 174.070 174.046 0.024 17919 14847 1 37 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.749 0.710 17919 14848 1 37 . 1 1 10 10 GLY H H 10 7.810 7.810 8.181 -0.371 17919 14849 1 37 . 1 1 11 11 LYS N N 11 121.600 121.600 123.864 -2.264 17919 14850 1 37 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.003 0.358 17919 14851 1 37 . 1 1 11 11 LYS C C 11 175.940 175.940 175.341 0.599 17919 14852 1 37 . 1 1 11 11 LYS CA C 11 56.280 56.280 57.601 -1.321 17919 14853 1 37 . 1 1 11 11 LYS CB C 11 33.200 33.200 32.819 0.381 17919 14854 1 37 . 1 1 11 11 LYS H H 11 7.280 7.280 7.938 -0.658 17919 14855 1 37 . 1 1 12 12 THR N N 12 120.440 120.440 117.547 2.893 17919 14856 1 37 . 1 1 12 12 THR HA H 12 5.046 5.046 4.966 0.080 17919 14857 1 37 . 1 1 12 12 THR C C 12 174.320 174.320 174.146 0.174 17919 14858 1 37 . 1 1 12 12 THR CA C 12 62.390 62.390 60.901 1.489 17919 14859 1 37 . 1 1 12 12 THR CB C 12 69.910 69.910 70.887 -0.977 17919 14860 1 37 . 1 1 12 12 THR H H 12 8.650 8.650 8.246 0.404 17919 14861 1 37 . 1 1 13 13 ILE N N 13 127.110 127.110 120.733 6.377 17919 14862 1 37 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.842 -0.298 17919 14863 1 37 . 1 1 13 13 ILE C C 13 175.220 175.220 174.072 1.148 17919 14864 1 37 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.633 0.347 17919 14865 1 37 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.907 0.043 17919 14866 1 37 . 1 1 13 13 ILE H H 13 9.450 9.450 8.899 0.551 17919 14867 1 37 . 1 1 14 14 THR N N 14 121.520 121.520 121.527 -0.007 17919 14868 1 37 . 1 1 14 14 THR HA H 14 4.964 4.964 4.816 0.148 17919 14869 1 37 . 1 1 14 14 THR C C 14 173.790 173.790 173.556 0.234 17919 14870 1 37 . 1 1 14 14 THR CA C 14 61.940 61.940 61.945 -0.005 17919 14871 1 37 . 1 1 14 14 THR CB C 14 69.650 69.650 69.593 0.057 17919 14872 1 37 . 1 1 14 14 THR H H 14 8.710 8.710 8.370 0.340 17919 14873 1 37 . 1 1 15 15 LEU N N 15 124.800 124.800 126.361 -1.561 17919 14874 1 37 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.733 0.047 17919 14875 1 37 . 1 1 15 15 LEU C C 15 174.670 174.670 174.579 0.091 17919 14876 1 37 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.802 -0.972 17919 14877 1 37 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.417 1.653 17919 14878 1 37 . 1 1 15 15 LEU H H 15 8.710 8.710 8.341 0.369 17919 14879 1 37 . 1 1 16 16 GLU N N 16 122.160 122.160 123.658 -1.498 17919 14880 1 37 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.692 0.225 17919 14881 1 37 . 1 1 16 16 GLU C C 16 175.860 175.860 174.946 0.914 17919 14882 1 37 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.433 -0.613 17919 14883 1 37 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.078 -0.628 17919 14884 1 37 . 1 1 16 16 GLU H H 16 8.140 8.140 8.367 -0.227 17919 14885 1 37 . 1 1 17 17 VAL N N 17 117.210 117.210 120.157 -2.947 17919 14886 1 37 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.558 0.156 17919 14887 1 37 . 1 1 17 17 VAL C C 17 174.160 174.160 174.050 0.110 17919 14888 1 37 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.945 -1.515 17919 14889 1 37 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.282 1.118 17919 14890 1 37 . 1 1 17 17 VAL H H 17 8.900 8.900 8.832 0.068 17919 14891 1 37 . 1 1 18 18 GLU N N 18 118.990 118.990 118.709 0.281 17919 14892 1 37 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.675 0.404 17919 14893 1 37 . 1 1 18 18 GLU C C 18 176.160 176.160 175.219 0.941 17919 14894 1 37 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.782 -1.062 17919 14895 1 37 . 1 1 18 18 GLU CB C 18 30.310 30.310 31.692 -1.382 17919 14896 1 37 . 1 1 18 18 GLU H H 18 8.640 8.640 8.536 0.104 17919 14897 1 37 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.304 -0.163 17919 14898 1 37 . 1 1 19 19 PRO C C 19 175.310 175.310 177.677 -2.367 17919 14899 1 37 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.292 0.178 17919 14900 1 37 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.098 -0.148 17919 14901 1 37 . 1 1 20 20 SER N N 20 103.400 103.400 111.710 -8.310 17919 14902 1 37 . 1 1 20 20 SER HA H 20 4.370 4.370 4.301 0.069 17919 14903 1 37 . 1 1 20 20 SER C C 20 174.660 174.660 174.422 0.238 17919 14904 1 37 . 1 1 20 20 SER CA C 20 57.400 57.400 59.011 -1.611 17919 14905 1 37 . 1 1 20 20 SER CB C 20 63.370 63.370 62.748 0.622 17919 14906 1 37 . 1 1 20 20 SER H H 20 7.040 7.040 8.111 -1.071 17919 14907 1 37 . 1 1 21 21 ASP N N 21 123.480 123.480 122.449 1.031 17919 14908 1 37 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.804 -0.109 17919 14909 1 37 . 1 1 21 21 ASP C C 21 176.360 176.360 175.228 1.132 17919 14910 1 37 . 1 1 21 21 ASP CA C 21 55.700 55.700 53.859 1.841 17919 14911 1 37 . 1 1 21 21 ASP CB C 21 40.800 40.800 42.628 -1.828 17919 14912 1 37 . 1 1 21 21 ASP H H 21 8.030 8.030 7.493 0.537 17919 14913 1 37 . 1 1 22 22 THR N N 22 108.800 108.800 113.771 -4.971 17919 14914 1 37 . 1 1 22 22 THR HA H 22 4.920 4.920 4.899 0.021 17919 14915 1 37 . 1 1 22 22 THR C C 22 176.750 176.750 176.136 0.614 17919 14916 1 37 . 1 1 22 22 THR CA C 22 59.690 59.690 60.247 -0.557 17919 14917 1 37 . 1 1 22 22 THR CB C 22 71.200 71.200 71.501 -0.302 17919 14918 1 37 . 1 1 22 22 THR H H 22 7.900 7.900 8.018 -0.118 17919 14919 1 37 . 1 1 23 23 ILE N N 23 121.190 121.190 123.076 -1.886 17919 14920 1 37 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.655 0.002 17919 14921 1 37 . 1 1 23 23 ILE C C 23 179.040 179.040 177.828 1.212 17919 14922 1 37 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.778 -1.518 17919 14923 1 37 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.232 -1.882 17919 14924 1 37 . 1 1 23 23 ILE H H 23 8.560 8.560 9.066 -0.506 17919 14925 1 37 . 1 1 24 24 GLU N N 24 120.830 120.830 120.449 0.381 17919 14926 1 37 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.931 -0.014 17919 14927 1 37 . 1 1 24 24 GLU C C 24 178.640 178.640 179.154 -0.514 17919 14928 1 37 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.757 0.463 17919 14929 1 37 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.399 -1.119 17919 14930 1 37 . 1 1 24 24 GLU H H 24 9.760 9.760 8.090 1.670 17919 14931 1 37 . 1 1 25 25 ASN N N 25 120.570 120.570 117.578 2.992 17919 14932 1 37 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.582 -0.057 17919 14933 1 37 . 1 1 25 25 ASN C C 25 178.380 178.380 177.760 0.620 17919 14934 1 37 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.648 0.412 17919 14935 1 37 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.760 -0.310 17919 14936 1 37 . 1 1 25 25 ASN H H 25 7.920 7.920 7.690 0.230 17919 14937 1 37 . 1 1 26 26 VAL N N 26 121.710 121.710 121.041 0.669 17919 14938 1 37 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.852 -0.455 17919 14939 1 37 . 1 1 26 26 VAL C C 26 177.950 177.950 176.592 1.358 17919 14940 1 37 . 1 1 26 26 VAL CA C 26 67.660 67.660 63.880 3.780 17919 14941 1 37 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.394 -0.554 17919 14942 1 37 . 1 1 26 26 VAL H H 26 8.070 8.070 8.418 -0.348 17919 14943 1 37 . 1 1 27 27 LYS N N 27 118.860 118.860 121.057 -2.197 17919 14944 1 37 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.288 0.292 17919 14945 1 37 . 1 1 27 27 LYS C C 27 180.550 180.550 178.859 1.691 17919 14946 1 37 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.860 -0.610 17919 14947 1 37 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.168 1.562 17919 14948 1 37 . 1 1 27 27 LYS H H 27 8.560 8.560 8.606 -0.046 17919 14949 1 37 . 1 1 28 28 ALA N N 28 123.440 123.440 122.395 1.045 17919 14950 1 37 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.033 0.127 17919 14951 1 37 . 1 1 28 28 ALA C C 28 180.300 180.300 179.053 1.247 17919 14952 1 37 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.232 0.138 17919 14953 1 37 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.250 -0.540 17919 14954 1 37 . 1 1 28 28 ALA H H 28 8.060 8.060 7.598 0.462 17919 14955 1 37 . 1 1 29 29 LYS N N 29 119.940 119.940 119.644 0.296 17919 14956 1 37 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.036 0.171 17919 14957 1 37 . 1 1 29 29 LYS C C 29 180.320 180.320 179.087 1.233 17919 14958 1 37 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.326 0.324 17919 14959 1 37 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.370 0.920 17919 14960 1 37 . 1 1 29 29 LYS H H 29 7.850 7.850 7.443 0.407 17919 14961 1 37 . 1 1 30 30 ILE N N 30 121.080 121.080 120.241 0.839 17919 14962 1 37 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.543 -0.036 17919 14963 1 37 . 1 1 30 30 ILE C C 30 178.310 178.310 177.437 0.873 17919 14964 1 37 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.270 0.880 17919 14965 1 37 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.449 -0.649 17919 14966 1 37 . 1 1 30 30 ILE H H 30 8.280 8.280 8.246 0.034 17919 14967 1 37 . 1 1 31 31 GLN N N 31 123.490 123.490 119.864 3.626 17919 14968 1 37 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.938 -0.109 17919 14969 1 37 . 1 1 31 31 GLN C C 31 178.890 178.890 178.311 0.579 17919 14970 1 37 . 1 1 31 31 GLN CA C 31 60.000 60.000 58.817 1.183 17919 14971 1 37 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.559 -0.839 17919 14972 1 37 . 1 1 31 31 GLN H H 31 8.580 8.580 8.011 0.569 17919 14973 1 37 . 1 1 32 32 ASP N N 32 119.360 119.360 119.190 0.170 17919 14974 1 37 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.407 -0.053 17919 14975 1 37 . 1 1 32 32 ASP C C 32 177.250 177.250 178.073 -0.823 17919 14976 1 37 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.754 0.436 17919 14977 1 37 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.919 -0.339 17919 14978 1 37 . 1 1 32 32 ASP H H 32 8.010 8.010 8.357 -0.347 17919 14979 1 37 . 1 1 33 33 LYS N N 33 115.130 115.130 118.572 -3.442 17919 14980 1 37 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.304 0.033 17919 14981 1 37 . 1 1 33 33 LYS C C 33 177.870 177.870 178.356 -0.486 17919 14982 1 37 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.974 0.076 17919 14983 1 37 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.369 0.801 17919 14984 1 37 . 1 1 33 33 LYS H H 33 7.430 7.430 7.492 -0.062 17919 14985 1 37 . 1 1 34 34 GLU N N 34 113.870 113.870 114.746 -0.876 17919 14986 1 37 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.514 0.111 17919 14987 1 37 . 1 1 34 34 GLU C C 34 177.840 177.840 177.211 0.629 17919 14988 1 37 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.206 -1.036 17919 14989 1 37 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.980 0.680 17919 14990 1 37 . 1 1 34 34 GLU H H 34 8.740 8.740 8.278 0.462 17919 14991 1 37 . 1 1 35 35 GLY N N 35 108.650 108.650 108.676 -0.026 17919 14992 1 37 . 1 1 35 35 GLY C C 35 173.960 173.960 174.758 -0.798 17919 14993 1 37 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.700 0.381 17919 14994 1 37 . 1 1 35 35 GLY H H 35 8.530 8.530 7.692 0.838 17919 14995 1 37 . 1 1 36 36 ILE N N 36 119.880 119.880 122.628 -2.748 17919 14996 1 37 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.165 0.280 17919 14997 1 37 . 1 1 36 36 ILE C C 36 173.590 173.590 174.187 -0.597 17919 14998 1 37 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.696 -0.946 17919 14999 1 37 . 1 1 36 36 ILE CB C 36 40.580 40.580 37.999 2.581 17919 15000 1 37 . 1 1 36 36 ILE H H 36 6.150 6.150 7.720 -1.570 17919 15001 1 37 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.621 0.013 17919 15002 1 37 . 1 1 37 37 PRO C C 37 176.940 176.940 176.064 0.876 17919 15003 1 37 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.569 0.091 17919 15004 1 37 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.021 0.829 17919 15005 1 37 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.218 -0.101 17919 15006 1 37 . 1 1 38 38 PRO C C 38 178.320 178.320 178.369 -0.049 17919 15007 1 37 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.191 1.069 17919 15008 1 37 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.682 1.208 17919 15009 1 37 . 1 1 39 39 ASP N N 39 113.380 113.380 118.494 -5.114 17919 15010 1 37 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.255 0.175 17919 15011 1 37 . 1 1 39 39 ASP C C 39 177.090 177.090 178.045 -0.955 17919 15012 1 37 . 1 1 39 39 ASP CA C 39 55.640 55.640 57.916 -2.276 17919 15013 1 37 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.645 -1.105 17919 15014 1 37 . 1 1 39 39 ASP H H 39 8.550 8.550 8.523 0.027 17919 15015 1 37 . 1 1 40 40 GLN N N 40 116.780 116.780 117.935 -1.155 17919 15016 1 37 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.297 0.167 17919 15017 1 37 . 1 1 40 40 GLN C C 40 175.380 175.380 176.474 -1.094 17919 15018 1 37 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.716 -1.076 17919 15019 1 37 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.967 0.173 17919 15020 1 37 . 1 1 40 40 GLN H H 40 7.820 7.820 8.007 -0.187 17919 15021 1 37 . 1 1 41 41 GLN N N 41 117.720 117.720 119.326 -1.606 17919 15022 1 37 . 1 1 41 41 GLN HA H 41 4.244 4.244 3.962 0.282 17919 15023 1 37 . 1 1 41 41 GLN C C 41 176.300 176.300 176.010 0.290 17919 15024 1 37 . 1 1 41 41 GLN CA C 41 56.470 56.470 57.852 -1.382 17919 15025 1 37 . 1 1 41 41 GLN CB C 41 31.650 31.650 28.550 3.100 17919 15026 1 37 . 1 1 41 41 GLN H H 41 7.480 7.480 7.307 0.173 17919 15027 1 37 . 1 1 42 42 ARG N N 42 122.680 122.680 126.862 -4.182 17919 15028 1 37 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.625 -0.125 17919 15029 1 37 . 1 1 42 42 ARG C C 42 174.050 174.050 174.649 -0.599 17919 15030 1 37 . 1 1 42 42 ARG CA C 42 55.050 55.050 53.656 1.394 17919 15031 1 37 . 1 1 42 42 ARG CB C 42 31.750 31.750 30.678 1.072 17919 15032 1 37 . 1 1 42 42 ARG H H 42 8.530 8.530 8.510 0.020 17919 15033 1 37 . 1 1 43 43 LEU N N 43 124.040 124.040 125.100 -1.060 17919 15034 1 37 . 1 1 43 43 LEU C C 43 175.290 175.290 176.462 -1.172 17919 15035 1 37 . 1 1 43 43 LEU CA C 43 52.980 52.980 56.322 -3.342 17919 15036 1 37 . 1 1 43 43 LEU CB C 43 45.790 45.790 42.014 3.776 17919 15037 1 37 . 1 1 43 43 LEU H H 43 8.820 8.820 8.518 0.302 17919 15038 1 37 . 1 1 44 44 ILE N N 44 121.920 121.920 122.034 -0.114 17919 15039 1 37 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.065 -0.073 17919 15040 1 37 . 1 1 44 44 ILE C C 44 176.060 176.060 174.724 1.336 17919 15041 1 37 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.108 -1.128 17919 15042 1 37 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.362 0.058 17919 15043 1 37 . 1 1 44 44 ILE H H 44 9.030 9.030 7.749 1.281 17919 15044 1 37 . 1 1 45 45 PHE N N 45 125.390 125.390 127.259 -1.869 17919 15045 1 37 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.012 0.033 17919 15046 1 37 . 1 1 45 45 PHE C C 45 174.470 174.470 174.433 0.037 17919 15047 1 37 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.363 0.657 17919 15048 1 37 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.347 0.413 17919 15049 1 37 . 1 1 45 45 PHE H H 45 8.830 8.830 8.621 0.209 17919 15050 1 37 . 1 1 46 46 ALA N N 46 132.200 132.200 128.065 4.135 17919 15051 1 37 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.725 -0.035 17919 15052 1 37 . 1 1 46 46 ALA C C 46 177.290 177.290 177.865 -0.575 17919 15053 1 37 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.850 -0.310 17919 15054 1 37 . 1 1 46 46 ALA CB C 46 16.570 16.570 17.029 -0.459 17919 15055 1 37 . 1 1 46 46 ALA H H 46 8.810 8.810 8.834 -0.024 17919 15056 1 37 . 1 1 47 47 GLY N N 47 102.340 102.340 102.493 -0.153 17919 15057 1 37 . 1 1 47 47 GLY C C 47 173.810 173.810 174.257 -0.447 17919 15058 1 37 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.057 0.293 17919 15059 1 37 . 1 1 47 47 GLY H H 47 8.130 8.130 8.429 -0.299 17919 15060 1 37 . 1 1 48 48 LYS N N 48 121.570 121.570 120.724 0.846 17919 15061 1 37 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.640 -0.018 17919 15062 1 37 . 1 1 48 48 LYS C C 48 174.700 174.700 175.234 -0.534 17919 15063 1 37 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.095 -0.545 17919 15064 1 37 . 1 1 48 48 LYS CB C 48 34.530 34.530 35.252 -0.722 17919 15065 1 37 . 1 1 48 48 LYS H H 48 7.980 7.980 8.022 -0.042 17919 15066 1 37 . 1 1 49 49 GLN N N 49 122.410 122.410 122.130 0.280 17919 15067 1 37 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.796 -0.236 17919 15068 1 37 . 1 1 49 49 GLN C C 49 175.670 175.670 176.248 -0.578 17919 15069 1 37 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.814 -0.074 17919 15070 1 37 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.748 -0.748 17919 15071 1 37 . 1 1 49 49 GLN H H 49 8.600 8.600 8.540 0.060 17919 15072 1 37 . 1 1 50 50 LEU N N 50 125.520 125.520 124.634 0.886 17919 15073 1 37 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.112 -0.022 17919 15074 1 37 . 1 1 50 50 LEU C C 50 176.660 176.660 176.459 0.201 17919 15075 1 37 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.110 0.130 17919 15076 1 37 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.331 0.239 17919 15077 1 37 . 1 1 50 50 LEU H H 50 8.530 8.530 8.489 0.041 17919 15078 1 37 . 1 1 51 51 GLU N N 51 122.940 122.940 125.736 -2.796 17919 15079 1 37 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.294 0.194 17919 15080 1 37 . 1 1 51 51 GLU C C 51 175.870 175.870 176.951 -1.081 17919 15081 1 37 . 1 1 51 51 GLU CA C 51 55.960 55.960 56.424 -0.464 17919 15082 1 37 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.127 0.443 17919 15083 1 37 . 1 1 51 51 GLU H H 51 8.400 8.400 8.120 0.280 17919 15084 1 37 . 1 1 52 52 ASP N N 52 120.030 120.030 126.607 -6.577 17919 15085 1 37 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.510 -0.151 17919 15086 1 37 . 1 1 52 52 ASP C C 52 177.330 177.330 177.687 -0.357 17919 15087 1 37 . 1 1 52 52 ASP CA C 52 56.960 56.960 56.968 -0.008 17919 15088 1 37 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.672 0.178 17919 15089 1 37 . 1 1 52 52 ASP H H 52 8.160 8.160 8.796 -0.636 17919 15090 1 37 . 1 1 53 53 GLY N N 53 106.660 106.660 104.256 2.404 17919 15091 1 37 . 1 1 53 53 GLY C C 53 174.870 174.870 174.554 0.316 17919 15092 1 37 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.015 0.155 17919 15093 1 37 . 1 1 53 53 GLY H H 53 9.390 9.390 8.311 1.079 17919 15094 1 37 . 1 1 54 54 ARG N N 54 119.050 119.050 119.369 -0.319 17919 15095 1 37 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.492 0.203 17919 15096 1 37 . 1 1 54 54 ARG C C 54 175.350 175.350 174.978 0.372 17919 15097 1 37 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.479 -0.089 17919 15098 1 37 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.469 -0.819 17919 15099 1 37 . 1 1 54 54 ARG H H 54 7.460 7.460 7.228 0.232 17919 15100 1 37 . 1 1 55 55 THR N N 55 108.400 108.400 111.970 -3.570 17919 15101 1 37 . 1 1 55 55 THR HA H 55 5.240 5.240 4.841 0.399 17919 15102 1 37 . 1 1 55 55 THR C C 55 176.560 176.560 176.125 0.435 17919 15103 1 37 . 1 1 55 55 THR CA C 55 59.690 59.690 60.452 -0.762 17919 15104 1 37 . 1 1 55 55 THR CB C 55 72.260 72.260 70.375 1.885 17919 15105 1 37 . 1 1 55 55 THR H H 55 8.730 8.730 8.802 -0.072 17919 15106 1 37 . 1 1 56 56 LEU N N 56 117.920 117.920 122.659 -4.739 17919 15107 1 37 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.968 0.092 17919 15108 1 37 . 1 1 56 56 LEU C C 56 180.810 180.810 178.667 2.143 17919 15109 1 37 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.443 0.267 17919 15110 1 37 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.415 -1.045 17919 15111 1 37 . 1 1 56 56 LEU H H 56 8.140 8.140 8.564 -0.424 17919 15112 1 37 . 1 1 57 57 SER N N 57 113.330 113.330 113.471 -0.141 17919 15113 1 37 . 1 1 57 57 SER HA H 57 4.370 4.370 4.122 0.248 17919 15114 1 37 . 1 1 57 57 SER C C 57 178.310 178.310 176.452 1.858 17919 15115 1 37 . 1 1 57 57 SER CA C 57 61.080 61.080 61.246 -0.166 17919 15116 1 37 . 1 1 57 57 SER CB C 57 62.530 62.530 62.684 -0.154 17919 15117 1 37 . 1 1 57 57 SER H H 57 8.470 8.470 7.819 0.651 17919 15118 1 37 . 1 1 58 58 ASP N N 58 124.190 124.190 121.248 2.942 17919 15119 1 37 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.314 -0.018 17919 15120 1 37 . 1 1 58 58 ASP C C 58 177.400 177.400 176.541 0.859 17919 15121 1 37 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.352 0.828 17919 15122 1 37 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.158 -0.058 17919 15123 1 37 . 1 1 58 58 ASP H H 58 7.930 7.930 7.904 0.026 17919 15124 1 37 . 1 1 59 59 TYR N N 59 115.510 115.510 115.152 0.358 17919 15125 1 37 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.721 -0.051 17919 15126 1 37 . 1 1 59 59 TYR C C 59 174.700 174.700 175.398 -0.698 17919 15127 1 37 . 1 1 59 59 TYR CA C 59 58.250 58.250 56.758 1.492 17919 15128 1 37 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.650 1.420 17919 15129 1 37 . 1 1 59 59 TYR H H 59 7.250 7.250 7.234 0.016 17919 15130 1 37 . 1 1 60 60 ASN N N 60 115.900 115.900 117.613 -1.713 17919 15131 1 37 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.375 -0.020 17919 15132 1 37 . 1 1 60 60 ASN C C 60 174.340 174.340 174.374 -0.034 17919 15133 1 37 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.509 -0.389 17919 15134 1 37 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.740 -0.330 17919 15135 1 37 . 1 1 60 60 ASN H H 60 8.150 8.150 7.976 0.174 17919 15136 1 37 . 1 1 61 61 ILE N N 61 118.600 118.600 120.479 -1.879 17919 15137 1 37 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.639 -0.246 17919 15138 1 37 . 1 1 61 61 ILE C C 61 174.610 174.610 175.124 -0.514 17919 15139 1 37 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.271 0.149 17919 15140 1 37 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.552 -0.812 17919 15141 1 37 . 1 1 61 61 ILE H H 61 7.250 7.250 7.403 -0.153 17919 15142 1 37 . 1 1 62 62 GLN N N 62 124.740 124.740 125.018 -0.278 17919 15143 1 37 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.740 -0.234 17919 15144 1 37 . 1 1 62 62 GLN C C 62 175.970 175.970 175.648 0.322 17919 15145 1 37 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.296 0.364 17919 15146 1 37 . 1 1 62 62 GLN CB C 62 31.650 31.650 32.806 -1.156 17919 15147 1 37 . 1 1 62 62 GLN H H 62 7.610 7.610 7.935 -0.325 17919 15148 1 37 . 1 1 63 63 LYS N N 63 120.300 120.300 122.743 -2.443 17919 15149 1 37 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.816 0.185 17919 15150 1 37 . 1 1 63 63 LYS C C 63 175.810 175.810 176.775 -0.965 17919 15151 1 37 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.287 -0.497 17919 15152 1 37 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.991 0.659 17919 15153 1 37 . 1 1 63 63 LYS H H 63 8.490 8.490 8.781 -0.291 17919 15154 1 37 . 1 1 64 64 GLU N N 64 113.950 113.950 120.122 -6.172 17919 15155 1 37 . 1 1 64 64 GLU HA H 64 3.465 3.465 4.120 -0.655 17919 15156 1 37 . 1 1 64 64 GLU C C 64 175.250 175.250 175.300 -0.050 17919 15157 1 37 . 1 1 64 64 GLU CA C 64 57.890 57.890 58.144 -0.254 17919 15158 1 37 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.412 -2.512 17919 15159 1 37 . 1 1 64 64 GLU H H 64 9.280 9.280 8.736 0.544 17919 15160 1 37 . 1 1 65 65 SER N N 65 114.730 114.730 113.679 1.051 17919 15161 1 37 . 1 1 65 65 SER HA H 65 4.640 4.640 4.832 -0.192 17919 15162 1 37 . 1 1 65 65 SER C C 65 172.160 172.160 174.092 -1.932 17919 15163 1 37 . 1 1 65 65 SER CA C 65 60.890 60.890 58.337 2.553 17919 15164 1 37 . 1 1 65 65 SER CB C 65 64.910 64.910 65.790 -0.880 17919 15165 1 37 . 1 1 65 65 SER H H 65 7.670 7.670 7.794 -0.124 17919 15166 1 37 . 1 1 66 66 THR N N 66 117.110 117.110 119.445 -2.335 17919 15167 1 37 . 1 1 66 66 THR HA H 66 5.270 5.270 5.160 0.110 17919 15168 1 37 . 1 1 66 66 THR C C 66 173.950 173.950 174.470 -0.520 17919 15169 1 37 . 1 1 66 66 THR CA C 66 62.340 62.340 62.310 0.030 17919 15170 1 37 . 1 1 66 66 THR CB C 66 70.080 70.080 69.880 0.200 17919 15171 1 37 . 1 1 66 66 THR H H 66 8.730 8.730 8.528 0.202 17919 15172 1 37 . 1 1 67 67 LEU N N 67 127.110 127.110 129.016 -1.906 17919 15173 1 37 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.743 0.317 17919 15174 1 37 . 1 1 67 67 LEU C C 67 175.770 175.770 175.477 0.293 17919 15175 1 37 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.172 -0.272 17919 15176 1 37 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.044 0.216 17919 15177 1 37 . 1 1 67 67 LEU H H 67 9.410 9.410 9.299 0.111 17919 15178 1 37 . 1 1 68 68 HIS N N 68 118.380 118.380 122.666 -4.286 17919 15179 1 37 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.549 -0.309 17919 15180 1 37 . 1 1 68 68 HIS C C 68 173.150 173.150 174.212 -1.062 17919 15181 1 37 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.595 0.405 17919 15182 1 37 . 1 1 68 68 HIS CB C 68 30.530 30.530 33.113 -2.583 17919 15183 1 37 . 1 1 68 68 HIS H H 68 9.230 9.230 9.071 0.159 17919 15184 1 37 . 1 1 69 69 LEU N N 69 124.460 124.460 121.002 3.458 17919 15185 1 37 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.587 0.603 17919 15186 1 37 . 1 1 69 69 LEU C C 69 175.270 175.270 173.927 1.343 17919 15187 1 37 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.818 -0.928 17919 15188 1 37 . 1 1 69 69 LEU CB C 69 44.380 44.380 45.344 -0.964 17919 15189 1 37 . 1 1 69 69 LEU H H 69 8.340 8.340 6.484 1.856 17919 15190 1 37 . 1 1 70 70 VAL N N 70 126.940 126.940 125.159 1.781 17919 15191 1 37 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.482 -0.132 17919 15192 1 37 . 1 1 70 70 VAL C C 70 174.000 174.000 174.707 -0.707 17919 15193 1 37 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.439 0.361 17919 15194 1 37 . 1 1 70 70 VAL CB C 70 34.910 34.910 34.112 0.798 17919 15195 1 37 . 1 1 70 70 VAL H H 70 9.200 9.200 8.287 0.913 17919 15196 1 37 . 1 1 71 71 LEU N N 71 123.130 123.130 123.485 -0.355 17919 15197 1 37 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.906 0.154 17919 15198 1 37 . 1 1 71 71 LEU C C 71 177.830 177.830 177.458 0.372 17919 15199 1 37 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.942 -0.002 17919 15200 1 37 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.149 -0.299 17919 15201 1 37 . 1 1 71 71 LEU H H 71 8.120 8.120 8.405 -0.285 17919 15202 1 37 . 1 1 72 72 ARG N N 72 123.490 123.490 123.284 0.206 17919 15203 1 37 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.235 0.066 17919 15204 1 37 . 1 1 72 72 ARG C C 72 175.350 175.350 175.073 0.277 17919 15205 1 37 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.280 -0.670 17919 15206 1 37 . 1 1 72 72 ARG CB C 72 31.350 31.350 31.096 0.254 17919 15207 1 37 . 1 1 72 72 ARG H H 72 8.580 8.580 8.302 0.278 17919 15208 1 38 . 1 1 2 2 GLN N N 2 123.220 123.220 123.489 -0.269 17919 15209 1 38 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.052 0.197 17919 15210 1 38 . 1 1 2 2 GLN C C 2 175.920 175.920 175.163 0.757 17919 15211 1 38 . 1 1 2 2 GLN CA C 2 55.080 55.080 55.297 -0.217 17919 15212 1 38 . 1 1 2 2 GLN CB C 2 30.760 30.760 29.456 1.304 17919 15213 1 38 . 1 1 2 2 GLN H H 2 8.900 8.900 8.483 0.417 17919 15214 1 38 . 1 1 3 3 ILE N N 3 115.340 115.340 119.386 -4.046 17919 15215 1 38 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.588 -0.375 17919 15216 1 38 . 1 1 3 3 ILE C C 3 172.450 172.450 173.493 -1.043 17919 15217 1 38 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.503 0.067 17919 15218 1 38 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.698 0.512 17919 15219 1 38 . 1 1 3 3 ILE H H 3 8.320 8.320 7.534 0.786 17919 15220 1 38 . 1 1 4 4 PHE N N 4 118.110 118.110 118.812 -0.702 17919 15221 1 38 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.148 0.482 17919 15222 1 38 . 1 1 4 4 PHE C C 4 175.320 175.320 175.104 0.216 17919 15223 1 38 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.844 -0.635 17919 15224 1 38 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.466 -0.986 17919 15225 1 38 . 1 1 4 4 PHE H H 4 8.610 8.610 8.261 0.349 17919 15226 1 38 . 1 1 5 5 VAL N N 5 121.000 121.000 121.554 -0.554 17919 15227 1 38 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.614 0.111 17919 15228 1 38 . 1 1 5 5 VAL C C 5 174.870 174.870 174.911 -0.041 17919 15229 1 38 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.744 -1.124 17919 15230 1 38 . 1 1 5 5 VAL CB C 5 34.230 34.230 32.632 1.598 17919 15231 1 38 . 1 1 5 5 VAL H H 5 9.300 9.300 8.629 0.671 17919 15232 1 38 . 1 1 6 6 LYS N N 6 127.520 127.520 129.563 -2.043 17919 15233 1 38 . 1 1 6 6 LYS HA H 6 5.367 5.367 4.900 0.467 17919 15234 1 38 . 1 1 6 6 LYS C C 6 177.140 177.140 176.152 0.988 17919 15235 1 38 . 1 1 6 6 LYS CA C 6 54.520 54.520 55.142 -0.622 17919 15236 1 38 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.668 0.382 17919 15237 1 38 . 1 1 6 6 LYS H H 6 8.820 8.820 8.878 -0.058 17919 15238 1 38 . 1 1 7 7 THR N N 7 115.400 115.400 117.795 -2.395 17919 15239 1 38 . 1 1 7 7 THR HA H 7 4.970 4.970 4.702 0.268 17919 15240 1 38 . 1 1 7 7 THR C C 7 176.910 176.910 175.678 1.232 17919 15241 1 38 . 1 1 7 7 THR CA C 7 60.470 60.470 60.261 0.209 17919 15242 1 38 . 1 1 7 7 THR CB C 7 70.630 70.630 70.665 -0.035 17919 15243 1 38 . 1 1 7 7 THR H H 7 8.730 8.730 8.320 0.410 17919 15244 1 38 . 1 1 8 8 LEU N N 8 121.330 121.330 120.804 0.526 17919 15245 1 38 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.275 0.035 17919 15246 1 38 . 1 1 8 8 LEU C C 8 178.800 178.800 177.531 1.269 17919 15247 1 38 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.384 0.196 17919 15248 1 38 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.944 0.026 17919 15249 1 38 . 1 1 8 8 LEU H H 8 9.100 9.100 8.672 0.428 17919 15250 1 38 . 1 1 9 9 THR N N 9 105.590 105.590 107.821 -2.231 17919 15251 1 38 . 1 1 9 9 THR HA H 9 4.428 4.428 4.307 0.121 17919 15252 1 38 . 1 1 9 9 THR C C 9 175.520 175.520 175.457 0.063 17919 15253 1 38 . 1 1 9 9 THR CA C 9 61.400 61.400 61.713 -0.313 17919 15254 1 38 . 1 1 9 9 THR CB C 9 69.140 69.140 68.862 0.278 17919 15255 1 38 . 1 1 9 9 THR H H 9 7.630 7.630 7.665 -0.035 17919 15256 1 38 . 1 1 10 10 GLY N N 10 108.890 108.890 111.078 -2.188 17919 15257 1 38 . 1 1 10 10 GLY C C 10 174.070 174.070 174.138 -0.068 17919 15258 1 38 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.034 0.426 17919 15259 1 38 . 1 1 10 10 GLY H H 10 7.810 7.810 8.098 -0.288 17919 15260 1 38 . 1 1 11 11 LYS N N 11 121.600 121.600 122.096 -0.496 17919 15261 1 38 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.256 0.105 17919 15262 1 38 . 1 1 11 11 LYS C C 11 175.940 175.940 176.291 -0.351 17919 15263 1 38 . 1 1 11 11 LYS CA C 11 56.280 56.280 55.968 0.312 17919 15264 1 38 . 1 1 11 11 LYS CB C 11 33.200 33.200 32.656 0.544 17919 15265 1 38 . 1 1 11 11 LYS H H 11 7.280 7.280 7.648 -0.368 17919 15266 1 38 . 1 1 12 12 THR N N 12 120.440 120.440 121.134 -0.694 17919 15267 1 38 . 1 1 12 12 THR HA H 12 5.046 5.046 4.444 0.602 17919 15268 1 38 . 1 1 12 12 THR C C 12 174.320 174.320 174.706 -0.386 17919 15269 1 38 . 1 1 12 12 THR CA C 12 62.390 62.390 63.512 -1.122 17919 15270 1 38 . 1 1 12 12 THR CB C 12 69.910 69.910 69.038 0.872 17919 15271 1 38 . 1 1 12 12 THR H H 12 8.650 8.650 8.569 0.081 17919 15272 1 38 . 1 1 13 13 ILE N N 13 127.110 127.110 130.493 -3.383 17919 15273 1 38 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.235 0.309 17919 15274 1 38 . 1 1 13 13 ILE C C 13 175.220 175.220 175.102 0.118 17919 15275 1 38 . 1 1 13 13 ILE CA C 13 59.980 59.980 61.214 -1.234 17919 15276 1 38 . 1 1 13 13 ILE CB C 13 40.950 40.950 38.880 2.070 17919 15277 1 38 . 1 1 13 13 ILE H H 13 9.450 9.450 9.200 0.250 17919 15278 1 38 . 1 1 14 14 THR N N 14 121.520 121.520 124.596 -3.076 17919 15279 1 38 . 1 1 14 14 THR HA H 14 4.964 4.964 4.524 0.440 17919 15280 1 38 . 1 1 14 14 THR C C 14 173.790 173.790 173.775 0.015 17919 15281 1 38 . 1 1 14 14 THR CA C 14 61.940 61.940 62.826 -0.886 17919 15282 1 38 . 1 1 14 14 THR CB C 14 69.650 69.650 69.461 0.189 17919 15283 1 38 . 1 1 14 14 THR H H 14 8.710 8.710 8.605 0.105 17919 15284 1 38 . 1 1 15 15 LEU N N 15 124.800 124.800 127.820 -3.020 17919 15285 1 38 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.579 0.201 17919 15286 1 38 . 1 1 15 15 LEU C C 15 174.670 174.670 175.474 -0.804 17919 15287 1 38 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.539 -0.709 17919 15288 1 38 . 1 1 15 15 LEU CB C 15 47.070 47.070 44.785 2.285 17919 15289 1 38 . 1 1 15 15 LEU H H 15 8.710 8.710 7.966 0.744 17919 15290 1 38 . 1 1 16 16 GLU N N 16 122.160 122.160 121.809 0.351 17919 15291 1 38 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.902 0.015 17919 15292 1 38 . 1 1 16 16 GLU C C 16 175.860 175.860 176.101 -0.241 17919 15293 1 38 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.654 -0.834 17919 15294 1 38 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.407 -0.957 17919 15295 1 38 . 1 1 16 16 GLU H H 16 8.140 8.140 8.496 -0.356 17919 15296 1 38 . 1 1 17 17 VAL N N 17 117.210 117.210 118.595 -1.385 17919 15297 1 38 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.545 0.169 17919 15298 1 38 . 1 1 17 17 VAL C C 17 174.160 174.160 174.399 -0.239 17919 15299 1 38 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.954 -0.524 17919 15300 1 38 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.268 1.132 17919 15301 1 38 . 1 1 17 17 VAL H H 17 8.900 8.900 8.926 -0.026 17919 15302 1 38 . 1 1 18 18 GLU N N 18 118.990 118.990 118.657 0.333 17919 15303 1 38 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.843 0.236 17919 15304 1 38 . 1 1 18 18 GLU C C 18 176.160 176.160 174.687 1.473 17919 15305 1 38 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.702 0.019 17919 15306 1 38 . 1 1 18 18 GLU CB C 18 30.310 30.310 32.233 -1.923 17919 15307 1 38 . 1 1 18 18 GLU H H 18 8.640 8.640 8.353 0.287 17919 15308 1 38 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.437 -0.296 17919 15309 1 38 . 1 1 19 19 PRO C C 19 175.310 175.310 177.129 -1.819 17919 15310 1 38 . 1 1 19 19 PRO CA C 19 65.470 65.470 64.765 0.705 17919 15311 1 38 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.094 -0.144 17919 15312 1 38 . 1 1 20 20 SER N N 20 103.400 103.400 111.984 -8.584 17919 15313 1 38 . 1 1 20 20 SER HA H 20 4.370 4.370 4.328 0.042 17919 15314 1 38 . 1 1 20 20 SER C C 20 174.660 174.660 174.755 -0.095 17919 15315 1 38 . 1 1 20 20 SER CA C 20 57.400 57.400 58.417 -1.017 17919 15316 1 38 . 1 1 20 20 SER CB C 20 63.370 63.370 62.583 0.787 17919 15317 1 38 . 1 1 20 20 SER H H 20 7.040 7.040 7.881 -0.841 17919 15318 1 38 . 1 1 21 21 ASP N N 21 123.480 123.480 125.312 -1.832 17919 15319 1 38 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.395 0.300 17919 15320 1 38 . 1 1 21 21 ASP C C 21 176.360 176.360 175.758 0.602 17919 15321 1 38 . 1 1 21 21 ASP CA C 21 55.700 55.700 56.229 -0.529 17919 15322 1 38 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.465 -0.665 17919 15323 1 38 . 1 1 21 21 ASP H H 21 8.030 8.030 7.835 0.196 17919 15324 1 38 . 1 1 22 22 THR N N 22 108.800 108.800 115.385 -6.585 17919 15325 1 38 . 1 1 22 22 THR HA H 22 4.920 4.920 4.529 0.391 17919 15326 1 38 . 1 1 22 22 THR C C 22 176.750 176.750 175.623 1.127 17919 15327 1 38 . 1 1 22 22 THR CA C 22 59.690 59.690 61.983 -2.292 17919 15328 1 38 . 1 1 22 22 THR CB C 22 71.200 71.200 69.982 1.218 17919 15329 1 38 . 1 1 22 22 THR H H 22 7.900 7.900 8.361 -0.461 17919 15330 1 38 . 1 1 23 23 ILE N N 23 121.190 121.190 124.578 -3.388 17919 15331 1 38 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.705 -0.048 17919 15332 1 38 . 1 1 23 23 ILE C C 23 179.040 179.040 177.702 1.338 17919 15333 1 38 . 1 1 23 23 ILE CA C 23 62.260 62.260 61.886 0.374 17919 15334 1 38 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.615 -2.265 17919 15335 1 38 . 1 1 23 23 ILE H H 23 8.560 8.560 8.758 -0.198 17919 15336 1 38 . 1 1 24 24 GLU N N 24 120.830 120.830 120.912 -0.082 17919 15337 1 38 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.795 0.122 17919 15338 1 38 . 1 1 24 24 GLU C C 24 178.640 178.640 178.722 -0.082 17919 15339 1 38 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.437 -0.217 17919 15340 1 38 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.152 -0.872 17919 15341 1 38 . 1 1 24 24 GLU H H 24 9.760 9.760 8.693 1.067 17919 15342 1 38 . 1 1 25 25 ASN N N 25 120.570 120.570 116.056 4.514 17919 15343 1 38 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.554 -0.029 17919 15344 1 38 . 1 1 25 25 ASN C C 25 178.380 178.380 177.861 0.519 17919 15345 1 38 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.696 0.364 17919 15346 1 38 . 1 1 25 25 ASN CB C 25 38.450 38.450 37.893 0.557 17919 15347 1 38 . 1 1 25 25 ASN H H 25 7.920 7.920 8.542 -0.622 17919 15348 1 38 . 1 1 26 26 VAL N N 26 121.710 121.710 120.592 1.118 17919 15349 1 38 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.518 -0.121 17919 15350 1 38 . 1 1 26 26 VAL C C 26 177.950 177.950 177.773 0.177 17919 15351 1 38 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.330 1.330 17919 15352 1 38 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.460 -0.620 17919 15353 1 38 . 1 1 26 26 VAL H H 26 8.070 8.070 7.744 0.326 17919 15354 1 38 . 1 1 27 27 LYS N N 27 118.860 118.860 119.706 -0.846 17919 15355 1 38 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.129 0.451 17919 15356 1 38 . 1 1 27 27 LYS C C 27 180.550 180.550 179.087 1.463 17919 15357 1 38 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.458 -0.208 17919 15358 1 38 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.234 1.496 17919 15359 1 38 . 1 1 27 27 LYS H H 27 8.560 8.560 8.012 0.548 17919 15360 1 38 . 1 1 28 28 ALA N N 28 123.440 123.440 121.760 1.680 17919 15361 1 38 . 1 1 28 28 ALA HA H 28 4.160 4.160 3.914 0.246 17919 15362 1 38 . 1 1 28 28 ALA C C 28 180.300 180.300 179.256 1.044 17919 15363 1 38 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.617 -0.247 17919 15364 1 38 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.178 -0.468 17919 15365 1 38 . 1 1 28 28 ALA H H 28 8.060 8.060 8.466 -0.406 17919 15366 1 38 . 1 1 29 29 LYS N N 29 119.940 119.940 119.435 0.505 17919 15367 1 38 . 1 1 29 29 LYS HA H 29 4.207 4.207 3.928 0.279 17919 15368 1 38 . 1 1 29 29 LYS C C 29 180.320 180.320 179.272 1.048 17919 15369 1 38 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.331 0.319 17919 15370 1 38 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.212 1.078 17919 15371 1 38 . 1 1 29 29 LYS H H 29 7.850 7.850 7.525 0.325 17919 15372 1 38 . 1 1 30 30 ILE N N 30 121.080 121.080 119.367 1.713 17919 15373 1 38 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.603 -0.096 17919 15374 1 38 . 1 1 30 30 ILE C C 30 178.310 178.310 177.580 0.730 17919 15375 1 38 . 1 1 30 30 ILE CA C 30 66.150 66.150 64.979 1.171 17919 15376 1 38 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.568 -0.768 17919 15377 1 38 . 1 1 30 30 ILE H H 30 8.280 8.280 7.544 0.736 17919 15378 1 38 . 1 1 31 31 GLN N N 31 123.490 123.490 120.948 2.542 17919 15379 1 38 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.009 -0.180 17919 15380 1 38 . 1 1 31 31 GLN C C 31 178.890 178.890 178.354 0.536 17919 15381 1 38 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.135 0.866 17919 15382 1 38 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.494 -0.773 17919 15383 1 38 . 1 1 31 31 GLN H H 31 8.580 8.580 8.488 0.092 17919 15384 1 38 . 1 1 32 32 ASP N N 32 119.360 119.360 118.777 0.583 17919 15385 1 38 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.387 -0.033 17919 15386 1 38 . 1 1 32 32 ASP C C 32 177.250 177.250 177.689 -0.439 17919 15387 1 38 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.919 0.272 17919 15388 1 38 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.868 -0.288 17919 15389 1 38 . 1 1 32 32 ASP H H 32 8.010 8.010 8.435 -0.425 17919 15390 1 38 . 1 1 33 33 LYS N N 33 115.130 115.130 117.320 -2.190 17919 15391 1 38 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.384 -0.047 17919 15392 1 38 . 1 1 33 33 LYS C C 33 177.870 177.870 178.056 -0.186 17919 15393 1 38 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.230 0.820 17919 15394 1 38 . 1 1 33 33 LYS CB C 33 34.170 34.170 34.678 -0.508 17919 15395 1 38 . 1 1 33 33 LYS H H 33 7.430 7.430 7.497 -0.067 17919 15396 1 38 . 1 1 34 34 GLU N N 34 113.870 113.870 117.139 -3.269 17919 15397 1 38 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.437 0.188 17919 15398 1 38 . 1 1 34 34 GLU C C 34 177.840 177.840 177.495 0.345 17919 15399 1 38 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.346 -1.176 17919 15400 1 38 . 1 1 34 34 GLU CB C 34 32.660 32.660 30.404 2.256 17919 15401 1 38 . 1 1 34 34 GLU H H 34 8.740 8.740 8.164 0.576 17919 15402 1 38 . 1 1 35 35 GLY N N 35 108.650 108.650 108.709 -0.059 17919 15403 1 38 . 1 1 35 35 GLY C C 35 173.960 173.960 174.342 -0.382 17919 15404 1 38 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.506 0.574 17919 15405 1 38 . 1 1 35 35 GLY H H 35 8.530 8.530 8.074 0.456 17919 15406 1 38 . 1 1 36 36 ILE N N 36 119.880 119.880 122.906 -3.026 17919 15407 1 38 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.341 0.104 17919 15408 1 38 . 1 1 36 36 ILE C C 36 173.590 173.590 174.596 -1.006 17919 15409 1 38 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.752 -0.002 17919 15410 1 38 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.420 2.160 17919 15411 1 38 . 1 1 36 36 ILE H H 36 6.150 6.150 7.589 -1.439 17919 15412 1 38 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.638 -0.004 17919 15413 1 38 . 1 1 37 37 PRO C C 37 176.940 176.940 176.758 0.182 17919 15414 1 38 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.760 -0.100 17919 15415 1 38 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.198 0.652 17919 15416 1 38 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.254 -0.137 17919 15417 1 38 . 1 1 38 38 PRO C C 38 178.320 178.320 178.543 -0.223 17919 15418 1 38 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.581 0.679 17919 15419 1 38 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.851 1.039 17919 15420 1 38 . 1 1 39 39 ASP N N 39 113.380 113.380 118.950 -5.570 17919 15421 1 38 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.244 0.186 17919 15422 1 38 . 1 1 39 39 ASP C C 39 177.090 177.090 178.175 -1.085 17919 15423 1 38 . 1 1 39 39 ASP CA C 39 55.640 55.640 57.738 -2.098 17919 15424 1 38 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.177 -0.637 17919 15425 1 38 . 1 1 39 39 ASP H H 39 8.550 8.550 8.634 -0.084 17919 15426 1 38 . 1 1 40 40 GLN N N 40 116.780 116.780 117.709 -0.929 17919 15427 1 38 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.160 0.304 17919 15428 1 38 . 1 1 40 40 GLN C C 40 175.380 175.380 175.895 -0.515 17919 15429 1 38 . 1 1 40 40 GLN CA C 40 55.640 55.640 57.095 -1.455 17919 15430 1 38 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.124 1.016 17919 15431 1 38 . 1 1 40 40 GLN H H 40 7.820 7.820 7.714 0.106 17919 15432 1 38 . 1 1 41 41 GLN N N 41 117.720 117.720 119.417 -1.697 17919 15433 1 38 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.378 -0.134 17919 15434 1 38 . 1 1 41 41 GLN C C 41 176.300 176.300 174.733 1.567 17919 15435 1 38 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.255 1.215 17919 15436 1 38 . 1 1 41 41 GLN CB C 41 31.650 31.650 28.594 3.056 17919 15437 1 38 . 1 1 41 41 GLN H H 41 7.480 7.480 7.403 0.077 17919 15438 1 38 . 1 1 42 42 ARG N N 42 122.680 122.680 126.506 -3.826 17919 15439 1 38 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.478 0.022 17919 15440 1 38 . 1 1 42 42 ARG C C 42 174.050 174.050 174.328 -0.278 17919 15441 1 38 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.808 -0.758 17919 15442 1 38 . 1 1 42 42 ARG CB C 42 31.750 31.750 31.411 0.339 17919 15443 1 38 . 1 1 42 42 ARG H H 42 8.530 8.530 7.882 0.648 17919 15444 1 38 . 1 1 43 43 LEU N N 43 124.040 124.040 127.060 -3.020 17919 15445 1 38 . 1 1 43 43 LEU C C 43 175.290 175.290 176.382 -1.092 17919 15446 1 38 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.432 -0.452 17919 15447 1 38 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.610 1.180 17919 15448 1 38 . 1 1 43 43 LEU H H 43 8.820 8.820 8.666 0.154 17919 15449 1 38 . 1 1 44 44 ILE N N 44 121.920 121.920 117.922 3.998 17919 15450 1 38 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.189 -0.197 17919 15451 1 38 . 1 1 44 44 ILE C C 44 176.060 176.060 174.281 1.779 17919 15452 1 38 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.614 -0.634 17919 15453 1 38 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.658 -0.238 17919 15454 1 38 . 1 1 44 44 ILE H H 44 9.030 9.030 8.456 0.574 17919 15455 1 38 . 1 1 45 45 PHE N N 45 125.390 125.390 125.326 0.064 17919 15456 1 38 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.057 -0.012 17919 15457 1 38 . 1 1 45 45 PHE C C 45 174.470 174.470 174.481 -0.011 17919 15458 1 38 . 1 1 45 45 PHE CA C 45 57.020 57.020 57.241 -0.221 17919 15459 1 38 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.054 0.706 17919 15460 1 38 . 1 1 45 45 PHE H H 45 8.830 8.830 8.778 0.052 17919 15461 1 38 . 1 1 46 46 ALA N N 46 132.200 132.200 130.678 1.522 17919 15462 1 38 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.740 -0.050 17919 15463 1 38 . 1 1 46 46 ALA C C 46 177.290 177.290 177.593 -0.303 17919 15464 1 38 . 1 1 46 46 ALA CA C 46 52.540 52.540 53.152 -0.612 17919 15465 1 38 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.575 -0.005 17919 15466 1 38 . 1 1 46 46 ALA H H 46 8.810 8.810 9.067 -0.257 17919 15467 1 38 . 1 1 47 47 GLY N N 47 102.340 102.340 103.368 -1.028 17919 15468 1 38 . 1 1 47 47 GLY C C 47 173.810 173.810 174.780 -0.970 17919 15469 1 38 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.423 -0.074 17919 15470 1 38 . 1 1 47 47 GLY H H 47 8.130 8.130 8.551 -0.421 17919 15471 1 38 . 1 1 48 48 LYS N N 48 121.570 121.570 122.735 -1.165 17919 15472 1 38 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.468 0.154 17919 15473 1 38 . 1 1 48 48 LYS C C 48 174.700 174.700 175.641 -0.941 17919 15474 1 38 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.180 -0.630 17919 15475 1 38 . 1 1 48 48 LYS CB C 48 34.530 34.530 33.266 1.264 17919 15476 1 38 . 1 1 48 48 LYS H H 48 7.980 7.980 8.072 -0.092 17919 15477 1 38 . 1 1 49 49 GLN N N 49 122.410 122.410 126.105 -3.695 17919 15478 1 38 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.440 0.120 17919 15479 1 38 . 1 1 49 49 GLN C C 49 175.670 175.670 175.514 0.156 17919 15480 1 38 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.054 -0.314 17919 15481 1 38 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.303 -0.303 17919 15482 1 38 . 1 1 49 49 GLN H H 49 8.600 8.600 8.751 -0.151 17919 15483 1 38 . 1 1 50 50 LEU N N 50 125.520 125.520 128.810 -3.290 17919 15484 1 38 . 1 1 50 50 LEU HA H 50 4.090 4.090 3.934 0.156 17919 15485 1 38 . 1 1 50 50 LEU C C 50 176.660 176.660 176.034 0.626 17919 15486 1 38 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.510 0.730 17919 15487 1 38 . 1 1 50 50 LEU CB C 50 41.570 41.570 40.532 1.038 17919 15488 1 38 . 1 1 50 50 LEU H H 50 8.530 8.530 8.245 0.285 17919 15489 1 38 . 1 1 51 51 GLU N N 51 122.940 122.940 123.860 -0.920 17919 15490 1 38 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.537 -0.049 17919 15491 1 38 . 1 1 51 51 GLU C C 51 175.870 175.870 176.365 -0.495 17919 15492 1 38 . 1 1 51 51 GLU CA C 51 55.960 55.960 54.808 1.152 17919 15493 1 38 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.896 -0.326 17919 15494 1 38 . 1 1 51 51 GLU H H 51 8.400 8.400 8.711 -0.311 17919 15495 1 38 . 1 1 52 52 ASP N N 52 120.030 120.030 123.475 -3.445 17919 15496 1 38 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.502 -0.143 17919 15497 1 38 . 1 1 52 52 ASP C C 52 177.330 177.330 178.336 -1.006 17919 15498 1 38 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.195 -0.235 17919 15499 1 38 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.458 0.392 17919 15500 1 38 . 1 1 52 52 ASP H H 52 8.160 8.160 8.776 -0.616 17919 15501 1 38 . 1 1 53 53 GLY N N 53 106.660 106.660 106.268 0.392 17919 15502 1 38 . 1 1 53 53 GLY C C 53 174.870 174.870 174.488 0.382 17919 15503 1 38 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.479 -0.309 17919 15504 1 38 . 1 1 53 53 GLY H H 53 9.390 9.390 8.404 0.986 17919 15505 1 38 . 1 1 54 54 ARG N N 54 119.050 119.050 119.593 -0.543 17919 15506 1 38 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.681 0.014 17919 15507 1 38 . 1 1 54 54 ARG C C 54 175.350 175.350 175.414 -0.064 17919 15508 1 38 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.619 -0.229 17919 15509 1 38 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.059 -0.409 17919 15510 1 38 . 1 1 54 54 ARG H H 54 7.460 7.460 7.800 -0.340 17919 15511 1 38 . 1 1 55 55 THR N N 55 108.400 108.400 114.697 -6.297 17919 15512 1 38 . 1 1 55 55 THR HA H 55 5.240 5.240 4.964 0.276 17919 15513 1 38 . 1 1 55 55 THR C C 55 176.560 176.560 175.952 0.608 17919 15514 1 38 . 1 1 55 55 THR CA C 55 59.690 59.690 61.495 -1.805 17919 15515 1 38 . 1 1 55 55 THR CB C 55 72.260 72.260 70.820 1.440 17919 15516 1 38 . 1 1 55 55 THR H H 55 8.730 8.730 8.341 0.389 17919 15517 1 38 . 1 1 56 56 LEU N N 56 117.920 117.920 122.118 -4.198 17919 15518 1 38 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.142 -0.082 17919 15519 1 38 . 1 1 56 56 LEU C C 56 180.810 180.810 178.875 1.935 17919 15520 1 38 . 1 1 56 56 LEU CA C 56 58.710 58.710 57.934 0.776 17919 15521 1 38 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.219 -0.849 17919 15522 1 38 . 1 1 56 56 LEU H H 56 8.140 8.140 8.581 -0.441 17919 15523 1 38 . 1 1 57 57 SER N N 57 113.330 113.330 114.928 -1.598 17919 15524 1 38 . 1 1 57 57 SER HA H 57 4.370 4.370 4.237 0.133 17919 15525 1 38 . 1 1 57 57 SER C C 57 178.310 178.310 176.870 1.440 17919 15526 1 38 . 1 1 57 57 SER CA C 57 61.080 61.080 61.537 -0.457 17919 15527 1 38 . 1 1 57 57 SER CB C 57 62.530 62.530 62.617 -0.087 17919 15528 1 38 . 1 1 57 57 SER H H 57 8.470 8.470 7.897 0.573 17919 15529 1 38 . 1 1 58 58 ASP N N 58 124.190 124.190 124.142 0.048 17919 15530 1 38 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.340 -0.044 17919 15531 1 38 . 1 1 58 58 ASP C C 58 177.400 177.400 177.728 -0.328 17919 15532 1 38 . 1 1 58 58 ASP CA C 58 57.180 57.180 57.457 -0.277 17919 15533 1 38 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.304 -0.204 17919 15534 1 38 . 1 1 58 58 ASP H H 58 7.930 7.930 7.672 0.258 17919 15535 1 38 . 1 1 59 59 TYR N N 59 115.510 115.510 116.240 -0.730 17919 15536 1 38 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.510 0.160 17919 15537 1 38 . 1 1 59 59 TYR C C 59 174.700 174.700 175.507 -0.807 17919 15538 1 38 . 1 1 59 59 TYR CA C 59 58.250 58.250 58.598 -0.348 17919 15539 1 38 . 1 1 59 59 TYR CB C 59 40.070 40.070 37.843 2.227 17919 15540 1 38 . 1 1 59 59 TYR H H 59 7.250 7.250 7.422 -0.172 17919 15541 1 38 . 1 1 60 60 ASN N N 60 115.900 115.900 113.806 2.094 17919 15542 1 38 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.360 -0.005 17919 15543 1 38 . 1 1 60 60 ASN C C 60 174.340 174.340 174.666 -0.326 17919 15544 1 38 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.243 -0.123 17919 15545 1 38 . 1 1 60 60 ASN CB C 60 37.410 37.410 36.320 1.090 17919 15546 1 38 . 1 1 60 60 ASN H H 60 8.150 8.150 7.877 0.273 17919 15547 1 38 . 1 1 61 61 ILE N N 61 118.600 118.600 120.813 -2.213 17919 15548 1 38 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.930 -0.537 17919 15549 1 38 . 1 1 61 61 ILE C C 61 174.610 174.610 175.279 -0.669 17919 15550 1 38 . 1 1 61 61 ILE CA C 61 62.420 62.420 63.098 -0.678 17919 15551 1 38 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.598 -0.858 17919 15552 1 38 . 1 1 61 61 ILE H H 61 7.250 7.250 7.748 -0.498 17919 15553 1 38 . 1 1 62 62 GLN N N 62 124.740 124.740 125.276 -0.536 17919 15554 1 38 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.752 -0.246 17919 15555 1 38 . 1 1 62 62 GLN C C 62 175.970 175.970 174.984 0.986 17919 15556 1 38 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.912 -0.252 17919 15557 1 38 . 1 1 62 62 GLN CB C 62 31.650 31.650 33.090 -1.440 17919 15558 1 38 . 1 1 62 62 GLN H H 62 7.610 7.610 8.060 -0.450 17919 15559 1 38 . 1 1 63 63 LYS N N 63 120.300 120.300 120.093 0.207 17919 15560 1 38 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.928 0.073 17919 15561 1 38 . 1 1 63 63 LYS C C 63 175.810 175.810 176.437 -0.627 17919 15562 1 38 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.332 -0.542 17919 15563 1 38 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.867 0.783 17919 15564 1 38 . 1 1 63 63 LYS H H 63 8.490 8.490 8.604 -0.114 17919 15565 1 38 . 1 1 64 64 GLU N N 64 113.950 113.950 116.863 -2.913 17919 15566 1 38 . 1 1 64 64 GLU HA H 64 3.465 3.465 4.043 -0.578 17919 15567 1 38 . 1 1 64 64 GLU C C 64 175.250 175.250 175.536 -0.286 17919 15568 1 38 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.506 0.384 17919 15569 1 38 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.231 -2.331 17919 15570 1 38 . 1 1 64 64 GLU H H 64 9.280 9.280 8.711 0.569 17919 15571 1 38 . 1 1 65 65 SER N N 65 114.730 114.730 115.723 -0.993 17919 15572 1 38 . 1 1 65 65 SER HA H 65 4.640 4.640 4.570 0.070 17919 15573 1 38 . 1 1 65 65 SER C C 65 172.160 172.160 173.934 -1.774 17919 15574 1 38 . 1 1 65 65 SER CA C 65 60.890 60.890 59.665 1.225 17919 15575 1 38 . 1 1 65 65 SER CB C 65 64.910 64.910 64.328 0.582 17919 15576 1 38 . 1 1 65 65 SER H H 65 7.670 7.670 7.650 0.020 17919 15577 1 38 . 1 1 66 66 THR N N 66 117.110 117.110 118.017 -0.907 17919 15578 1 38 . 1 1 66 66 THR HA H 66 5.270 5.270 4.918 0.352 17919 15579 1 38 . 1 1 66 66 THR C C 66 173.950 173.950 173.719 0.231 17919 15580 1 38 . 1 1 66 66 THR CA C 66 62.340 62.340 61.737 0.603 17919 15581 1 38 . 1 1 66 66 THR CB C 66 70.080 70.080 70.280 -0.200 17919 15582 1 38 . 1 1 66 66 THR H H 66 8.730 8.730 8.376 0.354 17919 15583 1 38 . 1 1 67 67 LEU N N 67 127.110 127.110 128.228 -1.118 17919 15584 1 38 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.361 0.699 17919 15585 1 38 . 1 1 67 67 LEU C C 67 175.770 175.770 175.417 0.353 17919 15586 1 38 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.881 0.019 17919 15587 1 38 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.692 0.568 17919 15588 1 38 . 1 1 67 67 LEU H H 67 9.410 9.410 9.139 0.271 17919 15589 1 38 . 1 1 68 68 HIS N N 68 118.380 118.380 118.294 0.086 17919 15590 1 38 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.178 0.062 17919 15591 1 38 . 1 1 68 68 HIS C C 68 173.150 173.150 174.443 -1.293 17919 15592 1 38 . 1 1 68 68 HIS CA C 68 55.000 55.000 55.598 -0.598 17919 15593 1 38 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.173 -1.643 17919 15594 1 38 . 1 1 68 68 HIS H H 68 9.230 9.230 8.622 0.608 17919 15595 1 38 . 1 1 69 69 LEU N N 69 124.460 124.460 124.235 0.225 17919 15596 1 38 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.326 -0.136 17919 15597 1 38 . 1 1 69 69 LEU C C 69 175.270 175.270 174.664 0.606 17919 15598 1 38 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.874 0.016 17919 15599 1 38 . 1 1 69 69 LEU CB C 69 44.380 44.380 45.591 -1.211 17919 15600 1 38 . 1 1 69 69 LEU H H 69 8.340 8.340 8.164 0.176 17919 15601 1 38 . 1 1 70 70 VAL N N 70 126.940 126.940 123.183 3.757 17919 15602 1 38 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.636 -0.286 17919 15603 1 38 . 1 1 70 70 VAL C C 70 174.000 174.000 173.628 0.372 17919 15604 1 38 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.097 0.703 17919 15605 1 38 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.242 -0.332 17919 15606 1 38 . 1 1 70 70 VAL H H 70 9.200 9.200 8.144 1.056 17919 15607 1 38 . 1 1 71 71 LEU N N 71 123.130 123.130 126.145 -3.015 17919 15608 1 38 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.878 0.182 17919 15609 1 38 . 1 1 71 71 LEU C C 71 177.830 177.830 177.698 0.132 17919 15610 1 38 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.874 0.066 17919 15611 1 38 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.846 0.004 17919 15612 1 38 . 1 1 71 71 LEU H H 71 8.120 8.120 8.565 -0.445 17919 15613 1 38 . 1 1 72 72 ARG N N 72 123.490 123.490 122.364 1.126 17919 15614 1 38 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.310 -0.009 17919 15615 1 38 . 1 1 72 72 ARG C C 72 175.350 175.350 177.143 -1.793 17919 15616 1 38 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.245 -0.634 17919 15617 1 38 . 1 1 72 72 ARG CB C 72 31.350 31.350 29.009 2.341 17919 15618 1 38 . 1 1 72 72 ARG H H 72 8.580 8.580 8.213 0.367 17919 15619 1 39 . 1 1 2 2 GLN N N 2 123.220 123.220 121.263 1.957 17919 15620 1 39 . 1 1 2 2 GLN HA H 2 5.249 5.249 4.187 1.062 17919 15621 1 39 . 1 1 2 2 GLN C C 2 175.920 175.920 175.579 0.341 17919 15622 1 39 . 1 1 2 2 GLN CA C 2 55.080 55.080 56.860 -1.780 17919 15623 1 39 . 1 1 2 2 GLN CB C 2 30.760 30.760 28.707 2.053 17919 15624 1 39 . 1 1 2 2 GLN H H 2 8.900 8.900 8.428 0.472 17919 15625 1 39 . 1 1 3 3 ILE N N 3 115.340 115.340 117.595 -2.255 17919 15626 1 39 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.339 -0.126 17919 15627 1 39 . 1 1 3 3 ILE C C 3 172.450 172.450 173.656 -1.206 17919 15628 1 39 . 1 1 3 3 ILE CA C 3 59.570 59.570 58.922 0.648 17919 15629 1 39 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.341 0.869 17919 15630 1 39 . 1 1 3 3 ILE H H 3 8.320 8.320 7.749 0.571 17919 15631 1 39 . 1 1 4 4 PHE N N 4 118.110 118.110 118.299 -0.189 17919 15632 1 39 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.239 0.391 17919 15633 1 39 . 1 1 4 4 PHE C C 4 175.320 175.320 175.021 0.299 17919 15634 1 39 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.589 -0.379 17919 15635 1 39 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.397 0.083 17919 15636 1 39 . 1 1 4 4 PHE H H 4 8.610 8.610 7.976 0.634 17919 15637 1 39 . 1 1 5 5 VAL N N 5 121.000 121.000 120.354 0.646 17919 15638 1 39 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.680 0.045 17919 15639 1 39 . 1 1 5 5 VAL C C 5 174.870 174.870 174.389 0.481 17919 15640 1 39 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.136 -0.516 17919 15641 1 39 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.942 -0.712 17919 15642 1 39 . 1 1 5 5 VAL H H 5 9.300 9.300 8.549 0.751 17919 15643 1 39 . 1 1 6 6 LYS N N 6 127.520 127.520 127.949 -0.429 17919 15644 1 39 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.071 0.296 17919 15645 1 39 . 1 1 6 6 LYS C C 6 177.140 177.140 176.520 0.620 17919 15646 1 39 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.720 -0.200 17919 15647 1 39 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.502 -0.452 17919 15648 1 39 . 1 1 6 6 LYS H H 6 8.820 8.820 9.270 -0.450 17919 15649 1 39 . 1 1 7 7 THR N N 7 115.400 115.400 119.340 -3.940 17919 15650 1 39 . 1 1 7 7 THR HA H 7 4.970 4.970 4.411 0.559 17919 15651 1 39 . 1 1 7 7 THR C C 7 176.910 176.910 175.743 1.167 17919 15652 1 39 . 1 1 7 7 THR CA C 7 60.470 60.470 61.344 -0.874 17919 15653 1 39 . 1 1 7 7 THR CB C 7 70.630 70.630 70.034 0.596 17919 15654 1 39 . 1 1 7 7 THR H H 7 8.730 8.730 8.893 -0.163 17919 15655 1 39 . 1 1 8 8 LEU N N 8 121.330 121.330 119.927 1.403 17919 15656 1 39 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.575 -0.265 17919 15657 1 39 . 1 1 8 8 LEU C C 8 178.800 178.800 177.557 1.243 17919 15658 1 39 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.104 0.476 17919 15659 1 39 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.356 -0.386 17919 15660 1 39 . 1 1 8 8 LEU H H 8 9.100 9.100 8.581 0.519 17919 15661 1 39 . 1 1 9 9 THR N N 9 105.590 105.590 107.407 -1.817 17919 15662 1 39 . 1 1 9 9 THR HA H 9 4.428 4.428 4.238 0.190 17919 15663 1 39 . 1 1 9 9 THR C C 9 175.520 175.520 175.637 -0.117 17919 15664 1 39 . 1 1 9 9 THR CA C 9 61.400 61.400 62.972 -1.572 17919 15665 1 39 . 1 1 9 9 THR CB C 9 69.140 69.140 69.351 -0.211 17919 15666 1 39 . 1 1 9 9 THR H H 9 7.630 7.630 7.785 -0.154 17919 15667 1 39 . 1 1 10 10 GLY N N 10 108.890 108.890 111.049 -2.159 17919 15668 1 39 . 1 1 10 10 GLY C C 10 174.070 174.070 173.309 0.761 17919 15669 1 39 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.992 0.468 17919 15670 1 39 . 1 1 10 10 GLY H H 10 7.810 7.810 7.792 0.018 17919 15671 1 39 . 1 1 11 11 LYS N N 11 121.600 121.600 122.306 -0.706 17919 15672 1 39 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.753 -0.392 17919 15673 1 39 . 1 1 11 11 LYS C C 11 175.940 175.940 175.113 0.827 17919 15674 1 39 . 1 1 11 11 LYS CA C 11 56.280 56.280 54.824 1.456 17919 15675 1 39 . 1 1 11 11 LYS CB C 11 33.200 33.200 34.672 -1.472 17919 15676 1 39 . 1 1 11 11 LYS H H 11 7.280 7.280 7.975 -0.695 17919 15677 1 39 . 1 1 12 12 THR N N 12 120.440 120.440 120.475 -0.035 17919 15678 1 39 . 1 1 12 12 THR HA H 12 5.046 5.046 4.705 0.341 17919 15679 1 39 . 1 1 12 12 THR C C 12 174.320 174.320 174.472 -0.152 17919 15680 1 39 . 1 1 12 12 THR CA C 12 62.390 62.390 61.830 0.560 17919 15681 1 39 . 1 1 12 12 THR CB C 12 69.910 69.910 69.967 -0.057 17919 15682 1 39 . 1 1 12 12 THR H H 12 8.650 8.650 8.473 0.177 17919 15683 1 39 . 1 1 13 13 ILE N N 13 127.110 127.110 122.505 4.605 17919 15684 1 39 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.751 -0.207 17919 15685 1 39 . 1 1 13 13 ILE C C 13 175.220 175.220 173.605 1.615 17919 15686 1 39 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.435 0.545 17919 15687 1 39 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.261 -0.311 17919 15688 1 39 . 1 1 13 13 ILE H H 13 9.450 9.450 8.529 0.921 17919 15689 1 39 . 1 1 14 14 THR N N 14 121.520 121.520 121.823 -0.303 17919 15690 1 39 . 1 1 14 14 THR HA H 14 4.964 4.964 4.749 0.215 17919 15691 1 39 . 1 1 14 14 THR C C 14 173.790 173.790 173.541 0.249 17919 15692 1 39 . 1 1 14 14 THR CA C 14 61.940 61.940 61.646 0.294 17919 15693 1 39 . 1 1 14 14 THR CB C 14 69.650 69.650 70.183 -0.533 17919 15694 1 39 . 1 1 14 14 THR H H 14 8.710 8.710 8.486 0.225 17919 15695 1 39 . 1 1 15 15 LEU N N 15 124.800 124.800 127.339 -2.539 17919 15696 1 39 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.705 0.075 17919 15697 1 39 . 1 1 15 15 LEU C C 15 174.670 174.670 175.164 -0.494 17919 15698 1 39 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.783 -0.953 17919 15699 1 39 . 1 1 15 15 LEU CB C 15 47.070 47.070 43.882 3.188 17919 15700 1 39 . 1 1 15 15 LEU H H 15 8.710 8.710 8.132 0.578 17919 15701 1 39 . 1 1 16 16 GLU N N 16 122.160 122.160 123.606 -1.446 17919 15702 1 39 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.507 0.410 17919 15703 1 39 . 1 1 16 16 GLU C C 16 175.860 175.860 175.832 0.028 17919 15704 1 39 . 1 1 16 16 GLU CA C 16 54.820 54.820 53.759 1.061 17919 15705 1 39 . 1 1 16 16 GLU CB C 16 29.450 29.450 28.363 1.087 17919 15706 1 39 . 1 1 16 16 GLU H H 16 8.140 8.140 8.736 -0.596 17919 15707 1 39 . 1 1 17 17 VAL N N 17 117.210 117.210 118.805 -1.595 17919 15708 1 39 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.893 -0.179 17919 15709 1 39 . 1 1 17 17 VAL C C 17 174.160 174.160 175.759 -1.599 17919 15710 1 39 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.889 -0.459 17919 15711 1 39 . 1 1 17 17 VAL CB C 17 36.400 36.400 34.470 1.930 17919 15712 1 39 . 1 1 17 17 VAL H H 17 8.900 8.900 7.902 0.998 17919 15713 1 39 . 1 1 18 18 GLU N N 18 118.990 118.990 119.494 -0.504 17919 15714 1 39 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.875 0.204 17919 15715 1 39 . 1 1 18 18 GLU C C 18 176.160 176.160 175.479 0.681 17919 15716 1 39 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.884 -0.164 17919 15717 1 39 . 1 1 18 18 GLU CB C 18 30.310 30.310 31.018 -0.708 17919 15718 1 39 . 1 1 18 18 GLU H H 18 8.640 8.640 8.879 -0.239 17919 15719 1 39 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.146 -0.005 17919 15720 1 39 . 1 1 19 19 PRO C C 19 175.310 175.310 178.120 -2.810 17919 15721 1 39 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.995 -0.525 17919 15722 1 39 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.912 0.038 17919 15723 1 39 . 1 1 20 20 SER N N 20 103.400 103.400 107.877 -4.477 17919 15724 1 39 . 1 1 20 20 SER HA H 20 4.370 4.370 4.359 0.011 17919 15725 1 39 . 1 1 20 20 SER C C 20 174.660 174.660 174.207 0.453 17919 15726 1 39 . 1 1 20 20 SER CA C 20 57.400 57.400 58.553 -1.153 17919 15727 1 39 . 1 1 20 20 SER CB C 20 63.370 63.370 62.650 0.720 17919 15728 1 39 . 1 1 20 20 SER H H 20 7.040 7.040 8.182 -1.142 17919 15729 1 39 . 1 1 21 21 ASP N N 21 123.480 123.480 124.409 -0.929 17919 15730 1 39 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.666 0.029 17919 15731 1 39 . 1 1 21 21 ASP C C 21 176.360 176.360 175.808 0.552 17919 15732 1 39 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.221 0.479 17919 15733 1 39 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.828 -1.028 17919 15734 1 39 . 1 1 21 21 ASP H H 21 8.030 8.030 7.617 0.413 17919 15735 1 39 . 1 1 22 22 THR N N 22 108.800 108.800 113.128 -4.328 17919 15736 1 39 . 1 1 22 22 THR HA H 22 4.920 4.920 4.654 0.266 17919 15737 1 39 . 1 1 22 22 THR C C 22 176.750 176.750 176.116 0.634 17919 15738 1 39 . 1 1 22 22 THR CA C 22 59.690 59.690 61.446 -1.756 17919 15739 1 39 . 1 1 22 22 THR CB C 22 71.200 71.200 70.000 1.200 17919 15740 1 39 . 1 1 22 22 THR H H 22 7.900 7.900 8.386 -0.486 17919 15741 1 39 . 1 1 23 23 ILE N N 23 121.190 121.190 122.494 -1.304 17919 15742 1 39 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.711 -0.054 17919 15743 1 39 . 1 1 23 23 ILE C C 23 179.040 179.040 177.569 1.471 17919 15744 1 39 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.176 -0.916 17919 15745 1 39 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.308 -1.958 17919 15746 1 39 . 1 1 23 23 ILE H H 23 8.560 8.560 9.214 -0.654 17919 15747 1 39 . 1 1 24 24 GLU N N 24 120.830 120.830 120.505 0.325 17919 15748 1 39 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.917 0.000 17919 15749 1 39 . 1 1 24 24 GLU C C 24 178.640 178.640 178.446 0.194 17919 15750 1 39 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.883 0.337 17919 15751 1 39 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.516 -1.236 17919 15752 1 39 . 1 1 24 24 GLU H H 24 9.760 9.760 7.862 1.898 17919 15753 1 39 . 1 1 25 25 ASN N N 25 120.570 120.570 117.410 3.160 17919 15754 1 39 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.541 -0.016 17919 15755 1 39 . 1 1 25 25 ASN C C 25 178.380 178.380 178.182 0.198 17919 15756 1 39 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.898 0.162 17919 15757 1 39 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.444 0.006 17919 15758 1 39 . 1 1 25 25 ASN H H 25 7.920 7.920 7.384 0.536 17919 15759 1 39 . 1 1 26 26 VAL N N 26 121.710 121.710 120.899 0.811 17919 15760 1 39 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.520 -0.123 17919 15761 1 39 . 1 1 26 26 VAL C C 26 177.950 177.950 177.680 0.270 17919 15762 1 39 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.739 0.922 17919 15763 1 39 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.641 -0.801 17919 15764 1 39 . 1 1 26 26 VAL H H 26 8.070 8.070 7.970 0.100 17919 15765 1 39 . 1 1 27 27 LYS N N 27 118.860 118.860 118.711 0.149 17919 15766 1 39 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.248 0.332 17919 15767 1 39 . 1 1 27 27 LYS C C 27 180.550 180.550 178.994 1.556 17919 15768 1 39 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.168 0.082 17919 15769 1 39 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.178 1.552 17919 15770 1 39 . 1 1 27 27 LYS H H 27 8.560 8.560 7.632 0.928 17919 15771 1 39 . 1 1 28 28 ALA N N 28 123.440 123.440 122.839 0.601 17919 15772 1 39 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.041 0.119 17919 15773 1 39 . 1 1 28 28 ALA C C 28 180.300 180.300 178.975 1.325 17919 15774 1 39 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.594 -0.224 17919 15775 1 39 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.358 -0.648 17919 15776 1 39 . 1 1 28 28 ALA H H 28 8.060 8.060 8.432 -0.372 17919 15777 1 39 . 1 1 29 29 LYS N N 29 119.940 119.940 119.589 0.351 17919 15778 1 39 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.010 0.197 17919 15779 1 39 . 1 1 29 29 LYS C C 29 180.320 180.320 179.290 1.030 17919 15780 1 39 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.283 0.367 17919 15781 1 39 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.140 1.150 17919 15782 1 39 . 1 1 29 29 LYS H H 29 7.850 7.850 7.560 0.290 17919 15783 1 39 . 1 1 30 30 ILE N N 30 121.080 121.080 120.516 0.564 17919 15784 1 39 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.533 -0.026 17919 15785 1 39 . 1 1 30 30 ILE C C 30 178.310 178.310 177.412 0.898 17919 15786 1 39 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.469 0.681 17919 15787 1 39 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.171 -0.371 17919 15788 1 39 . 1 1 30 30 ILE H H 30 8.280 8.280 8.430 -0.150 17919 15789 1 39 . 1 1 31 31 GLN N N 31 123.490 123.490 120.193 3.297 17919 15790 1 39 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.031 -0.202 17919 15791 1 39 . 1 1 31 31 GLN C C 31 178.890 178.890 178.445 0.445 17919 15792 1 39 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.182 0.818 17919 15793 1 39 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.442 -0.722 17919 15794 1 39 . 1 1 31 31 GLN H H 31 8.580 8.580 8.065 0.515 17919 15795 1 39 . 1 1 32 32 ASP N N 32 119.360 119.360 119.520 -0.160 17919 15796 1 39 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.333 0.021 17919 15797 1 39 . 1 1 32 32 ASP C C 32 177.250 177.250 177.919 -0.669 17919 15798 1 39 . 1 1 32 32 ASP CA C 32 57.190 57.190 57.076 0.114 17919 15799 1 39 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.712 -0.132 17919 15800 1 39 . 1 1 32 32 ASP H H 32 8.010 8.010 8.478 -0.468 17919 15801 1 39 . 1 1 33 33 LYS N N 33 115.130 115.130 118.013 -2.883 17919 15802 1 39 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.297 0.040 17919 15803 1 39 . 1 1 33 33 LYS C C 33 177.870 177.870 178.234 -0.364 17919 15804 1 39 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.001 0.049 17919 15805 1 39 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.455 0.715 17919 15806 1 39 . 1 1 33 33 LYS H H 33 7.430 7.430 7.468 -0.038 17919 15807 1 39 . 1 1 34 34 GLU N N 34 113.870 113.870 114.873 -1.003 17919 15808 1 39 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.497 0.128 17919 15809 1 39 . 1 1 34 34 GLU C C 34 177.840 177.840 177.625 0.215 17919 15810 1 39 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.708 -0.538 17919 15811 1 39 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.495 1.165 17919 15812 1 39 . 1 1 34 34 GLU H H 34 8.740 8.740 8.184 0.556 17919 15813 1 39 . 1 1 35 35 GLY N N 35 108.650 108.650 109.177 -0.527 17919 15814 1 39 . 1 1 35 35 GLY C C 35 173.960 173.960 174.326 -0.366 17919 15815 1 39 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.968 0.112 17919 15816 1 39 . 1 1 35 35 GLY H H 35 8.530 8.530 8.516 0.014 17919 15817 1 39 . 1 1 36 36 ILE N N 36 119.880 119.880 122.442 -2.562 17919 15818 1 39 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.304 0.141 17919 15819 1 39 . 1 1 36 36 ILE C C 36 173.590 173.590 174.255 -0.665 17919 15820 1 39 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.023 -0.273 17919 15821 1 39 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.409 2.171 17919 15822 1 39 . 1 1 36 36 ILE H H 36 6.150 6.150 7.664 -1.514 17919 15823 1 39 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.924 -0.290 17919 15824 1 39 . 1 1 37 37 PRO C C 37 176.940 176.940 175.907 1.033 17919 15825 1 39 . 1 1 37 37 PRO CA C 37 61.660 61.660 60.518 1.142 17919 15826 1 39 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.278 0.572 17919 15827 1 39 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.173 -0.056 17919 15828 1 39 . 1 1 38 38 PRO C C 38 178.320 178.320 178.695 -0.375 17919 15829 1 39 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.771 0.489 17919 15830 1 39 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.918 0.972 17919 15831 1 39 . 1 1 39 39 ASP N N 39 113.380 113.380 115.926 -2.546 17919 15832 1 39 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.402 0.028 17919 15833 1 39 . 1 1 39 39 ASP C C 39 177.090 177.090 177.958 -0.868 17919 15834 1 39 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.623 -0.983 17919 15835 1 39 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.621 -1.081 17919 15836 1 39 . 1 1 39 39 ASP H H 39 8.550 8.550 8.497 0.053 17919 15837 1 39 . 1 1 40 40 GLN N N 40 116.780 116.780 117.251 -0.471 17919 15838 1 39 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.262 0.202 17919 15839 1 39 . 1 1 40 40 GLN C C 40 175.380 175.380 175.736 -0.356 17919 15840 1 39 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.702 -0.062 17919 15841 1 39 . 1 1 40 40 GLN CB C 40 30.140 30.140 28.489 1.651 17919 15842 1 39 . 1 1 40 40 GLN H H 40 7.820 7.820 7.706 0.114 17919 15843 1 39 . 1 1 41 41 GLN N N 41 117.720 117.720 119.116 -1.396 17919 15844 1 39 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.927 -0.683 17919 15845 1 39 . 1 1 41 41 GLN C C 41 176.300 176.300 174.678 1.622 17919 15846 1 39 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.037 1.433 17919 15847 1 39 . 1 1 41 41 GLN CB C 41 31.650 31.650 31.650 -0.000 17919 15848 1 39 . 1 1 41 41 GLN H H 41 7.480 7.480 7.496 -0.016 17919 15849 1 39 . 1 1 42 42 ARG N N 42 122.680 122.680 123.607 -0.927 17919 15850 1 39 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.738 -0.238 17919 15851 1 39 . 1 1 42 42 ARG C C 42 174.050 174.050 174.258 -0.208 17919 15852 1 39 . 1 1 42 42 ARG CA C 42 55.050 55.050 53.684 1.366 17919 15853 1 39 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.513 -0.763 17919 15854 1 39 . 1 1 42 42 ARG H H 42 8.530 8.530 8.148 0.382 17919 15855 1 39 . 1 1 43 43 LEU N N 43 124.040 124.040 124.961 -0.921 17919 15856 1 39 . 1 1 43 43 LEU C C 43 175.290 175.290 175.506 -0.216 17919 15857 1 39 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.998 -1.018 17919 15858 1 39 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.411 1.379 17919 15859 1 39 . 1 1 43 43 LEU H H 43 8.820 8.820 8.858 -0.038 17919 15860 1 39 . 1 1 44 44 ILE N N 44 121.920 121.920 121.880 0.040 17919 15861 1 39 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.842 0.150 17919 15862 1 39 . 1 1 44 44 ILE C C 44 176.060 176.060 174.450 1.610 17919 15863 1 39 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.668 -0.688 17919 15864 1 39 . 1 1 44 44 ILE CB C 44 41.420 41.420 39.513 1.907 17919 15865 1 39 . 1 1 44 44 ILE H H 44 9.030 9.030 8.250 0.780 17919 15866 1 39 . 1 1 45 45 PHE N N 45 125.390 125.390 128.423 -3.033 17919 15867 1 39 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.961 0.084 17919 15868 1 39 . 1 1 45 45 PHE C C 45 174.470 174.470 174.841 -0.371 17919 15869 1 39 . 1 1 45 45 PHE CA C 45 57.020 57.020 55.828 1.192 17919 15870 1 39 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.571 1.189 17919 15871 1 39 . 1 1 45 45 PHE H H 45 8.830 8.830 8.853 -0.023 17919 15872 1 39 . 1 1 46 46 ALA N N 46 132.200 132.200 130.421 1.779 17919 15873 1 39 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.704 -0.014 17919 15874 1 39 . 1 1 46 46 ALA C C 46 177.290 177.290 176.982 0.308 17919 15875 1 39 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.713 -0.173 17919 15876 1 39 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.347 0.223 17919 15877 1 39 . 1 1 46 46 ALA H H 46 8.810 8.810 8.933 -0.123 17919 15878 1 39 . 1 1 47 47 GLY N N 47 102.340 102.340 104.473 -2.133 17919 15879 1 39 . 1 1 47 47 GLY C C 47 173.810 173.810 174.273 -0.463 17919 15880 1 39 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.405 -0.055 17919 15881 1 39 . 1 1 47 47 GLY H H 47 8.130 8.130 8.556 -0.426 17919 15882 1 39 . 1 1 48 48 LYS N N 48 121.570 121.570 120.466 1.104 17919 15883 1 39 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.542 0.080 17919 15884 1 39 . 1 1 48 48 LYS C C 48 174.700 174.700 174.875 -0.175 17919 15885 1 39 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.089 -0.539 17919 15886 1 39 . 1 1 48 48 LYS CB C 48 34.530 34.530 35.598 -1.068 17919 15887 1 39 . 1 1 48 48 LYS H H 48 7.980 7.980 7.907 0.073 17919 15888 1 39 . 1 1 49 49 GLN N N 49 122.410 122.410 126.051 -3.641 17919 15889 1 39 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.598 -0.038 17919 15890 1 39 . 1 1 49 49 GLN C C 49 175.670 175.670 175.291 0.379 17919 15891 1 39 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.697 0.044 17919 15892 1 39 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.229 -0.229 17919 15893 1 39 . 1 1 49 49 GLN H H 49 8.600 8.600 8.701 -0.101 17919 15894 1 39 . 1 1 50 50 LEU N N 50 125.520 125.520 130.086 -4.566 17919 15895 1 39 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.231 -0.141 17919 15896 1 39 . 1 1 50 50 LEU C C 50 176.660 176.660 176.436 0.224 17919 15897 1 39 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.081 0.160 17919 15898 1 39 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.541 0.029 17919 15899 1 39 . 1 1 50 50 LEU H H 50 8.530 8.530 8.719 -0.189 17919 15900 1 39 . 1 1 51 51 GLU N N 51 122.940 122.940 125.020 -2.080 17919 15901 1 39 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.347 0.141 17919 15902 1 39 . 1 1 51 51 GLU C C 51 175.870 175.870 176.442 -0.572 17919 15903 1 39 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.886 0.074 17919 15904 1 39 . 1 1 51 51 GLU CB C 51 31.570 31.570 30.828 0.742 17919 15905 1 39 . 1 1 51 51 GLU H H 51 8.400 8.400 8.798 -0.398 17919 15906 1 39 . 1 1 52 52 ASP N N 52 120.030 120.030 123.763 -3.733 17919 15907 1 39 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.522 -0.163 17919 15908 1 39 . 1 1 52 52 ASP C C 52 177.330 177.330 177.941 -0.611 17919 15909 1 39 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.105 -0.145 17919 15910 1 39 . 1 1 52 52 ASP CB C 52 40.850 40.850 41.036 -0.186 17919 15911 1 39 . 1 1 52 52 ASP H H 52 8.160 8.160 8.861 -0.701 17919 15912 1 39 . 1 1 53 53 GLY N N 53 106.660 106.660 106.654 0.006 17919 15913 1 39 . 1 1 53 53 GLY C C 53 174.870 174.870 174.022 0.848 17919 15914 1 39 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.036 0.133 17919 15915 1 39 . 1 1 53 53 GLY H H 53 9.390 9.390 8.392 0.998 17919 15916 1 39 . 1 1 54 54 ARG N N 54 119.050 119.050 120.147 -1.097 17919 15917 1 39 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.583 0.112 17919 15918 1 39 . 1 1 54 54 ARG C C 54 175.350 175.350 174.961 0.389 17919 15919 1 39 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.314 0.076 17919 15920 1 39 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.098 -0.448 17919 15921 1 39 . 1 1 54 54 ARG H H 54 7.460 7.460 7.307 0.153 17919 15922 1 39 . 1 1 55 55 THR N N 55 108.400 108.400 112.639 -4.239 17919 15923 1 39 . 1 1 55 55 THR HA H 55 5.240 5.240 4.863 0.377 17919 15924 1 39 . 1 1 55 55 THR C C 55 176.560 176.560 175.836 0.724 17919 15925 1 39 . 1 1 55 55 THR CA C 55 59.690 59.690 61.178 -1.488 17919 15926 1 39 . 1 1 55 55 THR CB C 55 72.260 72.260 70.677 1.583 17919 15927 1 39 . 1 1 55 55 THR H H 55 8.730 8.730 8.392 0.338 17919 15928 1 39 . 1 1 56 56 LEU N N 56 117.920 117.920 120.914 -2.994 17919 15929 1 39 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.003 0.057 17919 15930 1 39 . 1 1 56 56 LEU C C 56 180.810 180.810 178.755 2.055 17919 15931 1 39 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.361 0.349 17919 15932 1 39 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.830 -1.460 17919 15933 1 39 . 1 1 56 56 LEU H H 56 8.140 8.140 8.436 -0.296 17919 15934 1 39 . 1 1 57 57 SER N N 57 113.330 113.330 113.640 -0.310 17919 15935 1 39 . 1 1 57 57 SER HA H 57 4.370 4.370 4.250 0.120 17919 15936 1 39 . 1 1 57 57 SER C C 57 178.310 178.310 176.602 1.708 17919 15937 1 39 . 1 1 57 57 SER CA C 57 61.080 61.080 61.587 -0.507 17919 15938 1 39 . 1 1 57 57 SER CB C 57 62.530 62.530 62.784 -0.254 17919 15939 1 39 . 1 1 57 57 SER H H 57 8.470 8.470 7.987 0.483 17919 15940 1 39 . 1 1 58 58 ASP N N 58 124.190 124.190 122.185 2.005 17919 15941 1 39 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.350 -0.054 17919 15942 1 39 . 1 1 58 58 ASP C C 58 177.400 177.400 176.854 0.546 17919 15943 1 39 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.606 0.574 17919 15944 1 39 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.408 -0.308 17919 15945 1 39 . 1 1 58 58 ASP H H 58 7.930 7.930 7.826 0.104 17919 15946 1 39 . 1 1 59 59 TYR N N 59 115.510 115.510 115.052 0.458 17919 15947 1 39 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.673 -0.003 17919 15948 1 39 . 1 1 59 59 TYR C C 59 174.700 174.700 175.337 -0.637 17919 15949 1 39 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.372 0.878 17919 15950 1 39 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.520 1.550 17919 15951 1 39 . 1 1 59 59 TYR H H 59 7.250 7.250 7.285 -0.035 17919 15952 1 39 . 1 1 60 60 ASN N N 60 115.900 115.900 117.475 -1.575 17919 15953 1 39 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.364 -0.009 17919 15954 1 39 . 1 1 60 60 ASN C C 60 174.340 174.340 174.840 -0.500 17919 15955 1 39 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.293 -0.173 17919 15956 1 39 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.234 0.176 17919 15957 1 39 . 1 1 60 60 ASN H H 60 8.150 8.150 7.761 0.389 17919 15958 1 39 . 1 1 61 61 ILE N N 61 118.600 118.600 118.741 -0.141 17919 15959 1 39 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.737 -0.344 17919 15960 1 39 . 1 1 61 61 ILE C C 61 174.610 174.610 175.039 -0.429 17919 15961 1 39 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.778 0.642 17919 15962 1 39 . 1 1 61 61 ILE CB C 61 36.740 36.740 38.277 -1.537 17919 15963 1 39 . 1 1 61 61 ILE H H 61 7.250 7.250 7.677 -0.427 17919 15964 1 39 . 1 1 62 62 GLN N N 62 124.740 124.740 123.950 0.790 17919 15965 1 39 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.657 -0.151 17919 15966 1 39 . 1 1 62 62 GLN C C 62 175.970 175.970 174.655 1.315 17919 15967 1 39 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.604 0.056 17919 15968 1 39 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.459 0.191 17919 15969 1 39 . 1 1 62 62 GLN H H 62 7.610 7.610 7.997 -0.387 17919 15970 1 39 . 1 1 63 63 LYS N N 63 120.300 120.300 122.263 -1.963 17919 15971 1 39 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.827 0.174 17919 15972 1 39 . 1 1 63 63 LYS C C 63 175.810 175.810 176.735 -0.925 17919 15973 1 39 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.486 -0.696 17919 15974 1 39 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.884 0.766 17919 15975 1 39 . 1 1 63 63 LYS H H 63 8.490 8.490 8.594 -0.104 17919 15976 1 39 . 1 1 64 64 GLU N N 64 113.950 113.950 121.700 -7.750 17919 15977 1 39 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.717 -0.252 17919 15978 1 39 . 1 1 64 64 GLU C C 64 175.250 175.250 175.680 -0.430 17919 15979 1 39 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.629 0.261 17919 15980 1 39 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.209 -2.309 17919 15981 1 39 . 1 1 64 64 GLU H H 64 9.280 9.280 8.440 0.840 17919 15982 1 39 . 1 1 65 65 SER N N 65 114.730 114.730 114.465 0.265 17919 15983 1 39 . 1 1 65 65 SER HA H 65 4.640 4.640 4.495 0.145 17919 15984 1 39 . 1 1 65 65 SER C C 65 172.160 172.160 173.925 -1.765 17919 15985 1 39 . 1 1 65 65 SER CA C 65 60.890 60.890 60.065 0.825 17919 15986 1 39 . 1 1 65 65 SER CB C 65 64.910 64.910 64.118 0.792 17919 15987 1 39 . 1 1 65 65 SER H H 65 7.670 7.670 7.626 0.044 17919 15988 1 39 . 1 1 66 66 THR N N 66 117.110 117.110 117.045 0.065 17919 15989 1 39 . 1 1 66 66 THR HA H 66 5.270 5.270 5.259 0.011 17919 15990 1 39 . 1 1 66 66 THR C C 66 173.950 173.950 173.823 0.127 17919 15991 1 39 . 1 1 66 66 THR CA C 66 62.340 62.340 62.138 0.202 17919 15992 1 39 . 1 1 66 66 THR CB C 66 70.080 70.080 71.166 -1.086 17919 15993 1 39 . 1 1 66 66 THR H H 66 8.730 8.730 8.486 0.244 17919 15994 1 39 . 1 1 67 67 LEU N N 67 127.110 127.110 126.039 1.071 17919 15995 1 39 . 1 1 67 67 LEU HA H 67 5.060 5.060 5.227 -0.167 17919 15996 1 39 . 1 1 67 67 LEU C C 67 175.770 175.770 174.986 0.784 17919 15997 1 39 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.626 0.274 17919 15998 1 39 . 1 1 67 67 LEU CB C 67 44.260 44.260 45.127 -0.867 17919 15999 1 39 . 1 1 67 67 LEU H H 67 9.410 9.410 8.515 0.895 17919 16000 1 39 . 1 1 68 68 HIS N N 68 118.380 118.380 121.522 -3.142 17919 16001 1 39 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.027 0.213 17919 16002 1 39 . 1 1 68 68 HIS C C 68 173.150 173.150 174.184 -1.034 17919 16003 1 39 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.064 0.936 17919 16004 1 39 . 1 1 68 68 HIS CB C 68 30.530 30.530 31.633 -1.103 17919 16005 1 39 . 1 1 68 68 HIS H H 68 9.230 9.230 8.796 0.434 17919 16006 1 39 . 1 1 69 69 LEU N N 69 124.460 124.460 130.665 -6.205 17919 16007 1 39 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.295 0.895 17919 16008 1 39 . 1 1 69 69 LEU C C 69 175.270 175.270 175.184 0.086 17919 16009 1 39 . 1 1 69 69 LEU CA C 69 53.890 53.890 55.031 -1.141 17919 16010 1 39 . 1 1 69 69 LEU CB C 69 44.380 44.380 42.046 2.334 17919 16011 1 39 . 1 1 69 69 LEU H H 69 8.340 8.340 8.731 -0.391 17919 16012 1 39 . 1 1 70 70 VAL N N 70 126.940 126.940 128.392 -1.452 17919 16013 1 39 . 1 1 70 70 VAL HA H 70 4.350 4.350 3.851 0.499 17919 16014 1 39 . 1 1 70 70 VAL C C 70 174.000 174.000 174.934 -0.934 17919 16015 1 39 . 1 1 70 70 VAL CA C 70 60.800 60.800 61.257 -0.457 17919 16016 1 39 . 1 1 70 70 VAL CB C 70 34.910 34.910 31.942 2.968 17919 16017 1 39 . 1 1 70 70 VAL H H 70 9.200 9.200 8.620 0.580 17919 16018 1 39 . 1 1 71 71 LEU N N 71 123.130 123.130 127.388 -4.258 17919 16019 1 39 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.466 0.594 17919 16020 1 39 . 1 1 71 71 LEU C C 71 177.830 177.830 177.620 0.210 17919 16021 1 39 . 1 1 71 71 LEU CA C 71 53.940 53.940 54.036 -0.096 17919 16022 1 39 . 1 1 71 71 LEU CB C 71 42.850 42.850 41.576 1.274 17919 16023 1 39 . 1 1 71 71 LEU H H 71 8.120 8.120 8.589 -0.469 17919 16024 1 39 . 1 1 72 72 ARG N N 72 123.490 123.490 125.453 -1.963 17919 16025 1 39 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.222 0.079 17919 16026 1 39 . 1 1 72 72 ARG C C 72 175.350 175.350 175.120 0.230 17919 16027 1 39 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.702 -1.092 17919 16028 1 39 . 1 1 72 72 ARG CB C 72 31.350 31.350 29.594 1.756 17919 16029 1 39 . 1 1 72 72 ARG H H 72 8.580 8.580 8.409 0.171 17919 16030 1 40 . 1 1 2 2 GLN N N 2 123.220 123.220 119.309 3.911 17919 16031 1 40 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.382 -0.133 17919 16032 1 40 . 1 1 2 2 GLN C C 2 175.920 175.920 174.749 1.171 17919 16033 1 40 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.490 0.590 17919 16034 1 40 . 1 1 2 2 GLN CB C 2 30.760 30.760 31.871 -1.111 17919 16035 1 40 . 1 1 2 2 GLN H H 2 8.900 8.900 8.177 0.723 17919 16036 1 40 . 1 1 3 3 ILE N N 3 115.340 115.340 117.499 -2.159 17919 16037 1 40 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.929 -0.716 17919 16038 1 40 . 1 1 3 3 ILE C C 3 172.450 172.450 173.669 -1.219 17919 16039 1 40 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.056 0.514 17919 16040 1 40 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.046 1.164 17919 16041 1 40 . 1 1 3 3 ILE H H 3 8.320 8.320 8.281 0.039 17919 16042 1 40 . 1 1 4 4 PHE N N 4 118.110 118.110 119.772 -1.662 17919 16043 1 40 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.519 0.111 17919 16044 1 40 . 1 1 4 4 PHE C C 4 175.320 175.320 174.628 0.692 17919 16045 1 40 . 1 1 4 4 PHE CA C 4 55.210 55.210 56.049 -0.839 17919 16046 1 40 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.888 -1.407 17919 16047 1 40 . 1 1 4 4 PHE H H 4 8.610 8.610 7.983 0.627 17919 16048 1 40 . 1 1 5 5 VAL N N 5 121.000 121.000 122.708 -1.708 17919 16049 1 40 . 1 1 5 5 VAL HA H 5 4.725 4.725 5.208 -0.483 17919 16050 1 40 . 1 1 5 5 VAL C C 5 174.870 174.870 175.250 -0.380 17919 16051 1 40 . 1 1 5 5 VAL CA C 5 60.620 60.620 60.791 -0.171 17919 16052 1 40 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.659 -0.429 17919 16053 1 40 . 1 1 5 5 VAL H H 5 9.300 9.300 9.168 0.132 17919 16054 1 40 . 1 1 6 6 LYS N N 6 127.520 127.520 128.178 -0.658 17919 16055 1 40 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.167 0.200 17919 16056 1 40 . 1 1 6 6 LYS C C 6 177.140 177.140 177.142 -0.002 17919 16057 1 40 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.041 0.478 17919 16058 1 40 . 1 1 6 6 LYS CB C 6 35.050 35.050 33.212 1.838 17919 16059 1 40 . 1 1 6 6 LYS H H 6 8.820 8.820 9.077 -0.257 17919 16060 1 40 . 1 1 7 7 THR N N 7 115.400 115.400 115.985 -0.585 17919 16061 1 40 . 1 1 7 7 THR HA H 7 4.970 4.970 4.591 0.379 17919 16062 1 40 . 1 1 7 7 THR C C 7 176.910 176.910 176.233 0.677 17919 16063 1 40 . 1 1 7 7 THR CA C 7 60.470 60.470 60.323 0.147 17919 16064 1 40 . 1 1 7 7 THR CB C 7 70.630 70.630 70.382 0.248 17919 16065 1 40 . 1 1 7 7 THR H H 7 8.730 8.730 8.005 0.725 17919 16066 1 40 . 1 1 8 8 LEU N N 8 121.330 121.330 119.258 2.072 17919 16067 1 40 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.331 -0.021 17919 16068 1 40 . 1 1 8 8 LEU C C 8 178.800 178.800 177.755 1.045 17919 16069 1 40 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.632 -0.052 17919 16070 1 40 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.775 0.195 17919 16071 1 40 . 1 1 8 8 LEU H H 8 9.100 9.100 8.642 0.458 17919 16072 1 40 . 1 1 9 9 THR N N 9 105.590 105.590 110.878 -5.288 17919 16073 1 40 . 1 1 9 9 THR HA H 9 4.428 4.428 4.155 0.273 17919 16074 1 40 . 1 1 9 9 THR C C 9 175.520 175.520 175.740 -0.220 17919 16075 1 40 . 1 1 9 9 THR CA C 9 61.400 61.400 63.129 -1.729 17919 16076 1 40 . 1 1 9 9 THR CB C 9 69.140 69.140 69.053 0.087 17919 16077 1 40 . 1 1 9 9 THR H H 9 7.630 7.630 7.817 -0.187 17919 16078 1 40 . 1 1 10 10 GLY N N 10 108.890 108.890 111.411 -2.521 17919 16079 1 40 . 1 1 10 10 GLY C C 10 174.070 174.070 173.772 0.298 17919 16080 1 40 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.739 0.721 17919 16081 1 40 . 1 1 10 10 GLY H H 10 7.810 7.810 7.686 0.124 17919 16082 1 40 . 1 1 11 11 LYS N N 11 121.600 121.600 121.221 0.379 17919 16083 1 40 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.108 0.253 17919 16084 1 40 . 1 1 11 11 LYS C C 11 175.940 175.940 176.166 -0.226 17919 16085 1 40 . 1 1 11 11 LYS CA C 11 56.280 56.280 57.029 -0.749 17919 16086 1 40 . 1 1 11 11 LYS CB C 11 33.200 33.200 32.970 0.230 17919 16087 1 40 . 1 1 11 11 LYS H H 11 7.280 7.280 7.513 -0.233 17919 16088 1 40 . 1 1 12 12 THR N N 12 120.440 120.440 123.119 -2.679 17919 16089 1 40 . 1 1 12 12 THR HA H 12 5.046 5.046 4.377 0.669 17919 16090 1 40 . 1 1 12 12 THR C C 12 174.320 174.320 174.889 -0.569 17919 16091 1 40 . 1 1 12 12 THR CA C 12 62.390 62.390 63.376 -0.986 17919 16092 1 40 . 1 1 12 12 THR CB C 12 69.910 69.910 68.468 1.442 17919 16093 1 40 . 1 1 12 12 THR H H 12 8.650 8.650 8.494 0.156 17919 16094 1 40 . 1 1 13 13 ILE N N 13 127.110 127.110 127.734 -0.624 17919 16095 1 40 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.312 0.232 17919 16096 1 40 . 1 1 13 13 ILE C C 13 175.220 175.220 174.939 0.281 17919 16097 1 40 . 1 1 13 13 ILE CA C 13 59.980 59.980 62.008 -2.028 17919 16098 1 40 . 1 1 13 13 ILE CB C 13 40.950 40.950 38.794 2.156 17919 16099 1 40 . 1 1 13 13 ILE H H 13 9.450 9.450 7.971 1.479 17919 16100 1 40 . 1 1 14 14 THR N N 14 121.520 121.520 121.113 0.407 17919 16101 1 40 . 1 1 14 14 THR HA H 14 4.964 4.964 4.470 0.494 17919 16102 1 40 . 1 1 14 14 THR C C 14 173.790 173.790 173.581 0.209 17919 16103 1 40 . 1 1 14 14 THR CA C 14 61.940 61.940 61.863 0.077 17919 16104 1 40 . 1 1 14 14 THR CB C 14 69.650 69.650 69.970 -0.320 17919 16105 1 40 . 1 1 14 14 THR H H 14 8.710 8.710 8.285 0.425 17919 16106 1 40 . 1 1 15 15 LEU N N 15 124.800 124.800 128.344 -3.544 17919 16107 1 40 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.628 0.152 17919 16108 1 40 . 1 1 15 15 LEU C C 15 174.670 174.670 174.241 0.429 17919 16109 1 40 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.797 -0.967 17919 16110 1 40 . 1 1 15 15 LEU CB C 15 47.070 47.070 46.624 0.446 17919 16111 1 40 . 1 1 15 15 LEU H H 15 8.710 8.710 8.222 0.488 17919 16112 1 40 . 1 1 16 16 GLU N N 16 122.160 122.160 124.399 -2.239 17919 16113 1 40 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.812 0.105 17919 16114 1 40 . 1 1 16 16 GLU C C 16 175.860 175.860 175.699 0.161 17919 16115 1 40 . 1 1 16 16 GLU CA C 16 54.820 54.820 54.079 0.741 17919 16116 1 40 . 1 1 16 16 GLU CB C 16 29.450 29.450 28.541 0.909 17919 16117 1 40 . 1 1 16 16 GLU H H 16 8.140 8.140 8.553 -0.413 17919 16118 1 40 . 1 1 17 17 VAL N N 17 117.210 117.210 117.281 -0.071 17919 16119 1 40 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.487 0.227 17919 16120 1 40 . 1 1 17 17 VAL C C 17 174.160 174.160 175.085 -0.925 17919 16121 1 40 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.025 -0.595 17919 16122 1 40 . 1 1 17 17 VAL CB C 17 36.400 36.400 34.929 1.471 17919 16123 1 40 . 1 1 17 17 VAL H H 17 8.900 8.900 7.921 0.979 17919 16124 1 40 . 1 1 18 18 GLU N N 18 118.990 118.990 123.822 -4.832 17919 16125 1 40 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.909 0.170 17919 16126 1 40 . 1 1 18 18 GLU C C 18 176.160 176.160 175.293 0.867 17919 16127 1 40 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.379 0.341 17919 16128 1 40 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.981 -0.671 17919 16129 1 40 . 1 1 18 18 GLU H H 18 8.640 8.640 8.801 -0.161 17919 16130 1 40 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.274 -0.133 17919 16131 1 40 . 1 1 19 19 PRO C C 19 175.310 175.310 177.557 -2.247 17919 16132 1 40 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.256 0.214 17919 16133 1 40 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.917 0.033 17919 16134 1 40 . 1 1 20 20 SER N N 20 103.400 103.400 110.095 -6.695 17919 16135 1 40 . 1 1 20 20 SER HA H 20 4.370 4.370 4.303 0.067 17919 16136 1 40 . 1 1 20 20 SER C C 20 174.660 174.660 174.925 -0.265 17919 16137 1 40 . 1 1 20 20 SER CA C 20 57.400 57.400 59.252 -1.852 17919 16138 1 40 . 1 1 20 20 SER CB C 20 63.370 63.370 62.593 0.777 17919 16139 1 40 . 1 1 20 20 SER H H 20 7.040 7.040 8.046 -1.006 17919 16140 1 40 . 1 1 21 21 ASP N N 21 123.480 123.480 124.943 -1.463 17919 16141 1 40 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.440 0.255 17919 16142 1 40 . 1 1 21 21 ASP C C 21 176.360 176.360 176.420 -0.060 17919 16143 1 40 . 1 1 21 21 ASP CA C 21 55.700 55.700 56.395 -0.695 17919 16144 1 40 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.233 -0.433 17919 16145 1 40 . 1 1 21 21 ASP H H 21 8.030 8.030 7.740 0.290 17919 16146 1 40 . 1 1 22 22 THR N N 22 108.800 108.800 112.533 -3.733 17919 16147 1 40 . 1 1 22 22 THR HA H 22 4.920 4.920 4.824 0.096 17919 16148 1 40 . 1 1 22 22 THR C C 22 176.750 176.750 175.879 0.871 17919 16149 1 40 . 1 1 22 22 THR CA C 22 59.690 59.690 60.782 -1.092 17919 16150 1 40 . 1 1 22 22 THR CB C 22 71.200 71.200 70.704 0.496 17919 16151 1 40 . 1 1 22 22 THR H H 22 7.900 7.900 8.152 -0.252 17919 16152 1 40 . 1 1 23 23 ILE N N 23 121.190 121.190 121.522 -0.332 17919 16153 1 40 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.856 -0.199 17919 16154 1 40 . 1 1 23 23 ILE C C 23 179.040 179.040 177.413 1.627 17919 16155 1 40 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.808 -1.548 17919 16156 1 40 . 1 1 23 23 ILE CB C 23 34.350 34.350 37.560 -3.210 17919 16157 1 40 . 1 1 23 23 ILE H H 23 8.560 8.560 8.738 -0.178 17919 16158 1 40 . 1 1 24 24 GLU N N 24 120.830 120.830 121.567 -0.737 17919 16159 1 40 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.942 -0.025 17919 16160 1 40 . 1 1 24 24 GLU C C 24 178.640 178.640 178.442 0.198 17919 16161 1 40 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.236 -0.016 17919 16162 1 40 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.359 -1.079 17919 16163 1 40 . 1 1 24 24 GLU H H 24 9.760 9.760 8.657 1.103 17919 16164 1 40 . 1 1 25 25 ASN N N 25 120.570 120.570 117.756 2.814 17919 16165 1 40 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.541 -0.016 17919 16166 1 40 . 1 1 25 25 ASN C C 25 178.380 178.380 177.618 0.762 17919 16167 1 40 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.722 0.338 17919 16168 1 40 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.453 -0.002 17919 16169 1 40 . 1 1 25 25 ASN H H 25 7.920 7.920 7.877 0.043 17919 16170 1 40 . 1 1 26 26 VAL N N 26 121.710 121.710 120.779 0.931 17919 16171 1 40 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.518 -0.121 17919 16172 1 40 . 1 1 26 26 VAL C C 26 177.950 177.950 177.804 0.146 17919 16173 1 40 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.216 1.444 17919 16174 1 40 . 1 1 26 26 VAL CB C 26 30.840 30.840 30.890 -0.050 17919 16175 1 40 . 1 1 26 26 VAL H H 26 8.070 8.070 8.070 -0.000 17919 16176 1 40 . 1 1 27 27 LYS N N 27 118.860 118.860 119.835 -0.975 17919 16177 1 40 . 1 1 27 27 LYS HA H 27 4.580 4.580 3.995 0.585 17919 16178 1 40 . 1 1 27 27 LYS C C 27 180.550 180.550 178.971 1.579 17919 16179 1 40 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.620 -0.370 17919 16180 1 40 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.276 1.454 17919 16181 1 40 . 1 1 27 27 LYS H H 27 8.560 8.560 8.210 0.350 17919 16182 1 40 . 1 1 28 28 ALA N N 28 123.440 123.440 120.260 3.180 17919 16183 1 40 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.094 0.066 17919 16184 1 40 . 1 1 28 28 ALA C C 28 180.300 180.300 178.913 1.387 17919 16185 1 40 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.389 0.981 17919 16186 1 40 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.357 -0.647 17919 16187 1 40 . 1 1 28 28 ALA H H 28 8.060 8.060 8.385 -0.325 17919 16188 1 40 . 1 1 29 29 LYS N N 29 119.940 119.940 119.499 0.441 17919 16189 1 40 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.082 0.125 17919 16190 1 40 . 1 1 29 29 LYS C C 29 180.320 180.320 179.270 1.050 17919 16191 1 40 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.084 0.566 17919 16192 1 40 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.538 0.752 17919 16193 1 40 . 1 1 29 29 LYS H H 29 7.850 7.850 7.742 0.108 17919 16194 1 40 . 1 1 30 30 ILE N N 30 121.080 121.080 120.275 0.805 17919 16195 1 40 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.615 -0.108 17919 16196 1 40 . 1 1 30 30 ILE C C 30 178.310 178.310 177.358 0.952 17919 16197 1 40 . 1 1 30 30 ILE CA C 30 66.150 66.150 64.925 1.224 17919 16198 1 40 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.260 -0.460 17919 16199 1 40 . 1 1 30 30 ILE H H 30 8.280 8.280 7.566 0.714 17919 16200 1 40 . 1 1 31 31 GLN N N 31 123.490 123.490 119.468 4.022 17919 16201 1 40 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.173 -0.344 17919 16202 1 40 . 1 1 31 31 GLN C C 31 178.890 178.890 177.507 1.383 17919 16203 1 40 . 1 1 31 31 GLN CA C 31 60.000 60.000 58.714 1.286 17919 16204 1 40 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.756 -1.036 17919 16205 1 40 . 1 1 31 31 GLN H H 31 8.580 8.580 8.177 0.403 17919 16206 1 40 . 1 1 32 32 ASP N N 32 119.360 119.360 119.368 -0.008 17919 16207 1 40 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.436 -0.082 17919 16208 1 40 . 1 1 32 32 ASP C C 32 177.250 177.250 177.537 -0.287 17919 16209 1 40 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.743 0.447 17919 16210 1 40 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.584 -0.004 17919 16211 1 40 . 1 1 32 32 ASP H H 32 8.010 8.010 7.777 0.233 17919 16212 1 40 . 1 1 33 33 LYS N N 33 115.130 115.130 117.093 -1.963 17919 16213 1 40 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.357 -0.020 17919 16214 1 40 . 1 1 33 33 LYS C C 33 177.870 177.870 177.556 0.314 17919 16215 1 40 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.049 0.001 17919 16216 1 40 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.991 0.179 17919 16217 1 40 . 1 1 33 33 LYS H H 33 7.430 7.430 7.348 0.082 17919 16218 1 40 . 1 1 34 34 GLU N N 34 113.870 113.870 114.978 -1.108 17919 16219 1 40 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.461 0.164 17919 16220 1 40 . 1 1 34 34 GLU C C 34 177.840 177.840 177.304 0.536 17919 16221 1 40 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.922 -0.752 17919 16222 1 40 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.369 1.291 17919 16223 1 40 . 1 1 34 34 GLU H H 34 8.740 8.740 7.984 0.756 17919 16224 1 40 . 1 1 35 35 GLY N N 35 108.650 108.650 108.490 0.160 17919 16225 1 40 . 1 1 35 35 GLY C C 35 173.960 173.960 174.452 -0.492 17919 16226 1 40 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.817 0.263 17919 16227 1 40 . 1 1 35 35 GLY H H 35 8.530 8.530 7.899 0.631 17919 16228 1 40 . 1 1 36 36 ILE N N 36 119.880 119.880 122.772 -2.892 17919 16229 1 40 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.395 0.050 17919 16230 1 40 . 1 1 36 36 ILE C C 36 173.590 173.590 174.286 -0.696 17919 16231 1 40 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.151 -0.401 17919 16232 1 40 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.283 2.297 17919 16233 1 40 . 1 1 36 36 ILE H H 36 6.150 6.150 7.669 -1.519 17919 16234 1 40 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.844 -0.210 17919 16235 1 40 . 1 1 37 37 PRO C C 37 176.940 176.940 176.191 0.749 17919 16236 1 40 . 1 1 37 37 PRO CA C 37 61.660 61.660 60.920 0.740 17919 16237 1 40 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.181 0.669 17919 16238 1 40 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.115 0.002 17919 16239 1 40 . 1 1 38 38 PRO C C 38 178.320 178.320 177.398 0.922 17919 16240 1 40 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.909 0.351 17919 16241 1 40 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.683 1.206 17919 16242 1 40 . 1 1 39 39 ASP N N 39 113.380 113.380 114.684 -1.304 17919 16243 1 40 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.387 0.043 17919 16244 1 40 . 1 1 39 39 ASP C C 39 177.090 177.090 176.291 0.799 17919 16245 1 40 . 1 1 39 39 ASP CA C 39 55.640 55.640 55.420 0.220 17919 16246 1 40 . 1 1 39 39 ASP CB C 39 39.540 39.540 39.994 -0.454 17919 16247 1 40 . 1 1 39 39 ASP H H 39 8.550 8.550 8.488 0.062 17919 16248 1 40 . 1 1 40 40 GLN N N 40 116.780 116.780 118.735 -1.955 17919 16249 1 40 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.271 0.193 17919 16250 1 40 . 1 1 40 40 GLN C C 40 175.380 175.380 175.580 -0.200 17919 16251 1 40 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.480 -0.840 17919 16252 1 40 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.690 0.450 17919 16253 1 40 . 1 1 40 40 GLN H H 40 7.820 7.820 7.766 0.054 17919 16254 1 40 . 1 1 41 41 GLN N N 41 117.720 117.720 119.492 -1.772 17919 16255 1 40 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.324 -0.080 17919 16256 1 40 . 1 1 41 41 GLN C C 41 176.300 176.300 174.941 1.359 17919 16257 1 40 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.956 0.514 17919 16258 1 40 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.608 2.042 17919 16259 1 40 . 1 1 41 41 GLN H H 41 7.480 7.480 7.377 0.103 17919 16260 1 40 . 1 1 42 42 ARG N N 42 122.680 122.680 122.446 0.234 17919 16261 1 40 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.583 -0.083 17919 16262 1 40 . 1 1 42 42 ARG C C 42 174.050 174.050 173.865 0.185 17919 16263 1 40 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.759 0.291 17919 16264 1 40 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.147 -0.397 17919 16265 1 40 . 1 1 42 42 ARG H H 42 8.530 8.530 8.196 0.334 17919 16266 1 40 . 1 1 43 43 LEU N N 43 124.040 124.040 125.397 -1.357 17919 16267 1 40 . 1 1 43 43 LEU C C 43 175.290 175.290 175.143 0.147 17919 16268 1 40 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.815 -0.835 17919 16269 1 40 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.440 2.350 17919 16270 1 40 . 1 1 43 43 LEU H H 43 8.820 8.820 8.740 0.080 17919 16271 1 40 . 1 1 44 44 ILE N N 44 121.920 121.920 124.270 -2.350 17919 16272 1 40 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.833 0.159 17919 16273 1 40 . 1 1 44 44 ILE C C 44 176.060 176.060 174.546 1.514 17919 16274 1 40 . 1 1 44 44 ILE CA C 44 58.980 58.980 58.463 0.517 17919 16275 1 40 . 1 1 44 44 ILE CB C 44 41.420 41.420 39.013 2.407 17919 16276 1 40 . 1 1 44 44 ILE H H 44 9.030 9.030 9.013 0.017 17919 16277 1 40 . 1 1 45 45 PHE N N 45 125.390 125.390 128.142 -2.752 17919 16278 1 40 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.917 0.128 17919 16279 1 40 . 1 1 45 45 PHE C C 45 174.470 174.470 174.705 -0.235 17919 16280 1 40 . 1 1 45 45 PHE CA C 45 57.020 57.020 55.596 1.425 17919 16281 1 40 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.573 1.187 17919 16282 1 40 . 1 1 45 45 PHE H H 45 8.830 8.830 9.097 -0.267 17919 16283 1 40 . 1 1 46 46 ALA N N 46 132.200 132.200 131.811 0.389 17919 16284 1 40 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.660 0.030 17919 16285 1 40 . 1 1 46 46 ALA C C 46 177.290 177.290 177.218 0.072 17919 16286 1 40 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.606 -0.066 17919 16287 1 40 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.597 -0.027 17919 16288 1 40 . 1 1 46 46 ALA H H 46 8.810 8.810 8.780 0.030 17919 16289 1 40 . 1 1 47 47 GLY N N 47 102.340 102.340 105.162 -2.822 17919 16290 1 40 . 1 1 47 47 GLY C C 47 173.810 173.810 174.142 -0.332 17919 16291 1 40 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.337 0.014 17919 16292 1 40 . 1 1 47 47 GLY H H 47 8.130 8.130 8.539 -0.409 17919 16293 1 40 . 1 1 48 48 LYS N N 48 121.570 121.570 121.292 0.278 17919 16294 1 40 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.593 0.029 17919 16295 1 40 . 1 1 48 48 LYS C C 48 174.700 174.700 175.033 -0.333 17919 16296 1 40 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.026 -0.476 17919 16297 1 40 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.971 -0.442 17919 16298 1 40 . 1 1 48 48 LYS H H 48 7.980 7.980 7.537 0.443 17919 16299 1 40 . 1 1 49 49 GLN N N 49 122.410 122.410 124.449 -2.039 17919 16300 1 40 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.211 0.349 17919 16301 1 40 . 1 1 49 49 GLN C C 49 175.670 175.670 175.532 0.138 17919 16302 1 40 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.672 -0.932 17919 16303 1 40 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.460 -0.460 17919 16304 1 40 . 1 1 49 49 GLN H H 49 8.600 8.600 8.660 -0.060 17919 16305 1 40 . 1 1 50 50 LEU N N 50 125.520 125.520 127.188 -1.668 17919 16306 1 40 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.215 -0.125 17919 16307 1 40 . 1 1 50 50 LEU C C 50 176.660 176.660 176.001 0.659 17919 16308 1 40 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.425 -0.185 17919 16309 1 40 . 1 1 50 50 LEU CB C 50 41.570 41.570 43.064 -1.494 17919 16310 1 40 . 1 1 50 50 LEU H H 50 8.530 8.530 8.320 0.210 17919 16311 1 40 . 1 1 51 51 GLU N N 51 122.940 122.940 120.401 2.539 17919 16312 1 40 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.559 -0.071 17919 16313 1 40 . 1 1 51 51 GLU C C 51 175.870 175.870 176.087 -0.217 17919 16314 1 40 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.068 0.892 17919 16315 1 40 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.938 -0.368 17919 16316 1 40 . 1 1 51 51 GLU H H 51 8.400 8.400 8.465 -0.065 17919 16317 1 40 . 1 1 52 52 ASP N N 52 120.030 120.030 125.161 -5.131 17919 16318 1 40 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.481 -0.122 17919 16319 1 40 . 1 1 52 52 ASP C C 52 177.330 177.330 177.607 -0.277 17919 16320 1 40 . 1 1 52 52 ASP CA C 52 56.960 56.960 56.771 0.189 17919 16321 1 40 . 1 1 52 52 ASP CB C 52 40.850 40.850 41.062 -0.212 17919 16322 1 40 . 1 1 52 52 ASP H H 52 8.160 8.160 8.836 -0.676 17919 16323 1 40 . 1 1 53 53 GLY N N 53 106.660 106.660 105.290 1.370 17919 16324 1 40 . 1 1 53 53 GLY C C 53 174.870 174.870 174.059 0.811 17919 16325 1 40 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.594 0.576 17919 16326 1 40 . 1 1 53 53 GLY H H 53 9.390 9.390 8.329 1.061 17919 16327 1 40 . 1 1 54 54 ARG N N 54 119.050 119.050 120.807 -1.757 17919 16328 1 40 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.750 -0.055 17919 16329 1 40 . 1 1 54 54 ARG C C 54 175.350 175.350 174.989 0.361 17919 16330 1 40 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.115 0.275 17919 16331 1 40 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.556 -0.906 17919 16332 1 40 . 1 1 54 54 ARG H H 54 7.460 7.460 7.745 -0.285 17919 16333 1 40 . 1 1 55 55 THR N N 55 108.400 108.400 112.808 -4.408 17919 16334 1 40 . 1 1 55 55 THR HA H 55 5.240 5.240 4.994 0.246 17919 16335 1 40 . 1 1 55 55 THR C C 55 176.560 176.560 176.355 0.205 17919 16336 1 40 . 1 1 55 55 THR CA C 55 59.690 59.690 60.846 -1.156 17919 16337 1 40 . 1 1 55 55 THR CB C 55 72.260 72.260 70.824 1.436 17919 16338 1 40 . 1 1 55 55 THR H H 55 8.730 8.730 8.636 0.094 17919 16339 1 40 . 1 1 56 56 LEU N N 56 117.920 117.920 123.189 -5.269 17919 16340 1 40 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.998 0.062 17919 16341 1 40 . 1 1 56 56 LEU C C 56 180.810 180.810 178.656 2.154 17919 16342 1 40 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.445 0.265 17919 16343 1 40 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.113 -0.743 17919 16344 1 40 . 1 1 56 56 LEU H H 56 8.140 8.140 8.754 -0.614 17919 16345 1 40 . 1 1 57 57 SER N N 57 113.330 113.330 114.705 -1.375 17919 16346 1 40 . 1 1 57 57 SER HA H 57 4.370 4.370 4.201 0.169 17919 16347 1 40 . 1 1 57 57 SER C C 57 178.310 178.310 176.457 1.853 17919 16348 1 40 . 1 1 57 57 SER CA C 57 61.080 61.080 62.089 -1.009 17919 16349 1 40 . 1 1 57 57 SER CB C 57 62.530 62.530 62.772 -0.242 17919 16350 1 40 . 1 1 57 57 SER H H 57 8.470 8.470 8.332 0.138 17919 16351 1 40 . 1 1 58 58 ASP N N 58 124.190 124.190 121.314 2.876 17919 16352 1 40 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.283 0.013 17919 16353 1 40 . 1 1 58 58 ASP C C 58 177.400 177.400 176.154 1.246 17919 16354 1 40 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.581 0.599 17919 16355 1 40 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.129 -0.029 17919 16356 1 40 . 1 1 58 58 ASP H H 58 7.930 7.930 7.942 -0.012 17919 16357 1 40 . 1 1 59 59 TYR N N 59 115.510 115.510 113.760 1.750 17919 16358 1 40 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.682 -0.012 17919 16359 1 40 . 1 1 59 59 TYR C C 59 174.700 174.700 174.977 -0.277 17919 16360 1 40 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.158 1.092 17919 16361 1 40 . 1 1 59 59 TYR CB C 59 40.070 40.070 39.490 0.579 17919 16362 1 40 . 1 1 59 59 TYR H H 59 7.250 7.250 7.067 0.183 17919 16363 1 40 . 1 1 60 60 ASN N N 60 115.900 115.900 118.207 -2.307 17919 16364 1 40 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.358 -0.003 17919 16365 1 40 . 1 1 60 60 ASN C C 60 174.340 174.340 174.349 -0.009 17919 16366 1 40 . 1 1 60 60 ASN CA C 60 54.120 54.120 53.981 0.139 17919 16367 1 40 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.233 0.176 17919 16368 1 40 . 1 1 60 60 ASN H H 60 8.150 8.150 7.983 0.167 17919 16369 1 40 . 1 1 61 61 ILE N N 61 118.600 118.600 119.403 -0.803 17919 16370 1 40 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.792 -0.399 17919 16371 1 40 . 1 1 61 61 ILE C C 61 174.610 174.610 175.106 -0.496 17919 16372 1 40 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.996 0.424 17919 16373 1 40 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.673 -0.933 17919 16374 1 40 . 1 1 61 61 ILE H H 61 7.250 7.250 8.187 -0.937 17919 16375 1 40 . 1 1 62 62 GLN N N 62 124.740 124.740 124.414 0.326 17919 16376 1 40 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.801 -0.295 17919 16377 1 40 . 1 1 62 62 GLN C C 62 175.970 175.970 175.776 0.194 17919 16378 1 40 . 1 1 62 62 GLN CA C 62 53.660 53.660 52.527 1.133 17919 16379 1 40 . 1 1 62 62 GLN CB C 62 31.650 31.650 32.325 -0.675 17919 16380 1 40 . 1 1 62 62 GLN H H 62 7.610 7.610 8.426 -0.816 17919 16381 1 40 . 1 1 63 63 LYS N N 63 120.300 120.300 120.687 -0.387 17919 16382 1 40 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.160 -0.159 17919 16383 1 40 . 1 1 63 63 LYS C C 63 175.810 175.810 176.689 -0.879 17919 16384 1 40 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.055 -0.265 17919 16385 1 40 . 1 1 63 63 LYS CB C 63 32.650 32.650 30.407 2.244 17919 16386 1 40 . 1 1 63 63 LYS H H 63 8.490 8.490 8.627 -0.137 17919 16387 1 40 . 1 1 64 64 GLU N N 64 113.950 113.950 116.987 -3.037 17919 16388 1 40 . 1 1 64 64 GLU HA H 64 3.465 3.465 4.193 -0.728 17919 16389 1 40 . 1 1 64 64 GLU C C 64 175.250 175.250 175.943 -0.693 17919 16390 1 40 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.895 -0.005 17919 16391 1 40 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.439 -2.539 17919 16392 1 40 . 1 1 64 64 GLU H H 64 9.280 9.280 9.043 0.237 17919 16393 1 40 . 1 1 65 65 SER N N 65 114.730 114.730 117.372 -2.642 17919 16394 1 40 . 1 1 65 65 SER HA H 65 4.640 4.640 4.546 0.094 17919 16395 1 40 . 1 1 65 65 SER C C 65 172.160 172.160 174.075 -1.915 17919 16396 1 40 . 1 1 65 65 SER CA C 65 60.890 60.890 60.370 0.520 17919 16397 1 40 . 1 1 65 65 SER CB C 65 64.910 64.910 63.693 1.217 17919 16398 1 40 . 1 1 65 65 SER H H 65 7.670 7.670 7.961 -0.291 17919 16399 1 40 . 1 1 66 66 THR N N 66 117.110 117.110 122.109 -4.999 17919 16400 1 40 . 1 1 66 66 THR HA H 66 5.270 5.270 4.867 0.403 17919 16401 1 40 . 1 1 66 66 THR C C 66 173.950 173.950 173.632 0.318 17919 16402 1 40 . 1 1 66 66 THR CA C 66 62.340 62.340 62.110 0.230 17919 16403 1 40 . 1 1 66 66 THR CB C 66 70.080 70.080 69.784 0.296 17919 16404 1 40 . 1 1 66 66 THR H H 66 8.730 8.730 8.555 0.175 17919 16405 1 40 . 1 1 67 67 LEU N N 67 127.110 127.110 128.361 -1.251 17919 16406 1 40 . 1 1 67 67 LEU HA H 67 5.060 5.060 5.333 -0.273 17919 16407 1 40 . 1 1 67 67 LEU C C 67 175.770 175.770 175.474 0.296 17919 16408 1 40 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.546 0.354 17919 16409 1 40 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.287 -0.027 17919 16410 1 40 . 1 1 67 67 LEU H H 67 9.410 9.410 9.275 0.135 17919 16411 1 40 . 1 1 68 68 HIS N N 68 118.380 118.380 118.983 -0.603 17919 16412 1 40 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.368 -0.128 17919 16413 1 40 . 1 1 68 68 HIS C C 68 173.150 173.150 172.901 0.249 17919 16414 1 40 . 1 1 68 68 HIS CA C 68 55.000 55.000 53.907 1.093 17919 16415 1 40 . 1 1 68 68 HIS CB C 68 30.530 30.530 34.195 -3.665 17919 16416 1 40 . 1 1 68 68 HIS H H 68 9.230 9.230 9.188 0.042 17919 16417 1 40 . 1 1 69 69 LEU N N 69 124.460 124.460 123.335 1.125 17919 16418 1 40 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.991 0.199 17919 16419 1 40 . 1 1 69 69 LEU C C 69 175.270 175.270 174.872 0.398 17919 16420 1 40 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.865 -0.975 17919 16421 1 40 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.317 0.063 17919 16422 1 40 . 1 1 69 69 LEU H H 69 8.340 8.340 8.138 0.202 17919 16423 1 40 . 1 1 70 70 VAL N N 70 126.940 126.940 126.693 0.247 17919 16424 1 40 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.400 -0.050 17919 16425 1 40 . 1 1 70 70 VAL C C 70 174.000 174.000 174.738 -0.738 17919 16426 1 40 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.630 0.170 17919 16427 1 40 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.315 -0.405 17919 16428 1 40 . 1 1 70 70 VAL H H 70 9.200 9.200 7.906 1.294 17919 16429 1 40 . 1 1 71 71 LEU N N 71 123.130 123.130 124.665 -1.535 17919 16430 1 40 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.845 0.215 17919 16431 1 40 . 1 1 71 71 LEU C C 71 177.830 177.830 177.162 0.668 17919 16432 1 40 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.432 0.508 17919 16433 1 40 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.459 -0.609 17919 16434 1 40 . 1 1 71 71 LEU H H 71 8.120 8.120 8.459 -0.339 17919 16435 1 40 . 1 1 72 72 ARG N N 72 123.490 123.490 122.023 1.467 17919 16436 1 40 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.580 -0.279 17919 16437 1 40 . 1 1 72 72 ARG C C 72 175.350 175.350 175.116 0.234 17919 16438 1 40 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.191 -0.580 17919 16439 1 40 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.845 0.506 17919 16440 1 40 . 1 1 72 72 ARG H H 72 8.580 8.580 8.052 0.528 17919 16441 1 41 . 1 1 2 2 GLN N N 2 123.220 123.220 123.355 -0.135 17919 16442 1 41 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.069 0.180 17919 16443 1 41 . 1 1 2 2 GLN C C 2 175.920 175.920 175.298 0.622 17919 16444 1 41 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.752 0.328 17919 16445 1 41 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.606 0.154 17919 16446 1 41 . 1 1 2 2 GLN H H 2 8.900 8.900 8.252 0.648 17919 16447 1 41 . 1 1 3 3 ILE N N 3 115.340 115.340 116.584 -1.244 17919 16448 1 41 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.506 -0.293 17919 16449 1 41 . 1 1 3 3 ILE C C 3 172.450 172.450 174.186 -1.736 17919 16450 1 41 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.142 0.428 17919 16451 1 41 . 1 1 3 3 ILE CB C 3 42.210 42.210 40.596 1.614 17919 16452 1 41 . 1 1 3 3 ILE H H 3 8.320 8.320 7.799 0.521 17919 16453 1 41 . 1 1 4 4 PHE N N 4 118.110 118.110 121.304 -3.194 17919 16454 1 41 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.310 0.320 17919 16455 1 41 . 1 1 4 4 PHE C C 4 175.320 175.320 175.200 0.120 17919 16456 1 41 . 1 1 4 4 PHE CA C 4 55.210 55.210 54.732 0.478 17919 16457 1 41 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.015 0.465 17919 16458 1 41 . 1 1 4 4 PHE H H 4 8.610 8.610 8.090 0.520 17919 16459 1 41 . 1 1 5 5 VAL N N 5 121.000 121.000 122.964 -1.964 17919 16460 1 41 . 1 1 5 5 VAL HA H 5 4.725 4.725 5.014 -0.289 17919 16461 1 41 . 1 1 5 5 VAL C C 5 174.870 174.870 175.829 -0.959 17919 16462 1 41 . 1 1 5 5 VAL CA C 5 60.620 60.620 60.947 -0.327 17919 16463 1 41 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.139 1.091 17919 16464 1 41 . 1 1 5 5 VAL H H 5 9.300 9.300 9.273 0.027 17919 16465 1 41 . 1 1 6 6 LYS N N 6 127.520 127.520 128.685 -1.165 17919 16466 1 41 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.272 0.095 17919 16467 1 41 . 1 1 6 6 LYS C C 6 177.140 177.140 177.226 -0.086 17919 16468 1 41 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.523 -0.003 17919 16469 1 41 . 1 1 6 6 LYS CB C 6 35.050 35.050 33.958 1.092 17919 16470 1 41 . 1 1 6 6 LYS H H 6 8.820 8.820 8.875 -0.055 17919 16471 1 41 . 1 1 7 7 THR N N 7 115.400 115.400 113.758 1.642 17919 16472 1 41 . 1 1 7 7 THR HA H 7 4.970 4.970 4.654 0.317 17919 16473 1 41 . 1 1 7 7 THR C C 7 176.910 176.910 177.348 -0.438 17919 16474 1 41 . 1 1 7 7 THR CA C 7 60.470 60.470 60.822 -0.352 17919 16475 1 41 . 1 1 7 7 THR CB C 7 70.630 70.630 70.567 0.063 17919 16476 1 41 . 1 1 7 7 THR H H 7 8.730 8.730 8.114 0.616 17919 16477 1 41 . 1 1 8 8 LEU N N 8 121.330 121.330 118.730 2.600 17919 16478 1 41 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.320 -0.010 17919 16479 1 41 . 1 1 8 8 LEU C C 8 178.800 178.800 177.034 1.766 17919 16480 1 41 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.497 0.083 17919 16481 1 41 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.520 0.450 17919 16482 1 41 . 1 1 8 8 LEU H H 8 9.100 9.100 8.191 0.909 17919 16483 1 41 . 1 1 9 9 THR N N 9 105.590 105.590 107.634 -2.044 17919 16484 1 41 . 1 1 9 9 THR HA H 9 4.428 4.428 4.462 -0.034 17919 16485 1 41 . 1 1 9 9 THR C C 9 175.520 175.520 175.592 -0.072 17919 16486 1 41 . 1 1 9 9 THR CA C 9 61.400 61.400 61.635 -0.235 17919 16487 1 41 . 1 1 9 9 THR CB C 9 69.140 69.140 70.016 -0.876 17919 16488 1 41 . 1 1 9 9 THR H H 9 7.630 7.630 7.406 0.224 17919 16489 1 41 . 1 1 10 10 GLY N N 10 108.890 108.890 111.057 -2.167 17919 16490 1 41 . 1 1 10 10 GLY C C 10 174.070 174.070 173.876 0.194 17919 16491 1 41 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.990 0.470 17919 16492 1 41 . 1 1 10 10 GLY H H 10 7.810 7.810 7.843 -0.033 17919 16493 1 41 . 1 1 11 11 LYS N N 11 121.600 121.600 120.343 1.257 17919 16494 1 41 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.448 -0.087 17919 16495 1 41 . 1 1 11 11 LYS C C 11 175.940 175.940 175.403 0.537 17919 16496 1 41 . 1 1 11 11 LYS CA C 11 56.280 56.280 55.782 0.498 17919 16497 1 41 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.032 0.168 17919 16498 1 41 . 1 1 11 11 LYS H H 11 7.280 7.280 7.766 -0.486 17919 16499 1 41 . 1 1 12 12 THR N N 12 120.440 120.440 118.343 2.097 17919 16500 1 41 . 1 1 12 12 THR HA H 12 5.046 5.046 4.419 0.627 17919 16501 1 41 . 1 1 12 12 THR C C 12 174.320 174.320 174.107 0.213 17919 16502 1 41 . 1 1 12 12 THR CA C 12 62.390 62.390 62.074 0.316 17919 16503 1 41 . 1 1 12 12 THR CB C 12 69.910 69.910 69.254 0.656 17919 16504 1 41 . 1 1 12 12 THR H H 12 8.650 8.650 8.231 0.419 17919 16505 1 41 . 1 1 13 13 ILE N N 13 127.110 127.110 128.854 -1.744 17919 16506 1 41 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.401 0.143 17919 16507 1 41 . 1 1 13 13 ILE C C 13 175.220 175.220 174.843 0.377 17919 16508 1 41 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.914 -0.934 17919 16509 1 41 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.142 0.808 17919 16510 1 41 . 1 1 13 13 ILE H H 13 9.450 9.450 8.682 0.768 17919 16511 1 41 . 1 1 14 14 THR N N 14 121.520 121.520 122.081 -0.561 17919 16512 1 41 . 1 1 14 14 THR HA H 14 4.964 4.964 5.400 -0.436 17919 16513 1 41 . 1 1 14 14 THR C C 14 173.790 173.790 173.961 -0.171 17919 16514 1 41 . 1 1 14 14 THR CA C 14 61.940 61.940 61.337 0.604 17919 16515 1 41 . 1 1 14 14 THR CB C 14 69.650 69.650 70.543 -0.893 17919 16516 1 41 . 1 1 14 14 THR H H 14 8.710 8.710 8.407 0.303 17919 16517 1 41 . 1 1 15 15 LEU N N 15 124.800 124.800 124.847 -0.047 17919 16518 1 41 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.835 -0.055 17919 16519 1 41 . 1 1 15 15 LEU C C 15 174.670 174.670 175.005 -0.335 17919 16520 1 41 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.681 -0.851 17919 16521 1 41 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.524 1.546 17919 16522 1 41 . 1 1 15 15 LEU H H 15 8.710 8.710 8.415 0.295 17919 16523 1 41 . 1 1 16 16 GLU N N 16 122.160 122.160 124.313 -2.153 17919 16524 1 41 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.517 0.400 17919 16525 1 41 . 1 1 16 16 GLU C C 16 175.860 175.860 174.938 0.922 17919 16526 1 41 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.490 -0.670 17919 16527 1 41 . 1 1 16 16 GLU CB C 16 29.450 29.450 29.355 0.095 17919 16528 1 41 . 1 1 16 16 GLU H H 16 8.140 8.140 8.674 -0.534 17919 16529 1 41 . 1 1 17 17 VAL N N 17 117.210 117.210 120.419 -3.209 17919 16530 1 41 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.429 0.285 17919 16531 1 41 . 1 1 17 17 VAL C C 17 174.160 174.160 175.004 -0.844 17919 16532 1 41 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.077 -0.647 17919 16533 1 41 . 1 1 17 17 VAL CB C 17 36.400 36.400 34.302 2.098 17919 16534 1 41 . 1 1 17 17 VAL H H 17 8.900 8.900 8.118 0.782 17919 16535 1 41 . 1 1 18 18 GLU N N 18 118.990 118.990 118.848 0.142 17919 16536 1 41 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.930 0.149 17919 16537 1 41 . 1 1 18 18 GLU C C 18 176.160 176.160 175.207 0.953 17919 16538 1 41 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.026 -0.306 17919 16539 1 41 . 1 1 18 18 GLU CB C 18 30.310 30.310 31.186 -0.875 17919 16540 1 41 . 1 1 18 18 GLU H H 18 8.640 8.640 9.237 -0.597 17919 16541 1 41 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.361 -0.220 17919 16542 1 41 . 1 1 19 19 PRO C C 19 175.310 175.310 177.440 -2.130 17919 16543 1 41 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.112 0.358 17919 16544 1 41 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.092 -0.142 17919 16545 1 41 . 1 1 20 20 SER N N 20 103.400 103.400 111.175 -7.775 17919 16546 1 41 . 1 1 20 20 SER HA H 20 4.370 4.370 4.344 0.026 17919 16547 1 41 . 1 1 20 20 SER C C 20 174.660 174.660 174.519 0.141 17919 16548 1 41 . 1 1 20 20 SER CA C 20 57.400 57.400 59.403 -2.003 17919 16549 1 41 . 1 1 20 20 SER CB C 20 63.370 63.370 62.611 0.759 17919 16550 1 41 . 1 1 20 20 SER H H 20 7.040 7.040 8.022 -0.982 17919 16551 1 41 . 1 1 21 21 ASP N N 21 123.480 123.480 123.987 -0.507 17919 16552 1 41 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.494 0.201 17919 16553 1 41 . 1 1 21 21 ASP C C 21 176.360 176.360 175.496 0.864 17919 16554 1 41 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.773 -0.073 17919 16555 1 41 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.169 -0.369 17919 16556 1 41 . 1 1 21 21 ASP H H 21 8.030 8.030 7.730 0.300 17919 16557 1 41 . 1 1 22 22 THR N N 22 108.800 108.800 114.992 -6.192 17919 16558 1 41 . 1 1 22 22 THR HA H 22 4.920 4.920 4.684 0.236 17919 16559 1 41 . 1 1 22 22 THR C C 22 176.750 176.750 175.528 1.222 17919 16560 1 41 . 1 1 22 22 THR CA C 22 59.690 59.690 61.616 -1.926 17919 16561 1 41 . 1 1 22 22 THR CB C 22 71.200 71.200 70.052 1.148 17919 16562 1 41 . 1 1 22 22 THR H H 22 7.900 7.900 8.477 -0.577 17919 16563 1 41 . 1 1 23 23 ILE N N 23 121.190 121.190 123.796 -2.606 17919 16564 1 41 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.698 -0.041 17919 16565 1 41 . 1 1 23 23 ILE C C 23 179.040 179.040 177.465 1.575 17919 16566 1 41 . 1 1 23 23 ILE CA C 23 62.260 62.260 65.226 -2.966 17919 16567 1 41 . 1 1 23 23 ILE CB C 23 34.350 34.350 37.595 -3.245 17919 16568 1 41 . 1 1 23 23 ILE H H 23 8.560 8.560 9.000 -0.440 17919 16569 1 41 . 1 1 24 24 GLU N N 24 120.830 120.830 120.579 0.251 17919 16570 1 41 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.793 0.124 17919 16571 1 41 . 1 1 24 24 GLU C C 24 178.640 178.640 178.268 0.372 17919 16572 1 41 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.168 0.052 17919 16573 1 41 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.358 -1.078 17919 16574 1 41 . 1 1 24 24 GLU H H 24 9.760 9.760 8.018 1.742 17919 16575 1 41 . 1 1 25 25 ASN N N 25 120.570 120.570 117.348 3.222 17919 16576 1 41 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.477 0.048 17919 16577 1 41 . 1 1 25 25 ASN C C 25 178.380 178.380 178.013 0.367 17919 16578 1 41 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.049 0.011 17919 16579 1 41 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.632 -0.182 17919 16580 1 41 . 1 1 25 25 ASN H H 25 7.920 7.920 7.576 0.344 17919 16581 1 41 . 1 1 26 26 VAL N N 26 121.710 121.710 120.622 1.088 17919 16582 1 41 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.672 -0.275 17919 16583 1 41 . 1 1 26 26 VAL C C 26 177.950 177.950 177.976 -0.026 17919 16584 1 41 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.230 1.430 17919 16585 1 41 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.680 -0.840 17919 16586 1 41 . 1 1 26 26 VAL H H 26 8.070 8.070 8.178 -0.108 17919 16587 1 41 . 1 1 27 27 LYS N N 27 118.860 118.860 119.826 -0.966 17919 16588 1 41 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.273 0.307 17919 16589 1 41 . 1 1 27 27 LYS C C 27 180.550 180.550 178.860 1.690 17919 16590 1 41 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.245 0.005 17919 16591 1 41 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.364 1.366 17919 16592 1 41 . 1 1 27 27 LYS H H 27 8.560 8.560 8.343 0.217 17919 16593 1 41 . 1 1 28 28 ALA N N 28 123.440 123.440 123.362 0.078 17919 16594 1 41 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.009 0.151 17919 16595 1 41 . 1 1 28 28 ALA C C 28 180.300 180.300 179.365 0.935 17919 16596 1 41 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.322 0.048 17919 16597 1 41 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.167 -0.457 17919 16598 1 41 . 1 1 28 28 ALA H H 28 8.060 8.060 8.002 0.058 17919 16599 1 41 . 1 1 29 29 LYS N N 29 119.940 119.940 119.095 0.845 17919 16600 1 41 . 1 1 29 29 LYS HA H 29 4.207 4.207 3.916 0.291 17919 16601 1 41 . 1 1 29 29 LYS C C 29 180.320 180.320 179.472 0.848 17919 16602 1 41 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.530 0.120 17919 16603 1 41 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.118 1.172 17919 16604 1 41 . 1 1 29 29 LYS H H 29 7.850 7.850 7.464 0.386 17919 16605 1 41 . 1 1 30 30 ILE N N 30 121.080 121.080 119.243 1.837 17919 16606 1 41 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.637 -0.130 17919 16607 1 41 . 1 1 30 30 ILE C C 30 178.310 178.310 177.482 0.828 17919 16608 1 41 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.074 1.076 17919 16609 1 41 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.277 -0.477 17919 16610 1 41 . 1 1 30 30 ILE H H 30 8.280 8.280 7.923 0.357 17919 16611 1 41 . 1 1 31 31 GLN N N 31 123.490 123.490 120.942 2.548 17919 16612 1 41 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.031 -0.202 17919 16613 1 41 . 1 1 31 31 GLN C C 31 178.890 178.890 178.449 0.441 17919 16614 1 41 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.222 0.778 17919 16615 1 41 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.595 -0.875 17919 16616 1 41 . 1 1 31 31 GLN H H 31 8.580 8.580 8.436 0.144 17919 16617 1 41 . 1 1 32 32 ASP N N 32 119.360 119.360 119.234 0.126 17919 16618 1 41 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.423 -0.069 17919 16619 1 41 . 1 1 32 32 ASP C C 32 177.250 177.250 177.430 -0.180 17919 16620 1 41 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.790 0.400 17919 16621 1 41 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.851 -0.271 17919 16622 1 41 . 1 1 32 32 ASP H H 32 8.010 8.010 8.309 -0.299 17919 16623 1 41 . 1 1 33 33 LYS N N 33 115.130 115.130 119.026 -3.896 17919 16624 1 41 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.251 0.086 17919 16625 1 41 . 1 1 33 33 LYS C C 33 177.870 177.870 177.927 -0.057 17919 16626 1 41 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.788 0.262 17919 16627 1 41 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.440 0.730 17919 16628 1 41 . 1 1 33 33 LYS H H 33 7.430 7.430 7.329 0.101 17919 16629 1 41 . 1 1 34 34 GLU N N 34 113.870 113.870 114.740 -0.870 17919 16630 1 41 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.491 0.134 17919 16631 1 41 . 1 1 34 34 GLU C C 34 177.840 177.840 176.869 0.971 17919 16632 1 41 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.152 -0.982 17919 16633 1 41 . 1 1 34 34 GLU CB C 34 32.660 32.660 32.561 0.099 17919 16634 1 41 . 1 1 34 34 GLU H H 34 8.740 8.740 8.242 0.498 17919 16635 1 41 . 1 1 35 35 GLY N N 35 108.650 108.650 109.912 -1.262 17919 16636 1 41 . 1 1 35 35 GLY C C 35 173.960 173.960 174.326 -0.366 17919 16637 1 41 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.965 0.115 17919 16638 1 41 . 1 1 35 35 GLY H H 35 8.530 8.530 8.414 0.116 17919 16639 1 41 . 1 1 36 36 ILE N N 36 119.880 119.880 119.644 0.236 17919 16640 1 41 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.277 0.168 17919 16641 1 41 . 1 1 36 36 ILE C C 36 173.590 173.590 174.054 -0.464 17919 16642 1 41 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.839 -0.089 17919 16643 1 41 . 1 1 36 36 ILE CB C 36 40.580 40.580 37.576 3.004 17919 16644 1 41 . 1 1 36 36 ILE H H 36 6.150 6.150 7.442 -1.292 17919 16645 1 41 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.499 0.135 17919 16646 1 41 . 1 1 37 37 PRO C C 37 176.940 176.940 176.039 0.901 17919 16647 1 41 . 1 1 37 37 PRO CA C 37 61.660 61.660 62.335 -0.675 17919 16648 1 41 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.377 0.473 17919 16649 1 41 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.503 -0.386 17919 16650 1 41 . 1 1 38 38 PRO C C 38 178.320 178.320 177.500 0.820 17919 16651 1 41 . 1 1 38 38 PRO CA C 38 66.260 66.260 64.609 1.651 17919 16652 1 41 . 1 1 38 38 PRO CB C 38 32.890 32.890 32.217 0.673 17919 16653 1 41 . 1 1 39 39 ASP N N 39 113.380 113.380 117.672 -4.292 17919 16654 1 41 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.367 0.063 17919 16655 1 41 . 1 1 39 39 ASP C C 39 177.090 177.090 177.816 -0.726 17919 16656 1 41 . 1 1 39 39 ASP CA C 39 55.640 55.640 57.160 -1.520 17919 16657 1 41 . 1 1 39 39 ASP CB C 39 39.540 39.540 39.573 -0.033 17919 16658 1 41 . 1 1 39 39 ASP H H 39 8.550 8.550 8.991 -0.441 17919 16659 1 41 . 1 1 40 40 GLN N N 40 116.780 116.780 119.441 -2.661 17919 16660 1 41 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.318 0.146 17919 16661 1 41 . 1 1 40 40 GLN C C 40 175.380 175.380 175.851 -0.471 17919 16662 1 41 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.776 -1.136 17919 16663 1 41 . 1 1 40 40 GLN CB C 40 30.140 30.140 30.205 -0.065 17919 16664 1 41 . 1 1 40 40 GLN H H 40 7.820 7.820 7.444 0.376 17919 16665 1 41 . 1 1 41 41 GLN N N 41 117.720 117.720 119.235 -1.515 17919 16666 1 41 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.365 -0.121 17919 16667 1 41 . 1 1 41 41 GLN C C 41 176.300 176.300 175.241 1.059 17919 16668 1 41 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.691 -0.222 17919 16669 1 41 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.306 2.344 17919 16670 1 41 . 1 1 41 41 GLN H H 41 7.480 7.480 7.457 0.023 17919 16671 1 41 . 1 1 42 42 ARG N N 42 122.680 122.680 123.381 -0.701 17919 16672 1 41 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.614 -0.114 17919 16673 1 41 . 1 1 42 42 ARG C C 42 174.050 174.050 174.440 -0.390 17919 16674 1 41 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.486 0.564 17919 16675 1 41 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.142 -1.393 17919 16676 1 41 . 1 1 42 42 ARG H H 42 8.530 8.530 8.064 0.466 17919 16677 1 41 . 1 1 43 43 LEU N N 43 124.040 124.040 125.687 -1.647 17919 16678 1 41 . 1 1 43 43 LEU C C 43 175.290 175.290 175.495 -0.205 17919 16679 1 41 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.876 -0.896 17919 16680 1 41 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.858 0.932 17919 16681 1 41 . 1 1 43 43 LEU H H 43 8.820 8.820 8.708 0.112 17919 16682 1 41 . 1 1 44 44 ILE N N 44 121.920 121.920 122.612 -0.692 17919 16683 1 41 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.708 0.284 17919 16684 1 41 . 1 1 44 44 ILE C C 44 176.060 176.060 174.732 1.328 17919 16685 1 41 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.914 -1.935 17919 16686 1 41 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.260 0.160 17919 16687 1 41 . 1 1 44 44 ILE H H 44 9.030 9.030 9.173 -0.143 17919 16688 1 41 . 1 1 45 45 PHE N N 45 125.390 125.390 129.310 -3.920 17919 16689 1 41 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.949 0.096 17919 16690 1 41 . 1 1 45 45 PHE C C 45 174.470 174.470 174.749 -0.279 17919 16691 1 41 . 1 1 45 45 PHE CA C 45 57.020 57.020 57.636 -0.616 17919 16692 1 41 . 1 1 45 45 PHE CB C 45 43.760 43.760 41.522 2.238 17919 16693 1 41 . 1 1 45 45 PHE H H 45 8.830 8.830 8.671 0.159 17919 16694 1 41 . 1 1 46 46 ALA N N 46 132.200 132.200 122.323 9.877 17919 16695 1 41 . 1 1 46 46 ALA HA H 46 3.690 3.690 4.278 -0.588 17919 16696 1 41 . 1 1 46 46 ALA C C 46 177.290 177.290 178.484 -1.194 17919 16697 1 41 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.136 0.404 17919 16698 1 41 . 1 1 46 46 ALA CB C 46 16.570 16.570 18.279 -1.709 17919 16699 1 41 . 1 1 46 46 ALA H H 46 8.810 8.810 7.953 0.857 17919 16700 1 41 . 1 1 47 47 GLY N N 47 102.340 102.340 105.906 -3.566 17919 16701 1 41 . 1 1 47 47 GLY C C 47 173.810 173.810 174.300 -0.490 17919 16702 1 41 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.069 0.281 17919 16703 1 41 . 1 1 47 47 GLY H H 47 8.130 8.130 8.187 -0.057 17919 16704 1 41 . 1 1 48 48 LYS N N 48 121.570 121.570 119.980 1.590 17919 16705 1 41 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.549 0.073 17919 16706 1 41 . 1 1 48 48 LYS C C 48 174.700 174.700 175.358 -0.658 17919 16707 1 41 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.215 -0.665 17919 16708 1 41 . 1 1 48 48 LYS CB C 48 34.530 34.530 35.352 -0.822 17919 16709 1 41 . 1 1 48 48 LYS H H 48 7.980 7.980 7.565 0.415 17919 16710 1 41 . 1 1 49 49 GLN N N 49 122.410 122.410 122.110 0.300 17919 16711 1 41 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.514 0.046 17919 16712 1 41 . 1 1 49 49 GLN C C 49 175.670 175.670 175.463 0.207 17919 16713 1 41 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.681 -0.941 17919 16714 1 41 . 1 1 49 49 GLN CB C 49 29.000 29.000 28.898 0.103 17919 16715 1 41 . 1 1 49 49 GLN H H 49 8.600 8.600 8.537 0.063 17919 16716 1 41 . 1 1 50 50 LEU N N 50 125.520 125.520 127.492 -1.972 17919 16717 1 41 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.216 -0.126 17919 16718 1 41 . 1 1 50 50 LEU C C 50 176.660 176.660 176.010 0.650 17919 16719 1 41 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.448 -0.208 17919 16720 1 41 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.355 0.215 17919 16721 1 41 . 1 1 50 50 LEU H H 50 8.530 8.530 8.802 -0.272 17919 16722 1 41 . 1 1 51 51 GLU N N 51 122.940 122.940 123.766 -0.826 17919 16723 1 41 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.693 -0.205 17919 16724 1 41 . 1 1 51 51 GLU C C 51 175.870 175.870 177.084 -1.214 17919 16725 1 41 . 1 1 51 51 GLU CA C 51 55.960 55.960 54.551 1.409 17919 16726 1 41 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.470 -0.900 17919 16727 1 41 . 1 1 51 51 GLU H H 51 8.400 8.400 8.080 0.320 17919 16728 1 41 . 1 1 52 52 ASP N N 52 120.030 120.030 120.974 -0.944 17919 16729 1 41 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.566 -0.207 17919 16730 1 41 . 1 1 52 52 ASP C C 52 177.330 177.330 177.286 0.044 17919 16731 1 41 . 1 1 52 52 ASP CA C 52 56.960 56.960 56.438 0.522 17919 16732 1 41 . 1 1 52 52 ASP CB C 52 40.850 40.850 41.011 -0.161 17919 16733 1 41 . 1 1 52 52 ASP H H 52 8.160 8.160 8.793 -0.633 17919 16734 1 41 . 1 1 53 53 GLY N N 53 106.660 106.660 105.850 0.810 17919 16735 1 41 . 1 1 53 53 GLY C C 53 174.870 174.870 173.942 0.928 17919 16736 1 41 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.648 0.522 17919 16737 1 41 . 1 1 53 53 GLY H H 53 9.390 9.390 8.316 1.074 17919 16738 1 41 . 1 1 54 54 ARG N N 54 119.050 119.050 119.953 -0.903 17919 16739 1 41 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.744 -0.049 17919 16740 1 41 . 1 1 54 54 ARG C C 54 175.350 175.350 174.888 0.462 17919 16741 1 41 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.068 0.322 17919 16742 1 41 . 1 1 54 54 ARG CB C 54 32.650 32.650 34.694 -2.044 17919 16743 1 41 . 1 1 54 54 ARG H H 54 7.460 7.460 7.522 -0.062 17919 16744 1 41 . 1 1 55 55 THR N N 55 108.400 108.400 111.792 -3.392 17919 16745 1 41 . 1 1 55 55 THR HA H 55 5.240 5.240 5.227 0.013 17919 16746 1 41 . 1 1 55 55 THR C C 55 176.560 176.560 175.955 0.605 17919 16747 1 41 . 1 1 55 55 THR CA C 55 59.690 59.690 59.899 -0.209 17919 16748 1 41 . 1 1 55 55 THR CB C 55 72.260 72.260 71.298 0.962 17919 16749 1 41 . 1 1 55 55 THR H H 55 8.730 8.730 8.562 0.168 17919 16750 1 41 . 1 1 56 56 LEU N N 56 117.920 117.920 120.820 -2.900 17919 16751 1 41 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.028 0.032 17919 16752 1 41 . 1 1 56 56 LEU C C 56 180.810 180.810 178.945 1.865 17919 16753 1 41 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.520 0.190 17919 16754 1 41 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.596 -1.226 17919 16755 1 41 . 1 1 56 56 LEU H H 56 8.140 8.140 8.874 -0.734 17919 16756 1 41 . 1 1 57 57 SER N N 57 113.330 113.330 113.458 -0.128 17919 16757 1 41 . 1 1 57 57 SER HA H 57 4.370 4.370 4.156 0.214 17919 16758 1 41 . 1 1 57 57 SER C C 57 178.310 178.310 176.669 1.641 17919 16759 1 41 . 1 1 57 57 SER CA C 57 61.080 61.080 61.516 -0.436 17919 16760 1 41 . 1 1 57 57 SER CB C 57 62.530 62.530 62.685 -0.155 17919 16761 1 41 . 1 1 57 57 SER H H 57 8.470 8.470 7.847 0.623 17919 16762 1 41 . 1 1 58 58 ASP N N 58 124.190 124.190 120.814 3.376 17919 16763 1 41 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.456 -0.160 17919 16764 1 41 . 1 1 58 58 ASP C C 58 177.400 177.400 177.360 0.040 17919 16765 1 41 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.798 0.382 17919 16766 1 41 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.857 -0.757 17919 16767 1 41 . 1 1 58 58 ASP H H 58 7.930 7.930 7.860 0.070 17919 16768 1 41 . 1 1 59 59 TYR N N 59 115.510 115.510 116.286 -0.776 17919 16769 1 41 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.680 -0.010 17919 16770 1 41 . 1 1 59 59 TYR C C 59 174.700 174.700 174.423 0.277 17919 16771 1 41 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.217 1.033 17919 16772 1 41 . 1 1 59 59 TYR CB C 59 40.070 40.070 39.148 0.922 17919 16773 1 41 . 1 1 59 59 TYR H H 59 7.250 7.250 7.326 -0.076 17919 16774 1 41 . 1 1 60 60 ASN N N 60 115.900 115.900 115.948 -0.048 17919 16775 1 41 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.369 -0.014 17919 16776 1 41 . 1 1 60 60 ASN C C 60 174.340 174.340 174.488 -0.148 17919 16777 1 41 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.067 0.053 17919 16778 1 41 . 1 1 60 60 ASN CB C 60 37.410 37.410 36.855 0.555 17919 16779 1 41 . 1 1 60 60 ASN H H 60 8.150 8.150 7.921 0.229 17919 16780 1 41 . 1 1 61 61 ILE N N 61 118.600 118.600 120.849 -2.249 17919 16781 1 41 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.929 -0.536 17919 16782 1 41 . 1 1 61 61 ILE C C 61 174.610 174.610 174.973 -0.363 17919 16783 1 41 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.225 1.195 17919 16784 1 41 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.209 -0.469 17919 16785 1 41 . 1 1 61 61 ILE H H 61 7.250 7.250 7.665 -0.415 17919 16786 1 41 . 1 1 62 62 GLN N N 62 124.740 124.740 126.834 -2.094 17919 16787 1 41 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.534 -0.028 17919 16788 1 41 . 1 1 62 62 GLN C C 62 175.970 175.970 174.820 1.150 17919 16789 1 41 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.491 0.169 17919 16790 1 41 . 1 1 62 62 GLN CB C 62 31.650 31.650 29.827 1.823 17919 16791 1 41 . 1 1 62 62 GLN H H 62 7.610 7.610 8.178 -0.568 17919 16792 1 41 . 1 1 63 63 LYS N N 63 120.300 120.300 121.481 -1.181 17919 16793 1 41 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.723 0.278 17919 16794 1 41 . 1 1 63 63 LYS C C 63 175.810 175.810 176.417 -0.607 17919 16795 1 41 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.020 -0.230 17919 16796 1 41 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.335 1.315 17919 16797 1 41 . 1 1 63 63 LYS H H 63 8.490 8.490 8.599 -0.109 17919 16798 1 41 . 1 1 64 64 GLU N N 64 113.950 113.950 116.921 -2.971 17919 16799 1 41 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.351 0.114 17919 16800 1 41 . 1 1 64 64 GLU C C 64 175.250 175.250 174.881 0.369 17919 16801 1 41 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.441 0.449 17919 16802 1 41 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.104 -2.204 17919 16803 1 41 . 1 1 64 64 GLU H H 64 9.280 9.280 8.533 0.747 17919 16804 1 41 . 1 1 65 65 SER N N 65 114.730 114.730 114.024 0.706 17919 16805 1 41 . 1 1 65 65 SER HA H 65 4.640 4.640 4.726 -0.086 17919 16806 1 41 . 1 1 65 65 SER C C 65 172.160 172.160 173.268 -1.108 17919 16807 1 41 . 1 1 65 65 SER CA C 65 60.890 60.890 57.836 3.054 17919 16808 1 41 . 1 1 65 65 SER CB C 65 64.910 64.910 64.856 0.055 17919 16809 1 41 . 1 1 65 65 SER H H 65 7.670 7.670 7.441 0.229 17919 16810 1 41 . 1 1 66 66 THR N N 66 117.110 117.110 119.933 -2.823 17919 16811 1 41 . 1 1 66 66 THR HA H 66 5.270 5.270 5.317 -0.047 17919 16812 1 41 . 1 1 66 66 THR C C 66 173.950 173.950 174.250 -0.300 17919 16813 1 41 . 1 1 66 66 THR CA C 66 62.340 62.340 61.987 0.353 17919 16814 1 41 . 1 1 66 66 THR CB C 66 70.080 70.080 70.333 -0.253 17919 16815 1 41 . 1 1 66 66 THR H H 66 8.730 8.730 8.528 0.202 17919 16816 1 41 . 1 1 67 67 LEU N N 67 127.110 127.110 125.531 1.579 17919 16817 1 41 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.827 0.233 17919 16818 1 41 . 1 1 67 67 LEU C C 67 175.770 175.770 175.323 0.447 17919 16819 1 41 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.394 0.506 17919 16820 1 41 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.444 -0.185 17919 16821 1 41 . 1 1 67 67 LEU H H 67 9.410 9.410 9.216 0.194 17919 16822 1 41 . 1 1 68 68 HIS N N 68 118.380 118.380 119.188 -0.808 17919 16823 1 41 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.367 -0.127 17919 16824 1 41 . 1 1 68 68 HIS C C 68 173.150 173.150 173.690 -0.540 17919 16825 1 41 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.542 0.458 17919 16826 1 41 . 1 1 68 68 HIS CB C 68 30.530 30.530 33.155 -2.625 17919 16827 1 41 . 1 1 68 68 HIS H H 68 9.230 9.230 8.639 0.591 17919 16828 1 41 . 1 1 69 69 LEU N N 69 124.460 124.460 128.972 -4.512 17919 16829 1 41 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.310 -0.120 17919 16830 1 41 . 1 1 69 69 LEU C C 69 175.270 175.270 174.080 1.190 17919 16831 1 41 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.586 0.304 17919 16832 1 41 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.939 -0.559 17919 16833 1 41 . 1 1 69 69 LEU H H 69 8.340 8.340 8.584 -0.244 17919 16834 1 41 . 1 1 70 70 VAL N N 70 126.940 126.940 124.524 2.416 17919 16835 1 41 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.370 -0.020 17919 16836 1 41 . 1 1 70 70 VAL C C 70 174.000 174.000 174.169 -0.169 17919 16837 1 41 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.200 0.600 17919 16838 1 41 . 1 1 70 70 VAL CB C 70 34.910 34.910 36.029 -1.119 17919 16839 1 41 . 1 1 70 70 VAL H H 70 9.200 9.200 8.254 0.946 17919 16840 1 41 . 1 1 71 71 LEU N N 71 123.130 123.130 121.837 1.293 17919 16841 1 41 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.921 0.139 17919 16842 1 41 . 1 1 71 71 LEU C C 71 177.830 177.830 176.092 1.738 17919 16843 1 41 . 1 1 71 71 LEU CA C 71 53.940 53.940 54.247 -0.307 17919 16844 1 41 . 1 1 71 71 LEU CB C 71 42.850 42.850 44.083 -1.232 17919 16845 1 41 . 1 1 71 71 LEU H H 71 8.120 8.120 8.310 -0.190 17919 16846 1 41 . 1 1 72 72 ARG N N 72 123.490 123.490 126.303 -2.813 17919 16847 1 41 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.447 -0.146 17919 16848 1 41 . 1 1 72 72 ARG C C 72 175.350 175.350 175.969 -0.619 17919 16849 1 41 . 1 1 72 72 ARG CA C 72 55.610 55.610 54.839 0.771 17919 16850 1 41 . 1 1 72 72 ARG CB C 72 31.350 31.350 29.471 1.879 17919 16851 1 41 . 1 1 72 72 ARG H H 72 8.580 8.580 9.013 -0.433 17919 16852 1 42 . 1 1 2 2 GLN N N 2 123.220 123.220 120.719 2.501 17919 16853 1 42 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.268 -0.019 17919 16854 1 42 . 1 1 2 2 GLN C C 2 175.920 175.920 175.797 0.123 17919 16855 1 42 . 1 1 2 2 GLN CA C 2 55.080 55.080 55.718 -0.638 17919 16856 1 42 . 1 1 2 2 GLN CB C 2 30.760 30.760 29.952 0.808 17919 16857 1 42 . 1 1 2 2 GLN H H 2 8.900 8.900 8.665 0.235 17919 16858 1 42 . 1 1 3 3 ILE N N 3 115.340 115.340 116.077 -0.737 17919 16859 1 42 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.182 0.031 17919 16860 1 42 . 1 1 3 3 ILE C C 3 172.450 172.450 173.690 -1.240 17919 16861 1 42 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.546 0.024 17919 16862 1 42 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.410 0.800 17919 16863 1 42 . 1 1 3 3 ILE H H 3 8.320 8.320 7.731 0.589 17919 16864 1 42 . 1 1 4 4 PHE N N 4 118.110 118.110 119.624 -1.514 17919 16865 1 42 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.155 0.475 17919 16866 1 42 . 1 1 4 4 PHE C C 4 175.320 175.320 174.903 0.417 17919 16867 1 42 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.242 -0.033 17919 16868 1 42 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.671 -0.191 17919 16869 1 42 . 1 1 4 4 PHE H H 4 8.610 8.610 7.933 0.677 17919 16870 1 42 . 1 1 5 5 VAL N N 5 121.000 121.000 122.180 -1.180 17919 16871 1 42 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.821 -0.096 17919 16872 1 42 . 1 1 5 5 VAL C C 5 174.870 174.870 174.944 -0.074 17919 16873 1 42 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.198 -0.578 17919 16874 1 42 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.670 0.560 17919 16875 1 42 . 1 1 5 5 VAL H H 5 9.300 9.300 8.853 0.447 17919 16876 1 42 . 1 1 6 6 LYS N N 6 127.520 127.520 128.666 -1.146 17919 16877 1 42 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.227 0.140 17919 16878 1 42 . 1 1 6 6 LYS C C 6 177.140 177.140 177.012 0.128 17919 16879 1 42 . 1 1 6 6 LYS CA C 6 54.520 54.520 55.078 -0.557 17919 16880 1 42 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.221 0.829 17919 16881 1 42 . 1 1 6 6 LYS H H 6 8.820 8.820 9.058 -0.238 17919 16882 1 42 . 1 1 7 7 THR N N 7 115.400 115.400 119.030 -3.630 17919 16883 1 42 . 1 1 7 7 THR HA H 7 4.970 4.970 4.463 0.507 17919 16884 1 42 . 1 1 7 7 THR C C 7 176.910 176.910 176.220 0.690 17919 16885 1 42 . 1 1 7 7 THR CA C 7 60.470 60.470 61.606 -1.136 17919 16886 1 42 . 1 1 7 7 THR CB C 7 70.630 70.630 69.802 0.828 17919 16887 1 42 . 1 1 7 7 THR H H 7 8.730 8.730 9.082 -0.352 17919 16888 1 42 . 1 1 8 8 LEU N N 8 121.330 121.330 124.313 -2.983 17919 16889 1 42 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.105 0.205 17919 16890 1 42 . 1 1 8 8 LEU C C 8 178.800 178.800 177.124 1.676 17919 16891 1 42 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.161 0.419 17919 16892 1 42 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.934 0.036 17919 16893 1 42 . 1 1 8 8 LEU H H 8 9.100 9.100 8.605 0.495 17919 16894 1 42 . 1 1 9 9 THR N N 9 105.590 105.590 107.671 -2.081 17919 16895 1 42 . 1 1 9 9 THR HA H 9 4.428 4.428 4.363 0.065 17919 16896 1 42 . 1 1 9 9 THR C C 9 175.520 175.520 175.641 -0.121 17919 16897 1 42 . 1 1 9 9 THR CA C 9 61.400 61.400 61.763 -0.363 17919 16898 1 42 . 1 1 9 9 THR CB C 9 69.140 69.140 69.130 0.010 17919 16899 1 42 . 1 1 9 9 THR H H 9 7.630 7.630 7.671 -0.041 17919 16900 1 42 . 1 1 10 10 GLY N N 10 108.890 108.890 110.661 -1.771 17919 16901 1 42 . 1 1 10 10 GLY C C 10 174.070 174.070 174.335 -0.265 17919 16902 1 42 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.831 0.629 17919 16903 1 42 . 1 1 10 10 GLY H H 10 7.810 7.810 8.167 -0.357 17919 16904 1 42 . 1 1 11 11 LYS N N 11 121.600 121.600 122.175 -0.575 17919 16905 1 42 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.189 0.172 17919 16906 1 42 . 1 1 11 11 LYS C C 11 175.940 175.940 175.630 0.310 17919 16907 1 42 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.967 -0.687 17919 16908 1 42 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.268 -0.068 17919 16909 1 42 . 1 1 11 11 LYS H H 11 7.280 7.280 7.681 -0.401 17919 16910 1 42 . 1 1 12 12 THR N N 12 120.440 120.440 118.086 2.354 17919 16911 1 42 . 1 1 12 12 THR HA H 12 5.046 5.046 5.169 -0.123 17919 16912 1 42 . 1 1 12 12 THR C C 12 174.320 174.320 173.954 0.366 17919 16913 1 42 . 1 1 12 12 THR CA C 12 62.390 62.390 61.291 1.099 17919 16914 1 42 . 1 1 12 12 THR CB C 12 69.910 69.910 70.182 -0.272 17919 16915 1 42 . 1 1 12 12 THR H H 12 8.650 8.650 8.358 0.292 17919 16916 1 42 . 1 1 13 13 ILE N N 13 127.110 127.110 129.303 -2.193 17919 16917 1 42 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.476 0.068 17919 16918 1 42 . 1 1 13 13 ILE C C 13 175.220 175.220 175.774 -0.554 17919 16919 1 42 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.314 0.666 17919 16920 1 42 . 1 1 13 13 ILE CB C 13 40.950 40.950 38.578 2.372 17919 16921 1 42 . 1 1 13 13 ILE H H 13 9.450 9.450 8.934 0.516 17919 16922 1 42 . 1 1 14 14 THR N N 14 121.520 121.520 124.607 -3.087 17919 16923 1 42 . 1 1 14 14 THR HA H 14 4.964 4.964 4.673 0.291 17919 16924 1 42 . 1 1 14 14 THR C C 14 173.790 173.790 173.996 -0.206 17919 16925 1 42 . 1 1 14 14 THR CA C 14 61.940 61.940 62.830 -0.889 17919 16926 1 42 . 1 1 14 14 THR CB C 14 69.650 69.650 69.572 0.078 17919 16927 1 42 . 1 1 14 14 THR H H 14 8.710 8.710 8.439 0.271 17919 16928 1 42 . 1 1 15 15 LEU N N 15 124.800 124.800 127.756 -2.956 17919 16929 1 42 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.720 0.060 17919 16930 1 42 . 1 1 15 15 LEU C C 15 174.670 174.670 175.675 -1.005 17919 16931 1 42 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.469 -0.639 17919 16932 1 42 . 1 1 15 15 LEU CB C 15 47.070 47.070 46.228 0.842 17919 16933 1 42 . 1 1 15 15 LEU H H 15 8.710 8.710 8.476 0.234 17919 16934 1 42 . 1 1 16 16 GLU N N 16 122.160 122.160 121.976 0.184 17919 16935 1 42 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.610 0.307 17919 16936 1 42 . 1 1 16 16 GLU C C 16 175.860 175.860 176.203 -0.343 17919 16937 1 42 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.414 -0.594 17919 16938 1 42 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.645 -1.195 17919 16939 1 42 . 1 1 16 16 GLU H H 16 8.140 8.140 8.573 -0.433 17919 16940 1 42 . 1 1 17 17 VAL N N 17 117.210 117.210 120.667 -3.457 17919 16941 1 42 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.803 -0.089 17919 16942 1 42 . 1 1 17 17 VAL C C 17 174.160 174.160 175.177 -1.017 17919 16943 1 42 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.857 -0.427 17919 16944 1 42 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.485 0.915 17919 16945 1 42 . 1 1 17 17 VAL H H 17 8.900 8.900 8.715 0.185 17919 16946 1 42 . 1 1 18 18 GLU N N 18 118.990 118.990 118.058 0.932 17919 16947 1 42 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.851 0.228 17919 16948 1 42 . 1 1 18 18 GLU C C 18 176.160 176.160 175.209 0.951 17919 16949 1 42 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.172 -0.452 17919 16950 1 42 . 1 1 18 18 GLU CB C 18 30.310 30.310 32.616 -2.306 17919 16951 1 42 . 1 1 18 18 GLU H H 18 8.640 8.640 8.064 0.576 17919 16952 1 42 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.301 -0.160 17919 16953 1 42 . 1 1 19 19 PRO C C 19 175.310 175.310 177.105 -1.795 17919 16954 1 42 . 1 1 19 19 PRO CA C 19 65.470 65.470 64.738 0.732 17919 16955 1 42 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.631 0.319 17919 16956 1 42 . 1 1 20 20 SER N N 20 103.400 103.400 110.650 -7.250 17919 16957 1 42 . 1 1 20 20 SER HA H 20 4.370 4.370 4.314 0.056 17919 16958 1 42 . 1 1 20 20 SER C C 20 174.660 174.660 174.790 -0.130 17919 16959 1 42 . 1 1 20 20 SER CA C 20 57.400 57.400 58.474 -1.074 17919 16960 1 42 . 1 1 20 20 SER CB C 20 63.370 63.370 63.006 0.364 17919 16961 1 42 . 1 1 20 20 SER H H 20 7.040 7.040 8.152 -1.112 17919 16962 1 42 . 1 1 21 21 ASP N N 21 123.480 123.480 124.960 -1.480 17919 16963 1 42 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.686 0.009 17919 16964 1 42 . 1 1 21 21 ASP C C 21 176.360 176.360 175.917 0.443 17919 16965 1 42 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.248 0.452 17919 16966 1 42 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.881 -1.081 17919 16967 1 42 . 1 1 21 21 ASP H H 21 8.030 8.030 7.777 0.253 17919 16968 1 42 . 1 1 22 22 THR N N 22 108.800 108.800 111.471 -2.671 17919 16969 1 42 . 1 1 22 22 THR HA H 22 4.920 4.920 4.910 0.010 17919 16970 1 42 . 1 1 22 22 THR C C 22 176.750 176.750 175.656 1.094 17919 16971 1 42 . 1 1 22 22 THR CA C 22 59.690 59.690 60.203 -0.513 17919 16972 1 42 . 1 1 22 22 THR CB C 22 71.200 71.200 71.641 -0.441 17919 16973 1 42 . 1 1 22 22 THR H H 22 7.900 7.900 8.058 -0.158 17919 16974 1 42 . 1 1 23 23 ILE N N 23 121.190 121.190 121.033 0.157 17919 16975 1 42 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.796 -0.139 17919 16976 1 42 . 1 1 23 23 ILE C C 23 179.040 179.040 177.712 1.328 17919 16977 1 42 . 1 1 23 23 ILE CA C 23 62.260 62.260 61.527 0.733 17919 16978 1 42 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.520 -2.170 17919 16979 1 42 . 1 1 23 23 ILE H H 23 8.560 8.560 9.092 -0.532 17919 16980 1 42 . 1 1 24 24 GLU N N 24 120.830 120.830 119.687 1.143 17919 16981 1 42 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.861 0.056 17919 16982 1 42 . 1 1 24 24 GLU C C 24 178.640 178.640 178.647 -0.007 17919 16983 1 42 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.720 0.500 17919 16984 1 42 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.375 -1.095 17919 16985 1 42 . 1 1 24 24 GLU H H 24 9.760 9.760 8.359 1.401 17919 16986 1 42 . 1 1 25 25 ASN N N 25 120.570 120.570 117.596 2.974 17919 16987 1 42 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.518 0.007 17919 16988 1 42 . 1 1 25 25 ASN C C 25 178.380 178.380 177.805 0.575 17919 16989 1 42 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.132 -0.072 17919 16990 1 42 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.251 0.199 17919 16991 1 42 . 1 1 25 25 ASN H H 25 7.920 7.920 7.538 0.382 17919 16992 1 42 . 1 1 26 26 VAL N N 26 121.710 121.710 119.886 1.824 17919 16993 1 42 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.621 -0.224 17919 16994 1 42 . 1 1 26 26 VAL C C 26 177.950 177.950 177.895 0.055 17919 16995 1 42 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.224 1.436 17919 16996 1 42 . 1 1 26 26 VAL CB C 26 30.840 30.840 30.962 -0.122 17919 16997 1 42 . 1 1 26 26 VAL H H 26 8.070 8.070 7.618 0.452 17919 16998 1 42 . 1 1 27 27 LYS N N 27 118.860 118.860 119.371 -0.511 17919 16999 1 42 . 1 1 27 27 LYS HA H 27 4.580 4.580 3.969 0.611 17919 17000 1 42 . 1 1 27 27 LYS C C 27 180.550 180.550 179.066 1.484 17919 17001 1 42 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.779 -0.529 17919 17002 1 42 . 1 1 27 27 LYS CB C 27 33.730 33.730 31.976 1.754 17919 17003 1 42 . 1 1 27 27 LYS H H 27 8.560 8.560 7.616 0.944 17919 17004 1 42 . 1 1 28 28 ALA N N 28 123.440 123.440 121.801 1.639 17919 17005 1 42 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.346 -0.186 17919 17006 1 42 . 1 1 28 28 ALA C C 28 180.300 180.300 179.470 0.830 17919 17007 1 42 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.682 0.688 17919 17008 1 42 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.524 -0.814 17919 17009 1 42 . 1 1 28 28 ALA H H 28 8.060 8.060 7.718 0.342 17919 17010 1 42 . 1 1 29 29 LYS N N 29 119.940 119.940 119.423 0.517 17919 17011 1 42 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.013 0.194 17919 17012 1 42 . 1 1 29 29 LYS C C 29 180.320 180.320 179.101 1.219 17919 17013 1 42 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.388 0.262 17919 17014 1 42 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.410 0.880 17919 17015 1 42 . 1 1 29 29 LYS H H 29 7.850 7.850 7.791 0.059 17919 17016 1 42 . 1 1 30 30 ILE N N 30 121.080 121.080 119.854 1.226 17919 17017 1 42 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.633 -0.126 17919 17018 1 42 . 1 1 30 30 ILE C C 30 178.310 178.310 177.305 1.005 17919 17019 1 42 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.055 1.095 17919 17020 1 42 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.727 -0.927 17919 17021 1 42 . 1 1 30 30 ILE H H 30 8.280 8.280 8.217 0.063 17919 17022 1 42 . 1 1 31 31 GLN N N 31 123.490 123.490 120.750 2.740 17919 17023 1 42 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.874 -0.045 17919 17024 1 42 . 1 1 31 31 GLN C C 31 178.890 178.890 178.581 0.309 17919 17025 1 42 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.147 0.854 17919 17026 1 42 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.302 -0.582 17919 17027 1 42 . 1 1 31 31 GLN H H 31 8.580 8.580 8.298 0.282 17919 17028 1 42 . 1 1 32 32 ASP N N 32 119.360 119.360 118.664 0.696 17919 17029 1 42 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.386 -0.032 17919 17030 1 42 . 1 1 32 32 ASP C C 32 177.250 177.250 177.785 -0.535 17919 17031 1 42 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.729 0.461 17919 17032 1 42 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.787 -0.207 17919 17033 1 42 . 1 1 32 32 ASP H H 32 8.010 8.010 7.844 0.166 17919 17034 1 42 . 1 1 33 33 LYS N N 33 115.130 115.130 117.639 -2.509 17919 17035 1 42 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.441 -0.104 17919 17036 1 42 . 1 1 33 33 LYS C C 33 177.870 177.870 178.457 -0.587 17919 17037 1 42 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.347 0.703 17919 17038 1 42 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.533 0.637 17919 17039 1 42 . 1 1 33 33 LYS H H 33 7.430 7.430 7.759 -0.329 17919 17040 1 42 . 1 1 34 34 GLU N N 34 113.870 113.870 116.657 -2.787 17919 17041 1 42 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.447 0.178 17919 17042 1 42 . 1 1 34 34 GLU C C 34 177.840 177.840 177.407 0.433 17919 17043 1 42 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.110 -0.940 17919 17044 1 42 . 1 1 34 34 GLU CB C 34 32.660 32.660 30.979 1.681 17919 17045 1 42 . 1 1 34 34 GLU H H 34 8.740 8.740 8.421 0.319 17919 17046 1 42 . 1 1 35 35 GLY N N 35 108.650 108.650 108.910 -0.260 17919 17047 1 42 . 1 1 35 35 GLY C C 35 173.960 173.960 174.501 -0.541 17919 17048 1 42 . 1 1 35 35 GLY CA C 35 46.080 46.080 46.072 0.008 17919 17049 1 42 . 1 1 35 35 GLY H H 35 8.530 8.530 7.805 0.725 17919 17050 1 42 . 1 1 36 36 ILE N N 36 119.880 119.880 117.429 2.451 17919 17051 1 42 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.448 -0.003 17919 17052 1 42 . 1 1 36 36 ILE C C 36 173.590 173.590 174.617 -1.027 17919 17053 1 42 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.597 0.153 17919 17054 1 42 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.339 2.241 17919 17055 1 42 . 1 1 36 36 ILE H H 36 6.150 6.150 7.501 -1.351 17919 17056 1 42 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.764 -0.130 17919 17057 1 42 . 1 1 37 37 PRO C C 37 176.940 176.940 176.332 0.608 17919 17058 1 42 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.490 0.170 17919 17059 1 42 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.301 0.549 17919 17060 1 42 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.241 -0.124 17919 17061 1 42 . 1 1 38 38 PRO C C 38 178.320 178.320 178.429 -0.109 17919 17062 1 42 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.358 0.902 17919 17063 1 42 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.786 1.104 17919 17064 1 42 . 1 1 39 39 ASP N N 39 113.380 113.380 116.030 -2.650 17919 17065 1 42 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.349 0.081 17919 17066 1 42 . 1 1 39 39 ASP C C 39 177.090 177.090 177.293 -0.203 17919 17067 1 42 . 1 1 39 39 ASP CA C 39 55.640 55.640 57.051 -1.411 17919 17068 1 42 . 1 1 39 39 ASP CB C 39 39.540 39.540 39.879 -0.339 17919 17069 1 42 . 1 1 39 39 ASP H H 39 8.550 8.550 8.793 -0.243 17919 17070 1 42 . 1 1 40 40 GLN N N 40 116.780 116.780 115.791 0.989 17919 17071 1 42 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.425 0.039 17919 17072 1 42 . 1 1 40 40 GLN C C 40 175.380 175.380 174.985 0.395 17919 17073 1 42 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.535 0.105 17919 17074 1 42 . 1 1 40 40 GLN CB C 40 30.140 30.140 30.258 -0.118 17919 17075 1 42 . 1 1 40 40 GLN H H 40 7.820 7.820 7.572 0.248 17919 17076 1 42 . 1 1 41 41 GLN N N 41 117.720 117.720 119.746 -2.026 17919 17077 1 42 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.795 -0.551 17919 17078 1 42 . 1 1 41 41 GLN C C 41 176.300 176.300 174.936 1.364 17919 17079 1 42 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.611 0.860 17919 17080 1 42 . 1 1 41 41 GLN CB C 41 31.650 31.650 30.322 1.328 17919 17081 1 42 . 1 1 41 41 GLN H H 41 7.480 7.480 7.492 -0.012 17919 17082 1 42 . 1 1 42 42 ARG N N 42 122.680 122.680 124.812 -2.132 17919 17083 1 42 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.651 -0.151 17919 17084 1 42 . 1 1 42 42 ARG C C 42 174.050 174.050 174.126 -0.076 17919 17085 1 42 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.202 -0.152 17919 17086 1 42 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.679 -0.929 17919 17087 1 42 . 1 1 42 42 ARG H H 42 8.530 8.530 8.098 0.432 17919 17088 1 42 . 1 1 43 43 LEU N N 43 124.040 124.040 127.394 -3.354 17919 17089 1 42 . 1 1 43 43 LEU C C 43 175.290 175.290 175.609 -0.319 17919 17090 1 42 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.316 -1.336 17919 17091 1 42 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.277 1.513 17919 17092 1 42 . 1 1 43 43 LEU H H 43 8.820 8.820 8.735 0.085 17919 17093 1 42 . 1 1 44 44 ILE N N 44 121.920 121.920 122.499 -0.579 17919 17094 1 42 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.268 -0.276 17919 17095 1 42 . 1 1 44 44 ILE C C 44 176.060 176.060 174.367 1.693 17919 17096 1 42 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.971 -0.991 17919 17097 1 42 . 1 1 44 44 ILE CB C 44 41.420 41.420 42.348 -0.928 17919 17098 1 42 . 1 1 44 44 ILE H H 44 9.030 9.030 8.752 0.278 17919 17099 1 42 . 1 1 45 45 PHE N N 45 125.390 125.390 125.770 -0.380 17919 17100 1 42 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.994 0.051 17919 17101 1 42 . 1 1 45 45 PHE C C 45 174.470 174.470 174.323 0.147 17919 17102 1 42 . 1 1 45 45 PHE CA C 45 57.020 57.020 57.127 -0.107 17919 17103 1 42 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.088 0.672 17919 17104 1 42 . 1 1 45 45 PHE H H 45 8.830 8.830 9.247 -0.417 17919 17105 1 42 . 1 1 46 46 ALA N N 46 132.200 132.200 130.141 2.059 17919 17106 1 42 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.683 0.007 17919 17107 1 42 . 1 1 46 46 ALA C C 46 177.290 177.290 177.907 -0.617 17919 17108 1 42 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.249 0.291 17919 17109 1 42 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.628 -0.058 17919 17110 1 42 . 1 1 46 46 ALA H H 46 8.810 8.810 8.522 0.288 17919 17111 1 42 . 1 1 47 47 GLY N N 47 102.340 102.340 104.765 -2.425 17919 17112 1 42 . 1 1 47 47 GLY C C 47 173.810 173.810 174.091 -0.281 17919 17113 1 42 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.085 0.265 17919 17114 1 42 . 1 1 47 47 GLY H H 47 8.130 8.130 8.399 -0.269 17919 17115 1 42 . 1 1 48 48 LYS N N 48 121.570 121.570 120.191 1.379 17919 17116 1 42 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.666 -0.044 17919 17117 1 42 . 1 1 48 48 LYS C C 48 174.700 174.700 175.536 -0.836 17919 17118 1 42 . 1 1 48 48 LYS CA C 48 54.550 54.550 53.914 0.636 17919 17119 1 42 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.707 -0.177 17919 17120 1 42 . 1 1 48 48 LYS H H 48 7.980 7.980 8.020 -0.040 17919 17121 1 42 . 1 1 49 49 GLN N N 49 122.410 122.410 124.500 -2.090 17919 17122 1 42 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.409 0.151 17919 17123 1 42 . 1 1 49 49 GLN C C 49 175.670 175.670 175.207 0.463 17919 17124 1 42 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.956 -1.216 17919 17125 1 42 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.114 -0.114 17919 17126 1 42 . 1 1 49 49 GLN H H 49 8.600 8.600 8.655 -0.055 17919 17127 1 42 . 1 1 50 50 LEU N N 50 125.520 125.520 127.611 -2.091 17919 17128 1 42 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.520 -0.430 17919 17129 1 42 . 1 1 50 50 LEU C C 50 176.660 176.660 175.307 1.353 17919 17130 1 42 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.859 0.381 17919 17131 1 42 . 1 1 50 50 LEU CB C 50 41.570 41.570 43.363 -1.793 17919 17132 1 42 . 1 1 50 50 LEU H H 50 8.530 8.530 8.563 -0.033 17919 17133 1 42 . 1 1 51 51 GLU N N 51 122.940 122.940 121.542 1.398 17919 17134 1 42 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.694 -0.206 17919 17135 1 42 . 1 1 51 51 GLU C C 51 175.870 175.870 176.068 -0.198 17919 17136 1 42 . 1 1 51 51 GLU CA C 51 55.960 55.960 54.919 1.040 17919 17137 1 42 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.169 -0.599 17919 17138 1 42 . 1 1 51 51 GLU H H 51 8.400 8.400 8.991 -0.591 17919 17139 1 42 . 1 1 52 52 ASP N N 52 120.030 120.030 122.372 -2.342 17919 17140 1 42 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.589 -0.230 17919 17141 1 42 . 1 1 52 52 ASP C C 52 177.330 177.330 178.123 -0.793 17919 17142 1 42 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.203 -0.243 17919 17143 1 42 . 1 1 52 52 ASP CB C 52 40.850 40.850 41.090 -0.240 17919 17144 1 42 . 1 1 52 52 ASP H H 52 8.160 8.160 8.888 -0.728 17919 17145 1 42 . 1 1 53 53 GLY N N 53 106.660 106.660 108.092 -1.432 17919 17146 1 42 . 1 1 53 53 GLY C C 53 174.870 174.870 174.357 0.513 17919 17147 1 42 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.104 0.066 17919 17148 1 42 . 1 1 53 53 GLY H H 53 9.390 9.390 8.592 0.798 17919 17149 1 42 . 1 1 54 54 ARG N N 54 119.050 119.050 121.426 -2.376 17919 17150 1 42 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.501 0.194 17919 17151 1 42 . 1 1 54 54 ARG C C 54 175.350 175.350 175.450 -0.100 17919 17152 1 42 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.952 -0.562 17919 17153 1 42 . 1 1 54 54 ARG CB C 54 32.650 32.650 31.262 1.388 17919 17154 1 42 . 1 1 54 54 ARG H H 54 7.460 7.460 7.581 -0.121 17919 17155 1 42 . 1 1 55 55 THR N N 55 108.400 108.400 112.479 -4.079 17919 17156 1 42 . 1 1 55 55 THR HA H 55 5.240 5.240 5.022 0.218 17919 17157 1 42 . 1 1 55 55 THR C C 55 176.560 176.560 176.231 0.329 17919 17158 1 42 . 1 1 55 55 THR CA C 55 59.690 59.690 60.146 -0.456 17919 17159 1 42 . 1 1 55 55 THR CB C 55 72.260 72.260 71.493 0.767 17919 17160 1 42 . 1 1 55 55 THR H H 55 8.730 8.730 8.883 -0.153 17919 17161 1 42 . 1 1 56 56 LEU N N 56 117.920 117.920 121.815 -3.895 17919 17162 1 42 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.867 0.193 17919 17163 1 42 . 1 1 56 56 LEU C C 56 180.810 180.810 178.755 2.055 17919 17164 1 42 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.532 0.178 17919 17165 1 42 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.271 -0.901 17919 17166 1 42 . 1 1 56 56 LEU H H 56 8.140 8.140 8.289 -0.149 17919 17167 1 42 . 1 1 57 57 SER N N 57 113.330 113.330 114.770 -1.440 17919 17168 1 42 . 1 1 57 57 SER HA H 57 4.370 4.370 4.235 0.135 17919 17169 1 42 . 1 1 57 57 SER C C 57 178.310 178.310 176.885 1.425 17919 17170 1 42 . 1 1 57 57 SER CA C 57 61.080 61.080 61.889 -0.809 17919 17171 1 42 . 1 1 57 57 SER CB C 57 62.530 62.530 62.696 -0.166 17919 17172 1 42 . 1 1 57 57 SER H H 57 8.470 8.470 8.031 0.439 17919 17173 1 42 . 1 1 58 58 ASP N N 58 124.190 124.190 123.614 0.576 17919 17174 1 42 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.206 0.090 17919 17175 1 42 . 1 1 58 58 ASP C C 58 177.400 177.400 177.747 -0.347 17919 17176 1 42 . 1 1 58 58 ASP CA C 58 57.180 57.180 57.109 0.070 17919 17177 1 42 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.418 -0.318 17919 17178 1 42 . 1 1 58 58 ASP H H 58 7.930 7.930 7.719 0.211 17919 17179 1 42 . 1 1 59 59 TYR N N 59 115.510 115.510 114.891 0.619 17919 17180 1 42 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.652 0.018 17919 17181 1 42 . 1 1 59 59 TYR C C 59 174.700 174.700 174.951 -0.251 17919 17182 1 42 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.473 0.777 17919 17183 1 42 . 1 1 59 59 TYR CB C 59 40.070 40.070 37.640 2.430 17919 17184 1 42 . 1 1 59 59 TYR H H 59 7.250 7.250 7.417 -0.167 17919 17185 1 42 . 1 1 60 60 ASN N N 60 115.900 115.900 113.908 1.992 17919 17186 1 42 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.297 0.058 17919 17187 1 42 . 1 1 60 60 ASN C C 60 174.340 174.340 174.480 -0.140 17919 17188 1 42 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.135 -0.015 17919 17189 1 42 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.719 -0.309 17919 17190 1 42 . 1 1 60 60 ASN H H 60 8.150 8.150 7.651 0.499 17919 17191 1 42 . 1 1 61 61 ILE N N 61 118.600 118.600 120.149 -1.549 17919 17192 1 42 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.560 -0.167 17919 17193 1 42 . 1 1 61 61 ILE C C 61 174.610 174.610 175.631 -1.021 17919 17194 1 42 . 1 1 61 61 ILE CA C 61 62.420 62.420 60.652 1.768 17919 17195 1 42 . 1 1 61 61 ILE CB C 61 36.740 36.740 36.004 0.736 17919 17196 1 42 . 1 1 61 61 ILE H H 61 7.250 7.250 8.025 -0.775 17919 17197 1 42 . 1 1 62 62 GLN N N 62 124.740 124.740 125.757 -1.017 17919 17198 1 42 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.552 -0.046 17919 17199 1 42 . 1 1 62 62 GLN C C 62 175.970 175.970 175.871 0.099 17919 17200 1 42 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.941 -0.281 17919 17201 1 42 . 1 1 62 62 GLN CB C 62 31.650 31.650 30.851 0.799 17919 17202 1 42 . 1 1 62 62 GLN H H 62 7.610 7.610 7.869 -0.259 17919 17203 1 42 . 1 1 63 63 LYS N N 63 120.300 120.300 120.677 -0.377 17919 17204 1 42 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.127 -0.126 17919 17205 1 42 . 1 1 63 63 LYS C C 63 175.810 175.810 177.439 -1.629 17919 17206 1 42 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.194 0.596 17919 17207 1 42 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.349 0.301 17919 17208 1 42 . 1 1 63 63 LYS H H 63 8.490 8.490 8.599 -0.109 17919 17209 1 42 . 1 1 64 64 GLU N N 64 113.950 113.950 118.937 -4.987 17919 17210 1 42 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.181 0.284 17919 17211 1 42 . 1 1 64 64 GLU C C 64 175.250 175.250 175.825 -0.575 17919 17212 1 42 . 1 1 64 64 GLU CA C 64 57.890 57.890 58.181 -0.291 17919 17213 1 42 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.718 -2.818 17919 17214 1 42 . 1 1 64 64 GLU H H 64 9.280 9.280 8.936 0.344 17919 17215 1 42 . 1 1 65 65 SER N N 65 114.730 114.730 115.383 -0.653 17919 17216 1 42 . 1 1 65 65 SER HA H 65 4.640 4.640 4.426 0.214 17919 17217 1 42 . 1 1 65 65 SER C C 65 172.160 172.160 174.777 -2.617 17919 17218 1 42 . 1 1 65 65 SER CA C 65 60.890 60.890 60.062 0.828 17919 17219 1 42 . 1 1 65 65 SER CB C 65 64.910 64.910 63.816 1.094 17919 17220 1 42 . 1 1 65 65 SER H H 65 7.670 7.670 7.543 0.127 17919 17221 1 42 . 1 1 66 66 THR N N 66 117.110 117.110 121.544 -4.434 17919 17222 1 42 . 1 1 66 66 THR HA H 66 5.270 5.270 4.894 0.376 17919 17223 1 42 . 1 1 66 66 THR C C 66 173.950 173.950 174.574 -0.624 17919 17224 1 42 . 1 1 66 66 THR CA C 66 62.340 62.340 63.521 -1.181 17919 17225 1 42 . 1 1 66 66 THR CB C 66 70.080 70.080 69.496 0.584 17919 17226 1 42 . 1 1 66 66 THR H H 66 8.730 8.730 8.602 0.128 17919 17227 1 42 . 1 1 67 67 LEU N N 67 127.110 127.110 127.108 0.002 17919 17228 1 42 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.909 0.151 17919 17229 1 42 . 1 1 67 67 LEU C C 67 175.770 175.770 175.250 0.520 17919 17230 1 42 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.592 0.308 17919 17231 1 42 . 1 1 67 67 LEU CB C 67 44.260 44.260 45.506 -1.246 17919 17232 1 42 . 1 1 67 67 LEU H H 67 9.410 9.410 8.910 0.500 17919 17233 1 42 . 1 1 68 68 HIS N N 68 118.380 118.380 123.447 -5.067 17919 17234 1 42 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.171 0.069 17919 17235 1 42 . 1 1 68 68 HIS C C 68 173.150 173.150 173.886 -0.736 17919 17236 1 42 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.388 0.612 17919 17237 1 42 . 1 1 68 68 HIS CB C 68 30.530 30.530 31.190 -0.660 17919 17238 1 42 . 1 1 68 68 HIS H H 68 9.230 9.230 9.025 0.205 17919 17239 1 42 . 1 1 69 69 LEU N N 69 124.460 124.460 130.546 -6.086 17919 17240 1 42 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.815 0.375 17919 17241 1 42 . 1 1 69 69 LEU C C 69 175.270 175.270 174.377 0.893 17919 17242 1 42 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.645 0.245 17919 17243 1 42 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.267 0.113 17919 17244 1 42 . 1 1 69 69 LEU H H 69 8.340 8.340 8.241 0.099 17919 17245 1 42 . 1 1 70 70 VAL N N 70 126.940 126.940 122.573 4.367 17919 17246 1 42 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.548 -0.198 17919 17247 1 42 . 1 1 70 70 VAL C C 70 174.000 174.000 173.615 0.385 17919 17248 1 42 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.605 1.195 17919 17249 1 42 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.145 -0.235 17919 17250 1 42 . 1 1 70 70 VAL H H 70 9.200 9.200 8.349 0.851 17919 17251 1 42 . 1 1 71 71 LEU N N 71 123.130 123.130 124.058 -0.928 17919 17252 1 42 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.536 0.524 17919 17253 1 42 . 1 1 71 71 LEU C C 71 177.830 177.830 177.005 0.825 17919 17254 1 42 . 1 1 71 71 LEU CA C 71 53.940 53.940 54.711 -0.771 17919 17255 1 42 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.198 -0.348 17919 17256 1 42 . 1 1 71 71 LEU H H 71 8.120 8.120 8.553 -0.433 17919 17257 1 42 . 1 1 72 72 ARG N N 72 123.490 123.490 125.581 -2.091 17919 17258 1 42 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.532 -0.231 17919 17259 1 42 . 1 1 72 72 ARG C C 72 175.350 175.350 175.653 -0.303 17919 17260 1 42 . 1 1 72 72 ARG CA C 72 55.610 55.610 54.877 0.733 17919 17261 1 42 . 1 1 72 72 ARG CB C 72 31.350 31.350 29.506 1.844 17919 17262 1 42 . 1 1 72 72 ARG H H 72 8.580 8.580 8.188 0.392 17919 17263 1 43 . 1 1 2 2 GLN N N 2 123.220 123.220 118.155 5.065 17919 17264 1 43 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.143 0.106 17919 17265 1 43 . 1 1 2 2 GLN C C 2 175.920 175.920 174.108 1.812 17919 17266 1 43 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.980 0.100 17919 17267 1 43 . 1 1 2 2 GLN CB C 2 30.760 30.760 33.155 -2.395 17919 17268 1 43 . 1 1 2 2 GLN H H 2 8.900 8.900 8.532 0.368 17919 17269 1 43 . 1 1 3 3 ILE N N 3 115.340 115.340 116.462 -1.122 17919 17270 1 43 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.784 -0.571 17919 17271 1 43 . 1 1 3 3 ILE C C 3 172.450 172.450 173.566 -1.116 17919 17272 1 43 . 1 1 3 3 ILE CA C 3 59.570 59.570 58.871 0.699 17919 17273 1 43 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.242 0.968 17919 17274 1 43 . 1 1 3 3 ILE H H 3 8.320 8.320 7.864 0.456 17919 17275 1 43 . 1 1 4 4 PHE N N 4 118.110 118.110 120.190 -2.080 17919 17276 1 43 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.630 0.000 17919 17277 1 43 . 1 1 4 4 PHE C C 4 175.320 175.320 175.478 -0.158 17919 17278 1 43 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.541 -0.331 17919 17279 1 43 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.831 -0.351 17919 17280 1 43 . 1 1 4 4 PHE H H 4 8.610 8.610 8.629 -0.019 17919 17281 1 43 . 1 1 5 5 VAL N N 5 121.000 121.000 120.291 0.709 17919 17282 1 43 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.830 -0.105 17919 17283 1 43 . 1 1 5 5 VAL C C 5 174.870 174.870 174.671 0.199 17919 17284 1 43 . 1 1 5 5 VAL CA C 5 60.620 60.620 60.955 -0.335 17919 17285 1 43 . 1 1 5 5 VAL CB C 5 34.230 34.230 35.124 -0.894 17919 17286 1 43 . 1 1 5 5 VAL H H 5 9.300 9.300 8.638 0.662 17919 17287 1 43 . 1 1 6 6 LYS N N 6 127.520 127.520 126.118 1.402 17919 17288 1 43 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.097 0.270 17919 17289 1 43 . 1 1 6 6 LYS C C 6 177.140 177.140 176.408 0.732 17919 17290 1 43 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.422 0.098 17919 17291 1 43 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.562 0.487 17919 17292 1 43 . 1 1 6 6 LYS H H 6 8.820 8.820 8.700 0.120 17919 17293 1 43 . 1 1 7 7 THR N N 7 115.400 115.400 114.793 0.607 17919 17294 1 43 . 1 1 7 7 THR HA H 7 4.970 4.970 4.132 0.838 17919 17295 1 43 . 1 1 7 7 THR C C 7 176.910 176.910 175.539 1.371 17919 17296 1 43 . 1 1 7 7 THR CA C 7 60.470 60.470 62.086 -1.616 17919 17297 1 43 . 1 1 7 7 THR CB C 7 70.630 70.630 69.399 1.231 17919 17298 1 43 . 1 1 7 7 THR H H 7 8.730 8.730 7.925 0.805 17919 17299 1 43 . 1 1 8 8 LEU N N 8 121.330 121.330 120.105 1.225 17919 17300 1 43 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.510 -0.200 17919 17301 1 43 . 1 1 8 8 LEU C C 8 178.800 178.800 177.823 0.977 17919 17302 1 43 . 1 1 8 8 LEU CA C 8 57.580 57.580 56.712 0.868 17919 17303 1 43 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.248 -0.278 17919 17304 1 43 . 1 1 8 8 LEU H H 8 9.100 9.100 8.707 0.393 17919 17305 1 43 . 1 1 9 9 THR N N 9 105.590 105.590 109.755 -4.165 17919 17306 1 43 . 1 1 9 9 THR HA H 9 4.428 4.428 4.378 0.050 17919 17307 1 43 . 1 1 9 9 THR C C 9 175.520 175.520 175.801 -0.281 17919 17308 1 43 . 1 1 9 9 THR CA C 9 61.400 61.400 62.005 -0.605 17919 17309 1 43 . 1 1 9 9 THR CB C 9 69.140 69.140 69.633 -0.493 17919 17310 1 43 . 1 1 9 9 THR H H 9 7.630 7.630 7.678 -0.048 17919 17311 1 43 . 1 1 10 10 GLY N N 10 108.890 108.890 110.842 -1.952 17919 17312 1 43 . 1 1 10 10 GLY C C 10 174.070 174.070 173.628 0.442 17919 17313 1 43 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.684 0.776 17919 17314 1 43 . 1 1 10 10 GLY H H 10 7.810 7.810 7.917 -0.107 17919 17315 1 43 . 1 1 11 11 LYS N N 11 121.600 121.600 122.899 -1.299 17919 17316 1 43 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.449 -0.088 17919 17317 1 43 . 1 1 11 11 LYS C C 11 175.940 175.940 175.336 0.604 17919 17318 1 43 . 1 1 11 11 LYS CA C 11 56.280 56.280 55.405 0.875 17919 17319 1 43 . 1 1 11 11 LYS CB C 11 33.200 33.200 32.988 0.212 17919 17320 1 43 . 1 1 11 11 LYS H H 11 7.280 7.280 7.947 -0.667 17919 17321 1 43 . 1 1 12 12 THR N N 12 120.440 120.440 122.288 -1.848 17919 17322 1 43 . 1 1 12 12 THR HA H 12 5.046 5.046 4.909 0.137 17919 17323 1 43 . 1 1 12 12 THR C C 12 174.320 174.320 174.471 -0.151 17919 17324 1 43 . 1 1 12 12 THR CA C 12 62.390 62.390 61.714 0.676 17919 17325 1 43 . 1 1 12 12 THR CB C 12 69.910 69.910 69.603 0.307 17919 17326 1 43 . 1 1 12 12 THR H H 12 8.650 8.650 8.342 0.308 17919 17327 1 43 . 1 1 13 13 ILE N N 13 127.110 127.110 123.589 3.521 17919 17328 1 43 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.757 -0.213 17919 17329 1 43 . 1 1 13 13 ILE C C 13 175.220 175.220 173.853 1.367 17919 17330 1 43 . 1 1 13 13 ILE CA C 13 59.980 59.980 58.809 1.171 17919 17331 1 43 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.154 -0.204 17919 17332 1 43 . 1 1 13 13 ILE H H 13 9.450 9.450 8.999 0.451 17919 17333 1 43 . 1 1 14 14 THR N N 14 121.520 121.520 117.658 3.862 17919 17334 1 43 . 1 1 14 14 THR HA H 14 4.964 4.964 5.224 -0.260 17919 17335 1 43 . 1 1 14 14 THR C C 14 173.790 173.790 173.636 0.154 17919 17336 1 43 . 1 1 14 14 THR CA C 14 61.940 61.940 61.426 0.514 17919 17337 1 43 . 1 1 14 14 THR CB C 14 69.650 69.650 70.343 -0.693 17919 17338 1 43 . 1 1 14 14 THR H H 14 8.710 8.710 8.280 0.430 17919 17339 1 43 . 1 1 15 15 LEU N N 15 124.800 124.800 124.562 0.238 17919 17340 1 43 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.732 0.048 17919 17341 1 43 . 1 1 15 15 LEU C C 15 174.670 174.670 174.980 -0.310 17919 17342 1 43 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.597 -0.767 17919 17343 1 43 . 1 1 15 15 LEU CB C 15 47.070 47.070 44.307 2.763 17919 17344 1 43 . 1 1 15 15 LEU H H 15 8.710 8.710 8.326 0.384 17919 17345 1 43 . 1 1 16 16 GLU N N 16 122.160 122.160 124.649 -2.489 17919 17346 1 43 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.557 0.360 17919 17347 1 43 . 1 1 16 16 GLU C C 16 175.860 175.860 176.071 -0.211 17919 17348 1 43 . 1 1 16 16 GLU CA C 16 54.820 54.820 54.565 0.255 17919 17349 1 43 . 1 1 16 16 GLU CB C 16 29.450 29.450 29.158 0.292 17919 17350 1 43 . 1 1 16 16 GLU H H 16 8.140 8.140 8.626 -0.486 17919 17351 1 43 . 1 1 17 17 VAL N N 17 117.210 117.210 118.690 -1.480 17919 17352 1 43 . 1 1 17 17 VAL HA H 17 4.714 4.714 5.002 -0.288 17919 17353 1 43 . 1 1 17 17 VAL C C 17 174.160 174.160 175.022 -0.862 17919 17354 1 43 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.882 -0.452 17919 17355 1 43 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.248 1.152 17919 17356 1 43 . 1 1 17 17 VAL H H 17 8.900 8.900 8.609 0.291 17919 17357 1 43 . 1 1 18 18 GLU N N 18 118.990 118.990 124.180 -5.190 17919 17358 1 43 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.854 0.225 17919 17359 1 43 . 1 1 18 18 GLU C C 18 176.160 176.160 175.435 0.725 17919 17360 1 43 . 1 1 18 18 GLU CA C 18 52.720 52.720 51.966 0.754 17919 17361 1 43 . 1 1 18 18 GLU CB C 18 30.310 30.310 32.089 -1.779 17919 17362 1 43 . 1 1 18 18 GLU H H 18 8.640 8.640 8.536 0.104 17919 17363 1 43 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.250 -0.109 17919 17364 1 43 . 1 1 19 19 PRO C C 19 175.310 175.310 177.652 -2.342 17919 17365 1 43 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.080 0.390 17919 17366 1 43 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.944 0.006 17919 17367 1 43 . 1 1 20 20 SER N N 20 103.400 103.400 111.036 -7.636 17919 17368 1 43 . 1 1 20 20 SER HA H 20 4.370 4.370 4.162 0.208 17919 17369 1 43 . 1 1 20 20 SER C C 20 174.660 174.660 174.251 0.409 17919 17370 1 43 . 1 1 20 20 SER CA C 20 57.400 57.400 59.953 -2.553 17919 17371 1 43 . 1 1 20 20 SER CB C 20 63.370 63.370 62.879 0.491 17919 17372 1 43 . 1 1 20 20 SER H H 20 7.040 7.040 8.255 -1.215 17919 17373 1 43 . 1 1 21 21 ASP N N 21 123.480 123.480 122.855 0.625 17919 17374 1 43 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.581 0.114 17919 17375 1 43 . 1 1 21 21 ASP C C 21 176.360 176.360 175.809 0.551 17919 17376 1 43 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.623 0.077 17919 17377 1 43 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.751 -0.951 17919 17378 1 43 . 1 1 21 21 ASP H H 21 8.030 8.030 7.819 0.211 17919 17379 1 43 . 1 1 22 22 THR N N 22 108.800 108.800 112.730 -3.930 17919 17380 1 43 . 1 1 22 22 THR HA H 22 4.920 4.920 4.546 0.374 17919 17381 1 43 . 1 1 22 22 THR C C 22 176.750 176.750 176.198 0.552 17919 17382 1 43 . 1 1 22 22 THR CA C 22 59.690 59.690 61.742 -2.052 17919 17383 1 43 . 1 1 22 22 THR CB C 22 71.200 71.200 70.051 1.149 17919 17384 1 43 . 1 1 22 22 THR H H 22 7.900 7.900 8.436 -0.536 17919 17385 1 43 . 1 1 23 23 ILE N N 23 121.190 121.190 122.473 -1.283 17919 17386 1 43 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.738 -0.081 17919 17387 1 43 . 1 1 23 23 ILE C C 23 179.040 179.040 177.921 1.119 17919 17388 1 43 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.327 -1.067 17919 17389 1 43 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.342 -1.992 17919 17390 1 43 . 1 1 23 23 ILE H H 23 8.560 8.560 9.079 -0.519 17919 17391 1 43 . 1 1 24 24 GLU N N 24 120.830 120.830 119.565 1.265 17919 17392 1 43 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.975 -0.058 17919 17393 1 43 . 1 1 24 24 GLU C C 24 178.640 178.640 178.667 -0.027 17919 17394 1 43 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.660 0.560 17919 17395 1 43 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.335 -1.055 17919 17396 1 43 . 1 1 24 24 GLU H H 24 9.760 9.760 8.350 1.410 17919 17397 1 43 . 1 1 25 25 ASN N N 25 120.570 120.570 117.428 3.142 17919 17398 1 43 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.552 -0.027 17919 17399 1 43 . 1 1 25 25 ASN C C 25 178.380 178.380 177.824 0.556 17919 17400 1 43 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.629 0.431 17919 17401 1 43 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.128 0.322 17919 17402 1 43 . 1 1 25 25 ASN H H 25 7.920 7.920 7.515 0.405 17919 17403 1 43 . 1 1 26 26 VAL N N 26 121.710 121.710 118.799 2.911 17919 17404 1 43 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.586 -0.189 17919 17405 1 43 . 1 1 26 26 VAL C C 26 177.950 177.950 177.710 0.240 17919 17406 1 43 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.657 1.003 17919 17407 1 43 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.039 -0.199 17919 17408 1 43 . 1 1 26 26 VAL H H 26 8.070 8.070 8.237 -0.167 17919 17409 1 43 . 1 1 27 27 LYS N N 27 118.860 118.860 118.591 0.269 17919 17410 1 43 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.230 0.350 17919 17411 1 43 . 1 1 27 27 LYS C C 27 180.550 180.550 178.951 1.599 17919 17412 1 43 . 1 1 27 27 LYS CA C 27 59.250 59.250 58.951 0.299 17919 17413 1 43 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.000 1.730 17919 17414 1 43 . 1 1 27 27 LYS H H 27 8.560 8.560 7.375 1.185 17919 17415 1 43 . 1 1 28 28 ALA N N 28 123.440 123.440 122.734 0.706 17919 17416 1 43 . 1 1 28 28 ALA HA H 28 4.160 4.160 3.983 0.177 17919 17417 1 43 . 1 1 28 28 ALA C C 28 180.300 180.300 178.942 1.358 17919 17418 1 43 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.617 -0.247 17919 17419 1 43 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.374 -0.664 17919 17420 1 43 . 1 1 28 28 ALA H H 28 8.060 8.060 7.870 0.190 17919 17421 1 43 . 1 1 29 29 LYS N N 29 119.940 119.940 117.992 1.948 17919 17422 1 43 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.157 0.050 17919 17423 1 43 . 1 1 29 29 LYS C C 29 180.320 180.320 179.233 1.087 17919 17424 1 43 . 1 1 29 29 LYS CA C 29 59.650 59.650 58.534 1.116 17919 17425 1 43 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.523 0.767 17919 17426 1 43 . 1 1 29 29 LYS H H 29 7.850 7.850 7.492 0.358 17919 17427 1 43 . 1 1 30 30 ILE N N 30 121.080 121.080 121.560 -0.480 17919 17428 1 43 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.522 -0.015 17919 17429 1 43 . 1 1 30 30 ILE C C 30 178.310 178.310 177.396 0.914 17919 17430 1 43 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.341 0.809 17919 17431 1 43 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.309 -0.509 17919 17432 1 43 . 1 1 30 30 ILE H H 30 8.280 8.280 7.733 0.547 17919 17433 1 43 . 1 1 31 31 GLN N N 31 123.490 123.490 120.138 3.352 17919 17434 1 43 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.128 -0.299 17919 17435 1 43 . 1 1 31 31 GLN C C 31 178.890 178.890 178.779 0.111 17919 17436 1 43 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.106 0.894 17919 17437 1 43 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.310 -0.590 17919 17438 1 43 . 1 1 31 31 GLN H H 31 8.580 8.580 8.162 0.418 17919 17439 1 43 . 1 1 32 32 ASP N N 32 119.360 119.360 119.238 0.122 17919 17440 1 43 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.399 -0.045 17919 17441 1 43 . 1 1 32 32 ASP C C 32 177.250 177.250 177.748 -0.498 17919 17442 1 43 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.810 0.380 17919 17443 1 43 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.913 -0.333 17919 17444 1 43 . 1 1 32 32 ASP H H 32 8.010 8.010 8.238 -0.228 17919 17445 1 43 . 1 1 33 33 LYS N N 33 115.130 115.130 117.311 -2.181 17919 17446 1 43 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.328 0.009 17919 17447 1 43 . 1 1 33 33 LYS C C 33 177.870 177.870 178.054 -0.184 17919 17448 1 43 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.775 0.275 17919 17449 1 43 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.771 0.399 17919 17450 1 43 . 1 1 33 33 LYS H H 33 7.430 7.430 7.465 -0.035 17919 17451 1 43 . 1 1 34 34 GLU N N 34 113.870 113.870 115.517 -1.647 17919 17452 1 43 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.319 0.306 17919 17453 1 43 . 1 1 34 34 GLU C C 34 177.840 177.840 177.433 0.407 17919 17454 1 43 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.877 -1.707 17919 17455 1 43 . 1 1 34 34 GLU CB C 34 32.660 32.660 30.633 2.027 17919 17456 1 43 . 1 1 34 34 GLU H H 34 8.740 8.740 8.408 0.332 17919 17457 1 43 . 1 1 35 35 GLY N N 35 108.650 108.650 107.676 0.974 17919 17458 1 43 . 1 1 35 35 GLY C C 35 173.960 173.960 174.263 -0.303 17919 17459 1 43 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.523 0.557 17919 17460 1 43 . 1 1 35 35 GLY H H 35 8.530 8.530 7.804 0.726 17919 17461 1 43 . 1 1 36 36 ILE N N 36 119.880 119.880 121.054 -1.174 17919 17462 1 43 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.495 -0.050 17919 17463 1 43 . 1 1 36 36 ILE C C 36 173.590 173.590 174.155 -0.565 17919 17464 1 43 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.600 0.150 17919 17465 1 43 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.901 1.679 17919 17466 1 43 . 1 1 36 36 ILE H H 36 6.150 6.150 7.641 -1.491 17919 17467 1 43 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.823 -0.189 17919 17468 1 43 . 1 1 37 37 PRO C C 37 176.940 176.940 176.225 0.715 17919 17469 1 43 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.306 0.354 17919 17470 1 43 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.245 0.605 17919 17471 1 43 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.184 -0.067 17919 17472 1 43 . 1 1 38 38 PRO C C 38 178.320 178.320 178.123 0.197 17919 17473 1 43 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.898 0.362 17919 17474 1 43 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.877 1.013 17919 17475 1 43 . 1 1 39 39 ASP N N 39 113.380 113.380 113.813 -0.433 17919 17476 1 43 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.601 -0.171 17919 17477 1 43 . 1 1 39 39 ASP C C 39 177.090 177.090 178.156 -1.066 17919 17478 1 43 . 1 1 39 39 ASP CA C 39 55.640 55.640 54.785 0.855 17919 17479 1 43 . 1 1 39 39 ASP CB C 39 39.540 39.540 39.675 -0.135 17919 17480 1 43 . 1 1 39 39 ASP H H 39 8.550 8.550 8.632 -0.082 17919 17481 1 43 . 1 1 40 40 GLN N N 40 116.780 116.780 120.262 -3.482 17919 17482 1 43 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.378 0.086 17919 17483 1 43 . 1 1 40 40 GLN C C 40 175.380 175.380 175.937 -0.557 17919 17484 1 43 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.617 -0.977 17919 17485 1 43 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.818 0.322 17919 17486 1 43 . 1 1 40 40 GLN H H 40 7.820 7.820 7.860 -0.040 17919 17487 1 43 . 1 1 41 41 GLN N N 41 117.720 117.720 118.959 -1.239 17919 17488 1 43 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.403 -0.159 17919 17489 1 43 . 1 1 41 41 GLN C C 41 176.300 176.300 175.777 0.523 17919 17490 1 43 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.162 0.308 17919 17491 1 43 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.678 1.972 17919 17492 1 43 . 1 1 41 41 GLN H H 41 7.480 7.480 7.636 -0.156 17919 17493 1 43 . 1 1 42 42 ARG N N 42 122.680 122.680 121.147 1.533 17919 17494 1 43 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.691 -0.191 17919 17495 1 43 . 1 1 42 42 ARG C C 42 174.050 174.050 175.067 -1.017 17919 17496 1 43 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.834 0.216 17919 17497 1 43 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.197 -1.447 17919 17498 1 43 . 1 1 42 42 ARG H H 42 8.530 8.530 8.041 0.489 17919 17499 1 43 . 1 1 43 43 LEU N N 43 124.040 124.040 124.216 -0.176 17919 17500 1 43 . 1 1 43 43 LEU C C 43 175.290 175.290 175.983 -0.693 17919 17501 1 43 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.319 -1.339 17919 17502 1 43 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.506 2.284 17919 17503 1 43 . 1 1 43 43 LEU H H 43 8.820 8.820 8.471 0.349 17919 17504 1 43 . 1 1 44 44 ILE N N 44 121.920 121.920 121.643 0.277 17919 17505 1 43 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.806 0.186 17919 17506 1 43 . 1 1 44 44 ILE C C 44 176.060 176.060 174.442 1.618 17919 17507 1 43 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.448 -1.468 17919 17508 1 43 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.899 -0.479 17919 17509 1 43 . 1 1 44 44 ILE H H 44 9.030 9.030 9.023 0.007 17919 17510 1 43 . 1 1 45 45 PHE N N 45 125.390 125.390 126.645 -1.255 17919 17511 1 43 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.014 0.031 17919 17512 1 43 . 1 1 45 45 PHE C C 45 174.470 174.470 174.350 0.120 17919 17513 1 43 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.418 0.602 17919 17514 1 43 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.957 0.803 17919 17515 1 43 . 1 1 45 45 PHE H H 45 8.830 8.830 9.136 -0.306 17919 17516 1 43 . 1 1 46 46 ALA N N 46 132.200 132.200 129.646 2.554 17919 17517 1 43 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.642 0.048 17919 17518 1 43 . 1 1 46 46 ALA C C 46 177.290 177.290 177.825 -0.535 17919 17519 1 43 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.386 0.154 17919 17520 1 43 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.413 0.157 17919 17521 1 43 . 1 1 46 46 ALA H H 46 8.810 8.810 8.722 0.088 17919 17522 1 43 . 1 1 47 47 GLY N N 47 102.340 102.340 104.773 -2.433 17919 17523 1 43 . 1 1 47 47 GLY C C 47 173.810 173.810 174.366 -0.556 17919 17524 1 43 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.398 -0.048 17919 17525 1 43 . 1 1 47 47 GLY H H 47 8.130 8.130 8.589 -0.459 17919 17526 1 43 . 1 1 48 48 LYS N N 48 121.570 121.570 120.398 1.172 17919 17527 1 43 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.462 0.160 17919 17528 1 43 . 1 1 48 48 LYS C C 48 174.700 174.700 175.284 -0.584 17919 17529 1 43 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.867 -0.317 17919 17530 1 43 . 1 1 48 48 LYS CB C 48 34.530 34.530 33.983 0.547 17919 17531 1 43 . 1 1 48 48 LYS H H 48 7.980 7.980 7.667 0.313 17919 17532 1 43 . 1 1 49 49 GLN N N 49 122.410 122.410 125.009 -2.599 17919 17533 1 43 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.154 0.406 17919 17534 1 43 . 1 1 49 49 GLN C C 49 175.670 175.670 175.307 0.363 17919 17535 1 43 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.282 -0.542 17919 17536 1 43 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.181 -0.181 17919 17537 1 43 . 1 1 49 49 GLN H H 49 8.600 8.600 8.577 0.023 17919 17538 1 43 . 1 1 50 50 LEU N N 50 125.520 125.520 127.744 -2.224 17919 17539 1 43 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.215 -0.125 17919 17540 1 43 . 1 1 50 50 LEU C C 50 176.660 176.660 176.535 0.125 17919 17541 1 43 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.712 -0.472 17919 17542 1 43 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.301 -0.731 17919 17543 1 43 . 1 1 50 50 LEU H H 50 8.530 8.530 8.719 -0.189 17919 17544 1 43 . 1 1 51 51 GLU N N 51 122.940 122.940 123.601 -0.661 17919 17545 1 43 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.426 0.062 17919 17546 1 43 . 1 1 51 51 GLU C C 51 175.870 175.870 176.899 -1.029 17919 17547 1 43 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.875 0.085 17919 17548 1 43 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.232 0.338 17919 17549 1 43 . 1 1 51 51 GLU H H 51 8.400 8.400 8.652 -0.252 17919 17550 1 43 . 1 1 52 52 ASP N N 52 120.030 120.030 126.936 -6.906 17919 17551 1 43 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.606 -0.247 17919 17552 1 43 . 1 1 52 52 ASP C C 52 177.330 177.330 176.372 0.958 17919 17553 1 43 . 1 1 52 52 ASP CA C 52 56.960 56.960 55.896 1.064 17919 17554 1 43 . 1 1 52 52 ASP CB C 52 40.850 40.850 41.053 -0.203 17919 17555 1 43 . 1 1 52 52 ASP H H 52 8.160 8.160 8.845 -0.685 17919 17556 1 43 . 1 1 53 53 GLY N N 53 106.660 106.660 105.451 1.209 17919 17557 1 43 . 1 1 53 53 GLY C C 53 174.870 174.870 174.015 0.855 17919 17558 1 43 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.645 0.525 17919 17559 1 43 . 1 1 53 53 GLY H H 53 9.390 9.390 8.448 0.942 17919 17560 1 43 . 1 1 54 54 ARG N N 54 119.050 119.050 120.713 -1.663 17919 17561 1 43 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.598 0.097 17919 17562 1 43 . 1 1 54 54 ARG C C 54 175.350 175.350 175.444 -0.094 17919 17563 1 43 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.567 -0.177 17919 17564 1 43 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.941 -0.291 17919 17565 1 43 . 1 1 54 54 ARG H H 54 7.460 7.460 7.501 -0.041 17919 17566 1 43 . 1 1 55 55 THR N N 55 108.400 108.400 112.055 -3.655 17919 17567 1 43 . 1 1 55 55 THR HA H 55 5.240 5.240 4.743 0.497 17919 17568 1 43 . 1 1 55 55 THR C C 55 176.560 176.560 176.285 0.275 17919 17569 1 43 . 1 1 55 55 THR CA C 55 59.690 59.690 60.971 -1.282 17919 17570 1 43 . 1 1 55 55 THR CB C 55 72.260 72.260 70.396 1.864 17919 17571 1 43 . 1 1 55 55 THR H H 55 8.730 8.730 8.638 0.092 17919 17572 1 43 . 1 1 56 56 LEU N N 56 117.920 117.920 120.252 -2.332 17919 17573 1 43 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.043 0.017 17919 17574 1 43 . 1 1 56 56 LEU C C 56 180.810 180.810 178.730 2.080 17919 17575 1 43 . 1 1 56 56 LEU CA C 56 58.710 58.710 57.998 0.712 17919 17576 1 43 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.337 -0.966 17919 17577 1 43 . 1 1 56 56 LEU H H 56 8.140 8.140 8.221 -0.081 17919 17578 1 43 . 1 1 57 57 SER N N 57 113.330 113.330 116.370 -3.040 17919 17579 1 43 . 1 1 57 57 SER HA H 57 4.370 4.370 4.131 0.239 17919 17580 1 43 . 1 1 57 57 SER C C 57 178.310 178.310 176.866 1.444 17919 17581 1 43 . 1 1 57 57 SER CA C 57 61.080 61.080 62.218 -1.138 17919 17582 1 43 . 1 1 57 57 SER CB C 57 62.530 62.530 62.731 -0.201 17919 17583 1 43 . 1 1 57 57 SER H H 57 8.470 8.470 7.956 0.514 17919 17584 1 43 . 1 1 58 58 ASP N N 58 124.190 124.190 121.707 2.483 17919 17585 1 43 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.327 -0.031 17919 17586 1 43 . 1 1 58 58 ASP C C 58 177.400 177.400 176.719 0.681 17919 17587 1 43 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.891 0.289 17919 17588 1 43 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.444 -0.345 17919 17589 1 43 . 1 1 58 58 ASP H H 58 7.930 7.930 7.954 -0.024 17919 17590 1 43 . 1 1 59 59 TYR N N 59 115.510 115.510 114.032 1.478 17919 17591 1 43 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.645 0.025 17919 17592 1 43 . 1 1 59 59 TYR C C 59 174.700 174.700 175.323 -0.623 17919 17593 1 43 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.337 0.912 17919 17594 1 43 . 1 1 59 59 TYR CB C 59 40.070 40.070 39.054 1.016 17919 17595 1 43 . 1 1 59 59 TYR H H 59 7.250 7.250 7.238 0.012 17919 17596 1 43 . 1 1 60 60 ASN N N 60 115.900 115.900 117.357 -1.457 17919 17597 1 43 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.376 -0.021 17919 17598 1 43 . 1 1 60 60 ASN C C 60 174.340 174.340 174.435 -0.095 17919 17599 1 43 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.418 -0.298 17919 17600 1 43 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.579 -0.169 17919 17601 1 43 . 1 1 60 60 ASN H H 60 8.150 8.150 7.967 0.183 17919 17602 1 43 . 1 1 61 61 ILE N N 61 118.600 118.600 119.754 -1.154 17919 17603 1 43 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.798 -0.405 17919 17604 1 43 . 1 1 61 61 ILE C C 61 174.610 174.610 175.232 -0.622 17919 17605 1 43 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.913 0.507 17919 17606 1 43 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.626 -0.886 17919 17607 1 43 . 1 1 61 61 ILE H H 61 7.250 7.250 7.882 -0.632 17919 17608 1 43 . 1 1 62 62 GLN N N 62 124.740 124.740 126.348 -1.608 17919 17609 1 43 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.713 -0.207 17919 17610 1 43 . 1 1 62 62 GLN C C 62 175.970 175.970 175.498 0.472 17919 17611 1 43 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.697 -0.037 17919 17612 1 43 . 1 1 62 62 GLN CB C 62 31.650 31.650 30.930 0.720 17919 17613 1 43 . 1 1 62 62 GLN H H 62 7.610 7.610 7.963 -0.353 17919 17614 1 43 . 1 1 63 63 LYS N N 63 120.300 120.300 119.380 0.920 17919 17615 1 43 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.119 -0.118 17919 17616 1 43 . 1 1 63 63 LYS C C 63 175.810 175.810 176.628 -0.818 17919 17617 1 43 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.058 0.732 17919 17618 1 43 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.194 0.457 17919 17619 1 43 . 1 1 63 63 LYS H H 63 8.490 8.490 8.318 0.172 17919 17620 1 43 . 1 1 64 64 GLU N N 64 113.950 113.950 117.954 -4.004 17919 17621 1 43 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.661 -0.196 17919 17622 1 43 . 1 1 64 64 GLU C C 64 175.250 175.250 175.628 -0.378 17919 17623 1 43 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.705 0.185 17919 17624 1 43 . 1 1 64 64 GLU CB C 64 25.900 25.900 27.776 -1.876 17919 17625 1 43 . 1 1 64 64 GLU H H 64 9.280 9.280 8.523 0.757 17919 17626 1 43 . 1 1 65 65 SER N N 65 114.730 114.730 113.804 0.926 17919 17627 1 43 . 1 1 65 65 SER HA H 65 4.640 4.640 4.504 0.136 17919 17628 1 43 . 1 1 65 65 SER C C 65 172.160 172.160 174.004 -1.844 17919 17629 1 43 . 1 1 65 65 SER CA C 65 60.890 60.890 60.286 0.604 17919 17630 1 43 . 1 1 65 65 SER CB C 65 64.910 64.910 64.029 0.881 17919 17631 1 43 . 1 1 65 65 SER H H 65 7.670 7.670 7.585 0.085 17919 17632 1 43 . 1 1 66 66 THR N N 66 117.110 117.110 118.887 -1.777 17919 17633 1 43 . 1 1 66 66 THR HA H 66 5.270 5.270 5.123 0.147 17919 17634 1 43 . 1 1 66 66 THR C C 66 173.950 173.950 173.870 0.080 17919 17635 1 43 . 1 1 66 66 THR CA C 66 62.340 62.340 62.324 0.016 17919 17636 1 43 . 1 1 66 66 THR CB C 66 70.080 70.080 69.876 0.203 17919 17637 1 43 . 1 1 66 66 THR H H 66 8.730 8.730 8.407 0.323 17919 17638 1 43 . 1 1 67 67 LEU N N 67 127.110 127.110 127.010 0.100 17919 17639 1 43 . 1 1 67 67 LEU HA H 67 5.060 5.060 5.186 -0.126 17919 17640 1 43 . 1 1 67 67 LEU C C 67 175.770 175.770 175.699 0.071 17919 17641 1 43 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.751 0.149 17919 17642 1 43 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.751 -0.491 17919 17643 1 43 . 1 1 67 67 LEU H H 67 9.410 9.410 9.000 0.410 17919 17644 1 43 . 1 1 68 68 HIS N N 68 118.380 118.380 120.382 -2.002 17919 17645 1 43 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.475 -0.235 17919 17646 1 43 . 1 1 68 68 HIS C C 68 173.150 173.150 174.055 -0.905 17919 17647 1 43 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.564 0.436 17919 17648 1 43 . 1 1 68 68 HIS CB C 68 30.530 30.530 33.338 -2.808 17919 17649 1 43 . 1 1 68 68 HIS H H 68 9.230 9.230 9.008 0.222 17919 17650 1 43 . 1 1 69 69 LEU N N 69 124.460 124.460 121.554 2.906 17919 17651 1 43 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.235 -0.045 17919 17652 1 43 . 1 1 69 69 LEU C C 69 175.270 175.270 174.206 1.064 17919 17653 1 43 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.388 -0.498 17919 17654 1 43 . 1 1 69 69 LEU CB C 69 44.380 44.380 45.497 -1.117 17919 17655 1 43 . 1 1 69 69 LEU H H 69 8.340 8.340 7.121 1.219 17919 17656 1 43 . 1 1 70 70 VAL N N 70 126.940 126.940 119.623 7.317 17919 17657 1 43 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.610 -0.260 17919 17658 1 43 . 1 1 70 70 VAL C C 70 174.000 174.000 173.995 0.005 17919 17659 1 43 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.017 0.783 17919 17660 1 43 . 1 1 70 70 VAL CB C 70 34.910 34.910 34.777 0.133 17919 17661 1 43 . 1 1 70 70 VAL H H 70 9.200 9.200 7.963 1.237 17919 17662 1 43 . 1 1 71 71 LEU N N 71 123.130 123.130 120.329 2.801 17919 17663 1 43 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.725 0.335 17919 17664 1 43 . 1 1 71 71 LEU C C 71 177.830 177.830 177.227 0.603 17919 17665 1 43 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.100 0.840 17919 17666 1 43 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.248 -0.398 17919 17667 1 43 . 1 1 71 71 LEU H H 71 8.120 8.120 8.125 -0.005 17919 17668 1 43 . 1 1 72 72 ARG N N 72 123.490 123.490 123.291 0.199 17919 17669 1 43 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.272 0.029 17919 17670 1 43 . 1 1 72 72 ARG C C 72 175.350 175.350 175.780 -0.430 17919 17671 1 43 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.103 -0.493 17919 17672 1 43 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.148 1.202 17919 17673 1 43 . 1 1 72 72 ARG H H 72 8.580 8.580 8.056 0.524 17919 17674 1 44 . 1 1 2 2 GLN N N 2 123.220 123.220 120.969 2.251 17919 17675 1 44 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.161 0.088 17919 17676 1 44 . 1 1 2 2 GLN C C 2 175.920 175.920 174.997 0.923 17919 17677 1 44 . 1 1 2 2 GLN CA C 2 55.080 55.080 55.215 -0.135 17919 17678 1 44 . 1 1 2 2 GLN CB C 2 30.760 30.760 29.677 1.083 17919 17679 1 44 . 1 1 2 2 GLN H H 2 8.900 8.900 8.562 0.338 17919 17680 1 44 . 1 1 3 3 ILE N N 3 115.340 115.340 114.399 0.941 17919 17681 1 44 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.038 0.175 17919 17682 1 44 . 1 1 3 3 ILE C C 3 172.450 172.450 173.653 -1.203 17919 17683 1 44 . 1 1 3 3 ILE CA C 3 59.570 59.570 60.053 -0.483 17919 17684 1 44 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.888 0.322 17919 17685 1 44 . 1 1 3 3 ILE H H 3 8.320 8.320 8.037 0.283 17919 17686 1 44 . 1 1 4 4 PHE N N 4 118.110 118.110 120.482 -2.372 17919 17687 1 44 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.114 0.516 17919 17688 1 44 . 1 1 4 4 PHE C C 4 175.320 175.320 175.286 0.034 17919 17689 1 44 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.252 -0.042 17919 17690 1 44 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.745 -0.265 17919 17691 1 44 . 1 1 4 4 PHE H H 4 8.610 8.610 8.702 -0.092 17919 17692 1 44 . 1 1 5 5 VAL N N 5 121.000 121.000 123.136 -2.136 17919 17693 1 44 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.546 0.179 17919 17694 1 44 . 1 1 5 5 VAL C C 5 174.870 174.870 174.827 0.043 17919 17695 1 44 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.980 -1.360 17919 17696 1 44 . 1 1 5 5 VAL CB C 5 34.230 34.230 32.557 1.673 17919 17697 1 44 . 1 1 5 5 VAL H H 5 9.300 9.300 8.606 0.694 17919 17698 1 44 . 1 1 6 6 LYS N N 6 127.520 127.520 129.345 -1.825 17919 17699 1 44 . 1 1 6 6 LYS HA H 6 5.367 5.367 4.985 0.382 17919 17700 1 44 . 1 1 6 6 LYS C C 6 177.140 177.140 176.232 0.908 17919 17701 1 44 . 1 1 6 6 LYS CA C 6 54.520 54.520 55.296 -0.776 17919 17702 1 44 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.749 0.301 17919 17703 1 44 . 1 1 6 6 LYS H H 6 8.820 8.820 8.789 0.031 17919 17704 1 44 . 1 1 7 7 THR N N 7 115.400 115.400 118.196 -2.796 17919 17705 1 44 . 1 1 7 7 THR HA H 7 4.970 4.970 4.364 0.606 17919 17706 1 44 . 1 1 7 7 THR C C 7 176.910 176.910 176.430 0.480 17919 17707 1 44 . 1 1 7 7 THR CA C 7 60.470 60.470 60.683 -0.213 17919 17708 1 44 . 1 1 7 7 THR CB C 7 70.630 70.630 70.020 0.609 17919 17709 1 44 . 1 1 7 7 THR H H 7 8.730 8.730 8.847 -0.117 17919 17710 1 44 . 1 1 8 8 LEU N N 8 121.330 121.330 120.172 1.158 17919 17711 1 44 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.268 0.042 17919 17712 1 44 . 1 1 8 8 LEU C C 8 178.800 178.800 177.590 1.210 17919 17713 1 44 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.767 -0.187 17919 17714 1 44 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.736 0.234 17919 17715 1 44 . 1 1 8 8 LEU H H 8 9.100 9.100 8.421 0.679 17919 17716 1 44 . 1 1 9 9 THR N N 9 105.590 105.590 107.708 -2.118 17919 17717 1 44 . 1 1 9 9 THR HA H 9 4.428 4.428 4.384 0.044 17919 17718 1 44 . 1 1 9 9 THR C C 9 175.520 175.520 175.921 -0.401 17919 17719 1 44 . 1 1 9 9 THR CA C 9 61.400 61.400 62.187 -0.787 17919 17720 1 44 . 1 1 9 9 THR CB C 9 69.140 69.140 69.534 -0.394 17919 17721 1 44 . 1 1 9 9 THR H H 9 7.630 7.630 7.712 -0.082 17919 17722 1 44 . 1 1 10 10 GLY N N 10 108.890 108.890 110.912 -2.022 17919 17723 1 44 . 1 1 10 10 GLY C C 10 174.070 174.070 174.076 -0.006 17919 17724 1 44 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.235 0.225 17919 17725 1 44 . 1 1 10 10 GLY H H 10 7.810 7.810 7.727 0.083 17919 17726 1 44 . 1 1 11 11 LYS N N 11 121.600 121.600 121.077 0.523 17919 17727 1 44 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.228 0.133 17919 17728 1 44 . 1 1 11 11 LYS C C 11 175.940 175.940 175.783 0.157 17919 17729 1 44 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.810 -0.530 17919 17730 1 44 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.137 0.063 17919 17731 1 44 . 1 1 11 11 LYS H H 11 7.280 7.280 7.672 -0.392 17919 17732 1 44 . 1 1 12 12 THR N N 12 120.440 120.440 122.551 -2.111 17919 17733 1 44 . 1 1 12 12 THR HA H 12 5.046 5.046 5.333 -0.287 17919 17734 1 44 . 1 1 12 12 THR C C 12 174.320 174.320 174.466 -0.146 17919 17735 1 44 . 1 1 12 12 THR CA C 12 62.390 62.390 61.190 1.200 17919 17736 1 44 . 1 1 12 12 THR CB C 12 69.910 69.910 70.050 -0.140 17919 17737 1 44 . 1 1 12 12 THR H H 12 8.650 8.650 8.403 0.247 17919 17738 1 44 . 1 1 13 13 ILE N N 13 127.110 127.110 123.825 3.285 17919 17739 1 44 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.686 -0.142 17919 17740 1 44 . 1 1 13 13 ILE C C 13 175.220 175.220 174.805 0.415 17919 17741 1 44 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.801 0.179 17919 17742 1 44 . 1 1 13 13 ILE CB C 13 40.950 40.950 39.903 1.047 17919 17743 1 44 . 1 1 13 13 ILE H H 13 9.450 9.450 8.962 0.488 17919 17744 1 44 . 1 1 14 14 THR N N 14 121.520 121.520 119.806 1.714 17919 17745 1 44 . 1 1 14 14 THR HA H 14 4.964 4.964 4.828 0.136 17919 17746 1 44 . 1 1 14 14 THR C C 14 173.790 173.790 173.218 0.572 17919 17747 1 44 . 1 1 14 14 THR CA C 14 61.940 61.940 62.437 -0.497 17919 17748 1 44 . 1 1 14 14 THR CB C 14 69.650 69.650 70.245 -0.595 17919 17749 1 44 . 1 1 14 14 THR H H 14 8.710 8.710 8.335 0.376 17919 17750 1 44 . 1 1 15 15 LEU N N 15 124.800 124.800 126.286 -1.486 17919 17751 1 44 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.692 0.088 17919 17752 1 44 . 1 1 15 15 LEU C C 15 174.670 174.670 174.915 -0.245 17919 17753 1 44 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.842 -1.012 17919 17754 1 44 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.927 1.143 17919 17755 1 44 . 1 1 15 15 LEU H H 15 8.710 8.710 8.361 0.349 17919 17756 1 44 . 1 1 16 16 GLU N N 16 122.160 122.160 125.600 -3.440 17919 17757 1 44 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.414 0.503 17919 17758 1 44 . 1 1 16 16 GLU C C 16 175.860 175.860 175.852 0.008 17919 17759 1 44 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.735 -0.915 17919 17760 1 44 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.059 -0.609 17919 17761 1 44 . 1 1 16 16 GLU H H 16 8.140 8.140 8.746 -0.606 17919 17762 1 44 . 1 1 17 17 VAL N N 17 117.210 117.210 121.623 -4.413 17919 17763 1 44 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.917 -0.203 17919 17764 1 44 . 1 1 17 17 VAL C C 17 174.160 174.160 175.687 -1.527 17919 17765 1 44 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.673 -0.243 17919 17766 1 44 . 1 1 17 17 VAL CB C 17 36.400 36.400 34.711 1.689 17919 17767 1 44 . 1 1 17 17 VAL H H 17 8.900 8.900 8.562 0.338 17919 17768 1 44 . 1 1 18 18 GLU N N 18 118.990 118.990 117.045 1.945 17919 17769 1 44 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.792 0.287 17919 17770 1 44 . 1 1 18 18 GLU C C 18 176.160 176.160 174.685 1.475 17919 17771 1 44 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.519 -0.798 17919 17772 1 44 . 1 1 18 18 GLU CB C 18 30.310 30.310 32.184 -1.873 17919 17773 1 44 . 1 1 18 18 GLU H H 18 8.640 8.640 7.958 0.682 17919 17774 1 44 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.497 -0.356 17919 17775 1 44 . 1 1 19 19 PRO C C 19 175.310 175.310 177.154 -1.844 17919 17776 1 44 . 1 1 19 19 PRO CA C 19 65.470 65.470 64.388 1.082 17919 17777 1 44 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.017 -0.067 17919 17778 1 44 . 1 1 20 20 SER N N 20 103.400 103.400 112.308 -8.908 17919 17779 1 44 . 1 1 20 20 SER HA H 20 4.370 4.370 4.445 -0.075 17919 17780 1 44 . 1 1 20 20 SER C C 20 174.660 174.660 174.441 0.219 17919 17781 1 44 . 1 1 20 20 SER CA C 20 57.400 57.400 58.544 -1.144 17919 17782 1 44 . 1 1 20 20 SER CB C 20 63.370 63.370 62.691 0.679 17919 17783 1 44 . 1 1 20 20 SER H H 20 7.040 7.040 7.954 -0.914 17919 17784 1 44 . 1 1 21 21 ASP N N 21 123.480 123.480 123.364 0.116 17919 17785 1 44 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.720 -0.025 17919 17786 1 44 . 1 1 21 21 ASP C C 21 176.360 176.360 175.777 0.583 17919 17787 1 44 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.140 0.560 17919 17788 1 44 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.611 -0.811 17919 17789 1 44 . 1 1 21 21 ASP H H 21 8.030 8.030 7.589 0.441 17919 17790 1 44 . 1 1 22 22 THR N N 22 108.800 108.800 111.622 -2.822 17919 17791 1 44 . 1 1 22 22 THR HA H 22 4.920 4.920 4.583 0.337 17919 17792 1 44 . 1 1 22 22 THR C C 22 176.750 176.750 175.779 0.971 17919 17793 1 44 . 1 1 22 22 THR CA C 22 59.690 59.690 60.726 -1.036 17919 17794 1 44 . 1 1 22 22 THR CB C 22 71.200 71.200 71.149 0.051 17919 17795 1 44 . 1 1 22 22 THR H H 22 7.900 7.900 8.071 -0.171 17919 17796 1 44 . 1 1 23 23 ILE N N 23 121.190 121.190 122.902 -1.712 17919 17797 1 44 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.720 -0.063 17919 17798 1 44 . 1 1 23 23 ILE C C 23 179.040 179.040 177.751 1.289 17919 17799 1 44 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.099 0.161 17919 17800 1 44 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.213 -1.863 17919 17801 1 44 . 1 1 23 23 ILE H H 23 8.560 8.560 8.473 0.087 17919 17802 1 44 . 1 1 24 24 GLU N N 24 120.830 120.830 119.057 1.773 17919 17803 1 44 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.900 0.017 17919 17804 1 44 . 1 1 24 24 GLU C C 24 178.640 178.640 178.664 -0.024 17919 17805 1 44 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.544 0.676 17919 17806 1 44 . 1 1 24 24 GLU CB C 24 28.280 28.280 28.667 -0.387 17919 17807 1 44 . 1 1 24 24 GLU H H 24 9.760 9.760 8.926 0.834 17919 17808 1 44 . 1 1 25 25 ASN N N 25 120.570 120.570 118.736 1.834 17919 17809 1 44 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.605 -0.080 17919 17810 1 44 . 1 1 25 25 ASN C C 25 178.380 178.380 177.824 0.556 17919 17811 1 44 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.520 0.540 17919 17812 1 44 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.321 0.129 17919 17813 1 44 . 1 1 25 25 ASN H H 25 7.920 7.920 7.663 0.257 17919 17814 1 44 . 1 1 26 26 VAL N N 26 121.710 121.710 121.072 0.638 17919 17815 1 44 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.515 -0.118 17919 17816 1 44 . 1 1 26 26 VAL C C 26 177.950 177.950 177.935 0.015 17919 17817 1 44 . 1 1 26 26 VAL CA C 26 67.660 67.660 67.022 0.638 17919 17818 1 44 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.480 -0.639 17919 17819 1 44 . 1 1 26 26 VAL H H 26 8.070 8.070 7.690 0.380 17919 17820 1 44 . 1 1 27 27 LYS N N 27 118.860 118.860 119.623 -0.763 17919 17821 1 44 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.159 0.421 17919 17822 1 44 . 1 1 27 27 LYS C C 27 180.550 180.550 179.224 1.326 17919 17823 1 44 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.430 -0.180 17919 17824 1 44 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.322 1.408 17919 17825 1 44 . 1 1 27 27 LYS H H 27 8.560 8.560 8.015 0.545 17919 17826 1 44 . 1 1 28 28 ALA N N 28 123.440 123.440 121.765 1.675 17919 17827 1 44 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.041 0.119 17919 17828 1 44 . 1 1 28 28 ALA C C 28 180.300 180.300 179.123 1.177 17919 17829 1 44 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.035 0.335 17919 17830 1 44 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.373 -0.663 17919 17831 1 44 . 1 1 28 28 ALA H H 28 8.060 8.060 8.651 -0.591 17919 17832 1 44 . 1 1 29 29 LYS N N 29 119.940 119.940 119.178 0.762 17919 17833 1 44 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.039 0.168 17919 17834 1 44 . 1 1 29 29 LYS C C 29 180.320 180.320 179.036 1.284 17919 17835 1 44 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.202 0.449 17919 17836 1 44 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.305 0.985 17919 17837 1 44 . 1 1 29 29 LYS H H 29 7.850 7.850 7.562 0.288 17919 17838 1 44 . 1 1 30 30 ILE N N 30 121.080 121.080 120.176 0.904 17919 17839 1 44 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.706 -0.199 17919 17840 1 44 . 1 1 30 30 ILE C C 30 178.310 178.310 177.436 0.874 17919 17841 1 44 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.090 1.060 17919 17842 1 44 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.670 -0.871 17919 17843 1 44 . 1 1 30 30 ILE H H 30 8.280 8.280 7.964 0.316 17919 17844 1 44 . 1 1 31 31 GLN N N 31 123.490 123.490 121.021 2.469 17919 17845 1 44 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.075 -0.246 17919 17846 1 44 . 1 1 31 31 GLN C C 31 178.890 178.890 178.434 0.456 17919 17847 1 44 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.161 0.839 17919 17848 1 44 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.527 -0.807 17919 17849 1 44 . 1 1 31 31 GLN H H 31 8.580 8.580 8.032 0.548 17919 17850 1 44 . 1 1 32 32 ASP N N 32 119.360 119.360 119.782 -0.422 17919 17851 1 44 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.412 -0.058 17919 17852 1 44 . 1 1 32 32 ASP C C 32 177.250 177.250 177.839 -0.589 17919 17853 1 44 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.693 0.497 17919 17854 1 44 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.828 -0.248 17919 17855 1 44 . 1 1 32 32 ASP H H 32 8.010 8.010 7.815 0.195 17919 17856 1 44 . 1 1 33 33 LYS N N 33 115.130 115.130 119.366 -4.236 17919 17857 1 44 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.136 0.201 17919 17858 1 44 . 1 1 33 33 LYS C C 33 177.870 177.870 177.911 -0.041 17919 17859 1 44 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.549 -0.499 17919 17860 1 44 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.047 1.123 17919 17861 1 44 . 1 1 33 33 LYS H H 33 7.430 7.430 7.568 -0.138 17919 17862 1 44 . 1 1 34 34 GLU N N 34 113.870 113.870 114.123 -0.253 17919 17863 1 44 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.449 0.176 17919 17864 1 44 . 1 1 34 34 GLU C C 34 177.840 177.840 176.617 1.223 17919 17865 1 44 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.601 -0.431 17919 17866 1 44 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.763 0.897 17919 17867 1 44 . 1 1 34 34 GLU H H 34 8.740 8.740 8.056 0.684 17919 17868 1 44 . 1 1 35 35 GLY N N 35 108.650 108.650 108.155 0.495 17919 17869 1 44 . 1 1 35 35 GLY C C 35 173.960 173.960 174.940 -0.980 17919 17870 1 44 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.785 0.295 17919 17871 1 44 . 1 1 35 35 GLY H H 35 8.530 8.530 7.887 0.643 17919 17872 1 44 . 1 1 36 36 ILE N N 36 119.880 119.880 117.879 2.001 17919 17873 1 44 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.604 -0.159 17919 17874 1 44 . 1 1 36 36 ILE C C 36 173.590 173.590 173.784 -0.194 17919 17875 1 44 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.984 -0.234 17919 17876 1 44 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.356 2.224 17919 17877 1 44 . 1 1 36 36 ILE H H 36 6.150 6.150 7.443 -1.293 17919 17878 1 44 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.612 0.022 17919 17879 1 44 . 1 1 37 37 PRO C C 37 176.940 176.940 176.252 0.688 17919 17880 1 44 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.842 -0.182 17919 17881 1 44 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.063 0.787 17919 17882 1 44 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.172 -0.055 17919 17883 1 44 . 1 1 38 38 PRO C C 38 178.320 178.320 177.964 0.356 17919 17884 1 44 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.659 0.601 17919 17885 1 44 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.893 0.997 17919 17886 1 44 . 1 1 39 39 ASP N N 39 113.380 113.380 116.327 -2.947 17919 17887 1 44 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.280 0.150 17919 17888 1 44 . 1 1 39 39 ASP C C 39 177.090 177.090 177.399 -0.309 17919 17889 1 44 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.932 -1.292 17919 17890 1 44 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.615 -1.075 17919 17891 1 44 . 1 1 39 39 ASP H H 39 8.550 8.550 8.599 -0.049 17919 17892 1 44 . 1 1 40 40 GLN N N 40 116.780 116.780 117.356 -0.576 17919 17893 1 44 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.292 0.172 17919 17894 1 44 . 1 1 40 40 GLN C C 40 175.380 175.380 175.926 -0.546 17919 17895 1 44 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.001 -0.361 17919 17896 1 44 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.666 0.474 17919 17897 1 44 . 1 1 40 40 GLN H H 40 7.820 7.820 7.866 -0.046 17919 17898 1 44 . 1 1 41 41 GLN N N 41 117.720 117.720 120.254 -2.534 17919 17899 1 44 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.322 -0.078 17919 17900 1 44 . 1 1 41 41 GLN C C 41 176.300 176.300 176.065 0.235 17919 17901 1 44 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.366 0.104 17919 17902 1 44 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.115 2.535 17919 17903 1 44 . 1 1 41 41 GLN H H 41 7.480 7.480 7.447 0.033 17919 17904 1 44 . 1 1 42 42 ARG N N 42 122.680 122.680 127.686 -5.006 17919 17905 1 44 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.500 0.000 17919 17906 1 44 . 1 1 42 42 ARG C C 42 174.050 174.050 174.781 -0.731 17919 17907 1 44 . 1 1 42 42 ARG CA C 42 55.050 55.050 53.643 1.407 17919 17908 1 44 . 1 1 42 42 ARG CB C 42 31.750 31.750 28.928 2.822 17919 17909 1 44 . 1 1 42 42 ARG H H 42 8.530 8.530 8.507 0.023 17919 17910 1 44 . 1 1 43 43 LEU N N 43 124.040 124.040 126.524 -2.484 17919 17911 1 44 . 1 1 43 43 LEU C C 43 175.290 175.290 175.919 -0.629 17919 17912 1 44 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.620 -1.639 17919 17913 1 44 . 1 1 43 43 LEU CB C 43 45.790 45.790 41.250 4.540 17919 17914 1 44 . 1 1 43 43 LEU H H 43 8.820 8.820 7.851 0.969 17919 17915 1 44 . 1 1 44 44 ILE N N 44 121.920 121.920 121.207 0.713 17919 17916 1 44 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.940 0.052 17919 17917 1 44 . 1 1 44 44 ILE C C 44 176.060 176.060 174.054 2.006 17919 17918 1 44 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.393 -0.413 17919 17919 1 44 . 1 1 44 44 ILE CB C 44 41.420 41.420 40.982 0.438 17919 17920 1 44 . 1 1 44 44 ILE H H 44 9.030 9.030 8.057 0.973 17919 17921 1 44 . 1 1 45 45 PHE N N 45 125.390 125.390 125.672 -0.282 17919 17922 1 44 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.037 0.008 17919 17923 1 44 . 1 1 45 45 PHE C C 45 174.470 174.470 174.518 -0.048 17919 17924 1 44 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.876 0.144 17919 17925 1 44 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.141 0.619 17919 17926 1 44 . 1 1 45 45 PHE H H 45 8.830 8.830 8.660 0.170 17919 17927 1 44 . 1 1 46 46 ALA N N 46 132.200 132.200 130.161 2.039 17919 17928 1 44 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.559 0.131 17919 17929 1 44 . 1 1 46 46 ALA C C 46 177.290 177.290 177.616 -0.326 17919 17930 1 44 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.546 -0.006 17919 17931 1 44 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.337 0.233 17919 17932 1 44 . 1 1 46 46 ALA H H 46 8.810 8.810 8.729 0.081 17919 17933 1 44 . 1 1 47 47 GLY N N 47 102.340 102.340 103.569 -1.229 17919 17934 1 44 . 1 1 47 47 GLY C C 47 173.810 173.810 174.715 -0.905 17919 17935 1 44 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.762 -0.412 17919 17936 1 44 . 1 1 47 47 GLY H H 47 8.130 8.130 8.550 -0.420 17919 17937 1 44 . 1 1 48 48 LYS N N 48 121.570 121.570 122.111 -0.541 17919 17938 1 44 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.649 -0.027 17919 17939 1 44 . 1 1 48 48 LYS C C 48 174.700 174.700 175.788 -1.088 17919 17940 1 44 . 1 1 48 48 LYS CA C 48 54.550 54.550 53.806 0.744 17919 17941 1 44 . 1 1 48 48 LYS CB C 48 34.530 34.530 33.140 1.390 17919 17942 1 44 . 1 1 48 48 LYS H H 48 7.980 7.980 7.995 -0.015 17919 17943 1 44 . 1 1 49 49 GLN N N 49 122.410 122.410 125.096 -2.686 17919 17944 1 44 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.178 0.382 17919 17945 1 44 . 1 1 49 49 GLN C C 49 175.670 175.670 176.323 -0.653 17919 17946 1 44 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.676 -0.936 17919 17947 1 44 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.340 -0.340 17919 17948 1 44 . 1 1 49 49 GLN H H 49 8.600 8.600 8.863 -0.263 17919 17949 1 44 . 1 1 50 50 LEU N N 50 125.520 125.520 126.648 -1.128 17919 17950 1 44 . 1 1 50 50 LEU HA H 50 4.090 4.090 3.505 0.585 17919 17951 1 44 . 1 1 50 50 LEU C C 50 176.660 176.660 176.572 0.088 17919 17952 1 44 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.589 -0.348 17919 17953 1 44 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.221 -0.651 17919 17954 1 44 . 1 1 50 50 LEU H H 50 8.530 8.530 8.188 0.342 17919 17955 1 44 . 1 1 51 51 GLU N N 51 122.940 122.940 117.803 5.137 17919 17956 1 44 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.485 0.003 17919 17957 1 44 . 1 1 51 51 GLU C C 51 175.870 175.870 175.614 0.256 17919 17958 1 44 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.766 0.194 17919 17959 1 44 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.461 -0.891 17919 17960 1 44 . 1 1 51 51 GLU H H 51 8.400 8.400 8.219 0.181 17919 17961 1 44 . 1 1 52 52 ASP N N 52 120.030 120.030 124.922 -4.892 17919 17962 1 44 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.468 -0.109 17919 17963 1 44 . 1 1 52 52 ASP C C 52 177.330 177.330 177.623 -0.293 17919 17964 1 44 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.208 -0.248 17919 17965 1 44 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.933 -0.083 17919 17966 1 44 . 1 1 52 52 ASP H H 52 8.160 8.160 8.850 -0.690 17919 17967 1 44 . 1 1 53 53 GLY N N 53 106.660 106.660 105.274 1.386 17919 17968 1 44 . 1 1 53 53 GLY C C 53 174.870 174.870 174.327 0.543 17919 17969 1 44 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.728 0.442 17919 17970 1 44 . 1 1 53 53 GLY H H 53 9.390 9.390 8.178 1.212 17919 17971 1 44 . 1 1 54 54 ARG N N 54 119.050 119.050 122.383 -3.333 17919 17972 1 44 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.453 0.242 17919 17973 1 44 . 1 1 54 54 ARG C C 54 175.350 175.350 175.942 -0.592 17919 17974 1 44 . 1 1 54 54 ARG CA C 54 54.390 54.390 55.708 -1.318 17919 17975 1 44 . 1 1 54 54 ARG CB C 54 32.650 32.650 31.897 0.753 17919 17976 1 44 . 1 1 54 54 ARG H H 54 7.460 7.460 7.753 -0.293 17919 17977 1 44 . 1 1 55 55 THR N N 55 108.400 108.400 115.672 -7.272 17919 17978 1 44 . 1 1 55 55 THR HA H 55 5.240 5.240 4.745 0.495 17919 17979 1 44 . 1 1 55 55 THR C C 55 176.560 176.560 176.270 0.290 17919 17980 1 44 . 1 1 55 55 THR CA C 55 59.690 59.690 61.171 -1.481 17919 17981 1 44 . 1 1 55 55 THR CB C 55 72.260 72.260 70.336 1.924 17919 17982 1 44 . 1 1 55 55 THR H H 55 8.730 8.730 8.346 0.384 17919 17983 1 44 . 1 1 56 56 LEU N N 56 117.920 117.920 121.767 -3.847 17919 17984 1 44 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.855 0.205 17919 17985 1 44 . 1 1 56 56 LEU C C 56 180.810 180.810 178.869 1.941 17919 17986 1 44 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.736 -0.026 17919 17987 1 44 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.161 -0.791 17919 17988 1 44 . 1 1 56 56 LEU H H 56 8.140 8.140 8.057 0.083 17919 17989 1 44 . 1 1 57 57 SER N N 57 113.330 113.330 114.145 -0.815 17919 17990 1 44 . 1 1 57 57 SER HA H 57 4.370 4.370 4.113 0.257 17919 17991 1 44 . 1 1 57 57 SER C C 57 178.310 178.310 176.866 1.444 17919 17992 1 44 . 1 1 57 57 SER CA C 57 61.080 61.080 61.956 -0.876 17919 17993 1 44 . 1 1 57 57 SER CB C 57 62.530 62.530 62.422 0.108 17919 17994 1 44 . 1 1 57 57 SER H H 57 8.470 8.470 8.028 0.442 17919 17995 1 44 . 1 1 58 58 ASP N N 58 124.190 124.190 122.116 2.074 17919 17996 1 44 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.451 -0.155 17919 17997 1 44 . 1 1 58 58 ASP C C 58 177.400 177.400 177.958 -0.558 17919 17998 1 44 . 1 1 58 58 ASP CA C 58 57.180 57.180 57.050 0.130 17919 17999 1 44 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.892 -0.792 17919 18000 1 44 . 1 1 58 58 ASP H H 58 7.930 7.930 7.600 0.330 17919 18001 1 44 . 1 1 59 59 TYR N N 59 115.510 115.510 116.259 -0.749 17919 18002 1 44 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.484 0.186 17919 18003 1 44 . 1 1 59 59 TYR C C 59 174.700 174.700 175.535 -0.835 17919 18004 1 44 . 1 1 59 59 TYR CA C 59 58.250 58.250 58.854 -0.604 17919 18005 1 44 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.382 1.688 17919 18006 1 44 . 1 1 59 59 TYR H H 59 7.250 7.250 7.752 -0.502 17919 18007 1 44 . 1 1 60 60 ASN N N 60 115.900 115.900 117.074 -1.174 17919 18008 1 44 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.494 -0.139 17919 18009 1 44 . 1 1 60 60 ASN C C 60 174.340 174.340 174.598 -0.258 17919 18010 1 44 . 1 1 60 60 ASN CA C 60 54.120 54.120 53.972 0.148 17919 18011 1 44 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.141 0.269 17919 18012 1 44 . 1 1 60 60 ASN H H 60 8.150 8.150 7.721 0.429 17919 18013 1 44 . 1 1 61 61 ILE N N 61 118.600 118.600 121.141 -2.541 17919 18014 1 44 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.844 -0.451 17919 18015 1 44 . 1 1 61 61 ILE C C 61 174.610 174.610 175.088 -0.478 17919 18016 1 44 . 1 1 61 61 ILE CA C 61 62.420 62.420 60.816 1.604 17919 18017 1 44 . 1 1 61 61 ILE CB C 61 36.740 36.740 35.794 0.946 17919 18018 1 44 . 1 1 61 61 ILE H H 61 7.250 7.250 8.303 -1.053 17919 18019 1 44 . 1 1 62 62 GLN N N 62 124.740 124.740 125.539 -0.799 17919 18020 1 44 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.224 0.282 17919 18021 1 44 . 1 1 62 62 GLN C C 62 175.970 175.970 175.918 0.052 17919 18022 1 44 . 1 1 62 62 GLN CA C 62 53.660 53.660 55.147 -1.487 17919 18023 1 44 . 1 1 62 62 GLN CB C 62 31.650 31.650 29.320 2.330 17919 18024 1 44 . 1 1 62 62 GLN H H 62 7.610 7.610 7.862 -0.252 17919 18025 1 44 . 1 1 63 63 LYS N N 63 120.300 120.300 119.032 1.268 17919 18026 1 44 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.924 0.077 17919 18027 1 44 . 1 1 63 63 LYS C C 63 175.810 175.810 176.483 -0.673 17919 18028 1 44 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.793 -0.003 17919 18029 1 44 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.264 0.386 17919 18030 1 44 . 1 1 63 63 LYS H H 63 8.490 8.490 8.331 0.159 17919 18031 1 44 . 1 1 64 64 GLU N N 64 113.950 113.950 117.629 -3.679 17919 18032 1 44 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.443 0.022 17919 18033 1 44 . 1 1 64 64 GLU C C 64 175.250 175.250 175.273 -0.023 17919 18034 1 44 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.737 0.153 17919 18035 1 44 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.915 -3.014 17919 18036 1 44 . 1 1 64 64 GLU H H 64 9.280 9.280 8.940 0.340 17919 18037 1 44 . 1 1 65 65 SER N N 65 114.730 114.730 116.421 -1.691 17919 18038 1 44 . 1 1 65 65 SER HA H 65 4.640 4.640 4.436 0.204 17919 18039 1 44 . 1 1 65 65 SER C C 65 172.160 172.160 174.299 -2.139 17919 18040 1 44 . 1 1 65 65 SER CA C 65 60.890 60.890 59.980 0.910 17919 18041 1 44 . 1 1 65 65 SER CB C 65 64.910 64.910 63.690 1.220 17919 18042 1 44 . 1 1 65 65 SER H H 65 7.670 7.670 7.442 0.228 17919 18043 1 44 . 1 1 66 66 THR N N 66 117.110 117.110 122.384 -5.274 17919 18044 1 44 . 1 1 66 66 THR HA H 66 5.270 5.270 4.753 0.517 17919 18045 1 44 . 1 1 66 66 THR C C 66 173.950 173.950 174.726 -0.776 17919 18046 1 44 . 1 1 66 66 THR CA C 66 62.340 62.340 63.602 -1.262 17919 18047 1 44 . 1 1 66 66 THR CB C 66 70.080 70.080 69.363 0.717 17919 18048 1 44 . 1 1 66 66 THR H H 66 8.730 8.730 8.648 0.082 17919 18049 1 44 . 1 1 67 67 LEU N N 67 127.110 127.110 127.808 -0.698 17919 18050 1 44 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.852 0.208 17919 18051 1 44 . 1 1 67 67 LEU C C 67 175.770 175.770 175.352 0.418 17919 18052 1 44 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.436 -0.536 17919 18053 1 44 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.995 0.265 17919 18054 1 44 . 1 1 67 67 LEU H H 67 9.410 9.410 9.166 0.244 17919 18055 1 44 . 1 1 68 68 HIS N N 68 118.380 118.380 119.880 -1.500 17919 18056 1 44 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.371 -0.131 17919 18057 1 44 . 1 1 68 68 HIS C C 68 173.150 173.150 173.981 -0.831 17919 18058 1 44 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.479 0.521 17919 18059 1 44 . 1 1 68 68 HIS CB C 68 30.530 30.530 33.445 -2.915 17919 18060 1 44 . 1 1 68 68 HIS H H 68 9.230 9.230 8.924 0.306 17919 18061 1 44 . 1 1 69 69 LEU N N 69 124.460 124.460 123.466 0.994 17919 18062 1 44 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.619 0.571 17919 18063 1 44 . 1 1 69 69 LEU C C 69 175.270 175.270 173.985 1.285 17919 18064 1 44 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.395 -0.505 17919 18065 1 44 . 1 1 69 69 LEU CB C 69 44.380 44.380 45.572 -1.192 17919 18066 1 44 . 1 1 69 69 LEU H H 69 8.340 8.340 7.327 1.013 17919 18067 1 44 . 1 1 70 70 VAL N N 70 126.940 126.940 119.831 7.109 17919 18068 1 44 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.534 -0.184 17919 18069 1 44 . 1 1 70 70 VAL C C 70 174.000 174.000 173.938 0.062 17919 18070 1 44 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.333 1.467 17919 18071 1 44 . 1 1 70 70 VAL CB C 70 34.910 34.910 34.938 -0.028 17919 18072 1 44 . 1 1 70 70 VAL H H 70 9.200 9.200 7.805 1.395 17919 18073 1 44 . 1 1 71 71 LEU N N 71 123.130 123.130 120.821 2.309 17919 18074 1 44 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.869 0.191 17919 18075 1 44 . 1 1 71 71 LEU C C 71 177.830 177.830 176.007 1.823 17919 18076 1 44 . 1 1 71 71 LEU CA C 71 53.940 53.940 54.304 -0.364 17919 18077 1 44 . 1 1 71 71 LEU CB C 71 42.850 42.850 44.321 -1.471 17919 18078 1 44 . 1 1 71 71 LEU H H 71 8.120 8.120 8.213 -0.093 17919 18079 1 44 . 1 1 72 72 ARG N N 72 123.490 123.490 126.189 -2.699 17919 18080 1 44 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.289 0.012 17919 18081 1 44 . 1 1 72 72 ARG C C 72 175.350 175.350 175.347 0.003 17919 18082 1 44 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.053 -0.443 17919 18083 1 44 . 1 1 72 72 ARG CB C 72 31.350 31.350 29.542 1.808 17919 18084 1 44 . 1 1 72 72 ARG H H 72 8.580 8.580 8.280 0.300 17919 18085 1 45 . 1 1 2 2 GLN N N 2 123.220 123.220 121.683 1.537 17919 18086 1 45 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.302 -0.053 17919 18087 1 45 . 1 1 2 2 GLN C C 2 175.920 175.920 174.696 1.224 17919 18088 1 45 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.766 0.315 17919 18089 1 45 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.506 0.254 17919 18090 1 45 . 1 1 2 2 GLN H H 2 8.900 8.900 8.454 0.446 17919 18091 1 45 . 1 1 3 3 ILE N N 3 115.340 115.340 117.488 -2.148 17919 18092 1 45 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.143 0.070 17919 18093 1 45 . 1 1 3 3 ILE C C 3 172.450 172.450 172.845 -0.395 17919 18094 1 45 . 1 1 3 3 ILE CA C 3 59.570 59.570 60.146 -0.576 17919 18095 1 45 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.929 0.281 17919 18096 1 45 . 1 1 3 3 ILE H H 3 8.320 8.320 8.342 -0.022 17919 18097 1 45 . 1 1 4 4 PHE N N 4 118.110 118.110 119.802 -1.692 17919 18098 1 45 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.685 -0.055 17919 18099 1 45 . 1 1 4 4 PHE C C 4 175.320 175.320 174.887 0.433 17919 18100 1 45 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.167 0.043 17919 18101 1 45 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.918 -0.438 17919 18102 1 45 . 1 1 4 4 PHE H H 4 8.610 8.610 8.256 0.354 17919 18103 1 45 . 1 1 5 5 VAL N N 5 121.000 121.000 120.785 0.215 17919 18104 1 45 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.931 -0.206 17919 18105 1 45 . 1 1 5 5 VAL C C 5 174.870 174.870 174.799 0.071 17919 18106 1 45 . 1 1 5 5 VAL CA C 5 60.620 60.620 60.643 -0.023 17919 18107 1 45 . 1 1 5 5 VAL CB C 5 34.230 34.230 35.048 -0.818 17919 18108 1 45 . 1 1 5 5 VAL H H 5 9.300 9.300 8.806 0.494 17919 18109 1 45 . 1 1 6 6 LYS N N 6 127.520 127.520 126.469 1.051 17919 18110 1 45 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.459 -0.092 17919 18111 1 45 . 1 1 6 6 LYS C C 6 177.140 177.140 176.502 0.638 17919 18112 1 45 . 1 1 6 6 LYS CA C 6 54.520 54.520 53.923 0.597 17919 18113 1 45 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.544 -0.494 17919 18114 1 45 . 1 1 6 6 LYS H H 6 8.820 8.820 8.415 0.405 17919 18115 1 45 . 1 1 7 7 THR N N 7 115.400 115.400 114.127 1.273 17919 18116 1 45 . 1 1 7 7 THR HA H 7 4.970 4.970 4.609 0.361 17919 18117 1 45 . 1 1 7 7 THR C C 7 176.910 176.910 176.938 -0.028 17919 18118 1 45 . 1 1 7 7 THR CA C 7 60.470 60.470 60.944 -0.474 17919 18119 1 45 . 1 1 7 7 THR CB C 7 70.630 70.630 70.346 0.284 17919 18120 1 45 . 1 1 7 7 THR H H 7 8.730 8.730 7.969 0.761 17919 18121 1 45 . 1 1 8 8 LEU N N 8 121.330 121.330 119.087 2.243 17919 18122 1 45 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.406 -0.096 17919 18123 1 45 . 1 1 8 8 LEU C C 8 178.800 178.800 177.455 1.345 17919 18124 1 45 . 1 1 8 8 LEU CA C 8 57.580 57.580 58.083 -0.503 17919 18125 1 45 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.640 0.330 17919 18126 1 45 . 1 1 8 8 LEU H H 8 9.100 9.100 8.532 0.568 17919 18127 1 45 . 1 1 9 9 THR N N 9 105.590 105.590 106.978 -1.388 17919 18128 1 45 . 1 1 9 9 THR HA H 9 4.428 4.428 4.368 0.060 17919 18129 1 45 . 1 1 9 9 THR C C 9 175.520 175.520 175.559 -0.039 17919 18130 1 45 . 1 1 9 9 THR CA C 9 61.400 61.400 60.977 0.423 17919 18131 1 45 . 1 1 9 9 THR CB C 9 69.140 69.140 68.403 0.737 17919 18132 1 45 . 1 1 9 9 THR H H 9 7.630 7.630 7.479 0.151 17919 18133 1 45 . 1 1 10 10 GLY N N 10 108.890 108.890 110.135 -1.245 17919 18134 1 45 . 1 1 10 10 GLY C C 10 174.070 174.070 174.402 -0.332 17919 18135 1 45 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.995 0.465 17919 18136 1 45 . 1 1 10 10 GLY H H 10 7.810 7.810 7.549 0.261 17919 18137 1 45 . 1 1 11 11 LYS N N 11 121.600 121.600 121.211 0.389 17919 18138 1 45 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.444 -0.083 17919 18139 1 45 . 1 1 11 11 LYS C C 11 175.940 175.940 175.850 0.090 17919 18140 1 45 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.053 0.227 17919 18141 1 45 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.241 -0.041 17919 18142 1 45 . 1 1 11 11 LYS H H 11 7.280 7.280 7.774 -0.494 17919 18143 1 45 . 1 1 12 12 THR N N 12 120.440 120.440 121.206 -0.766 17919 18144 1 45 . 1 1 12 12 THR HA H 12 5.046 5.046 4.585 0.461 17919 18145 1 45 . 1 1 12 12 THR C C 12 174.320 174.320 174.677 -0.357 17919 18146 1 45 . 1 1 12 12 THR CA C 12 62.390 62.390 62.483 -0.093 17919 18147 1 45 . 1 1 12 12 THR CB C 12 69.910 69.910 68.971 0.939 17919 18148 1 45 . 1 1 12 12 THR H H 12 8.650 8.650 8.360 0.290 17919 18149 1 45 . 1 1 13 13 ILE N N 13 127.110 127.110 129.007 -1.897 17919 18150 1 45 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.372 0.172 17919 18151 1 45 . 1 1 13 13 ILE C C 13 175.220 175.220 175.986 -0.766 17919 18152 1 45 . 1 1 13 13 ILE CA C 13 59.980 59.980 61.240 -1.260 17919 18153 1 45 . 1 1 13 13 ILE CB C 13 40.950 40.950 39.242 1.708 17919 18154 1 45 . 1 1 13 13 ILE H H 13 9.450 9.450 8.693 0.757 17919 18155 1 45 . 1 1 14 14 THR N N 14 121.520 121.520 123.176 -1.656 17919 18156 1 45 . 1 1 14 14 THR HA H 14 4.964 4.964 4.942 0.022 17919 18157 1 45 . 1 1 14 14 THR C C 14 173.790 173.790 173.915 -0.125 17919 18158 1 45 . 1 1 14 14 THR CA C 14 61.940 61.940 61.811 0.129 17919 18159 1 45 . 1 1 14 14 THR CB C 14 69.650 69.650 70.034 -0.384 17919 18160 1 45 . 1 1 14 14 THR H H 14 8.710 8.710 8.267 0.443 17919 18161 1 45 . 1 1 15 15 LEU N N 15 124.800 124.800 126.471 -1.671 17919 18162 1 45 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.714 0.066 17919 18163 1 45 . 1 1 15 15 LEU C C 15 174.670 174.670 175.471 -0.801 17919 18164 1 45 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.807 -0.977 17919 18165 1 45 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.996 1.074 17919 18166 1 45 . 1 1 15 15 LEU H H 15 8.710 8.710 8.532 0.178 17919 18167 1 45 . 1 1 16 16 GLU N N 16 122.160 122.160 124.574 -2.414 17919 18168 1 45 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.856 0.061 17919 18169 1 45 . 1 1 16 16 GLU C C 16 175.860 175.860 175.562 0.298 17919 18170 1 45 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.819 -1.000 17919 18171 1 45 . 1 1 16 16 GLU CB C 16 29.450 29.450 29.611 -0.161 17919 18172 1 45 . 1 1 16 16 GLU H H 16 8.140 8.140 8.640 -0.500 17919 18173 1 45 . 1 1 17 17 VAL N N 17 117.210 117.210 118.480 -1.270 17919 18174 1 45 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.519 0.195 17919 18175 1 45 . 1 1 17 17 VAL C C 17 174.160 174.160 174.686 -0.526 17919 18176 1 45 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.988 -0.558 17919 18177 1 45 . 1 1 17 17 VAL CB C 17 36.400 36.400 34.336 2.064 17919 18178 1 45 . 1 1 17 17 VAL H H 17 8.900 8.900 8.662 0.238 17919 18179 1 45 . 1 1 18 18 GLU N N 18 118.990 118.990 122.115 -3.125 17919 18180 1 45 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.808 0.271 17919 18181 1 45 . 1 1 18 18 GLU C C 18 176.160 176.160 175.242 0.918 17919 18182 1 45 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.758 -0.038 17919 18183 1 45 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.037 0.273 17919 18184 1 45 . 1 1 18 18 GLU H H 18 8.640 8.640 7.994 0.646 17919 18185 1 45 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.088 0.053 17919 18186 1 45 . 1 1 19 19 PRO C C 19 175.310 175.310 177.908 -2.598 17919 18187 1 45 . 1 1 19 19 PRO CA C 19 65.470 65.470 66.116 -0.646 17919 18188 1 45 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.906 0.044 17919 18189 1 45 . 1 1 20 20 SER N N 20 103.400 103.400 109.418 -6.018 17919 18190 1 45 . 1 1 20 20 SER HA H 20 4.370 4.370 4.315 0.055 17919 18191 1 45 . 1 1 20 20 SER C C 20 174.660 174.660 173.853 0.807 17919 18192 1 45 . 1 1 20 20 SER CA C 20 57.400 57.400 59.018 -1.618 17919 18193 1 45 . 1 1 20 20 SER CB C 20 63.370 63.370 62.763 0.607 17919 18194 1 45 . 1 1 20 20 SER H H 20 7.040 7.040 8.018 -0.978 17919 18195 1 45 . 1 1 21 21 ASP N N 21 123.480 123.480 123.704 -0.224 17919 18196 1 45 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.653 0.042 17919 18197 1 45 . 1 1 21 21 ASP C C 21 176.360 176.360 175.697 0.663 17919 18198 1 45 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.974 0.726 17919 18199 1 45 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.143 -0.343 17919 18200 1 45 . 1 1 21 21 ASP H H 21 8.030 8.030 7.917 0.113 17919 18201 1 45 . 1 1 22 22 THR N N 22 108.800 108.800 114.057 -5.257 17919 18202 1 45 . 1 1 22 22 THR HA H 22 4.920 4.920 4.749 0.171 17919 18203 1 45 . 1 1 22 22 THR C C 22 176.750 176.750 176.024 0.726 17919 18204 1 45 . 1 1 22 22 THR CA C 22 59.690 59.690 61.367 -1.677 17919 18205 1 45 . 1 1 22 22 THR CB C 22 71.200 71.200 70.141 1.059 17919 18206 1 45 . 1 1 22 22 THR H H 22 7.900 7.900 8.321 -0.421 17919 18207 1 45 . 1 1 23 23 ILE N N 23 121.190 121.190 122.484 -1.294 17919 18208 1 45 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.732 -0.075 17919 18209 1 45 . 1 1 23 23 ILE C C 23 179.040 179.040 177.852 1.188 17919 18210 1 45 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.154 -0.894 17919 18211 1 45 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.330 -1.980 17919 18212 1 45 . 1 1 23 23 ILE H H 23 8.560 8.560 8.759 -0.199 17919 18213 1 45 . 1 1 24 24 GLU N N 24 120.830 120.830 119.022 1.808 17919 18214 1 45 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.932 -0.015 17919 18215 1 45 . 1 1 24 24 GLU C C 24 178.640 178.640 178.673 -0.033 17919 18216 1 45 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.401 0.819 17919 18217 1 45 . 1 1 24 24 GLU CB C 24 28.280 28.280 28.602 -0.322 17919 18218 1 45 . 1 1 24 24 GLU H H 24 9.760 9.760 8.350 1.410 17919 18219 1 45 . 1 1 25 25 ASN N N 25 120.570 120.570 118.751 1.819 17919 18220 1 45 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.499 0.026 17919 18221 1 45 . 1 1 25 25 ASN C C 25 178.380 178.380 177.862 0.518 17919 18222 1 45 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.890 0.170 17919 18223 1 45 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.570 -0.120 17919 18224 1 45 . 1 1 25 25 ASN H H 25 7.920 7.920 7.608 0.312 17919 18225 1 45 . 1 1 26 26 VAL N N 26 121.710 121.710 119.565 2.145 17919 18226 1 45 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.536 -0.139 17919 18227 1 45 . 1 1 26 26 VAL C C 26 177.950 177.950 177.975 -0.025 17919 18228 1 45 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.564 1.096 17919 18229 1 45 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.334 -0.494 17919 18230 1 45 . 1 1 26 26 VAL H H 26 8.070 8.070 7.826 0.244 17919 18231 1 45 . 1 1 27 27 LYS N N 27 118.860 118.860 119.327 -0.467 17919 18232 1 45 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.345 0.235 17919 18233 1 45 . 1 1 27 27 LYS C C 27 180.550 180.550 179.102 1.448 17919 18234 1 45 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.254 -0.004 17919 18235 1 45 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.309 1.421 17919 18236 1 45 . 1 1 27 27 LYS H H 27 8.560 8.560 7.790 0.770 17919 18237 1 45 . 1 1 28 28 ALA N N 28 123.440 123.440 122.434 1.006 17919 18238 1 45 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.044 0.116 17919 18239 1 45 . 1 1 28 28 ALA C C 28 180.300 180.300 178.922 1.378 17919 18240 1 45 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.291 0.079 17919 18241 1 45 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.394 -0.684 17919 18242 1 45 . 1 1 28 28 ALA H H 28 8.060 8.060 8.360 -0.300 17919 18243 1 45 . 1 1 29 29 LYS N N 29 119.940 119.940 120.019 -0.079 17919 18244 1 45 . 1 1 29 29 LYS HA H 29 4.207 4.207 3.970 0.237 17919 18245 1 45 . 1 1 29 29 LYS C C 29 180.320 180.320 178.922 1.398 17919 18246 1 45 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.558 0.092 17919 18247 1 45 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.289 1.001 17919 18248 1 45 . 1 1 29 29 LYS H H 29 7.850 7.850 7.575 0.275 17919 18249 1 45 . 1 1 30 30 ILE N N 30 121.080 121.080 119.732 1.348 17919 18250 1 45 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.546 -0.039 17919 18251 1 45 . 1 1 30 30 ILE C C 30 178.310 178.310 177.626 0.684 17919 18252 1 45 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.566 0.584 17919 18253 1 45 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.256 -0.456 17919 18254 1 45 . 1 1 30 30 ILE H H 30 8.280 8.280 8.377 -0.097 17919 18255 1 45 . 1 1 31 31 GLN N N 31 123.490 123.490 119.598 3.892 17919 18256 1 45 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.931 -0.102 17919 18257 1 45 . 1 1 31 31 GLN C C 31 178.890 178.890 178.420 0.470 17919 18258 1 45 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.225 0.775 17919 18259 1 45 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.340 -0.620 17919 18260 1 45 . 1 1 31 31 GLN H H 31 8.580 8.580 7.966 0.614 17919 18261 1 45 . 1 1 32 32 ASP N N 32 119.360 119.360 120.823 -1.463 17919 18262 1 45 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.367 -0.013 17919 18263 1 45 . 1 1 32 32 ASP C C 32 177.250 177.250 178.186 -0.936 17919 18264 1 45 . 1 1 32 32 ASP CA C 32 57.190 57.190 57.077 0.113 17919 18265 1 45 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.807 -0.227 17919 18266 1 45 . 1 1 32 32 ASP H H 32 8.010 8.010 8.358 -0.348 17919 18267 1 45 . 1 1 33 33 LYS N N 33 115.130 115.130 117.140 -2.010 17919 18268 1 45 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.232 0.105 17919 18269 1 45 . 1 1 33 33 LYS C C 33 177.870 177.870 177.634 0.236 17919 18270 1 45 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.808 0.242 17919 18271 1 45 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.126 1.044 17919 18272 1 45 . 1 1 33 33 LYS H H 33 7.430 7.430 8.110 -0.680 17919 18273 1 45 . 1 1 34 34 GLU N N 34 113.870 113.870 113.509 0.361 17919 18274 1 45 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.468 0.157 17919 18275 1 45 . 1 1 34 34 GLU C C 34 177.840 177.840 176.330 1.510 17919 18276 1 45 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.189 -1.019 17919 18277 1 45 . 1 1 34 34 GLU CB C 34 32.660 32.660 32.512 0.148 17919 18278 1 45 . 1 1 34 34 GLU H H 34 8.740 8.740 7.918 0.822 17919 18279 1 45 . 1 1 35 35 GLY N N 35 108.650 108.650 109.646 -0.996 17919 18280 1 45 . 1 1 35 35 GLY C C 35 173.960 173.960 174.581 -0.621 17919 18281 1 45 . 1 1 35 35 GLY CA C 35 46.080 46.080 46.063 0.017 17919 18282 1 45 . 1 1 35 35 GLY H H 35 8.530 8.530 8.207 0.323 17919 18283 1 45 . 1 1 36 36 ILE N N 36 119.880 119.880 121.606 -1.726 17919 18284 1 45 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.263 0.182 17919 18285 1 45 . 1 1 36 36 ILE C C 36 173.590 173.590 174.285 -0.695 17919 18286 1 45 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.343 -0.593 17919 18287 1 45 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.088 2.492 17919 18288 1 45 . 1 1 36 36 ILE H H 36 6.150 6.150 7.697 -1.547 17919 18289 1 45 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.629 0.005 17919 18290 1 45 . 1 1 37 37 PRO C C 37 176.940 176.940 175.989 0.951 17919 18291 1 45 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.181 0.479 17919 18292 1 45 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.370 0.480 17919 18293 1 45 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.299 -0.182 17919 18294 1 45 . 1 1 38 38 PRO C C 38 178.320 178.320 177.392 0.928 17919 18295 1 45 . 1 1 38 38 PRO CA C 38 66.260 66.260 64.972 1.288 17919 18296 1 45 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.974 0.916 17919 18297 1 45 . 1 1 39 39 ASP N N 39 113.380 113.380 116.541 -3.161 17919 18298 1 45 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.350 0.080 17919 18299 1 45 . 1 1 39 39 ASP C C 39 177.090 177.090 177.597 -0.507 17919 18300 1 45 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.640 -1.000 17919 18301 1 45 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.795 -1.255 17919 18302 1 45 . 1 1 39 39 ASP H H 39 8.550 8.550 8.146 0.404 17919 18303 1 45 . 1 1 40 40 GLN N N 40 116.780 116.780 116.863 -0.083 17919 18304 1 45 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.216 0.248 17919 18305 1 45 . 1 1 40 40 GLN C C 40 175.380 175.380 176.820 -1.440 17919 18306 1 45 . 1 1 40 40 GLN CA C 40 55.640 55.640 57.458 -1.818 17919 18307 1 45 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.874 0.266 17919 18308 1 45 . 1 1 40 40 GLN H H 40 7.820 7.820 7.697 0.123 17919 18309 1 45 . 1 1 41 41 GLN N N 41 117.720 117.720 119.354 -1.634 17919 18310 1 45 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.150 0.094 17919 18311 1 45 . 1 1 41 41 GLN C C 41 176.300 176.300 174.650 1.650 17919 18312 1 45 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.694 -0.224 17919 18313 1 45 . 1 1 41 41 GLN CB C 41 31.650 31.650 28.167 3.483 17919 18314 1 45 . 1 1 41 41 GLN H H 41 7.480 7.480 7.338 0.142 17919 18315 1 45 . 1 1 42 42 ARG N N 42 122.680 122.680 124.355 -1.675 17919 18316 1 45 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.586 -0.086 17919 18317 1 45 . 1 1 42 42 ARG C C 42 174.050 174.050 174.671 -0.621 17919 18318 1 45 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.689 0.361 17919 18319 1 45 . 1 1 42 42 ARG CB C 42 31.750 31.750 31.629 0.121 17919 18320 1 45 . 1 1 42 42 ARG H H 42 8.530 8.530 8.604 -0.074 17919 18321 1 45 . 1 1 43 43 LEU N N 43 124.040 124.040 125.835 -1.795 17919 18322 1 45 . 1 1 43 43 LEU C C 43 175.290 175.290 176.199 -0.909 17919 18323 1 45 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.341 -1.361 17919 18324 1 45 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.167 2.623 17919 18325 1 45 . 1 1 43 43 LEU H H 43 8.820 8.820 8.769 0.051 17919 18326 1 45 . 1 1 44 44 ILE N N 44 121.920 121.920 121.864 0.056 17919 18327 1 45 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.090 -0.098 17919 18328 1 45 . 1 1 44 44 ILE C C 44 176.060 176.060 174.656 1.404 17919 18329 1 45 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.096 -1.116 17919 18330 1 45 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.782 -0.362 17919 18331 1 45 . 1 1 44 44 ILE H H 44 9.030 9.030 9.147 -0.117 17919 18332 1 45 . 1 1 45 45 PHE N N 45 125.390 125.390 126.489 -1.099 17919 18333 1 45 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.888 0.157 17919 18334 1 45 . 1 1 45 45 PHE C C 45 174.470 174.470 174.181 0.289 17919 18335 1 45 . 1 1 45 45 PHE CA C 45 57.020 57.020 58.069 -1.049 17919 18336 1 45 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.600 1.160 17919 18337 1 45 . 1 1 45 45 PHE H H 45 8.830 8.830 8.770 0.060 17919 18338 1 45 . 1 1 46 46 ALA N N 46 132.200 132.200 129.293 2.907 17919 18339 1 45 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.641 0.049 17919 18340 1 45 . 1 1 46 46 ALA C C 46 177.290 177.290 177.792 -0.502 17919 18341 1 45 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.662 -0.122 17919 18342 1 45 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.693 -0.123 17919 18343 1 45 . 1 1 46 46 ALA H H 46 8.810 8.810 8.786 0.024 17919 18344 1 45 . 1 1 47 47 GLY N N 47 102.340 102.340 104.017 -1.677 17919 18345 1 45 . 1 1 47 47 GLY C C 47 173.810 173.810 174.175 -0.365 17919 18346 1 45 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.786 0.564 17919 18347 1 45 . 1 1 47 47 GLY H H 47 8.130 8.130 8.512 -0.382 17919 18348 1 45 . 1 1 48 48 LYS N N 48 121.570 121.570 120.648 0.922 17919 18349 1 45 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.749 -0.127 17919 18350 1 45 . 1 1 48 48 LYS C C 48 174.700 174.700 175.727 -1.027 17919 18351 1 45 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.538 0.011 17919 18352 1 45 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.267 0.263 17919 18353 1 45 . 1 1 48 48 LYS H H 48 7.980 7.980 7.603 0.377 17919 18354 1 45 . 1 1 49 49 GLN N N 49 122.410 122.410 120.678 1.732 17919 18355 1 45 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.440 0.120 17919 18356 1 45 . 1 1 49 49 GLN C C 49 175.670 175.670 176.090 -0.420 17919 18357 1 45 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.255 -0.515 17919 18358 1 45 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.410 -0.410 17919 18359 1 45 . 1 1 49 49 GLN H H 49 8.600 8.600 8.403 0.197 17919 18360 1 45 . 1 1 50 50 LEU N N 50 125.520 125.520 124.666 0.854 17919 18361 1 45 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.307 -0.217 17919 18362 1 45 . 1 1 50 50 LEU C C 50 176.660 176.660 177.171 -0.511 17919 18363 1 45 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.356 -0.116 17919 18364 1 45 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.809 -1.239 17919 18365 1 45 . 1 1 50 50 LEU H H 50 8.530 8.530 8.522 0.008 17919 18366 1 45 . 1 1 51 51 GLU N N 51 122.940 122.940 122.221 0.719 17919 18367 1 45 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.508 -0.020 17919 18368 1 45 . 1 1 51 51 GLU C C 51 175.870 175.870 176.690 -0.820 17919 18369 1 45 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.660 0.300 17919 18370 1 45 . 1 1 51 51 GLU CB C 51 31.570 31.570 30.160 1.410 17919 18371 1 45 . 1 1 51 51 GLU H H 51 8.400 8.400 9.108 -0.708 17919 18372 1 45 . 1 1 52 52 ASP N N 52 120.030 120.030 125.534 -5.504 17919 18373 1 45 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.317 0.042 17919 18374 1 45 . 1 1 52 52 ASP C C 52 177.330 177.330 177.598 -0.268 17919 18375 1 45 . 1 1 52 52 ASP CA C 52 56.960 56.960 58.266 -1.306 17919 18376 1 45 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.992 -0.143 17919 18377 1 45 . 1 1 52 52 ASP H H 52 8.160 8.160 8.896 -0.736 17919 18378 1 45 . 1 1 53 53 GLY N N 53 106.660 106.660 104.992 1.668 17919 18379 1 45 . 1 1 53 53 GLY C C 53 174.870 174.870 173.925 0.945 17919 18380 1 45 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.508 0.662 17919 18381 1 45 . 1 1 53 53 GLY H H 53 9.390 9.390 8.342 1.048 17919 18382 1 45 . 1 1 54 54 ARG N N 54 119.050 119.050 120.501 -1.451 17919 18383 1 45 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.542 0.153 17919 18384 1 45 . 1 1 54 54 ARG C C 54 175.350 175.350 174.971 0.379 17919 18385 1 45 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.669 -0.279 17919 18386 1 45 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.803 -0.153 17919 18387 1 45 . 1 1 54 54 ARG H H 54 7.460 7.460 8.064 -0.604 17919 18388 1 45 . 1 1 55 55 THR N N 55 108.400 108.400 111.156 -2.756 17919 18389 1 45 . 1 1 55 55 THR HA H 55 5.240 5.240 5.051 0.189 17919 18390 1 45 . 1 1 55 55 THR C C 55 176.560 176.560 176.688 -0.128 17919 18391 1 45 . 1 1 55 55 THR CA C 55 59.690 59.690 59.833 -0.143 17919 18392 1 45 . 1 1 55 55 THR CB C 55 72.260 72.260 71.136 1.124 17919 18393 1 45 . 1 1 55 55 THR H H 55 8.730 8.730 8.717 0.013 17919 18394 1 45 . 1 1 56 56 LEU N N 56 117.920 117.920 121.875 -3.955 17919 18395 1 45 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.946 0.114 17919 18396 1 45 . 1 1 56 56 LEU C C 56 180.810 180.810 178.675 2.135 17919 18397 1 45 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.606 0.104 17919 18398 1 45 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.085 -0.715 17919 18399 1 45 . 1 1 56 56 LEU H H 56 8.140 8.140 8.729 -0.589 17919 18400 1 45 . 1 1 57 57 SER N N 57 113.330 113.330 113.585 -0.255 17919 18401 1 45 . 1 1 57 57 SER HA H 57 4.370 4.370 4.177 0.193 17919 18402 1 45 . 1 1 57 57 SER C C 57 178.310 178.310 176.843 1.467 17919 18403 1 45 . 1 1 57 57 SER CA C 57 61.080 61.080 61.266 -0.186 17919 18404 1 45 . 1 1 57 57 SER CB C 57 62.530 62.530 62.567 -0.037 17919 18405 1 45 . 1 1 57 57 SER H H 57 8.470 8.470 8.109 0.361 17919 18406 1 45 . 1 1 58 58 ASP N N 58 124.190 124.190 122.074 2.116 17919 18407 1 45 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.301 -0.005 17919 18408 1 45 . 1 1 58 58 ASP C C 58 177.400 177.400 177.312 0.088 17919 18409 1 45 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.889 0.291 17919 18410 1 45 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.383 -0.283 17919 18411 1 45 . 1 1 58 58 ASP H H 58 7.930 7.930 7.700 0.230 17919 18412 1 45 . 1 1 59 59 TYR N N 59 115.510 115.510 114.701 0.809 17919 18413 1 45 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.731 -0.061 17919 18414 1 45 . 1 1 59 59 TYR C C 59 174.700 174.700 175.423 -0.723 17919 18415 1 45 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.268 0.982 17919 18416 1 45 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.551 1.519 17919 18417 1 45 . 1 1 59 59 TYR H H 59 7.250 7.250 7.260 -0.010 17919 18418 1 45 . 1 1 60 60 ASN N N 60 115.900 115.900 117.594 -1.694 17919 18419 1 45 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.406 -0.051 17919 18420 1 45 . 1 1 60 60 ASN C C 60 174.340 174.340 174.805 -0.465 17919 18421 1 45 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.015 0.105 17919 18422 1 45 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.755 -0.345 17919 18423 1 45 . 1 1 60 60 ASN H H 60 8.150 8.150 7.753 0.397 17919 18424 1 45 . 1 1 61 61 ILE N N 61 118.600 118.600 119.886 -1.286 17919 18425 1 45 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.810 -0.417 17919 18426 1 45 . 1 1 61 61 ILE C C 61 174.610 174.610 175.495 -0.885 17919 18427 1 45 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.167 1.253 17919 18428 1 45 . 1 1 61 61 ILE CB C 61 36.740 36.740 35.881 0.859 17919 18429 1 45 . 1 1 61 61 ILE H H 61 7.250 7.250 7.619 -0.369 17919 18430 1 45 . 1 1 62 62 GLN N N 62 124.740 124.740 125.512 -0.772 17919 18431 1 45 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.618 -0.112 17919 18432 1 45 . 1 1 62 62 GLN C C 62 175.970 175.970 175.463 0.507 17919 18433 1 45 . 1 1 62 62 GLN CA C 62 53.660 53.660 54.213 -0.553 17919 18434 1 45 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.867 -0.217 17919 18435 1 45 . 1 1 62 62 GLN H H 62 7.610 7.610 7.891 -0.281 17919 18436 1 45 . 1 1 63 63 LYS N N 63 120.300 120.300 121.975 -1.675 17919 18437 1 45 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.917 0.084 17919 18438 1 45 . 1 1 63 63 LYS C C 63 175.810 175.810 177.159 -1.349 17919 18439 1 45 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.646 0.144 17919 18440 1 45 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.667 0.983 17919 18441 1 45 . 1 1 63 63 LYS H H 63 8.490 8.490 8.636 -0.146 17919 18442 1 45 . 1 1 64 64 GLU N N 64 113.950 113.950 119.346 -5.396 17919 18443 1 45 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.619 -0.154 17919 18444 1 45 . 1 1 64 64 GLU C C 64 175.250 175.250 175.277 -0.027 17919 18445 1 45 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.609 0.280 17919 18446 1 45 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.471 -2.571 17919 18447 1 45 . 1 1 64 64 GLU H H 64 9.280 9.280 8.689 0.591 17919 18448 1 45 . 1 1 65 65 SER N N 65 114.730 114.730 115.796 -1.066 17919 18449 1 45 . 1 1 65 65 SER HA H 65 4.640 4.640 4.560 0.080 17919 18450 1 45 . 1 1 65 65 SER C C 65 172.160 172.160 173.846 -1.686 17919 18451 1 45 . 1 1 65 65 SER CA C 65 60.890 60.890 59.554 1.336 17919 18452 1 45 . 1 1 65 65 SER CB C 65 64.910 64.910 63.790 1.120 17919 18453 1 45 . 1 1 65 65 SER H H 65 7.670 7.670 7.703 -0.033 17919 18454 1 45 . 1 1 66 66 THR N N 66 117.110 117.110 122.151 -5.041 17919 18455 1 45 . 1 1 66 66 THR HA H 66 5.270 5.270 4.602 0.668 17919 18456 1 45 . 1 1 66 66 THR C C 66 173.950 173.950 174.500 -0.550 17919 18457 1 45 . 1 1 66 66 THR CA C 66 62.340 62.340 63.231 -0.891 17919 18458 1 45 . 1 1 66 66 THR CB C 66 70.080 70.080 69.545 0.535 17919 18459 1 45 . 1 1 66 66 THR H H 66 8.730 8.730 8.412 0.318 17919 18460 1 45 . 1 1 67 67 LEU N N 67 127.110 127.110 128.152 -1.042 17919 18461 1 45 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.791 0.269 17919 18462 1 45 . 1 1 67 67 LEU C C 67 175.770 175.770 175.866 -0.096 17919 18463 1 45 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.126 -0.226 17919 18464 1 45 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.895 0.365 17919 18465 1 45 . 1 1 67 67 LEU H H 67 9.410 9.410 8.839 0.571 17919 18466 1 45 . 1 1 68 68 HIS N N 68 118.380 118.380 120.158 -1.778 17919 18467 1 45 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.269 -0.029 17919 18468 1 45 . 1 1 68 68 HIS C C 68 173.150 173.150 173.569 -0.419 17919 18469 1 45 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.383 0.618 17919 18470 1 45 . 1 1 68 68 HIS CB C 68 30.530 30.530 33.562 -3.032 17919 18471 1 45 . 1 1 68 68 HIS H H 68 9.230 9.230 8.990 0.240 17919 18472 1 45 . 1 1 69 69 LEU N N 69 124.460 124.460 124.851 -0.391 17919 18473 1 45 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.254 -0.064 17919 18474 1 45 . 1 1 69 69 LEU C C 69 175.270 175.270 174.208 1.062 17919 18475 1 45 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.017 -0.127 17919 18476 1 45 . 1 1 69 69 LEU CB C 69 44.380 44.380 46.142 -1.762 17919 18477 1 45 . 1 1 69 69 LEU H H 69 8.340 8.340 7.970 0.370 17919 18478 1 45 . 1 1 70 70 VAL N N 70 126.940 126.940 125.863 1.077 17919 18479 1 45 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.557 -0.207 17919 18480 1 45 . 1 1 70 70 VAL C C 70 174.000 174.000 174.330 -0.330 17919 18481 1 45 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.820 -0.020 17919 18482 1 45 . 1 1 70 70 VAL CB C 70 34.910 34.910 34.478 0.432 17919 18483 1 45 . 1 1 70 70 VAL H H 70 9.200 9.200 8.312 0.888 17919 18484 1 45 . 1 1 71 71 LEU N N 71 123.130 123.130 123.904 -0.774 17919 18485 1 45 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.898 0.162 17919 18486 1 45 . 1 1 71 71 LEU C C 71 177.830 177.830 176.161 1.669 17919 18487 1 45 . 1 1 71 71 LEU CA C 71 53.940 53.940 52.732 1.208 17919 18488 1 45 . 1 1 71 71 LEU CB C 71 42.850 42.850 44.998 -2.148 17919 18489 1 45 . 1 1 71 71 LEU H H 71 8.120 8.120 8.406 -0.286 17919 18490 1 45 . 1 1 72 72 ARG N N 72 123.490 123.490 118.346 5.144 17919 18491 1 45 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.593 -0.292 17919 18492 1 45 . 1 1 72 72 ARG C C 72 175.350 175.350 174.909 0.441 17919 18493 1 45 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.646 -0.036 17919 18494 1 45 . 1 1 72 72 ARG CB C 72 31.350 31.350 32.289 -0.939 17919 18495 1 45 . 1 1 72 72 ARG H H 72 8.580 8.580 8.185 0.395 17919 18496 1 46 . 1 1 2 2 GLN N N 2 123.220 123.220 124.467 -1.247 17919 18497 1 46 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.057 0.192 17919 18498 1 46 . 1 1 2 2 GLN C C 2 175.920 175.920 174.276 1.644 17919 18499 1 46 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.775 0.305 17919 18500 1 46 . 1 1 2 2 GLN CB C 2 30.760 30.760 31.099 -0.339 17919 18501 1 46 . 1 1 2 2 GLN H H 2 8.900 8.900 8.536 0.364 17919 18502 1 46 . 1 1 3 3 ILE N N 3 115.340 115.340 116.967 -1.627 17919 18503 1 46 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.025 0.188 17919 18504 1 46 . 1 1 3 3 ILE C C 3 172.450 172.450 172.823 -0.373 17919 18505 1 46 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.979 -0.409 17919 18506 1 46 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.747 0.463 17919 18507 1 46 . 1 1 3 3 ILE H H 3 8.320 8.320 8.475 -0.155 17919 18508 1 46 . 1 1 4 4 PHE N N 4 118.110 118.110 121.129 -3.019 17919 18509 1 46 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.475 0.155 17919 18510 1 46 . 1 1 4 4 PHE C C 4 175.320 175.320 175.162 0.158 17919 18511 1 46 . 1 1 4 4 PHE CA C 4 55.210 55.210 54.666 0.544 17919 18512 1 46 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.235 0.245 17919 18513 1 46 . 1 1 4 4 PHE H H 4 8.610 8.610 8.007 0.603 17919 18514 1 46 . 1 1 5 5 VAL N N 5 121.000 121.000 123.839 -2.839 17919 18515 1 46 . 1 1 5 5 VAL HA H 5 4.725 4.725 5.011 -0.286 17919 18516 1 46 . 1 1 5 5 VAL C C 5 174.870 174.870 174.764 0.106 17919 18517 1 46 . 1 1 5 5 VAL CA C 5 60.620 60.620 60.804 -0.185 17919 18518 1 46 . 1 1 5 5 VAL CB C 5 34.230 34.230 32.884 1.346 17919 18519 1 46 . 1 1 5 5 VAL H H 5 9.300 9.300 8.987 0.313 17919 18520 1 46 . 1 1 6 6 LYS N N 6 127.520 127.520 129.171 -1.651 17919 18521 1 46 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.317 0.050 17919 18522 1 46 . 1 1 6 6 LYS C C 6 177.140 177.140 176.140 1.000 17919 18523 1 46 . 1 1 6 6 LYS CA C 6 54.520 54.520 53.248 1.272 17919 18524 1 46 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.822 -0.772 17919 18525 1 46 . 1 1 6 6 LYS H H 6 8.820 8.820 9.012 -0.192 17919 18526 1 46 . 1 1 7 7 THR N N 7 115.400 115.400 118.348 -2.948 17919 18527 1 46 . 1 1 7 7 THR HA H 7 4.970 4.970 4.716 0.254 17919 18528 1 46 . 1 1 7 7 THR C C 7 176.910 176.910 176.412 0.498 17919 18529 1 46 . 1 1 7 7 THR CA C 7 60.470 60.470 60.275 0.195 17919 18530 1 46 . 1 1 7 7 THR CB C 7 70.630 70.630 69.938 0.692 17919 18531 1 46 . 1 1 7 7 THR H H 7 8.730 8.730 8.140 0.590 17919 18532 1 46 . 1 1 8 8 LEU N N 8 121.330 121.330 122.318 -0.988 17919 18533 1 46 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.260 0.050 17919 18534 1 46 . 1 1 8 8 LEU C C 8 178.800 178.800 177.015 1.785 17919 18535 1 46 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.108 0.473 17919 18536 1 46 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.148 -0.178 17919 18537 1 46 . 1 1 8 8 LEU H H 8 9.100 9.100 9.234 -0.134 17919 18538 1 46 . 1 1 9 9 THR N N 9 105.590 105.590 107.095 -1.505 17919 18539 1 46 . 1 1 9 9 THR HA H 9 4.428 4.428 4.351 0.077 17919 18540 1 46 . 1 1 9 9 THR C C 9 175.520 175.520 175.467 0.053 17919 18541 1 46 . 1 1 9 9 THR CA C 9 61.400 61.400 61.622 -0.222 17919 18542 1 46 . 1 1 9 9 THR CB C 9 69.140 69.140 69.161 -0.021 17919 18543 1 46 . 1 1 9 9 THR H H 9 7.630 7.630 7.520 0.110 17919 18544 1 46 . 1 1 10 10 GLY N N 10 108.890 108.890 110.869 -1.979 17919 18545 1 46 . 1 1 10 10 GLY C C 10 174.070 174.070 174.096 -0.026 17919 18546 1 46 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.759 0.701 17919 18547 1 46 . 1 1 10 10 GLY H H 10 7.810 7.810 7.893 -0.083 17919 18548 1 46 . 1 1 11 11 LYS N N 11 121.600 121.600 122.563 -0.963 17919 18549 1 46 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.161 0.200 17919 18550 1 46 . 1 1 11 11 LYS C C 11 175.940 175.940 175.489 0.451 17919 18551 1 46 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.840 -0.560 17919 18552 1 46 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.319 -0.119 17919 18553 1 46 . 1 1 11 11 LYS H H 11 7.280 7.280 7.665 -0.385 17919 18554 1 46 . 1 1 12 12 THR N N 12 120.440 120.440 119.995 0.445 17919 18555 1 46 . 1 1 12 12 THR HA H 12 5.046 5.046 4.850 0.196 17919 18556 1 46 . 1 1 12 12 THR C C 12 174.320 174.320 174.662 -0.342 17919 18557 1 46 . 1 1 12 12 THR CA C 12 62.390 62.390 62.202 0.188 17919 18558 1 46 . 1 1 12 12 THR CB C 12 69.910 69.910 70.008 -0.098 17919 18559 1 46 . 1 1 12 12 THR H H 12 8.650 8.650 8.205 0.445 17919 18560 1 46 . 1 1 13 13 ILE N N 13 127.110 127.110 126.508 0.602 17919 18561 1 46 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.579 -0.035 17919 18562 1 46 . 1 1 13 13 ILE C C 13 175.220 175.220 175.017 0.203 17919 18563 1 46 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.825 -0.845 17919 18564 1 46 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.080 0.870 17919 18565 1 46 . 1 1 13 13 ILE H H 13 9.450 9.450 9.042 0.408 17919 18566 1 46 . 1 1 14 14 THR N N 14 121.520 121.520 123.154 -1.634 17919 18567 1 46 . 1 1 14 14 THR HA H 14 4.964 4.964 5.218 -0.254 17919 18568 1 46 . 1 1 14 14 THR C C 14 173.790 173.790 173.737 0.053 17919 18569 1 46 . 1 1 14 14 THR CA C 14 61.940 61.940 61.385 0.555 17919 18570 1 46 . 1 1 14 14 THR CB C 14 69.650 69.650 70.163 -0.513 17919 18571 1 46 . 1 1 14 14 THR H H 14 8.710 8.710 8.273 0.437 17919 18572 1 46 . 1 1 15 15 LEU N N 15 124.800 124.800 128.144 -3.344 17919 18573 1 46 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.725 0.055 17919 18574 1 46 . 1 1 15 15 LEU C C 15 174.670 174.670 175.370 -0.700 17919 18575 1 46 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.675 -0.845 17919 18576 1 46 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.044 2.026 17919 18577 1 46 . 1 1 15 15 LEU H H 15 8.710 8.710 8.415 0.295 17919 18578 1 46 . 1 1 16 16 GLU N N 16 122.160 122.160 123.113 -0.953 17919 18579 1 46 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.403 0.514 17919 18580 1 46 . 1 1 16 16 GLU C C 16 175.860 175.860 175.689 0.171 17919 18581 1 46 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.276 -0.456 17919 18582 1 46 . 1 1 16 16 GLU CB C 16 29.450 29.450 29.810 -0.360 17919 18583 1 46 . 1 1 16 16 GLU H H 16 8.140 8.140 8.507 -0.367 17919 18584 1 46 . 1 1 17 17 VAL N N 17 117.210 117.210 120.965 -3.755 17919 18585 1 46 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.710 0.004 17919 18586 1 46 . 1 1 17 17 VAL C C 17 174.160 174.160 175.311 -1.151 17919 18587 1 46 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.485 -1.055 17919 18588 1 46 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.060 1.340 17919 18589 1 46 . 1 1 17 17 VAL H H 17 8.900 8.900 8.145 0.755 17919 18590 1 46 . 1 1 18 18 GLU N N 18 118.990 118.990 123.166 -4.176 17919 18591 1 46 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.936 0.143 17919 18592 1 46 . 1 1 18 18 GLU C C 18 176.160 176.160 175.823 0.337 17919 18593 1 46 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.535 0.185 17919 18594 1 46 . 1 1 18 18 GLU CB C 18 30.310 30.310 31.462 -1.152 17919 18595 1 46 . 1 1 18 18 GLU H H 18 8.640 8.640 8.141 0.499 17919 18596 1 46 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.141 -0.000 17919 18597 1 46 . 1 1 19 19 PRO C C 19 175.310 175.310 177.950 -2.640 17919 18598 1 46 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.629 -0.159 17919 18599 1 46 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.981 -0.031 17919 18600 1 46 . 1 1 20 20 SER N N 20 103.400 103.400 110.998 -7.598 17919 18601 1 46 . 1 1 20 20 SER HA H 20 4.370 4.370 4.358 0.012 17919 18602 1 46 . 1 1 20 20 SER C C 20 174.660 174.660 173.795 0.865 17919 18603 1 46 . 1 1 20 20 SER CA C 20 57.400 57.400 58.015 -0.615 17919 18604 1 46 . 1 1 20 20 SER CB C 20 63.370 63.370 63.051 0.319 17919 18605 1 46 . 1 1 20 20 SER H H 20 7.040 7.040 7.922 -0.882 17919 18606 1 46 . 1 1 21 21 ASP N N 21 123.480 123.480 123.241 0.239 17919 18607 1 46 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.605 0.090 17919 18608 1 46 . 1 1 21 21 ASP C C 21 176.360 176.360 175.887 0.473 17919 18609 1 46 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.513 0.187 17919 18610 1 46 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.511 -0.711 17919 18611 1 46 . 1 1 21 21 ASP H H 21 8.030 8.030 8.165 -0.135 17919 18612 1 46 . 1 1 22 22 THR N N 22 108.800 108.800 111.363 -2.563 17919 18613 1 46 . 1 1 22 22 THR HA H 22 4.920 4.920 4.399 0.521 17919 18614 1 46 . 1 1 22 22 THR C C 22 176.750 176.750 175.780 0.970 17919 18615 1 46 . 1 1 22 22 THR CA C 22 59.690 59.690 61.428 -1.738 17919 18616 1 46 . 1 1 22 22 THR CB C 22 71.200 71.200 70.686 0.514 17919 18617 1 46 . 1 1 22 22 THR H H 22 7.900 7.900 8.217 -0.317 17919 18618 1 46 . 1 1 23 23 ILE N N 23 121.190 121.190 122.361 -1.171 17919 18619 1 46 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.751 -0.094 17919 18620 1 46 . 1 1 23 23 ILE C C 23 179.040 179.040 177.689 1.351 17919 18621 1 46 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.647 -0.387 17919 18622 1 46 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.438 -2.088 17919 18623 1 46 . 1 1 23 23 ILE H H 23 8.560 8.560 8.519 0.041 17919 18624 1 46 . 1 1 24 24 GLU N N 24 120.830 120.830 120.608 0.222 17919 18625 1 46 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.900 0.017 17919 18626 1 46 . 1 1 24 24 GLU C C 24 178.640 178.640 178.349 0.291 17919 18627 1 46 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.731 0.489 17919 18628 1 46 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.629 -1.349 17919 18629 1 46 . 1 1 24 24 GLU H H 24 9.760 9.760 8.698 1.062 17919 18630 1 46 . 1 1 25 25 ASN N N 25 120.570 120.570 118.499 2.071 17919 18631 1 46 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.510 0.015 17919 18632 1 46 . 1 1 25 25 ASN C C 25 178.380 178.380 177.860 0.520 17919 18633 1 46 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.951 0.109 17919 18634 1 46 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.389 0.061 17919 18635 1 46 . 1 1 25 25 ASN H H 25 7.920 7.920 7.647 0.273 17919 18636 1 46 . 1 1 26 26 VAL N N 26 121.710 121.710 119.851 1.859 17919 18637 1 46 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.591 -0.194 17919 18638 1 46 . 1 1 26 26 VAL C C 26 177.950 177.950 177.842 0.108 17919 18639 1 46 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.619 1.041 17919 18640 1 46 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.361 -0.521 17919 18641 1 46 . 1 1 26 26 VAL H H 26 8.070 8.070 7.727 0.343 17919 18642 1 46 . 1 1 27 27 LYS N N 27 118.860 118.860 119.970 -1.110 17919 18643 1 46 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.274 0.306 17919 18644 1 46 . 1 1 27 27 LYS C C 27 180.550 180.550 179.001 1.549 17919 18645 1 46 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.174 0.076 17919 18646 1 46 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.317 1.413 17919 18647 1 46 . 1 1 27 27 LYS H H 27 8.560 8.560 8.031 0.529 17919 18648 1 46 . 1 1 28 28 ALA N N 28 123.440 123.440 122.648 0.792 17919 18649 1 46 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.064 0.096 17919 18650 1 46 . 1 1 28 28 ALA C C 28 180.300 180.300 179.102 1.198 17919 18651 1 46 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.125 0.245 17919 18652 1 46 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.467 -0.757 17919 18653 1 46 . 1 1 28 28 ALA H H 28 8.060 8.060 8.152 -0.092 17919 18654 1 46 . 1 1 29 29 LYS N N 29 119.940 119.940 120.049 -0.109 17919 18655 1 46 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.217 -0.010 17919 18656 1 46 . 1 1 29 29 LYS C C 29 180.320 180.320 179.292 1.028 17919 18657 1 46 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.500 0.150 17919 18658 1 46 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.359 0.931 17919 18659 1 46 . 1 1 29 29 LYS H H 29 7.850 7.850 7.402 0.448 17919 18660 1 46 . 1 1 30 30 ILE N N 30 121.080 121.080 119.526 1.554 17919 18661 1 46 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.625 -0.118 17919 18662 1 46 . 1 1 30 30 ILE C C 30 178.310 178.310 177.546 0.764 17919 18663 1 46 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.345 0.805 17919 18664 1 46 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.599 -0.799 17919 18665 1 46 . 1 1 30 30 ILE H H 30 8.280 8.280 8.402 -0.122 17919 18666 1 46 . 1 1 31 31 GLN N N 31 123.490 123.490 120.567 2.923 17919 18667 1 46 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.028 -0.199 17919 18668 1 46 . 1 1 31 31 GLN C C 31 178.890 178.890 177.982 0.908 17919 18669 1 46 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.298 0.702 17919 18670 1 46 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.496 -0.776 17919 18671 1 46 . 1 1 31 31 GLN H H 31 8.580 8.580 7.803 0.777 17919 18672 1 46 . 1 1 32 32 ASP N N 32 119.360 119.360 118.984 0.376 17919 18673 1 46 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.434 -0.080 17919 18674 1 46 . 1 1 32 32 ASP C C 32 177.250 177.250 178.363 -1.113 17919 18675 1 46 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.593 0.597 17919 18676 1 46 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.705 -0.125 17919 18677 1 46 . 1 1 32 32 ASP H H 32 8.010 8.010 7.852 0.158 17919 18678 1 46 . 1 1 33 33 LYS N N 33 115.130 115.130 117.405 -2.275 17919 18679 1 46 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.485 -0.148 17919 18680 1 46 . 1 1 33 33 LYS C C 33 177.870 177.870 177.776 0.094 17919 18681 1 46 . 1 1 33 33 LYS CA C 33 58.050 58.050 56.661 1.389 17919 18682 1 46 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.280 0.890 17919 18683 1 46 . 1 1 33 33 LYS H H 33 7.430 7.430 7.908 -0.478 17919 18684 1 46 . 1 1 34 34 GLU N N 34 113.870 113.870 116.371 -2.501 17919 18685 1 46 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.511 0.114 17919 18686 1 46 . 1 1 34 34 GLU C C 34 177.840 177.840 177.017 0.823 17919 18687 1 46 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.200 -1.030 17919 18688 1 46 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.832 0.828 17919 18689 1 46 . 1 1 34 34 GLU H H 34 8.740 8.740 8.473 0.267 17919 18690 1 46 . 1 1 35 35 GLY N N 35 108.650 108.650 108.238 0.412 17919 18691 1 46 . 1 1 35 35 GLY C C 35 173.960 173.960 174.898 -0.938 17919 18692 1 46 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.483 0.597 17919 18693 1 46 . 1 1 35 35 GLY H H 35 8.530 8.530 7.757 0.773 17919 18694 1 46 . 1 1 36 36 ILE N N 36 119.880 119.880 121.664 -1.784 17919 18695 1 46 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.383 0.062 17919 18696 1 46 . 1 1 36 36 ILE C C 36 173.590 173.590 174.276 -0.686 17919 18697 1 46 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.040 0.710 17919 18698 1 46 . 1 1 36 36 ILE CB C 36 40.580 40.580 36.819 3.761 17919 18699 1 46 . 1 1 36 36 ILE H H 36 6.150 6.150 7.848 -1.698 17919 18700 1 46 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.801 -0.167 17919 18701 1 46 . 1 1 37 37 PRO C C 37 176.940 176.940 176.164 0.776 17919 18702 1 46 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.488 0.172 17919 18703 1 46 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.519 0.331 17919 18704 1 46 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.150 -0.033 17919 18705 1 46 . 1 1 38 38 PRO C C 38 178.320 178.320 178.409 -0.089 17919 18706 1 46 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.776 0.484 17919 18707 1 46 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.892 0.998 17919 18708 1 46 . 1 1 39 39 ASP N N 39 113.380 113.380 117.240 -3.860 17919 18709 1 46 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.333 0.097 17919 18710 1 46 . 1 1 39 39 ASP C C 39 177.090 177.090 177.461 -0.371 17919 18711 1 46 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.606 -0.966 17919 18712 1 46 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.235 -0.695 17919 18713 1 46 . 1 1 39 39 ASP H H 39 8.550 8.550 8.756 -0.206 17919 18714 1 46 . 1 1 40 40 GLN N N 40 116.780 116.780 116.666 0.114 17919 18715 1 46 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.282 0.182 17919 18716 1 46 . 1 1 40 40 GLN C C 40 175.380 175.380 175.184 0.196 17919 18717 1 46 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.031 -0.391 17919 18718 1 46 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.140 1.000 17919 18719 1 46 . 1 1 40 40 GLN H H 40 7.820 7.820 7.764 0.056 17919 18720 1 46 . 1 1 41 41 GLN N N 41 117.720 117.720 118.856 -1.136 17919 18721 1 46 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.557 -0.313 17919 18722 1 46 . 1 1 41 41 GLN C C 41 176.300 176.300 174.681 1.619 17919 18723 1 46 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.090 1.380 17919 18724 1 46 . 1 1 41 41 GLN CB C 41 31.650 31.650 30.647 1.003 17919 18725 1 46 . 1 1 41 41 GLN H H 41 7.480 7.480 7.327 0.153 17919 18726 1 46 . 1 1 42 42 ARG N N 42 122.680 122.680 124.287 -1.607 17919 18727 1 46 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.640 -0.140 17919 18728 1 46 . 1 1 42 42 ARG C C 42 174.050 174.050 174.551 -0.501 17919 18729 1 46 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.005 0.045 17919 18730 1 46 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.318 -0.568 17919 18731 1 46 . 1 1 42 42 ARG H H 42 8.530 8.530 8.151 0.379 17919 18732 1 46 . 1 1 43 43 LEU N N 43 124.040 124.040 125.867 -1.827 17919 18733 1 46 . 1 1 43 43 LEU C C 43 175.290 175.290 175.359 -0.069 17919 18734 1 46 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.676 -0.696 17919 18735 1 46 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.231 1.559 17919 18736 1 46 . 1 1 43 43 LEU H H 43 8.820 8.820 8.789 0.031 17919 18737 1 46 . 1 1 44 44 ILE N N 44 121.920 121.920 123.131 -1.211 17919 18738 1 46 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.834 0.158 17919 18739 1 46 . 1 1 44 44 ILE C C 44 176.060 176.060 174.475 1.585 17919 18740 1 46 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.349 -1.369 17919 18741 1 46 . 1 1 44 44 ILE CB C 44 41.420 41.420 40.862 0.558 17919 18742 1 46 . 1 1 44 44 ILE H H 44 9.030 9.030 8.631 0.399 17919 18743 1 46 . 1 1 45 45 PHE N N 45 125.390 125.390 127.850 -2.460 17919 18744 1 46 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.076 -0.031 17919 18745 1 46 . 1 1 45 45 PHE C C 45 174.470 174.470 174.330 0.140 17919 18746 1 46 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.719 0.301 17919 18747 1 46 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.402 0.358 17919 18748 1 46 . 1 1 45 45 PHE H H 45 8.830 8.830 9.044 -0.214 17919 18749 1 46 . 1 1 46 46 ALA N N 46 132.200 132.200 129.450 2.750 17919 18750 1 46 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.636 0.054 17919 18751 1 46 . 1 1 46 46 ALA C C 46 177.290 177.290 177.497 -0.207 17919 18752 1 46 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.921 -0.381 17919 18753 1 46 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.773 -0.203 17919 18754 1 46 . 1 1 46 46 ALA H H 46 8.810 8.810 8.782 0.028 17919 18755 1 46 . 1 1 47 47 GLY N N 47 102.340 102.340 103.956 -1.616 17919 18756 1 46 . 1 1 47 47 GLY C C 47 173.810 173.810 174.620 -0.810 17919 18757 1 46 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.406 -0.056 17919 18758 1 46 . 1 1 47 47 GLY H H 47 8.130 8.130 8.459 -0.329 17919 18759 1 46 . 1 1 48 48 LYS N N 48 121.570 121.570 121.652 -0.082 17919 18760 1 46 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.567 0.055 17919 18761 1 46 . 1 1 48 48 LYS C C 48 174.700 174.700 175.175 -0.475 17919 18762 1 46 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.974 -0.424 17919 18763 1 46 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.451 0.079 17919 18764 1 46 . 1 1 48 48 LYS H H 48 7.980 7.980 7.876 0.104 17919 18765 1 46 . 1 1 49 49 GLN N N 49 122.410 122.410 125.495 -3.085 17919 18766 1 46 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.562 -0.002 17919 18767 1 46 . 1 1 49 49 GLN C C 49 175.670 175.670 176.148 -0.478 17919 18768 1 46 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.716 0.024 17919 18769 1 46 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.061 -0.061 17919 18770 1 46 . 1 1 49 49 GLN H H 49 8.600 8.600 8.707 -0.107 17919 18771 1 46 . 1 1 50 50 LEU N N 50 125.520 125.520 127.092 -1.572 17919 18772 1 46 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.092 -0.002 17919 18773 1 46 . 1 1 50 50 LEU C C 50 176.660 176.660 176.813 -0.153 17919 18774 1 46 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.622 -0.382 17919 18775 1 46 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.800 -0.230 17919 18776 1 46 . 1 1 50 50 LEU H H 50 8.530 8.530 8.197 0.333 17919 18777 1 46 . 1 1 51 51 GLU N N 51 122.940 122.940 123.017 -0.077 17919 18778 1 46 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.336 0.152 17919 18779 1 46 . 1 1 51 51 GLU C C 51 175.870 175.870 176.903 -1.033 17919 18780 1 46 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.756 0.204 17919 18781 1 46 . 1 1 51 51 GLU CB C 51 31.570 31.570 30.761 0.809 17919 18782 1 46 . 1 1 51 51 GLU H H 51 8.400 8.400 8.104 0.296 17919 18783 1 46 . 1 1 52 52 ASP N N 52 120.030 120.030 126.916 -6.886 17919 18784 1 46 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.400 -0.041 17919 18785 1 46 . 1 1 52 52 ASP C C 52 177.330 177.330 177.190 0.140 17919 18786 1 46 . 1 1 52 52 ASP CA C 52 56.960 56.960 56.469 0.491 17919 18787 1 46 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.859 -0.009 17919 18788 1 46 . 1 1 52 52 ASP H H 52 8.160 8.160 8.806 -0.646 17919 18789 1 46 . 1 1 53 53 GLY N N 53 106.660 106.660 105.572 1.088 17919 18790 1 46 . 1 1 53 53 GLY C C 53 174.870 174.870 174.650 0.220 17919 18791 1 46 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.850 0.320 17919 18792 1 46 . 1 1 53 53 GLY H H 53 9.390 9.390 8.323 1.067 17919 18793 1 46 . 1 1 54 54 ARG N N 54 119.050 119.050 121.564 -2.514 17919 18794 1 46 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.529 0.166 17919 18795 1 46 . 1 1 54 54 ARG C C 54 175.350 175.350 176.021 -0.671 17919 18796 1 46 . 1 1 54 54 ARG CA C 54 54.390 54.390 55.857 -1.467 17919 18797 1 46 . 1 1 54 54 ARG CB C 54 32.650 32.650 31.534 1.116 17919 18798 1 46 . 1 1 54 54 ARG H H 54 7.460 7.460 7.862 -0.402 17919 18799 1 46 . 1 1 55 55 THR N N 55 108.400 108.400 114.573 -6.173 17919 18800 1 46 . 1 1 55 55 THR HA H 55 5.240 5.240 4.555 0.685 17919 18801 1 46 . 1 1 55 55 THR C C 55 176.560 176.560 175.980 0.580 17919 18802 1 46 . 1 1 55 55 THR CA C 55 59.690 59.690 61.299 -1.609 17919 18803 1 46 . 1 1 55 55 THR CB C 55 72.260 72.260 70.347 1.914 17919 18804 1 46 . 1 1 55 55 THR H H 55 8.730 8.730 8.273 0.457 17919 18805 1 46 . 1 1 56 56 LEU N N 56 117.920 117.920 121.718 -3.798 17919 18806 1 46 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.084 -0.024 17919 18807 1 46 . 1 1 56 56 LEU C C 56 180.810 180.810 179.037 1.773 17919 18808 1 46 . 1 1 56 56 LEU CA C 56 58.710 58.710 57.837 0.873 17919 18809 1 46 . 1 1 56 56 LEU CB C 56 40.370 40.370 40.688 -0.318 17919 18810 1 46 . 1 1 56 56 LEU H H 56 8.140 8.140 8.181 -0.041 17919 18811 1 46 . 1 1 57 57 SER N N 57 113.330 113.330 113.388 -0.058 17919 18812 1 46 . 1 1 57 57 SER HA H 57 4.370 4.370 4.174 0.196 17919 18813 1 46 . 1 1 57 57 SER C C 57 178.310 178.310 176.617 1.693 17919 18814 1 46 . 1 1 57 57 SER CA C 57 61.080 61.080 62.369 -1.289 17919 18815 1 46 . 1 1 57 57 SER CB C 57 62.530 62.530 62.780 -0.250 17919 18816 1 46 . 1 1 57 57 SER H H 57 8.470 8.470 8.242 0.228 17919 18817 1 46 . 1 1 58 58 ASP N N 58 124.190 124.190 122.950 1.240 17919 18818 1 46 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.225 0.071 17919 18819 1 46 . 1 1 58 58 ASP C C 58 177.400 177.400 177.055 0.345 17919 18820 1 46 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.672 0.507 17919 18821 1 46 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.557 -0.457 17919 18822 1 46 . 1 1 58 58 ASP H H 58 7.930 7.930 7.723 0.207 17919 18823 1 46 . 1 1 59 59 TYR N N 59 115.510 115.510 115.071 0.439 17919 18824 1 46 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.683 -0.013 17919 18825 1 46 . 1 1 59 59 TYR C C 59 174.700 174.700 174.712 -0.012 17919 18826 1 46 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.333 0.917 17919 18827 1 46 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.001 2.069 17919 18828 1 46 . 1 1 59 59 TYR H H 59 7.250 7.250 7.366 -0.116 17919 18829 1 46 . 1 1 60 60 ASN N N 60 115.900 115.900 116.737 -0.837 17919 18830 1 46 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.322 0.033 17919 18831 1 46 . 1 1 60 60 ASN C C 60 174.340 174.340 174.434 -0.094 17919 18832 1 46 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.517 -0.397 17919 18833 1 46 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.683 -0.273 17919 18834 1 46 . 1 1 60 60 ASN H H 60 8.150 8.150 7.631 0.519 17919 18835 1 46 . 1 1 61 61 ILE N N 61 118.600 118.600 119.623 -1.023 17919 18836 1 46 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.699 -0.306 17919 18837 1 46 . 1 1 61 61 ILE C C 61 174.610 174.610 175.375 -0.765 17919 18838 1 46 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.713 0.707 17919 18839 1 46 . 1 1 61 61 ILE CB C 61 36.740 36.740 36.627 0.113 17919 18840 1 46 . 1 1 61 61 ILE H H 61 7.250 7.250 8.305 -1.055 17919 18841 1 46 . 1 1 62 62 GLN N N 62 124.740 124.740 127.035 -2.295 17919 18842 1 46 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.680 -0.174 17919 18843 1 46 . 1 1 62 62 GLN C C 62 175.970 175.970 175.527 0.443 17919 18844 1 46 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.439 0.221 17919 18845 1 46 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.712 -0.062 17919 18846 1 46 . 1 1 62 62 GLN H H 62 7.610 7.610 7.820 -0.210 17919 18847 1 46 . 1 1 63 63 LYS N N 63 120.300 120.300 118.832 1.468 17919 18848 1 46 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.973 0.028 17919 18849 1 46 . 1 1 63 63 LYS C C 63 175.810 175.810 177.064 -1.254 17919 18850 1 46 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.688 0.102 17919 18851 1 46 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.914 0.736 17919 18852 1 46 . 1 1 63 63 LYS H H 63 8.490 8.490 8.490 -0.000 17919 18853 1 46 . 1 1 64 64 GLU N N 64 113.950 113.950 118.167 -4.217 17919 18854 1 46 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.716 -0.251 17919 18855 1 46 . 1 1 64 64 GLU C C 64 175.250 175.250 175.027 0.223 17919 18856 1 46 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.662 0.228 17919 18857 1 46 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.055 -2.155 17919 18858 1 46 . 1 1 64 64 GLU H H 64 9.280 9.280 8.516 0.764 17919 18859 1 46 . 1 1 65 65 SER N N 65 114.730 114.730 113.787 0.943 17919 18860 1 46 . 1 1 65 65 SER HA H 65 4.640 4.640 4.822 -0.182 17919 18861 1 46 . 1 1 65 65 SER C C 65 172.160 172.160 173.776 -1.616 17919 18862 1 46 . 1 1 65 65 SER CA C 65 60.890 60.890 58.245 2.645 17919 18863 1 46 . 1 1 65 65 SER CB C 65 64.910 64.910 65.639 -0.729 17919 18864 1 46 . 1 1 65 65 SER H H 65 7.670 7.670 7.506 0.164 17919 18865 1 46 . 1 1 66 66 THR N N 66 117.110 117.110 121.952 -4.842 17919 18866 1 46 . 1 1 66 66 THR HA H 66 5.270 5.270 5.179 0.091 17919 18867 1 46 . 1 1 66 66 THR C C 66 173.950 173.950 173.995 -0.045 17919 18868 1 46 . 1 1 66 66 THR CA C 66 62.340 62.340 62.101 0.239 17919 18869 1 46 . 1 1 66 66 THR CB C 66 70.080 70.080 69.737 0.343 17919 18870 1 46 . 1 1 66 66 THR H H 66 8.730 8.730 8.826 -0.096 17919 18871 1 46 . 1 1 67 67 LEU N N 67 127.110 127.110 127.179 -0.069 17919 18872 1 46 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.965 0.095 17919 18873 1 46 . 1 1 67 67 LEU C C 67 175.770 175.770 176.117 -0.347 17919 18874 1 46 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.164 -0.264 17919 18875 1 46 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.682 0.578 17919 18876 1 46 . 1 1 67 67 LEU H H 67 9.410 9.410 8.984 0.426 17919 18877 1 46 . 1 1 68 68 HIS N N 68 118.380 118.380 122.165 -3.785 17919 18878 1 46 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.101 0.139 17919 18879 1 46 . 1 1 68 68 HIS C C 68 173.150 173.150 174.608 -1.458 17919 18880 1 46 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.356 0.644 17919 18881 1 46 . 1 1 68 68 HIS CB C 68 30.530 30.530 28.667 1.863 17919 18882 1 46 . 1 1 68 68 HIS H H 68 9.230 9.230 8.337 0.893 17919 18883 1 46 . 1 1 69 69 LEU N N 69 124.460 124.460 123.840 0.620 17919 18884 1 46 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.228 0.962 17919 18885 1 46 . 1 1 69 69 LEU C C 69 175.270 175.270 175.689 -0.419 17919 18886 1 46 . 1 1 69 69 LEU CA C 69 53.890 53.890 55.494 -1.604 17919 18887 1 46 . 1 1 69 69 LEU CB C 69 44.380 44.380 42.227 2.154 17919 18888 1 46 . 1 1 69 69 LEU H H 69 8.340 8.340 8.112 0.228 17919 18889 1 46 . 1 1 70 70 VAL N N 70 126.940 126.940 128.716 -1.776 17919 18890 1 46 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.346 0.004 17919 18891 1 46 . 1 1 70 70 VAL C C 70 174.000 174.000 174.758 -0.758 17919 18892 1 46 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.868 -0.068 17919 18893 1 46 . 1 1 70 70 VAL CB C 70 34.910 34.910 32.755 2.155 17919 18894 1 46 . 1 1 70 70 VAL H H 70 9.200 9.200 8.123 1.077 17919 18895 1 46 . 1 1 71 71 LEU N N 71 123.130 123.130 129.344 -6.214 17919 18896 1 46 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.857 0.203 17919 18897 1 46 . 1 1 71 71 LEU C C 71 177.830 177.830 176.285 1.545 17919 18898 1 46 . 1 1 71 71 LEU CA C 71 53.940 53.940 54.215 -0.275 17919 18899 1 46 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.803 -0.953 17919 18900 1 46 . 1 1 71 71 LEU H H 71 8.120 8.120 8.480 -0.360 17919 18901 1 46 . 1 1 72 72 ARG N N 72 123.490 123.490 126.103 -2.613 17919 18902 1 46 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.551 -0.250 17919 18903 1 46 . 1 1 72 72 ARG C C 72 175.350 175.350 174.947 0.403 17919 18904 1 46 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.479 0.131 17919 18905 1 46 . 1 1 72 72 ARG CB C 72 31.350 31.350 32.250 -0.900 17919 18906 1 46 . 1 1 72 72 ARG H H 72 8.580 8.580 8.439 0.141 17919 18907 1 47 . 1 1 2 2 GLN N N 2 123.220 123.220 120.057 3.163 17919 18908 1 47 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.170 0.079 17919 18909 1 47 . 1 1 2 2 GLN C C 2 175.920 175.920 174.836 1.084 17919 18910 1 47 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.933 0.147 17919 18911 1 47 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.426 0.334 17919 18912 1 47 . 1 1 2 2 GLN H H 2 8.900 8.900 8.365 0.535 17919 18913 1 47 . 1 1 3 3 ILE N N 3 115.340 115.340 113.812 1.528 17919 18914 1 47 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.178 0.035 17919 18915 1 47 . 1 1 3 3 ILE C C 3 172.450 172.450 173.293 -0.843 17919 18916 1 47 . 1 1 3 3 ILE CA C 3 59.570 59.570 60.046 -0.476 17919 18917 1 47 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.781 0.429 17919 18918 1 47 . 1 1 3 3 ILE H H 3 8.320 8.320 8.351 -0.031 17919 18919 1 47 . 1 1 4 4 PHE N N 4 118.110 118.110 119.884 -1.774 17919 18920 1 47 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.492 0.138 17919 18921 1 47 . 1 1 4 4 PHE C C 4 175.320 175.320 175.122 0.198 17919 18922 1 47 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.133 0.077 17919 18923 1 47 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.090 -0.610 17919 18924 1 47 . 1 1 4 4 PHE H H 4 8.610 8.610 8.334 0.276 17919 18925 1 47 . 1 1 5 5 VAL N N 5 121.000 121.000 121.428 -0.428 17919 18926 1 47 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.855 -0.130 17919 18927 1 47 . 1 1 5 5 VAL C C 5 174.870 174.870 175.891 -1.021 17919 18928 1 47 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.411 -0.791 17919 18929 1 47 . 1 1 5 5 VAL CB C 5 34.230 34.230 32.649 1.581 17919 18930 1 47 . 1 1 5 5 VAL H H 5 9.300 9.300 8.808 0.492 17919 18931 1 47 . 1 1 6 6 LYS N N 6 127.520 127.520 128.852 -1.332 17919 18932 1 47 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.262 0.105 17919 18933 1 47 . 1 1 6 6 LYS C C 6 177.140 177.140 176.203 0.937 17919 18934 1 47 . 1 1 6 6 LYS CA C 6 54.520 54.520 55.426 -0.906 17919 18935 1 47 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.427 0.623 17919 18936 1 47 . 1 1 6 6 LYS H H 6 8.820 8.820 8.796 0.024 17919 18937 1 47 . 1 1 7 7 THR N N 7 115.400 115.400 114.093 1.307 17919 18938 1 47 . 1 1 7 7 THR HA H 7 4.970 4.970 4.576 0.394 17919 18939 1 47 . 1 1 7 7 THR C C 7 176.910 176.910 175.864 1.046 17919 18940 1 47 . 1 1 7 7 THR CA C 7 60.470 60.470 59.564 0.906 17919 18941 1 47 . 1 1 7 7 THR CB C 7 70.630 70.630 71.852 -1.222 17919 18942 1 47 . 1 1 7 7 THR H H 7 8.730 8.730 8.604 0.126 17919 18943 1 47 . 1 1 8 8 LEU N N 8 121.330 121.330 124.138 -2.808 17919 18944 1 47 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.149 0.161 17919 18945 1 47 . 1 1 8 8 LEU C C 8 178.800 178.800 177.133 1.667 17919 18946 1 47 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.596 -0.016 17919 18947 1 47 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.239 -0.269 17919 18948 1 47 . 1 1 8 8 LEU H H 8 9.100 9.100 9.109 -0.009 17919 18949 1 47 . 1 1 9 9 THR N N 9 105.590 105.590 108.115 -2.525 17919 18950 1 47 . 1 1 9 9 THR HA H 9 4.428 4.428 4.446 -0.018 17919 18951 1 47 . 1 1 9 9 THR C C 9 175.520 175.520 175.434 0.086 17919 18952 1 47 . 1 1 9 9 THR CA C 9 61.400 61.400 61.469 -0.069 17919 18953 1 47 . 1 1 9 9 THR CB C 9 69.140 69.140 69.751 -0.611 17919 18954 1 47 . 1 1 9 9 THR H H 9 7.630 7.630 7.547 0.083 17919 18955 1 47 . 1 1 10 10 GLY N N 10 108.890 108.890 111.153 -2.263 17919 18956 1 47 . 1 1 10 10 GLY C C 10 174.070 174.070 173.495 0.575 17919 18957 1 47 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.047 0.413 17919 18958 1 47 . 1 1 10 10 GLY H H 10 7.810 7.810 7.908 -0.098 17919 18959 1 47 . 1 1 11 11 LYS N N 11 121.600 121.600 120.737 0.863 17919 18960 1 47 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.770 -0.409 17919 18961 1 47 . 1 1 11 11 LYS C C 11 175.940 175.940 175.132 0.808 17919 18962 1 47 . 1 1 11 11 LYS CA C 11 56.280 56.280 54.591 1.689 17919 18963 1 47 . 1 1 11 11 LYS CB C 11 33.200 33.200 34.594 -1.395 17919 18964 1 47 . 1 1 11 11 LYS H H 11 7.280 7.280 7.654 -0.374 17919 18965 1 47 . 1 1 12 12 THR N N 12 120.440 120.440 117.316 3.124 17919 18966 1 47 . 1 1 12 12 THR HA H 12 5.046 5.046 4.740 0.306 17919 18967 1 47 . 1 1 12 12 THR C C 12 174.320 174.320 174.127 0.193 17919 18968 1 47 . 1 1 12 12 THR CA C 12 62.390 62.390 61.994 0.396 17919 18969 1 47 . 1 1 12 12 THR CB C 12 69.910 69.910 69.818 0.092 17919 18970 1 47 . 1 1 12 12 THR H H 12 8.650 8.650 8.363 0.287 17919 18971 1 47 . 1 1 13 13 ILE N N 13 127.110 127.110 127.551 -0.441 17919 18972 1 47 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.448 0.096 17919 18973 1 47 . 1 1 13 13 ILE C C 13 175.220 175.220 175.227 -0.007 17919 18974 1 47 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.305 -0.325 17919 18975 1 47 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.285 -0.335 17919 18976 1 47 . 1 1 13 13 ILE H H 13 9.450 9.450 8.857 0.593 17919 18977 1 47 . 1 1 14 14 THR N N 14 121.520 121.520 122.434 -0.914 17919 18978 1 47 . 1 1 14 14 THR HA H 14 4.964 4.964 4.639 0.325 17919 18979 1 47 . 1 1 14 14 THR C C 14 173.790 173.790 174.131 -0.341 17919 18980 1 47 . 1 1 14 14 THR CA C 14 61.940 61.940 62.809 -0.869 17919 18981 1 47 . 1 1 14 14 THR CB C 14 69.650 69.650 69.521 0.129 17919 18982 1 47 . 1 1 14 14 THR H H 14 8.710 8.710 8.520 0.190 17919 18983 1 47 . 1 1 15 15 LEU N N 15 124.800 124.800 127.400 -2.600 17919 18984 1 47 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.585 0.195 17919 18985 1 47 . 1 1 15 15 LEU C C 15 174.670 174.670 175.788 -1.118 17919 18986 1 47 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.923 -1.093 17919 18987 1 47 . 1 1 15 15 LEU CB C 15 47.070 47.070 43.227 3.843 17919 18988 1 47 . 1 1 15 15 LEU H H 15 8.710 8.710 8.631 0.079 17919 18989 1 47 . 1 1 16 16 GLU N N 16 122.160 122.160 122.889 -0.729 17919 18990 1 47 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.928 -0.011 17919 18991 1 47 . 1 1 16 16 GLU C C 16 175.860 175.860 175.951 -0.091 17919 18992 1 47 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.803 -0.983 17919 18993 1 47 . 1 1 16 16 GLU CB C 16 29.450 29.450 31.349 -1.899 17919 18994 1 47 . 1 1 16 16 GLU H H 16 8.140 8.140 8.745 -0.605 17919 18995 1 47 . 1 1 17 17 VAL N N 17 117.210 117.210 120.064 -2.854 17919 18996 1 47 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.732 -0.018 17919 18997 1 47 . 1 1 17 17 VAL C C 17 174.160 174.160 174.413 -0.253 17919 18998 1 47 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.063 -0.633 17919 18999 1 47 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.618 0.782 17919 19000 1 47 . 1 1 17 17 VAL H H 17 8.900 8.900 8.737 0.163 17919 19001 1 47 . 1 1 18 18 GLU N N 18 118.990 118.990 118.718 0.272 17919 19002 1 47 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.852 0.227 17919 19003 1 47 . 1 1 18 18 GLU C C 18 176.160 176.160 175.295 0.865 17919 19004 1 47 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.079 -0.359 17919 19005 1 47 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.808 -0.498 17919 19006 1 47 . 1 1 18 18 GLU H H 18 8.640 8.640 8.758 -0.118 17919 19007 1 47 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.130 0.011 17919 19008 1 47 . 1 1 19 19 PRO C C 19 175.310 175.310 178.101 -2.791 17919 19009 1 47 . 1 1 19 19 PRO CA C 19 65.470 65.470 66.125 -0.655 17919 19010 1 47 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.949 0.001 17919 19011 1 47 . 1 1 20 20 SER N N 20 103.400 103.400 109.071 -5.671 17919 19012 1 47 . 1 1 20 20 SER HA H 20 4.370 4.370 4.246 0.124 17919 19013 1 47 . 1 1 20 20 SER C C 20 174.660 174.660 174.593 0.067 17919 19014 1 47 . 1 1 20 20 SER CA C 20 57.400 57.400 59.651 -2.251 17919 19015 1 47 . 1 1 20 20 SER CB C 20 63.370 63.370 62.725 0.645 17919 19016 1 47 . 1 1 20 20 SER H H 20 7.040 7.040 7.963 -0.923 17919 19017 1 47 . 1 1 21 21 ASP N N 21 123.480 123.480 124.765 -1.285 17919 19018 1 47 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.709 -0.014 17919 19019 1 47 . 1 1 21 21 ASP C C 21 176.360 176.360 175.917 0.443 17919 19020 1 47 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.180 0.520 17919 19021 1 47 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.196 -0.396 17919 19022 1 47 . 1 1 21 21 ASP H H 21 8.030 8.030 7.621 0.409 17919 19023 1 47 . 1 1 22 22 THR N N 22 108.800 108.800 113.957 -5.157 17919 19024 1 47 . 1 1 22 22 THR HA H 22 4.920 4.920 4.564 0.356 17919 19025 1 47 . 1 1 22 22 THR C C 22 176.750 176.750 176.136 0.614 17919 19026 1 47 . 1 1 22 22 THR CA C 22 59.690 59.690 61.802 -2.112 17919 19027 1 47 . 1 1 22 22 THR CB C 22 71.200 71.200 69.619 1.581 17919 19028 1 47 . 1 1 22 22 THR H H 22 7.900 7.900 8.262 -0.362 17919 19029 1 47 . 1 1 23 23 ILE N N 23 121.190 121.190 124.963 -3.773 17919 19030 1 47 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.722 -0.065 17919 19031 1 47 . 1 1 23 23 ILE C C 23 179.040 179.040 177.575 1.465 17919 19032 1 47 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.977 -0.717 17919 19033 1 47 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.408 -2.058 17919 19034 1 47 . 1 1 23 23 ILE H H 23 8.560 8.560 9.102 -0.542 17919 19035 1 47 . 1 1 24 24 GLU N N 24 120.830 120.830 118.938 1.892 17919 19036 1 47 . 1 1 24 24 GLU HA H 24 3.917 3.917 4.008 -0.091 17919 19037 1 47 . 1 1 24 24 GLU C C 24 178.640 178.640 178.446 0.194 17919 19038 1 47 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.250 0.970 17919 19039 1 47 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.128 -0.848 17919 19040 1 47 . 1 1 24 24 GLU H H 24 9.760 9.760 8.178 1.583 17919 19041 1 47 . 1 1 25 25 ASN N N 25 120.570 120.570 118.694 1.876 17919 19042 1 47 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.451 0.074 17919 19043 1 47 . 1 1 25 25 ASN C C 25 178.380 178.380 177.622 0.758 17919 19044 1 47 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.192 -0.132 17919 19045 1 47 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.718 -0.268 17919 19046 1 47 . 1 1 25 25 ASN H H 25 7.920 7.920 7.715 0.205 17919 19047 1 47 . 1 1 26 26 VAL N N 26 121.710 121.710 120.407 1.303 17919 19048 1 47 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.752 -0.355 17919 19049 1 47 . 1 1 26 26 VAL C C 26 177.950 177.950 177.654 0.296 17919 19050 1 47 . 1 1 26 26 VAL CA C 26 67.660 67.660 65.402 2.258 17919 19051 1 47 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.976 -1.136 17919 19052 1 47 . 1 1 26 26 VAL H H 26 8.070 8.070 8.048 0.022 17919 19053 1 47 . 1 1 27 27 LYS N N 27 118.860 118.860 120.138 -1.278 17919 19054 1 47 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.097 0.483 17919 19055 1 47 . 1 1 27 27 LYS C C 27 180.550 180.550 178.705 1.845 17919 19056 1 47 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.777 -0.527 17919 19057 1 47 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.179 1.551 17919 19058 1 47 . 1 1 27 27 LYS H H 27 8.560 8.560 8.582 -0.022 17919 19059 1 47 . 1 1 28 28 ALA N N 28 123.440 123.440 121.515 1.925 17919 19060 1 47 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.033 0.127 17919 19061 1 47 . 1 1 28 28 ALA C C 28 180.300 180.300 179.263 1.037 17919 19062 1 47 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.057 0.313 17919 19063 1 47 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.264 -0.554 17919 19064 1 47 . 1 1 28 28 ALA H H 28 8.060 8.060 7.785 0.275 17919 19065 1 47 . 1 1 29 29 LYS N N 29 119.940 119.940 119.160 0.780 17919 19066 1 47 . 1 1 29 29 LYS HA H 29 4.207 4.207 3.962 0.245 17919 19067 1 47 . 1 1 29 29 LYS C C 29 180.320 180.320 178.901 1.419 17919 19068 1 47 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.556 0.094 17919 19069 1 47 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.156 1.134 17919 19070 1 47 . 1 1 29 29 LYS H H 29 7.850 7.850 7.603 0.247 17919 19071 1 47 . 1 1 30 30 ILE N N 30 121.080 121.080 119.507 1.573 17919 19072 1 47 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.628 -0.121 17919 19073 1 47 . 1 1 30 30 ILE C C 30 178.310 178.310 177.544 0.766 17919 19074 1 47 . 1 1 30 30 ILE CA C 30 66.150 66.150 64.740 1.409 17919 19075 1 47 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.512 -0.712 17919 19076 1 47 . 1 1 30 30 ILE H H 30 8.280 8.280 7.316 0.964 17919 19077 1 47 . 1 1 31 31 GLN N N 31 123.490 123.490 120.057 3.433 17919 19078 1 47 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.912 -0.083 17919 19079 1 47 . 1 1 31 31 GLN C C 31 178.890 178.890 178.407 0.483 17919 19080 1 47 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.373 0.627 17919 19081 1 47 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.399 -0.679 17919 19082 1 47 . 1 1 31 31 GLN H H 31 8.580 8.580 8.201 0.379 17919 19083 1 47 . 1 1 32 32 ASP N N 32 119.360 119.360 118.736 0.624 17919 19084 1 47 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.382 -0.028 17919 19085 1 47 . 1 1 32 32 ASP C C 32 177.250 177.250 177.734 -0.484 17919 19086 1 47 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.741 0.449 17919 19087 1 47 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.851 -0.271 17919 19088 1 47 . 1 1 32 32 ASP H H 32 8.010 8.010 8.196 -0.186 17919 19089 1 47 . 1 1 33 33 LYS N N 33 115.130 115.130 115.346 -0.216 17919 19090 1 47 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.524 -0.187 17919 19091 1 47 . 1 1 33 33 LYS C C 33 177.870 177.870 177.473 0.397 17919 19092 1 47 . 1 1 33 33 LYS CA C 33 58.050 58.050 56.292 1.758 17919 19093 1 47 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.962 0.208 17919 19094 1 47 . 1 1 33 33 LYS H H 33 7.430 7.430 7.432 -0.002 17919 19095 1 47 . 1 1 34 34 GLU N N 34 113.870 113.870 117.840 -3.970 17919 19096 1 47 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.478 0.147 17919 19097 1 47 . 1 1 34 34 GLU C C 34 177.840 177.840 177.113 0.727 17919 19098 1 47 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.650 -0.480 17919 19099 1 47 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.711 0.949 17919 19100 1 47 . 1 1 34 34 GLU H H 34 8.740 8.740 8.304 0.436 17919 19101 1 47 . 1 1 35 35 GLY N N 35 108.650 108.650 107.959 0.691 17919 19102 1 47 . 1 1 35 35 GLY C C 35 173.960 173.960 174.777 -0.817 17919 19103 1 47 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.714 0.366 17919 19104 1 47 . 1 1 35 35 GLY H H 35 8.530 8.530 7.748 0.782 17919 19105 1 47 . 1 1 36 36 ILE N N 36 119.880 119.880 122.099 -2.219 17919 19106 1 47 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.132 0.313 17919 19107 1 47 . 1 1 36 36 ILE C C 36 173.590 173.590 174.183 -0.593 17919 19108 1 47 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.744 -0.994 17919 19109 1 47 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.525 2.055 17919 19110 1 47 . 1 1 36 36 ILE H H 36 6.150 6.150 7.795 -1.645 17919 19111 1 47 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.775 -0.141 17919 19112 1 47 . 1 1 37 37 PRO C C 37 176.940 176.940 176.153 0.787 17919 19113 1 47 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.013 0.647 17919 19114 1 47 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.524 0.326 17919 19115 1 47 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.156 -0.039 17919 19116 1 47 . 1 1 38 38 PRO C C 38 178.320 178.320 178.018 0.302 17919 19117 1 47 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.586 0.674 17919 19118 1 47 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.916 0.974 17919 19119 1 47 . 1 1 39 39 ASP N N 39 113.380 113.380 116.749 -3.369 17919 19120 1 47 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.304 0.126 17919 19121 1 47 . 1 1 39 39 ASP C C 39 177.090 177.090 178.282 -1.192 17919 19122 1 47 . 1 1 39 39 ASP CA C 39 55.640 55.640 57.077 -1.437 17919 19123 1 47 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.251 -0.711 17919 19124 1 47 . 1 1 39 39 ASP H H 39 8.550 8.550 8.648 -0.098 17919 19125 1 47 . 1 1 40 40 GLN N N 40 116.780 116.780 118.037 -1.257 17919 19126 1 47 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.200 0.264 17919 19127 1 47 . 1 1 40 40 GLN C C 40 175.380 175.380 176.919 -1.539 17919 19128 1 47 . 1 1 40 40 GLN CA C 40 55.640 55.640 57.571 -1.931 17919 19129 1 47 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.614 0.526 17919 19130 1 47 . 1 1 40 40 GLN H H 40 7.820 7.820 7.944 -0.124 17919 19131 1 47 . 1 1 41 41 GLN N N 41 117.720 117.720 119.466 -1.746 17919 19132 1 47 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.618 -0.374 17919 19133 1 47 . 1 1 41 41 GLN C C 41 176.300 176.300 175.183 1.117 17919 19134 1 47 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.962 0.508 17919 19135 1 47 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.133 2.517 17919 19136 1 47 . 1 1 41 41 GLN H H 41 7.480 7.480 7.637 -0.157 17919 19137 1 47 . 1 1 42 42 ARG N N 42 122.680 122.680 126.581 -3.901 17919 19138 1 47 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.588 -0.088 17919 19139 1 47 . 1 1 42 42 ARG C C 42 174.050 174.050 174.134 -0.084 17919 19140 1 47 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.724 0.327 17919 19141 1 47 . 1 1 42 42 ARG CB C 42 31.750 31.750 31.150 0.600 17919 19142 1 47 . 1 1 42 42 ARG H H 42 8.530 8.530 8.652 -0.122 17919 19143 1 47 . 1 1 43 43 LEU N N 43 124.040 124.040 127.312 -3.272 17919 19144 1 47 . 1 1 43 43 LEU C C 43 175.290 175.290 175.710 -0.420 17919 19145 1 47 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.311 -1.331 17919 19146 1 47 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.260 2.530 17919 19147 1 47 . 1 1 43 43 LEU H H 43 8.820 8.820 8.793 0.027 17919 19148 1 47 . 1 1 44 44 ILE N N 44 121.920 121.920 124.333 -2.413 17919 19149 1 47 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.704 0.288 17919 19150 1 47 . 1 1 44 44 ILE C C 44 176.060 176.060 174.061 1.999 17919 19151 1 47 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.355 -1.375 17919 19152 1 47 . 1 1 44 44 ILE CB C 44 41.420 41.420 40.842 0.578 17919 19153 1 47 . 1 1 44 44 ILE H H 44 9.030 9.030 9.160 -0.130 17919 19154 1 47 . 1 1 45 45 PHE N N 45 125.390 125.390 126.943 -1.553 17919 19155 1 47 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.956 0.089 17919 19156 1 47 . 1 1 45 45 PHE C C 45 174.470 174.470 174.415 0.055 17919 19157 1 47 . 1 1 45 45 PHE CA C 45 57.020 57.020 57.200 -0.180 17919 19158 1 47 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.008 0.752 17919 19159 1 47 . 1 1 45 45 PHE H H 45 8.830 8.830 8.681 0.149 17919 19160 1 47 . 1 1 46 46 ALA N N 46 132.200 132.200 129.363 2.837 17919 19161 1 47 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.515 0.175 17919 19162 1 47 . 1 1 46 46 ALA C C 46 177.290 177.290 177.723 -0.433 17919 19163 1 47 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.453 0.087 17919 19164 1 47 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.350 0.220 17919 19165 1 47 . 1 1 46 46 ALA H H 46 8.810 8.810 8.438 0.372 17919 19166 1 47 . 1 1 47 47 GLY N N 47 102.340 102.340 103.847 -1.507 17919 19167 1 47 . 1 1 47 47 GLY C C 47 173.810 173.810 173.828 -0.018 17919 19168 1 47 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.847 0.503 17919 19169 1 47 . 1 1 47 47 GLY H H 47 8.130 8.130 8.465 -0.335 17919 19170 1 47 . 1 1 48 48 LYS N N 48 121.570 121.570 121.693 -0.123 17919 19171 1 47 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.632 -0.010 17919 19172 1 47 . 1 1 48 48 LYS C C 48 174.700 174.700 175.219 -0.519 17919 19173 1 47 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.836 -0.286 17919 19174 1 47 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.509 0.021 17919 19175 1 47 . 1 1 48 48 LYS H H 48 7.980 7.980 7.588 0.392 17919 19176 1 47 . 1 1 49 49 GLN N N 49 122.410 122.410 125.097 -2.687 17919 19177 1 47 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.552 0.008 17919 19178 1 47 . 1 1 49 49 GLN C C 49 175.670 175.670 175.118 0.552 17919 19179 1 47 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.321 -0.581 17919 19180 1 47 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.285 -0.285 17919 19181 1 47 . 1 1 49 49 GLN H H 49 8.600 8.600 8.510 0.090 17919 19182 1 47 . 1 1 50 50 LEU N N 50 125.520 125.520 125.491 0.029 17919 19183 1 47 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.260 -0.170 17919 19184 1 47 . 1 1 50 50 LEU C C 50 176.660 176.660 176.687 -0.027 17919 19185 1 47 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.130 0.110 17919 19186 1 47 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.503 -0.933 17919 19187 1 47 . 1 1 50 50 LEU H H 50 8.530 8.530 8.062 0.468 17919 19188 1 47 . 1 1 51 51 GLU N N 51 122.940 122.940 123.216 -0.276 17919 19189 1 47 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.440 0.048 17919 19190 1 47 . 1 1 51 51 GLU C C 51 175.870 175.870 176.817 -0.947 17919 19191 1 47 . 1 1 51 51 GLU CA C 51 55.960 55.960 56.416 -0.456 17919 19192 1 47 . 1 1 51 51 GLU CB C 51 31.570 31.570 30.533 1.037 17919 19193 1 47 . 1 1 51 51 GLU H H 51 8.400 8.400 8.336 0.064 17919 19194 1 47 . 1 1 52 52 ASP N N 52 120.030 120.030 124.263 -4.233 17919 19195 1 47 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.589 -0.230 17919 19196 1 47 . 1 1 52 52 ASP C C 52 177.330 177.330 177.891 -0.561 17919 19197 1 47 . 1 1 52 52 ASP CA C 52 56.960 56.960 56.221 0.739 17919 19198 1 47 . 1 1 52 52 ASP CB C 52 40.850 40.850 41.087 -0.237 17919 19199 1 47 . 1 1 52 52 ASP H H 52 8.160 8.160 8.815 -0.655 17919 19200 1 47 . 1 1 53 53 GLY N N 53 106.660 106.660 108.254 -1.594 17919 19201 1 47 . 1 1 53 53 GLY C C 53 174.870 174.870 173.865 1.005 17919 19202 1 47 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.927 0.243 17919 19203 1 47 . 1 1 53 53 GLY H H 53 9.390 9.390 8.571 0.819 17919 19204 1 47 . 1 1 54 54 ARG N N 54 119.050 119.050 119.415 -0.365 17919 19205 1 47 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.612 0.083 17919 19206 1 47 . 1 1 54 54 ARG C C 54 175.350 175.350 174.578 0.772 17919 19207 1 47 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.102 0.288 17919 19208 1 47 . 1 1 54 54 ARG CB C 54 32.650 32.650 34.536 -1.886 17919 19209 1 47 . 1 1 54 54 ARG H H 54 7.460 7.460 7.766 -0.306 17919 19210 1 47 . 1 1 55 55 THR N N 55 108.400 108.400 111.780 -3.380 17919 19211 1 47 . 1 1 55 55 THR HA H 55 5.240 5.240 5.252 -0.012 17919 19212 1 47 . 1 1 55 55 THR C C 55 176.560 176.560 176.311 0.249 17919 19213 1 47 . 1 1 55 55 THR CA C 55 59.690 59.690 59.556 0.134 17919 19214 1 47 . 1 1 55 55 THR CB C 55 72.260 72.260 71.007 1.253 17919 19215 1 47 . 1 1 55 55 THR H H 55 8.730 8.730 9.072 -0.342 17919 19216 1 47 . 1 1 56 56 LEU N N 56 117.920 117.920 121.640 -3.720 17919 19217 1 47 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.867 0.193 17919 19218 1 47 . 1 1 56 56 LEU C C 56 180.810 180.810 178.784 2.026 17919 19219 1 47 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.866 -0.156 17919 19220 1 47 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.279 -0.909 17919 19221 1 47 . 1 1 56 56 LEU H H 56 8.140 8.140 8.227 -0.087 17919 19222 1 47 . 1 1 57 57 SER N N 57 113.330 113.330 113.411 -0.081 17919 19223 1 47 . 1 1 57 57 SER HA H 57 4.370 4.370 4.080 0.290 17919 19224 1 47 . 1 1 57 57 SER C C 57 178.310 178.310 177.103 1.207 17919 19225 1 47 . 1 1 57 57 SER CA C 57 61.080 61.080 61.531 -0.451 17919 19226 1 47 . 1 1 57 57 SER CB C 57 62.530 62.530 62.528 0.002 17919 19227 1 47 . 1 1 57 57 SER H H 57 8.470 8.470 7.807 0.663 17919 19228 1 47 . 1 1 58 58 ASP N N 58 124.190 124.190 122.109 2.081 17919 19229 1 47 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.253 0.043 17919 19230 1 47 . 1 1 58 58 ASP C C 58 177.400 177.400 177.561 -0.161 17919 19231 1 47 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.683 0.497 17919 19232 1 47 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.362 -0.262 17919 19233 1 47 . 1 1 58 58 ASP H H 58 7.930 7.930 7.616 0.314 17919 19234 1 47 . 1 1 59 59 TYR N N 59 115.510 115.510 114.894 0.616 17919 19235 1 47 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.676 -0.006 17919 19236 1 47 . 1 1 59 59 TYR C C 59 174.700 174.700 175.031 -0.331 17919 19237 1 47 . 1 1 59 59 TYR CA C 59 58.250 58.250 56.748 1.502 17919 19238 1 47 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.268 1.802 17919 19239 1 47 . 1 1 59 59 TYR H H 59 7.250 7.250 7.324 -0.074 17919 19240 1 47 . 1 1 60 60 ASN N N 60 115.900 115.900 117.464 -1.564 17919 19241 1 47 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.383 -0.028 17919 19242 1 47 . 1 1 60 60 ASN C C 60 174.340 174.340 174.702 -0.362 17919 19243 1 47 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.405 -0.285 17919 19244 1 47 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.670 -0.260 17919 19245 1 47 . 1 1 60 60 ASN H H 60 8.150 8.150 7.961 0.189 17919 19246 1 47 . 1 1 61 61 ILE N N 61 118.600 118.600 119.393 -0.793 17919 19247 1 47 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.724 -0.331 17919 19248 1 47 . 1 1 61 61 ILE C C 61 174.610 174.610 175.607 -0.997 17919 19249 1 47 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.417 1.003 17919 19250 1 47 . 1 1 61 61 ILE CB C 61 36.740 36.740 36.629 0.111 17919 19251 1 47 . 1 1 61 61 ILE H H 61 7.250 7.250 7.871 -0.621 17919 19252 1 47 . 1 1 62 62 GLN N N 62 124.740 124.740 125.430 -0.690 17919 19253 1 47 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.668 -0.162 17919 19254 1 47 . 1 1 62 62 GLN C C 62 175.970 175.970 175.163 0.807 17919 19255 1 47 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.774 -0.114 17919 19256 1 47 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.239 0.411 17919 19257 1 47 . 1 1 62 62 GLN H H 62 7.610 7.610 8.038 -0.428 17919 19258 1 47 . 1 1 63 63 LYS N N 63 120.300 120.300 121.939 -1.639 17919 19259 1 47 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.821 0.180 17919 19260 1 47 . 1 1 63 63 LYS C C 63 175.810 175.810 176.873 -1.063 17919 19261 1 47 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.342 -0.552 17919 19262 1 47 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.063 0.587 17919 19263 1 47 . 1 1 63 63 LYS H H 63 8.490 8.490 8.615 -0.125 17919 19264 1 47 . 1 1 64 64 GLU N N 64 113.950 113.950 120.362 -6.412 17919 19265 1 47 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.729 -0.264 17919 19266 1 47 . 1 1 64 64 GLU C C 64 175.250 175.250 175.626 -0.376 17919 19267 1 47 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.775 0.115 17919 19268 1 47 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.633 -2.733 17919 19269 1 47 . 1 1 64 64 GLU H H 64 9.280 9.280 8.489 0.791 17919 19270 1 47 . 1 1 65 65 SER N N 65 114.730 114.730 113.794 0.936 17919 19271 1 47 . 1 1 65 65 SER HA H 65 4.640 4.640 4.628 0.012 17919 19272 1 47 . 1 1 65 65 SER C C 65 172.160 172.160 174.276 -2.116 17919 19273 1 47 . 1 1 65 65 SER CA C 65 60.890 60.890 59.419 1.471 17919 19274 1 47 . 1 1 65 65 SER CB C 65 64.910 64.910 64.690 0.220 17919 19275 1 47 . 1 1 65 65 SER H H 65 7.670 7.670 7.449 0.221 17919 19276 1 47 . 1 1 66 66 THR N N 66 117.110 117.110 120.325 -3.215 17919 19277 1 47 . 1 1 66 66 THR HA H 66 5.270 5.270 5.146 0.124 17919 19278 1 47 . 1 1 66 66 THR C C 66 173.950 173.950 174.295 -0.345 17919 19279 1 47 . 1 1 66 66 THR CA C 66 62.340 62.340 61.938 0.402 17919 19280 1 47 . 1 1 66 66 THR CB C 66 70.080 70.080 70.056 0.024 17919 19281 1 47 . 1 1 66 66 THR H H 66 8.730 8.730 8.486 0.244 17919 19282 1 47 . 1 1 67 67 LEU N N 67 127.110 127.110 127.567 -0.457 17919 19283 1 47 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.993 0.067 17919 19284 1 47 . 1 1 67 67 LEU C C 67 175.770 175.770 175.216 0.554 17919 19285 1 47 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.945 -0.045 17919 19286 1 47 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.341 -0.081 17919 19287 1 47 . 1 1 67 67 LEU H H 67 9.410 9.410 8.565 0.845 17919 19288 1 47 . 1 1 68 68 HIS N N 68 118.380 118.380 118.834 -0.454 17919 19289 1 47 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.527 -0.287 17919 19290 1 47 . 1 1 68 68 HIS C C 68 173.150 173.150 173.887 -0.737 17919 19291 1 47 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.409 0.591 17919 19292 1 47 . 1 1 68 68 HIS CB C 68 30.530 30.530 33.452 -2.922 17919 19293 1 47 . 1 1 68 68 HIS H H 68 9.230 9.230 8.914 0.316 17919 19294 1 47 . 1 1 69 69 LEU N N 69 124.460 124.460 127.028 -2.568 17919 19295 1 47 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.051 0.139 17919 19296 1 47 . 1 1 69 69 LEU C C 69 175.270 175.270 174.421 0.849 17919 19297 1 47 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.442 0.448 17919 19298 1 47 . 1 1 69 69 LEU CB C 69 44.380 44.380 45.157 -0.777 17919 19299 1 47 . 1 1 69 69 LEU H H 69 8.340 8.340 7.633 0.707 17919 19300 1 47 . 1 1 70 70 VAL N N 70 126.940 126.940 121.131 5.809 17919 19301 1 47 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.775 -0.425 17919 19302 1 47 . 1 1 70 70 VAL C C 70 174.000 174.000 174.237 -0.237 17919 19303 1 47 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.238 1.562 17919 19304 1 47 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.260 -0.350 17919 19305 1 47 . 1 1 70 70 VAL H H 70 9.200 9.200 8.971 0.229 17919 19306 1 47 . 1 1 71 71 LEU N N 71 123.130 123.130 119.769 3.361 17919 19307 1 47 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.148 -0.088 17919 19308 1 47 . 1 1 71 71 LEU C C 71 177.830 177.830 177.248 0.582 17919 19309 1 47 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.607 0.333 17919 19310 1 47 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.865 -0.016 17919 19311 1 47 . 1 1 71 71 LEU H H 71 8.120 8.120 8.294 -0.174 17919 19312 1 47 . 1 1 72 72 ARG N N 72 123.490 123.490 123.956 -0.466 17919 19313 1 47 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.348 -0.047 17919 19314 1 47 . 1 1 72 72 ARG C C 72 175.350 175.350 175.081 0.269 17919 19315 1 47 . 1 1 72 72 ARG CA C 72 55.610 55.610 57.202 -1.592 17919 19316 1 47 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.836 0.514 17919 19317 1 47 . 1 1 72 72 ARG H H 72 8.580 8.580 8.376 0.204 17919 19318 1 48 . 1 1 2 2 GLN N N 2 123.220 123.220 118.239 4.981 17919 19319 1 48 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.263 -0.014 17919 19320 1 48 . 1 1 2 2 GLN C C 2 175.920 175.920 174.287 1.633 17919 19321 1 48 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.969 0.111 17919 19322 1 48 . 1 1 2 2 GLN CB C 2 30.760 30.760 33.309 -2.549 17919 19323 1 48 . 1 1 2 2 GLN H H 2 8.900 8.900 8.562 0.338 17919 19324 1 48 . 1 1 3 3 ILE N N 3 115.340 115.340 115.694 -0.354 17919 19325 1 48 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.356 -0.143 17919 19326 1 48 . 1 1 3 3 ILE C C 3 172.450 172.450 173.361 -0.911 17919 19327 1 48 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.571 -0.001 17919 19328 1 48 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.478 0.732 17919 19329 1 48 . 1 1 3 3 ILE H H 3 8.320 8.320 8.839 -0.519 17919 19330 1 48 . 1 1 4 4 PHE N N 4 118.110 118.110 119.321 -1.211 17919 19331 1 48 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.280 0.350 17919 19332 1 48 . 1 1 4 4 PHE C C 4 175.320 175.320 175.436 -0.116 17919 19333 1 48 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.397 -0.187 17919 19334 1 48 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.032 -0.552 17919 19335 1 48 . 1 1 4 4 PHE H H 4 8.610 8.610 8.727 -0.117 17919 19336 1 48 . 1 1 5 5 VAL N N 5 121.000 121.000 121.634 -0.634 17919 19337 1 48 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.919 -0.194 17919 19338 1 48 . 1 1 5 5 VAL C C 5 174.870 174.870 175.003 -0.133 17919 19339 1 48 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.242 -0.622 17919 19340 1 48 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.414 0.815 17919 19341 1 48 . 1 1 5 5 VAL H H 5 9.300 9.300 8.964 0.336 17919 19342 1 48 . 1 1 6 6 LYS N N 6 127.520 127.520 127.464 0.056 17919 19343 1 48 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.170 0.197 17919 19344 1 48 . 1 1 6 6 LYS C C 6 177.140 177.140 176.192 0.948 17919 19345 1 48 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.171 0.349 17919 19346 1 48 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.257 -0.207 17919 19347 1 48 . 1 1 6 6 LYS H H 6 8.820 8.820 9.042 -0.222 17919 19348 1 48 . 1 1 7 7 THR N N 7 115.400 115.400 113.201 2.199 17919 19349 1 48 . 1 1 7 7 THR HA H 7 4.970 4.970 4.466 0.504 17919 19350 1 48 . 1 1 7 7 THR C C 7 176.910 176.910 176.334 0.576 17919 19351 1 48 . 1 1 7 7 THR CA C 7 60.470 60.470 60.018 0.452 17919 19352 1 48 . 1 1 7 7 THR CB C 7 70.630 70.630 70.483 0.147 17919 19353 1 48 . 1 1 7 7 THR H H 7 8.730 8.730 8.066 0.664 17919 19354 1 48 . 1 1 8 8 LEU N N 8 121.330 121.330 120.040 1.290 17919 19355 1 48 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.210 0.100 17919 19356 1 48 . 1 1 8 8 LEU C C 8 178.800 178.800 177.811 0.989 17919 19357 1 48 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.877 -0.297 17919 19358 1 48 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.661 0.309 17919 19359 1 48 . 1 1 8 8 LEU H H 8 9.100 9.100 8.926 0.174 17919 19360 1 48 . 1 1 9 9 THR N N 9 105.590 105.590 107.221 -1.631 17919 19361 1 48 . 1 1 9 9 THR HA H 9 4.428 4.428 4.355 0.073 17919 19362 1 48 . 1 1 9 9 THR C C 9 175.520 175.520 175.524 -0.004 17919 19363 1 48 . 1 1 9 9 THR CA C 9 61.400 61.400 61.602 -0.202 17919 19364 1 48 . 1 1 9 9 THR CB C 9 69.140 69.140 68.705 0.435 17919 19365 1 48 . 1 1 9 9 THR H H 9 7.630 7.630 7.595 0.035 17919 19366 1 48 . 1 1 10 10 GLY N N 10 108.890 108.890 111.095 -2.205 17919 19367 1 48 . 1 1 10 10 GLY C C 10 174.070 174.070 174.172 -0.102 17919 19368 1 48 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.152 0.308 17919 19369 1 48 . 1 1 10 10 GLY H H 10 7.810 7.810 7.449 0.361 17919 19370 1 48 . 1 1 11 11 LYS N N 11 121.600 121.600 122.566 -0.966 17919 19371 1 48 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.227 0.134 17919 19372 1 48 . 1 1 11 11 LYS C C 11 175.940 175.940 175.598 0.342 17919 19373 1 48 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.833 -0.553 17919 19374 1 48 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.032 0.168 17919 19375 1 48 . 1 1 11 11 LYS H H 11 7.280 7.280 7.739 -0.459 17919 19376 1 48 . 1 1 12 12 THR N N 12 120.440 120.440 120.493 -0.053 17919 19377 1 48 . 1 1 12 12 THR HA H 12 5.046 5.046 5.163 -0.117 17919 19378 1 48 . 1 1 12 12 THR C C 12 174.320 174.320 174.443 -0.123 17919 19379 1 48 . 1 1 12 12 THR CA C 12 62.390 62.390 61.749 0.640 17919 19380 1 48 . 1 1 12 12 THR CB C 12 69.910 69.910 70.219 -0.309 17919 19381 1 48 . 1 1 12 12 THR H H 12 8.650 8.650 8.252 0.398 17919 19382 1 48 . 1 1 13 13 ILE N N 13 127.110 127.110 122.609 4.501 17919 19383 1 48 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.727 -0.183 17919 19384 1 48 . 1 1 13 13 ILE C C 13 175.220 175.220 174.478 0.742 17919 19385 1 48 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.355 0.625 17919 19386 1 48 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.976 -0.026 17919 19387 1 48 . 1 1 13 13 ILE H H 13 9.450 9.450 9.198 0.252 17919 19388 1 48 . 1 1 14 14 THR N N 14 121.520 121.520 120.371 1.149 17919 19389 1 48 . 1 1 14 14 THR HA H 14 4.964 4.964 4.979 -0.015 17919 19390 1 48 . 1 1 14 14 THR C C 14 173.790 173.790 173.968 -0.178 17919 19391 1 48 . 1 1 14 14 THR CA C 14 61.940 61.940 61.671 0.269 17919 19392 1 48 . 1 1 14 14 THR CB C 14 69.650 69.650 70.006 -0.356 17919 19393 1 48 . 1 1 14 14 THR H H 14 8.710 8.710 8.424 0.286 17919 19394 1 48 . 1 1 15 15 LEU N N 15 124.800 124.800 125.253 -0.453 17919 19395 1 48 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.900 -0.120 17919 19396 1 48 . 1 1 15 15 LEU C C 15 174.670 174.670 174.837 -0.167 17919 19397 1 48 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.851 -1.021 17919 19398 1 48 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.982 1.088 17919 19399 1 48 . 1 1 15 15 LEU H H 15 8.710 8.710 8.345 0.365 17919 19400 1 48 . 1 1 16 16 GLU N N 16 122.160 122.160 122.861 -0.701 17919 19401 1 48 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.177 -0.260 17919 19402 1 48 . 1 1 16 16 GLU C C 16 175.860 175.860 176.008 -0.148 17919 19403 1 48 . 1 1 16 16 GLU CA C 16 54.820 54.820 54.851 -0.031 17919 19404 1 48 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.670 -1.220 17919 19405 1 48 . 1 1 16 16 GLU H H 16 8.140 8.140 8.625 -0.485 17919 19406 1 48 . 1 1 17 17 VAL N N 17 117.210 117.210 118.126 -0.916 17919 19407 1 48 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.691 0.023 17919 19408 1 48 . 1 1 17 17 VAL C C 17 174.160 174.160 175.303 -1.143 17919 19409 1 48 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.965 -1.535 17919 19410 1 48 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.214 1.187 17919 19411 1 48 . 1 1 17 17 VAL H H 17 8.900 8.900 8.166 0.734 17919 19412 1 48 . 1 1 18 18 GLU N N 18 118.990 118.990 121.848 -2.858 17919 19413 1 48 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.842 0.237 17919 19414 1 48 . 1 1 18 18 GLU C C 18 176.160 176.160 176.607 -0.447 17919 19415 1 48 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.367 0.353 17919 19416 1 48 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.762 -0.452 17919 19417 1 48 . 1 1 18 18 GLU H H 18 8.640 8.640 8.765 -0.125 17919 19418 1 48 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.288 -0.147 17919 19419 1 48 . 1 1 19 19 PRO C C 19 175.310 175.310 177.003 -1.693 17919 19420 1 48 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.042 0.428 17919 19421 1 48 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.078 -0.128 17919 19422 1 48 . 1 1 20 20 SER N N 20 103.400 103.400 110.197 -6.797 17919 19423 1 48 . 1 1 20 20 SER HA H 20 4.370 4.370 4.396 -0.026 17919 19424 1 48 . 1 1 20 20 SER C C 20 174.660 174.660 174.489 0.171 17919 19425 1 48 . 1 1 20 20 SER CA C 20 57.400 57.400 57.597 -0.197 17919 19426 1 48 . 1 1 20 20 SER CB C 20 63.370 63.370 63.184 0.186 17919 19427 1 48 . 1 1 20 20 SER H H 20 7.040 7.040 7.799 -0.759 17919 19428 1 48 . 1 1 21 21 ASP N N 21 123.480 123.480 125.093 -1.613 17919 19429 1 48 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.568 0.127 17919 19430 1 48 . 1 1 21 21 ASP C C 21 176.360 176.360 175.805 0.555 17919 19431 1 48 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.974 -0.274 17919 19432 1 48 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.792 -0.993 17919 19433 1 48 . 1 1 21 21 ASP H H 21 8.030 8.030 7.983 0.047 17919 19434 1 48 . 1 1 22 22 THR N N 22 108.800 108.800 112.947 -4.147 17919 19435 1 48 . 1 1 22 22 THR HA H 22 4.920 4.920 4.726 0.194 17919 19436 1 48 . 1 1 22 22 THR C C 22 176.750 176.750 175.658 1.092 17919 19437 1 48 . 1 1 22 22 THR CA C 22 59.690 59.690 60.866 -1.176 17919 19438 1 48 . 1 1 22 22 THR CB C 22 71.200 71.200 70.698 0.502 17919 19439 1 48 . 1 1 22 22 THR H H 22 7.900 7.900 8.263 -0.363 17919 19440 1 48 . 1 1 23 23 ILE N N 23 121.190 121.190 122.232 -1.042 17919 19441 1 48 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.794 -0.137 17919 19442 1 48 . 1 1 23 23 ILE C C 23 179.040 179.040 177.904 1.136 17919 19443 1 48 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.355 -0.095 17919 19444 1 48 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.338 -1.988 17919 19445 1 48 . 1 1 23 23 ILE H H 23 8.560 8.560 8.848 -0.288 17919 19446 1 48 . 1 1 24 24 GLU N N 24 120.830 120.830 120.254 0.576 17919 19447 1 48 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.922 -0.005 17919 19448 1 48 . 1 1 24 24 GLU C C 24 178.640 178.640 178.511 0.129 17919 19449 1 48 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.227 -0.007 17919 19450 1 48 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.461 -1.181 17919 19451 1 48 . 1 1 24 24 GLU H H 24 9.760 9.760 7.887 1.873 17919 19452 1 48 . 1 1 25 25 ASN N N 25 120.570 120.570 117.069 3.501 17919 19453 1 48 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.533 -0.008 17919 19454 1 48 . 1 1 25 25 ASN C C 25 178.380 178.380 178.105 0.275 17919 19455 1 48 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.134 -0.074 17919 19456 1 48 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.273 0.177 17919 19457 1 48 . 1 1 25 25 ASN H H 25 7.920 7.920 7.560 0.360 17919 19458 1 48 . 1 1 26 26 VAL N N 26 121.710 121.710 118.582 3.128 17919 19459 1 48 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.543 -0.146 17919 19460 1 48 . 1 1 26 26 VAL C C 26 177.950 177.950 177.919 0.031 17919 19461 1 48 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.141 1.519 17919 19462 1 48 . 1 1 26 26 VAL CB C 26 30.840 30.840 30.303 0.537 17919 19463 1 48 . 1 1 26 26 VAL H H 26 8.070 8.070 8.366 -0.296 17919 19464 1 48 . 1 1 27 27 LYS N N 27 118.860 118.860 120.402 -1.542 17919 19465 1 48 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.314 0.266 17919 19466 1 48 . 1 1 27 27 LYS C C 27 180.550 180.550 179.345 1.205 17919 19467 1 48 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.285 -0.035 17919 19468 1 48 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.256 1.474 17919 19469 1 48 . 1 1 27 27 LYS H H 27 8.560 8.560 7.501 1.059 17919 19470 1 48 . 1 1 28 28 ALA N N 28 123.440 123.440 120.733 2.707 17919 19471 1 48 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.060 0.100 17919 19472 1 48 . 1 1 28 28 ALA C C 28 180.300 180.300 178.761 1.539 17919 19473 1 48 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.053 0.317 17919 19474 1 48 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.454 -0.744 17919 19475 1 48 . 1 1 28 28 ALA H H 28 8.060 8.060 8.074 -0.014 17919 19476 1 48 . 1 1 29 29 LYS N N 29 119.940 119.940 118.557 1.383 17919 19477 1 48 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.188 0.019 17919 19478 1 48 . 1 1 29 29 LYS C C 29 180.320 180.320 178.851 1.469 17919 19479 1 48 . 1 1 29 29 LYS CA C 29 59.650 59.650 58.559 1.091 17919 19480 1 48 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.569 0.721 17919 19481 1 48 . 1 1 29 29 LYS H H 29 7.850 7.850 7.202 0.648 17919 19482 1 48 . 1 1 30 30 ILE N N 30 121.080 121.080 120.761 0.319 17919 19483 1 48 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.581 -0.074 17919 19484 1 48 . 1 1 30 30 ILE C C 30 178.310 178.310 177.425 0.885 17919 19485 1 48 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.048 1.102 17919 19486 1 48 . 1 1 30 30 ILE CB C 30 36.800 36.800 36.737 0.063 17919 19487 1 48 . 1 1 30 30 ILE H H 30 8.280 8.280 8.404 -0.124 17919 19488 1 48 . 1 1 31 31 GLN N N 31 123.490 123.490 120.059 3.431 17919 19489 1 48 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.999 -0.170 17919 19490 1 48 . 1 1 31 31 GLN C C 31 178.890 178.890 178.443 0.447 17919 19491 1 48 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.219 0.781 17919 19492 1 48 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.290 -0.570 17919 19493 1 48 . 1 1 31 31 GLN H H 31 8.580 8.580 8.145 0.435 17919 19494 1 48 . 1 1 32 32 ASP N N 32 119.360 119.360 119.056 0.304 17919 19495 1 48 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.326 0.028 17919 19496 1 48 . 1 1 32 32 ASP C C 32 177.250 177.250 177.794 -0.544 17919 19497 1 48 . 1 1 32 32 ASP CA C 32 57.190 57.190 57.106 0.084 17919 19498 1 48 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.782 -0.202 17919 19499 1 48 . 1 1 32 32 ASP H H 32 8.010 8.010 7.858 0.152 17919 19500 1 48 . 1 1 33 33 LYS N N 33 115.130 115.130 117.538 -2.408 17919 19501 1 48 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.306 0.031 17919 19502 1 48 . 1 1 33 33 LYS C C 33 177.870 177.870 178.298 -0.428 17919 19503 1 48 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.594 0.456 17919 19504 1 48 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.053 1.117 17919 19505 1 48 . 1 1 33 33 LYS H H 33 7.430 7.430 7.627 -0.197 17919 19506 1 48 . 1 1 34 34 GLU N N 34 113.870 113.870 115.137 -1.267 17919 19507 1 48 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.467 0.158 17919 19508 1 48 . 1 1 34 34 GLU C C 34 177.840 177.840 177.529 0.311 17919 19509 1 48 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.055 -0.885 17919 19510 1 48 . 1 1 34 34 GLU CB C 34 32.660 32.660 32.133 0.527 17919 19511 1 48 . 1 1 34 34 GLU H H 34 8.740 8.740 8.060 0.680 17919 19512 1 48 . 1 1 35 35 GLY N N 35 108.650 108.650 110.084 -1.434 17919 19513 1 48 . 1 1 35 35 GLY C C 35 173.960 173.960 174.186 -0.226 17919 19514 1 48 . 1 1 35 35 GLY CA C 35 46.080 46.080 46.011 0.069 17919 19515 1 48 . 1 1 35 35 GLY H H 35 8.530 8.530 8.396 0.134 17919 19516 1 48 . 1 1 36 36 ILE N N 36 119.880 119.880 116.159 3.721 17919 19517 1 48 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.561 -0.116 17919 19518 1 48 . 1 1 36 36 ILE C C 36 173.590 173.590 173.518 0.072 17919 19519 1 48 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.356 0.394 17919 19520 1 48 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.619 1.961 17919 19521 1 48 . 1 1 36 36 ILE H H 36 6.150 6.150 7.273 -1.123 17919 19522 1 48 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.918 -0.284 17919 19523 1 48 . 1 1 37 37 PRO C C 37 176.940 176.940 176.212 0.728 17919 19524 1 48 . 1 1 37 37 PRO CA C 37 61.660 61.660 60.758 0.902 17919 19525 1 48 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.242 0.608 17919 19526 1 48 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.106 0.011 17919 19527 1 48 . 1 1 38 38 PRO C C 38 178.320 178.320 178.419 -0.099 17919 19528 1 48 . 1 1 38 38 PRO CA C 38 66.260 66.260 66.028 0.232 17919 19529 1 48 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.889 1.001 17919 19530 1 48 . 1 1 39 39 ASP N N 39 113.380 113.380 115.989 -2.609 17919 19531 1 48 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.317 0.113 17919 19532 1 48 . 1 1 39 39 ASP C C 39 177.090 177.090 177.792 -0.702 17919 19533 1 48 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.726 -1.086 17919 19534 1 48 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.352 -0.812 17919 19535 1 48 . 1 1 39 39 ASP H H 39 8.550 8.550 8.734 -0.184 17919 19536 1 48 . 1 1 40 40 GLN N N 40 116.780 116.780 117.019 -0.239 17919 19537 1 48 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.220 0.244 17919 19538 1 48 . 1 1 40 40 GLN C C 40 175.380 175.380 176.324 -0.944 17919 19539 1 48 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.507 -0.867 17919 19540 1 48 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.569 0.571 17919 19541 1 48 . 1 1 40 40 GLN H H 40 7.820 7.820 7.858 -0.038 17919 19542 1 48 . 1 1 41 41 GLN N N 41 117.720 117.720 119.407 -1.687 17919 19543 1 48 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.459 -0.215 17919 19544 1 48 . 1 1 41 41 GLN C C 41 176.300 176.300 175.467 0.833 17919 19545 1 48 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.835 -0.365 17919 19546 1 48 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.293 2.357 17919 19547 1 48 . 1 1 41 41 GLN H H 41 7.480 7.480 7.455 0.025 17919 19548 1 48 . 1 1 42 42 ARG N N 42 122.680 122.680 121.599 1.081 17919 19549 1 48 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.657 -0.157 17919 19550 1 48 . 1 1 42 42 ARG C C 42 174.050 174.050 175.072 -1.022 17919 19551 1 48 . 1 1 42 42 ARG CA C 42 55.050 55.050 53.436 1.614 17919 19552 1 48 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.704 -0.954 17919 19553 1 48 . 1 1 42 42 ARG H H 42 8.530 8.530 8.766 -0.236 17919 19554 1 48 . 1 1 43 43 LEU N N 43 124.040 124.040 124.591 -0.551 17919 19555 1 48 . 1 1 43 43 LEU C C 43 175.290 175.290 176.126 -0.836 17919 19556 1 48 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.679 -1.699 17919 19557 1 48 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.476 2.314 17919 19558 1 48 . 1 1 43 43 LEU H H 43 8.820 8.820 8.741 0.079 17919 19559 1 48 . 1 1 44 44 ILE N N 44 121.920 121.920 120.199 1.721 17919 19560 1 48 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.770 0.222 17919 19561 1 48 . 1 1 44 44 ILE C C 44 176.060 176.060 174.504 1.556 17919 19562 1 48 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.463 -1.483 17919 19563 1 48 . 1 1 44 44 ILE CB C 44 41.420 41.420 42.130 -0.710 17919 19564 1 48 . 1 1 44 44 ILE H H 44 9.030 9.030 8.461 0.569 17919 19565 1 48 . 1 1 45 45 PHE N N 45 125.390 125.390 126.434 -1.044 17919 19566 1 48 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.988 0.057 17919 19567 1 48 . 1 1 45 45 PHE C C 45 174.470 174.470 174.613 -0.143 17919 19568 1 48 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.433 0.587 17919 19569 1 48 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.033 0.727 17919 19570 1 48 . 1 1 45 45 PHE H H 45 8.830 8.830 8.981 -0.151 17919 19571 1 48 . 1 1 46 46 ALA N N 46 132.200 132.200 129.862 2.338 17919 19572 1 48 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.758 -0.068 17919 19573 1 48 . 1 1 46 46 ALA C C 46 177.290 177.290 177.893 -0.603 17919 19574 1 48 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.295 0.245 17919 19575 1 48 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.694 -0.124 17919 19576 1 48 . 1 1 46 46 ALA H H 46 8.810 8.810 8.652 0.158 17919 19577 1 48 . 1 1 47 47 GLY N N 47 102.340 102.340 104.387 -2.047 17919 19578 1 48 . 1 1 47 47 GLY C C 47 173.810 173.810 174.263 -0.453 17919 19579 1 48 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.127 0.223 17919 19580 1 48 . 1 1 47 47 GLY H H 47 8.130 8.130 8.500 -0.370 17919 19581 1 48 . 1 1 48 48 LYS N N 48 121.570 121.570 121.596 -0.026 17919 19582 1 48 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.687 -0.065 17919 19583 1 48 . 1 1 48 48 LYS C C 48 174.700 174.700 175.378 -0.678 17919 19584 1 48 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.045 -0.495 17919 19585 1 48 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.449 0.081 17919 19586 1 48 . 1 1 48 48 LYS H H 48 7.980 7.980 8.177 -0.197 17919 19587 1 48 . 1 1 49 49 GLN N N 49 122.410 122.410 125.846 -3.436 17919 19588 1 48 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.476 0.084 17919 19589 1 48 . 1 1 49 49 GLN C C 49 175.670 175.670 175.720 -0.050 17919 19590 1 48 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.845 -0.105 17919 19591 1 48 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.583 -0.583 17919 19592 1 48 . 1 1 49 49 GLN H H 49 8.600 8.600 8.730 -0.130 17919 19593 1 48 . 1 1 50 50 LEU N N 50 125.520 125.520 129.000 -3.480 17919 19594 1 48 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.058 0.032 17919 19595 1 48 . 1 1 50 50 LEU C C 50 176.660 176.660 175.729 0.931 17919 19596 1 48 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.753 -0.513 17919 19597 1 48 . 1 1 50 50 LEU CB C 50 41.570 41.570 40.422 1.148 17919 19598 1 48 . 1 1 50 50 LEU H H 50 8.530 8.530 8.946 -0.416 17919 19599 1 48 . 1 1 51 51 GLU N N 51 122.940 122.940 124.394 -1.454 17919 19600 1 48 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.569 -0.081 17919 19601 1 48 . 1 1 51 51 GLU C C 51 175.870 175.870 176.461 -0.591 17919 19602 1 48 . 1 1 51 51 GLU CA C 51 55.960 55.960 54.393 1.567 17919 19603 1 48 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.091 -0.521 17919 19604 1 48 . 1 1 51 51 GLU H H 51 8.400 8.400 7.979 0.421 17919 19605 1 48 . 1 1 52 52 ASP N N 52 120.030 120.030 120.455 -0.425 17919 19606 1 48 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.596 -0.237 17919 19607 1 48 . 1 1 52 52 ASP C C 52 177.330 177.330 177.014 0.316 17919 19608 1 48 . 1 1 52 52 ASP CA C 52 56.960 56.960 55.414 1.546 17919 19609 1 48 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.957 -0.107 17919 19610 1 48 . 1 1 52 52 ASP H H 52 8.160 8.160 8.722 -0.562 17919 19611 1 48 . 1 1 53 53 GLY N N 53 106.660 106.660 106.500 0.160 17919 19612 1 48 . 1 1 53 53 GLY C C 53 174.870 174.870 173.986 0.884 17919 19613 1 48 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.934 0.236 17919 19614 1 48 . 1 1 53 53 GLY H H 53 9.390 9.390 8.580 0.810 17919 19615 1 48 . 1 1 54 54 ARG N N 54 119.050 119.050 119.895 -0.845 17919 19616 1 48 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.693 0.002 17919 19617 1 48 . 1 1 54 54 ARG C C 54 175.350 175.350 174.617 0.733 17919 19618 1 48 . 1 1 54 54 ARG CA C 54 54.390 54.390 53.813 0.577 17919 19619 1 48 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.807 -1.157 17919 19620 1 48 . 1 1 54 54 ARG H H 54 7.460 7.460 7.671 -0.211 17919 19621 1 48 . 1 1 55 55 THR N N 55 108.400 108.400 112.835 -4.435 17919 19622 1 48 . 1 1 55 55 THR HA H 55 5.240 5.240 4.684 0.556 17919 19623 1 48 . 1 1 55 55 THR C C 55 176.560 176.560 176.194 0.366 17919 19624 1 48 . 1 1 55 55 THR CA C 55 59.690 59.690 61.159 -1.469 17919 19625 1 48 . 1 1 55 55 THR CB C 55 72.260 72.260 70.230 2.030 17919 19626 1 48 . 1 1 55 55 THR H H 55 8.730 8.730 8.709 0.021 17919 19627 1 48 . 1 1 56 56 LEU N N 56 117.920 117.920 121.719 -3.799 17919 19628 1 48 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.056 0.004 17919 19629 1 48 . 1 1 56 56 LEU C C 56 180.810 180.810 178.882 1.928 17919 19630 1 48 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.208 0.502 17919 19631 1 48 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.442 -1.072 17919 19632 1 48 . 1 1 56 56 LEU H H 56 8.140 8.140 8.105 0.035 17919 19633 1 48 . 1 1 57 57 SER N N 57 113.330 113.330 115.281 -1.951 17919 19634 1 48 . 1 1 57 57 SER HA H 57 4.370 4.370 4.206 0.164 17919 19635 1 48 . 1 1 57 57 SER C C 57 178.310 178.310 176.743 1.567 17919 19636 1 48 . 1 1 57 57 SER CA C 57 61.080 61.080 62.203 -1.123 17919 19637 1 48 . 1 1 57 57 SER CB C 57 62.530 62.530 62.834 -0.304 17919 19638 1 48 . 1 1 57 57 SER H H 57 8.470 8.470 8.409 0.061 17919 19639 1 48 . 1 1 58 58 ASP N N 58 124.190 124.190 121.087 3.103 17919 19640 1 48 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.268 0.028 17919 19641 1 48 . 1 1 58 58 ASP C C 58 177.400 177.400 176.531 0.869 17919 19642 1 48 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.576 0.604 17919 19643 1 48 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.225 -0.125 17919 19644 1 48 . 1 1 58 58 ASP H H 58 7.930 7.930 7.921 0.009 17919 19645 1 48 . 1 1 59 59 TYR N N 59 115.510 115.510 113.272 2.238 17919 19646 1 48 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.668 0.002 17919 19647 1 48 . 1 1 59 59 TYR C C 59 174.700 174.700 175.267 -0.567 17919 19648 1 48 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.435 0.815 17919 19649 1 48 . 1 1 59 59 TYR CB C 59 40.070 40.070 39.364 0.706 17919 19650 1 48 . 1 1 59 59 TYR H H 59 7.250 7.250 7.237 0.013 17919 19651 1 48 . 1 1 60 60 ASN N N 60 115.900 115.900 117.801 -1.901 17919 19652 1 48 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.382 -0.027 17919 19653 1 48 . 1 1 60 60 ASN C C 60 174.340 174.340 174.422 -0.082 17919 19654 1 48 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.170 -0.050 17919 19655 1 48 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.783 -0.373 17919 19656 1 48 . 1 1 60 60 ASN H H 60 8.150 8.150 7.960 0.190 17919 19657 1 48 . 1 1 61 61 ILE N N 61 118.600 118.600 120.167 -1.567 17919 19658 1 48 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.768 -0.375 17919 19659 1 48 . 1 1 61 61 ILE C C 61 174.610 174.610 174.630 -0.020 17919 19660 1 48 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.531 0.889 17919 19661 1 48 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.257 -0.517 17919 19662 1 48 . 1 1 61 61 ILE H H 61 7.250 7.250 7.671 -0.421 17919 19663 1 48 . 1 1 62 62 GLN N N 62 124.740 124.740 126.070 -1.330 17919 19664 1 48 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.669 -0.163 17919 19665 1 48 . 1 1 62 62 GLN C C 62 175.970 175.970 176.021 -0.051 17919 19666 1 48 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.581 0.079 17919 19667 1 48 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.441 0.209 17919 19668 1 48 . 1 1 62 62 GLN H H 62 7.610 7.610 7.969 -0.359 17919 19669 1 48 . 1 1 63 63 LYS N N 63 120.300 120.300 121.524 -1.224 17919 19670 1 48 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.025 -0.024 17919 19671 1 48 . 1 1 63 63 LYS C C 63 175.810 175.810 176.403 -0.593 17919 19672 1 48 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.566 0.224 17919 19673 1 48 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.580 1.070 17919 19674 1 48 . 1 1 63 63 LYS H H 63 8.490 8.490 8.647 -0.157 17919 19675 1 48 . 1 1 64 64 GLU N N 64 113.950 113.950 120.518 -6.568 17919 19676 1 48 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.465 0.000 17919 19677 1 48 . 1 1 64 64 GLU C C 64 175.250 175.250 175.786 -0.536 17919 19678 1 48 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.678 0.212 17919 19679 1 48 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.245 -2.345 17919 19680 1 48 . 1 1 64 64 GLU H H 64 9.280 9.280 8.919 0.361 17919 19681 1 48 . 1 1 65 65 SER N N 65 114.730 114.730 113.873 0.857 17919 19682 1 48 . 1 1 65 65 SER HA H 65 4.640 4.640 4.575 0.065 17919 19683 1 48 . 1 1 65 65 SER C C 65 172.160 172.160 173.953 -1.793 17919 19684 1 48 . 1 1 65 65 SER CA C 65 60.890 60.890 59.694 1.196 17919 19685 1 48 . 1 1 65 65 SER CB C 65 64.910 64.910 64.404 0.506 17919 19686 1 48 . 1 1 65 65 SER H H 65 7.670 7.670 7.873 -0.203 17919 19687 1 48 . 1 1 66 66 THR N N 66 117.110 117.110 117.099 0.011 17919 19688 1 48 . 1 1 66 66 THR HA H 66 5.270 5.270 5.301 -0.031 17919 19689 1 48 . 1 1 66 66 THR C C 66 173.950 173.950 174.099 -0.149 17919 19690 1 48 . 1 1 66 66 THR CA C 66 62.340 62.340 61.984 0.356 17919 19691 1 48 . 1 1 66 66 THR CB C 66 70.080 70.080 70.331 -0.251 17919 19692 1 48 . 1 1 66 66 THR H H 66 8.730 8.730 8.243 0.487 17919 19693 1 48 . 1 1 67 67 LEU N N 67 127.110 127.110 126.349 0.761 17919 19694 1 48 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.947 0.113 17919 19695 1 48 . 1 1 67 67 LEU C C 67 175.770 175.770 175.128 0.642 17919 19696 1 48 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.031 -0.131 17919 19697 1 48 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.592 -0.332 17919 19698 1 48 . 1 1 67 67 LEU H H 67 9.410 9.410 8.734 0.676 17919 19699 1 48 . 1 1 68 68 HIS N N 68 118.380 118.380 122.067 -3.687 17919 19700 1 48 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.295 -0.055 17919 19701 1 48 . 1 1 68 68 HIS C C 68 173.150 173.150 173.922 -0.772 17919 19702 1 48 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.755 0.245 17919 19703 1 48 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.126 -1.596 17919 19704 1 48 . 1 1 68 68 HIS H H 68 9.230 9.230 8.343 0.887 17919 19705 1 48 . 1 1 69 69 LEU N N 69 124.460 124.460 128.127 -3.667 17919 19706 1 48 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.977 0.213 17919 19707 1 48 . 1 1 69 69 LEU C C 69 175.270 175.270 174.138 1.132 17919 19708 1 48 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.584 0.306 17919 19709 1 48 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.991 -0.611 17919 19710 1 48 . 1 1 69 69 LEU H H 69 8.340 8.340 8.059 0.281 17919 19711 1 48 . 1 1 70 70 VAL N N 70 126.940 126.940 122.807 4.133 17919 19712 1 48 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.534 -0.184 17919 19713 1 48 . 1 1 70 70 VAL C C 70 174.000 174.000 173.390 0.610 17919 19714 1 48 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.169 1.631 17919 19715 1 48 . 1 1 70 70 VAL CB C 70 34.910 34.910 36.130 -1.220 17919 19716 1 48 . 1 1 70 70 VAL H H 70 9.200 9.200 8.764 0.436 17919 19717 1 48 . 1 1 71 71 LEU N N 71 123.130 123.130 123.861 -0.731 17919 19718 1 48 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.996 0.064 17919 19719 1 48 . 1 1 71 71 LEU C C 71 177.830 177.830 177.120 0.710 17919 19720 1 48 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.066 0.873 17919 19721 1 48 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.969 -0.119 17919 19722 1 48 . 1 1 71 71 LEU H H 71 8.120 8.120 8.323 -0.203 17919 19723 1 48 . 1 1 72 72 ARG N N 72 123.490 123.490 125.284 -1.794 17919 19724 1 48 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.241 0.060 17919 19725 1 48 . 1 1 72 72 ARG C C 72 175.350 175.350 175.102 0.248 17919 19726 1 48 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.183 -0.573 17919 19727 1 48 . 1 1 72 72 ARG CB C 72 31.350 31.350 31.146 0.204 17919 19728 1 48 . 1 1 72 72 ARG H H 72 8.580 8.580 8.235 0.345 17919 19729 1 49 . 1 1 2 2 GLN N N 2 123.220 123.220 122.360 0.860 17919 19730 1 49 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.265 -0.016 17919 19731 1 49 . 1 1 2 2 GLN C C 2 175.920 175.920 174.250 1.670 17919 19732 1 49 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.126 0.954 17919 19733 1 49 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.911 -0.151 17919 19734 1 49 . 1 1 2 2 GLN H H 2 8.900 8.900 8.700 0.200 17919 19735 1 49 . 1 1 3 3 ILE N N 3 115.340 115.340 119.164 -3.824 17919 19736 1 49 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.597 -0.384 17919 19737 1 49 . 1 1 3 3 ILE C C 3 172.450 172.450 173.297 -0.847 17919 19738 1 49 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.213 0.357 17919 19739 1 49 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.512 0.698 17919 19740 1 49 . 1 1 3 3 ILE H H 3 8.320 8.320 8.491 -0.171 17919 19741 1 49 . 1 1 4 4 PHE N N 4 118.110 118.110 122.823 -4.713 17919 19742 1 49 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.220 0.410 17919 19743 1 49 . 1 1 4 4 PHE C C 4 175.320 175.320 175.686 -0.366 17919 19744 1 49 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.514 -0.304 17919 19745 1 49 . 1 1 4 4 PHE CB C 4 41.480 41.480 40.633 0.847 17919 19746 1 49 . 1 1 4 4 PHE H H 4 8.610 8.610 9.028 -0.418 17919 19747 1 49 . 1 1 5 5 VAL N N 5 121.000 121.000 124.968 -3.968 17919 19748 1 49 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.389 0.336 17919 19749 1 49 . 1 1 5 5 VAL C C 5 174.870 174.870 175.188 -0.318 17919 19750 1 49 . 1 1 5 5 VAL CA C 5 60.620 60.620 62.817 -2.197 17919 19751 1 49 . 1 1 5 5 VAL CB C 5 34.230 34.230 32.631 1.599 17919 19752 1 49 . 1 1 5 5 VAL H H 5 9.300 9.300 8.854 0.446 17919 19753 1 49 . 1 1 6 6 LYS N N 6 127.520 127.520 128.955 -1.435 17919 19754 1 49 . 1 1 6 6 LYS HA H 6 5.367 5.367 4.687 0.680 17919 19755 1 49 . 1 1 6 6 LYS C C 6 177.140 177.140 176.269 0.871 17919 19756 1 49 . 1 1 6 6 LYS CA C 6 54.520 54.520 55.258 -0.737 17919 19757 1 49 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.639 0.410 17919 19758 1 49 . 1 1 6 6 LYS H H 6 8.820 8.820 8.871 -0.051 17919 19759 1 49 . 1 1 7 7 THR N N 7 115.400 115.400 116.812 -1.412 17919 19760 1 49 . 1 1 7 7 THR HA H 7 4.970 4.970 4.409 0.561 17919 19761 1 49 . 1 1 7 7 THR C C 7 176.910 176.910 176.332 0.578 17919 19762 1 49 . 1 1 7 7 THR CA C 7 60.470 60.470 61.489 -1.018 17919 19763 1 49 . 1 1 7 7 THR CB C 7 70.630 70.630 69.735 0.895 17919 19764 1 49 . 1 1 7 7 THR H H 7 8.730 8.730 7.949 0.781 17919 19765 1 49 . 1 1 8 8 LEU N N 8 121.330 121.330 121.796 -0.466 17919 19766 1 49 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.139 0.171 17919 19767 1 49 . 1 1 8 8 LEU C C 8 178.800 178.800 177.880 0.920 17919 19768 1 49 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.940 -0.360 17919 19769 1 49 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.134 -0.164 17919 19770 1 49 . 1 1 8 8 LEU H H 8 9.100 9.100 8.646 0.454 17919 19771 1 49 . 1 1 9 9 THR N N 9 105.590 105.590 107.702 -2.112 17919 19772 1 49 . 1 1 9 9 THR HA H 9 4.428 4.428 4.287 0.141 17919 19773 1 49 . 1 1 9 9 THR C C 9 175.520 175.520 175.473 0.047 17919 19774 1 49 . 1 1 9 9 THR CA C 9 61.400 61.400 61.901 -0.501 17919 19775 1 49 . 1 1 9 9 THR CB C 9 69.140 69.140 68.632 0.508 17919 19776 1 49 . 1 1 9 9 THR H H 9 7.630 7.630 7.720 -0.090 17919 19777 1 49 . 1 1 10 10 GLY N N 10 108.890 108.890 111.555 -2.665 17919 19778 1 49 . 1 1 10 10 GLY C C 10 174.070 174.070 173.706 0.364 17919 19779 1 49 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.234 0.226 17919 19780 1 49 . 1 1 10 10 GLY H H 10 7.810 7.810 7.801 0.009 17919 19781 1 49 . 1 1 11 11 LYS N N 11 121.600 121.600 121.559 0.041 17919 19782 1 49 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.577 -0.216 17919 19783 1 49 . 1 1 11 11 LYS C C 11 175.940 175.940 175.877 0.063 17919 19784 1 49 . 1 1 11 11 LYS CA C 11 56.280 56.280 55.214 1.066 17919 19785 1 49 . 1 1 11 11 LYS CB C 11 33.200 33.200 32.413 0.787 17919 19786 1 49 . 1 1 11 11 LYS H H 11 7.280 7.280 7.702 -0.422 17919 19787 1 49 . 1 1 12 12 THR N N 12 120.440 120.440 122.221 -1.781 17919 19788 1 49 . 1 1 12 12 THR HA H 12 5.046 5.046 4.777 0.269 17919 19789 1 49 . 1 1 12 12 THR C C 12 174.320 174.320 174.599 -0.279 17919 19790 1 49 . 1 1 12 12 THR CA C 12 62.390 62.390 63.075 -0.685 17919 19791 1 49 . 1 1 12 12 THR CB C 12 69.910 69.910 69.421 0.489 17919 19792 1 49 . 1 1 12 12 THR H H 12 8.650 8.650 8.489 0.161 17919 19793 1 49 . 1 1 13 13 ILE N N 13 127.110 127.110 128.821 -1.711 17919 19794 1 49 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.633 -0.089 17919 19795 1 49 . 1 1 13 13 ILE C C 13 175.220 175.220 174.725 0.495 17919 19796 1 49 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.478 -0.498 17919 19797 1 49 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.865 0.085 17919 19798 1 49 . 1 1 13 13 ILE H H 13 9.450 9.450 8.836 0.614 17919 19799 1 49 . 1 1 14 14 THR N N 14 121.520 121.520 123.927 -2.407 17919 19800 1 49 . 1 1 14 14 THR HA H 14 4.964 4.964 4.731 0.234 17919 19801 1 49 . 1 1 14 14 THR C C 14 173.790 173.790 173.754 0.036 17919 19802 1 49 . 1 1 14 14 THR CA C 14 61.940 61.940 62.102 -0.162 17919 19803 1 49 . 1 1 14 14 THR CB C 14 69.650 69.650 69.385 0.265 17919 19804 1 49 . 1 1 14 14 THR H H 14 8.710 8.710 8.457 0.253 17919 19805 1 49 . 1 1 15 15 LEU N N 15 124.800 124.800 127.510 -2.710 17919 19806 1 49 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.727 0.053 17919 19807 1 49 . 1 1 15 15 LEU C C 15 174.670 174.670 175.073 -0.403 17919 19808 1 49 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.933 -1.103 17919 19809 1 49 . 1 1 15 15 LEU CB C 15 47.070 47.070 44.341 2.729 17919 19810 1 49 . 1 1 15 15 LEU H H 15 8.710 8.710 8.675 0.035 17919 19811 1 49 . 1 1 16 16 GLU N N 16 122.160 122.160 123.369 -1.209 17919 19812 1 49 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.286 -0.369 17919 19813 1 49 . 1 1 16 16 GLU C C 16 175.860 175.860 175.667 0.193 17919 19814 1 49 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.155 -0.335 17919 19815 1 49 . 1 1 16 16 GLU CB C 16 29.450 29.450 32.017 -2.567 17919 19816 1 49 . 1 1 16 16 GLU H H 16 8.140 8.140 8.510 -0.370 17919 19817 1 49 . 1 1 17 17 VAL N N 17 117.210 117.210 119.581 -2.371 17919 19818 1 49 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.496 0.218 17919 19819 1 49 . 1 1 17 17 VAL C C 17 174.160 174.160 174.306 -0.146 17919 19820 1 49 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.444 -1.014 17919 19821 1 49 . 1 1 17 17 VAL CB C 17 36.400 36.400 34.663 1.737 17919 19822 1 49 . 1 1 17 17 VAL H H 17 8.900 8.900 9.013 -0.113 17919 19823 1 49 . 1 1 18 18 GLU N N 18 118.990 118.990 118.475 0.515 17919 19824 1 49 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.877 0.202 17919 19825 1 49 . 1 1 18 18 GLU C C 18 176.160 176.160 174.810 1.350 17919 19826 1 49 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.708 0.012 17919 19827 1 49 . 1 1 18 18 GLU CB C 18 30.310 30.310 29.832 0.478 17919 19828 1 49 . 1 1 18 18 GLU H H 18 8.640 8.640 8.053 0.587 17919 19829 1 49 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.233 -0.092 17919 19830 1 49 . 1 1 19 19 PRO C C 19 175.310 175.310 176.681 -1.371 17919 19831 1 49 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.242 0.228 17919 19832 1 49 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.123 -0.173 17919 19833 1 49 . 1 1 20 20 SER N N 20 103.400 103.400 107.709 -4.309 17919 19834 1 49 . 1 1 20 20 SER HA H 20 4.370 4.370 4.472 -0.102 17919 19835 1 49 . 1 1 20 20 SER C C 20 174.660 174.660 173.622 1.038 17919 19836 1 49 . 1 1 20 20 SER CA C 20 57.400 57.400 57.018 0.382 17919 19837 1 49 . 1 1 20 20 SER CB C 20 63.370 63.370 63.051 0.319 17919 19838 1 49 . 1 1 20 20 SER H H 20 7.040 7.040 7.743 -0.703 17919 19839 1 49 . 1 1 21 21 ASP N N 21 123.480 123.480 125.272 -1.792 17919 19840 1 49 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.684 0.011 17919 19841 1 49 . 1 1 21 21 ASP C C 21 176.360 176.360 175.538 0.822 17919 19842 1 49 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.189 0.511 17919 19843 1 49 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.781 -0.981 17919 19844 1 49 . 1 1 21 21 ASP H H 21 8.030 8.030 7.855 0.175 17919 19845 1 49 . 1 1 22 22 THR N N 22 108.800 108.800 113.484 -4.684 17919 19846 1 49 . 1 1 22 22 THR HA H 22 4.920 4.920 4.532 0.388 17919 19847 1 49 . 1 1 22 22 THR C C 22 176.750 176.750 175.905 0.845 17919 19848 1 49 . 1 1 22 22 THR CA C 22 59.690 59.690 61.651 -1.962 17919 19849 1 49 . 1 1 22 22 THR CB C 22 71.200 71.200 69.902 1.298 17919 19850 1 49 . 1 1 22 22 THR H H 22 7.900 7.900 8.449 -0.549 17919 19851 1 49 . 1 1 23 23 ILE N N 23 121.190 121.190 124.585 -3.395 17919 19852 1 49 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.715 -0.058 17919 19853 1 49 . 1 1 23 23 ILE C C 23 179.040 179.040 177.448 1.592 17919 19854 1 49 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.737 -0.477 17919 19855 1 49 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.648 -2.298 17919 19856 1 49 . 1 1 23 23 ILE H H 23 8.560 8.560 8.486 0.074 17919 19857 1 49 . 1 1 24 24 GLU N N 24 120.830 120.830 120.570 0.260 17919 19858 1 49 . 1 1 24 24 GLU HA H 24 3.917 3.917 4.024 -0.107 17919 19859 1 49 . 1 1 24 24 GLU C C 24 178.640 178.640 178.961 -0.321 17919 19860 1 49 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.821 0.399 17919 19861 1 49 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.426 -1.146 17919 19862 1 49 . 1 1 24 24 GLU H H 24 9.760 9.760 8.756 1.004 17919 19863 1 49 . 1 1 25 25 ASN N N 25 120.570 120.570 117.966 2.604 17919 19864 1 49 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.533 -0.008 17919 19865 1 49 . 1 1 25 25 ASN C C 25 178.380 178.380 177.823 0.557 17919 19866 1 49 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.103 -0.043 17919 19867 1 49 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.662 -0.212 17919 19868 1 49 . 1 1 25 25 ASN H H 25 7.920 7.920 8.092 -0.172 17919 19869 1 49 . 1 1 26 26 VAL N N 26 121.710 121.710 121.693 0.017 17919 19870 1 49 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.741 -0.344 17919 19871 1 49 . 1 1 26 26 VAL C C 26 177.950 177.950 177.413 0.537 17919 19872 1 49 . 1 1 26 26 VAL CA C 26 67.660 67.660 64.904 2.756 17919 19873 1 49 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.935 -1.095 17919 19874 1 49 . 1 1 26 26 VAL H H 26 8.070 8.070 8.481 -0.411 17919 19875 1 49 . 1 1 27 27 LYS N N 27 118.860 118.860 120.313 -1.453 17919 19876 1 49 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.143 0.437 17919 19877 1 49 . 1 1 27 27 LYS C C 27 180.550 180.550 179.191 1.359 17919 19878 1 49 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.780 -0.530 17919 19879 1 49 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.336 1.394 17919 19880 1 49 . 1 1 27 27 LYS H H 27 8.560 8.560 8.260 0.300 17919 19881 1 49 . 1 1 28 28 ALA N N 28 123.440 123.440 120.380 3.060 17919 19882 1 49 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.078 0.082 17919 19883 1 49 . 1 1 28 28 ALA C C 28 180.300 180.300 178.967 1.333 17919 19884 1 49 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.645 0.725 17919 19885 1 49 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.387 -0.677 17919 19886 1 49 . 1 1 28 28 ALA H H 28 8.060 8.060 8.266 -0.206 17919 19887 1 49 . 1 1 29 29 LYS N N 29 119.940 119.940 119.481 0.459 17919 19888 1 49 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.101 0.106 17919 19889 1 49 . 1 1 29 29 LYS C C 29 180.320 180.320 179.017 1.303 17919 19890 1 49 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.109 0.541 17919 19891 1 49 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.357 0.933 17919 19892 1 49 . 1 1 29 29 LYS H H 29 7.850 7.850 7.504 0.346 17919 19893 1 49 . 1 1 30 30 ILE N N 30 121.080 121.080 120.348 0.732 17919 19894 1 49 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.645 -0.138 17919 19895 1 49 . 1 1 30 30 ILE C C 30 178.310 178.310 177.139 1.171 17919 19896 1 49 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.204 0.946 17919 19897 1 49 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.789 -0.989 17919 19898 1 49 . 1 1 30 30 ILE H H 30 8.280 8.280 8.006 0.274 17919 19899 1 49 . 1 1 31 31 GLN N N 31 123.490 123.490 120.749 2.741 17919 19900 1 49 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.944 -0.115 17919 19901 1 49 . 1 1 31 31 GLN C C 31 178.890 178.890 178.191 0.699 17919 19902 1 49 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.070 0.930 17919 19903 1 49 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.474 -0.754 17919 19904 1 49 . 1 1 31 31 GLN H H 31 8.580 8.580 7.760 0.820 17919 19905 1 49 . 1 1 32 32 ASP N N 32 119.360 119.360 118.786 0.574 17919 19906 1 49 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.396 -0.042 17919 19907 1 49 . 1 1 32 32 ASP C C 32 177.250 177.250 177.641 -0.391 17919 19908 1 49 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.882 0.308 17919 19909 1 49 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.847 -0.267 17919 19910 1 49 . 1 1 32 32 ASP H H 32 8.010 8.010 7.976 0.034 17919 19911 1 49 . 1 1 33 33 LYS N N 33 115.130 115.130 116.184 -1.054 17919 19912 1 49 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.416 -0.079 17919 19913 1 49 . 1 1 33 33 LYS C C 33 177.870 177.870 177.138 0.732 17919 19914 1 49 . 1 1 33 33 LYS CA C 33 58.050 58.050 56.741 1.309 17919 19915 1 49 . 1 1 33 33 LYS CB C 33 34.170 34.170 34.065 0.105 17919 19916 1 49 . 1 1 33 33 LYS H H 33 7.430 7.430 7.402 0.028 17919 19917 1 49 . 1 1 34 34 GLU N N 34 113.870 113.870 117.288 -3.418 17919 19918 1 49 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.438 0.187 17919 19919 1 49 . 1 1 34 34 GLU C C 34 177.840 177.840 177.213 0.627 17919 19920 1 49 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.489 -0.319 17919 19921 1 49 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.342 1.318 17919 19922 1 49 . 1 1 34 34 GLU H H 34 8.740 8.740 8.035 0.705 17919 19923 1 49 . 1 1 35 35 GLY N N 35 108.650 108.650 109.303 -0.653 17919 19924 1 49 . 1 1 35 35 GLY C C 35 173.960 173.960 174.848 -0.888 17919 19925 1 49 . 1 1 35 35 GLY CA C 35 46.080 46.080 46.172 -0.092 17919 19926 1 49 . 1 1 35 35 GLY H H 35 8.530 8.530 7.873 0.657 17919 19927 1 49 . 1 1 36 36 ILE N N 36 119.880 119.880 116.179 3.701 17919 19928 1 49 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.499 -0.054 17919 19929 1 49 . 1 1 36 36 ILE C C 36 173.590 173.590 173.407 0.183 17919 19930 1 49 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.968 -0.218 17919 19931 1 49 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.844 1.736 17919 19932 1 49 . 1 1 36 36 ILE H H 36 6.150 6.150 7.437 -1.287 17919 19933 1 49 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.780 -0.146 17919 19934 1 49 . 1 1 37 37 PRO C C 37 176.940 176.940 176.459 0.481 17919 19935 1 49 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.382 0.278 17919 19936 1 49 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.169 0.681 17919 19937 1 49 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.229 -0.112 17919 19938 1 49 . 1 1 38 38 PRO C C 38 178.320 178.320 177.190 1.130 17919 19939 1 49 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.478 0.782 17919 19940 1 49 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.778 1.112 17919 19941 1 49 . 1 1 39 39 ASP N N 39 113.380 113.380 116.906 -3.526 17919 19942 1 49 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.424 0.006 17919 19943 1 49 . 1 1 39 39 ASP C C 39 177.090 177.090 176.937 0.153 17919 19944 1 49 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.158 -0.518 17919 19945 1 49 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.758 -1.218 17919 19946 1 49 . 1 1 39 39 ASP H H 39 8.550 8.550 8.522 0.028 17919 19947 1 49 . 1 1 40 40 GLN N N 40 116.780 116.780 117.733 -0.953 17919 19948 1 49 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.287 0.177 17919 19949 1 49 . 1 1 40 40 GLN C C 40 175.380 175.380 176.176 -0.796 17919 19950 1 49 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.227 -0.587 17919 19951 1 49 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.643 0.497 17919 19952 1 49 . 1 1 40 40 GLN H H 40 7.820 7.820 7.631 0.189 17919 19953 1 49 . 1 1 41 41 GLN N N 41 117.720 117.720 119.079 -1.359 17919 19954 1 49 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.216 0.028 17919 19955 1 49 . 1 1 41 41 GLN C C 41 176.300 176.300 176.248 0.052 17919 19956 1 49 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.859 -0.389 17919 19957 1 49 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.164 2.486 17919 19958 1 49 . 1 1 41 41 GLN H H 41 7.480 7.480 7.433 0.047 17919 19959 1 49 . 1 1 42 42 ARG N N 42 122.680 122.680 125.793 -3.113 17919 19960 1 49 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.556 -0.056 17919 19961 1 49 . 1 1 42 42 ARG C C 42 174.050 174.050 174.723 -0.673 17919 19962 1 49 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.281 0.769 17919 19963 1 49 . 1 1 42 42 ARG CB C 42 31.750 31.750 30.528 1.222 17919 19964 1 49 . 1 1 42 42 ARG H H 42 8.530 8.530 8.248 0.282 17919 19965 1 49 . 1 1 43 43 LEU N N 43 124.040 124.040 125.451 -1.411 17919 19966 1 49 . 1 1 43 43 LEU C C 43 175.290 175.290 175.594 -0.304 17919 19967 1 49 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.239 -1.260 17919 19968 1 49 . 1 1 43 43 LEU CB C 43 45.790 45.790 41.578 4.212 17919 19969 1 49 . 1 1 43 43 LEU H H 43 8.820 8.820 8.316 0.504 17919 19970 1 49 . 1 1 44 44 ILE N N 44 121.920 121.920 121.047 0.873 17919 19971 1 49 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.977 0.015 17919 19972 1 49 . 1 1 44 44 ILE C C 44 176.060 176.060 173.976 2.084 17919 19973 1 49 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.105 -0.126 17919 19974 1 49 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.346 0.074 17919 19975 1 49 . 1 1 44 44 ILE H H 44 9.030 9.030 7.591 1.439 17919 19976 1 49 . 1 1 45 45 PHE N N 45 125.390 125.390 126.140 -0.750 17919 19977 1 49 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.009 0.036 17919 19978 1 49 . 1 1 45 45 PHE C C 45 174.470 174.470 174.385 0.085 17919 19979 1 49 . 1 1 45 45 PHE CA C 45 57.020 57.020 57.480 -0.460 17919 19980 1 49 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.001 0.759 17919 19981 1 49 . 1 1 45 45 PHE H H 45 8.830 8.830 8.150 0.680 17919 19982 1 49 . 1 1 46 46 ALA N N 46 132.200 132.200 128.529 3.671 17919 19983 1 49 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.587 0.103 17919 19984 1 49 . 1 1 46 46 ALA C C 46 177.290 177.290 177.855 -0.565 17919 19985 1 49 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.479 0.061 17919 19986 1 49 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.457 0.113 17919 19987 1 49 . 1 1 46 46 ALA H H 46 8.810 8.810 8.548 0.262 17919 19988 1 49 . 1 1 47 47 GLY N N 47 102.340 102.340 104.309 -1.969 17919 19989 1 49 . 1 1 47 47 GLY C C 47 173.810 173.810 174.229 -0.419 17919 19990 1 49 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.201 0.149 17919 19991 1 49 . 1 1 47 47 GLY H H 47 8.130 8.130 8.491 -0.361 17919 19992 1 49 . 1 1 48 48 LYS N N 48 121.570 121.570 120.894 0.676 17919 19993 1 49 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.520 0.102 17919 19994 1 49 . 1 1 48 48 LYS C C 48 174.700 174.700 175.775 -1.075 17919 19995 1 49 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.916 -0.366 17919 19996 1 49 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.146 0.384 17919 19997 1 49 . 1 1 48 48 LYS H H 48 7.980 7.980 7.763 0.217 17919 19998 1 49 . 1 1 49 49 GLN N N 49 122.410 122.410 124.795 -2.385 17919 19999 1 49 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.098 0.462 17919 20000 1 49 . 1 1 49 49 GLN C C 49 175.670 175.670 175.536 0.134 17919 20001 1 49 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.451 -0.711 17919 20002 1 49 . 1 1 49 49 GLN CB C 49 29.000 29.000 28.808 0.192 17919 20003 1 49 . 1 1 49 49 GLN H H 49 8.600 8.600 8.628 -0.028 17919 20004 1 49 . 1 1 50 50 LEU N N 50 125.520 125.520 125.133 0.387 17919 20005 1 49 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.269 -0.179 17919 20006 1 49 . 1 1 50 50 LEU C C 50 176.660 176.660 177.136 -0.476 17919 20007 1 49 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.010 0.230 17919 20008 1 49 . 1 1 50 50 LEU CB C 50 41.570 41.570 43.125 -1.555 17919 20009 1 49 . 1 1 50 50 LEU H H 50 8.530 8.530 7.993 0.537 17919 20010 1 49 . 1 1 51 51 GLU N N 51 122.940 122.940 120.335 2.605 17919 20011 1 49 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.536 -0.048 17919 20012 1 49 . 1 1 51 51 GLU C C 51 175.870 175.870 175.898 -0.028 17919 20013 1 49 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.126 0.834 17919 20014 1 49 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.782 -1.212 17919 20015 1 49 . 1 1 51 51 GLU H H 51 8.400 8.400 8.666 -0.266 17919 20016 1 49 . 1 1 52 52 ASP N N 52 120.030 120.030 126.591 -6.561 17919 20017 1 49 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.459 -0.100 17919 20018 1 49 . 1 1 52 52 ASP C C 52 177.330 177.330 177.765 -0.435 17919 20019 1 49 . 1 1 52 52 ASP CA C 52 56.960 56.960 58.141 -1.181 17919 20020 1 49 . 1 1 52 52 ASP CB C 52 40.850 40.850 41.056 -0.206 17919 20021 1 49 . 1 1 52 52 ASP H H 52 8.160 8.160 8.889 -0.729 17919 20022 1 49 . 1 1 53 53 GLY N N 53 106.660 106.660 104.918 1.742 17919 20023 1 49 . 1 1 53 53 GLY C C 53 174.870 174.870 174.463 0.407 17919 20024 1 49 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.618 0.552 17919 20025 1 49 . 1 1 53 53 GLY H H 53 9.390 9.390 8.173 1.217 17919 20026 1 49 . 1 1 54 54 ARG N N 54 119.050 119.050 121.504 -2.454 17919 20027 1 49 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.461 0.234 17919 20028 1 49 . 1 1 54 54 ARG C C 54 175.350 175.350 175.913 -0.563 17919 20029 1 49 . 1 1 54 54 ARG CA C 54 54.390 54.390 55.492 -1.102 17919 20030 1 49 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.252 0.398 17919 20031 1 49 . 1 1 54 54 ARG H H 54 7.460 7.460 7.740 -0.280 17919 20032 1 49 . 1 1 55 55 THR N N 55 108.400 108.400 113.973 -5.573 17919 20033 1 49 . 1 1 55 55 THR HA H 55 5.240 5.240 4.965 0.275 17919 20034 1 49 . 1 1 55 55 THR C C 55 176.560 176.560 175.445 1.115 17919 20035 1 49 . 1 1 55 55 THR CA C 55 59.690 59.690 60.308 -0.618 17919 20036 1 49 . 1 1 55 55 THR CB C 55 72.260 72.260 71.249 1.011 17919 20037 1 49 . 1 1 55 55 THR H H 55 8.730 8.730 8.318 0.412 17919 20038 1 49 . 1 1 56 56 LEU N N 56 117.920 117.920 119.865 -1.945 17919 20039 1 49 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.201 -0.141 17919 20040 1 49 . 1 1 56 56 LEU C C 56 180.810 180.810 179.098 1.712 17919 20041 1 49 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.135 0.575 17919 20042 1 49 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.940 -1.569 17919 20043 1 49 . 1 1 56 56 LEU H H 56 8.140 8.140 8.194 -0.054 17919 20044 1 49 . 1 1 57 57 SER N N 57 113.330 113.330 114.448 -1.118 17919 20045 1 49 . 1 1 57 57 SER HA H 57 4.370 4.370 4.146 0.224 17919 20046 1 49 . 1 1 57 57 SER C C 57 178.310 178.310 176.947 1.363 17919 20047 1 49 . 1 1 57 57 SER CA C 57 61.080 61.080 61.370 -0.290 17919 20048 1 49 . 1 1 57 57 SER CB C 57 62.530 62.530 62.056 0.474 17919 20049 1 49 . 1 1 57 57 SER H H 57 8.470 8.470 7.863 0.607 17919 20050 1 49 . 1 1 58 58 ASP N N 58 124.190 124.190 123.217 0.973 17919 20051 1 49 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.258 0.038 17919 20052 1 49 . 1 1 58 58 ASP C C 58 177.400 177.400 176.685 0.715 17919 20053 1 49 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.699 0.481 17919 20054 1 49 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.542 -0.443 17919 20055 1 49 . 1 1 58 58 ASP H H 58 7.930 7.930 7.791 0.139 17919 20056 1 49 . 1 1 59 59 TYR N N 59 115.510 115.510 114.689 0.821 17919 20057 1 49 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.698 -0.028 17919 20058 1 49 . 1 1 59 59 TYR C C 59 174.700 174.700 174.951 -0.251 17919 20059 1 49 . 1 1 59 59 TYR CA C 59 58.250 58.250 56.671 1.579 17919 20060 1 49 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.717 1.353 17919 20061 1 49 . 1 1 59 59 TYR H H 59 7.250 7.250 7.046 0.204 17919 20062 1 49 . 1 1 60 60 ASN N N 60 115.900 115.900 117.960 -2.060 17919 20063 1 49 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.402 -0.047 17919 20064 1 49 . 1 1 60 60 ASN C C 60 174.340 174.340 174.172 0.168 17919 20065 1 49 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.207 -0.087 17919 20066 1 49 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.274 0.136 17919 20067 1 49 . 1 1 60 60 ASN H H 60 8.150 8.150 7.701 0.449 17919 20068 1 49 . 1 1 61 61 ILE N N 61 118.600 118.600 120.278 -1.678 17919 20069 1 49 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.927 -0.534 17919 20070 1 49 . 1 1 61 61 ILE C C 61 174.610 174.610 174.279 0.331 17919 20071 1 49 . 1 1 61 61 ILE CA C 61 62.420 62.420 60.865 1.555 17919 20072 1 49 . 1 1 61 61 ILE CB C 61 36.740 36.740 36.697 0.043 17919 20073 1 49 . 1 1 61 61 ILE H H 61 7.250 7.250 7.961 -0.711 17919 20074 1 49 . 1 1 62 62 GLN N N 62 124.740 124.740 125.868 -1.128 17919 20075 1 49 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.659 -0.153 17919 20076 1 49 . 1 1 62 62 GLN C C 62 175.970 175.970 175.655 0.315 17919 20077 1 49 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.523 0.137 17919 20078 1 49 . 1 1 62 62 GLN CB C 62 31.650 31.650 30.362 1.288 17919 20079 1 49 . 1 1 62 62 GLN H H 62 7.610 7.610 7.915 -0.305 17919 20080 1 49 . 1 1 63 63 LYS N N 63 120.300 120.300 118.769 1.531 17919 20081 1 49 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.903 0.098 17919 20082 1 49 . 1 1 63 63 LYS C C 63 175.810 175.810 176.468 -0.658 17919 20083 1 49 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.300 -0.509 17919 20084 1 49 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.917 0.733 17919 20085 1 49 . 1 1 63 63 LYS H H 63 8.490 8.490 8.430 0.060 17919 20086 1 49 . 1 1 64 64 GLU N N 64 113.950 113.950 119.046 -5.096 17919 20087 1 49 . 1 1 64 64 GLU HA H 64 3.465 3.465 4.059 -0.594 17919 20088 1 49 . 1 1 64 64 GLU C C 64 175.250 175.250 175.787 -0.537 17919 20089 1 49 . 1 1 64 64 GLU CA C 64 57.890 57.890 58.178 -0.288 17919 20090 1 49 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.115 -2.215 17919 20091 1 49 . 1 1 64 64 GLU H H 64 9.280 9.280 8.689 0.591 17919 20092 1 49 . 1 1 65 65 SER N N 65 114.730 114.730 114.336 0.394 17919 20093 1 49 . 1 1 65 65 SER HA H 65 4.640 4.640 4.579 0.061 17919 20094 1 49 . 1 1 65 65 SER C C 65 172.160 172.160 174.480 -2.320 17919 20095 1 49 . 1 1 65 65 SER CA C 65 60.890 60.890 60.062 0.828 17919 20096 1 49 . 1 1 65 65 SER CB C 65 64.910 64.910 64.273 0.637 17919 20097 1 49 . 1 1 65 65 SER H H 65 7.670 7.670 7.624 0.046 17919 20098 1 49 . 1 1 66 66 THR N N 66 117.110 117.110 121.307 -4.197 17919 20099 1 49 . 1 1 66 66 THR HA H 66 5.270 5.270 4.987 0.283 17919 20100 1 49 . 1 1 66 66 THR C C 66 173.950 173.950 174.560 -0.610 17919 20101 1 49 . 1 1 66 66 THR CA C 66 62.340 62.340 62.919 -0.579 17919 20102 1 49 . 1 1 66 66 THR CB C 66 70.080 70.080 69.303 0.777 17919 20103 1 49 . 1 1 66 66 THR H H 66 8.730 8.730 8.609 0.121 17919 20104 1 49 . 1 1 67 67 LEU N N 67 127.110 127.110 127.605 -0.495 17919 20105 1 49 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.857 0.203 17919 20106 1 49 . 1 1 67 67 LEU C C 67 175.770 175.770 175.589 0.181 17919 20107 1 49 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.153 -0.253 17919 20108 1 49 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.559 0.700 17919 20109 1 49 . 1 1 67 67 LEU H H 67 9.410 9.410 8.961 0.449 17919 20110 1 49 . 1 1 68 68 HIS N N 68 118.380 118.380 119.760 -1.380 17919 20111 1 49 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.677 -0.437 17919 20112 1 49 . 1 1 68 68 HIS C C 68 173.150 173.150 173.968 -0.818 17919 20113 1 49 . 1 1 68 68 HIS CA C 68 55.000 55.000 53.530 1.470 17919 20114 1 49 . 1 1 68 68 HIS CB C 68 30.530 30.530 34.012 -3.482 17919 20115 1 49 . 1 1 68 68 HIS H H 68 9.230 9.230 8.809 0.421 17919 20116 1 49 . 1 1 69 69 LEU N N 69 124.460 124.460 119.592 4.868 17919 20117 1 49 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.400 0.790 17919 20118 1 49 . 1 1 69 69 LEU C C 69 175.270 175.270 173.878 1.392 17919 20119 1 49 . 1 1 69 69 LEU CA C 69 53.890 53.890 55.301 -1.411 17919 20120 1 49 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.899 -0.519 17919 20121 1 49 . 1 1 69 69 LEU H H 69 8.340 8.340 6.700 1.640 17919 20122 1 49 . 1 1 70 70 VAL N N 70 126.940 126.940 123.482 3.458 17919 20123 1 49 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.346 0.004 17919 20124 1 49 . 1 1 70 70 VAL C C 70 174.000 174.000 174.577 -0.577 17919 20125 1 49 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.449 0.351 17919 20126 1 49 . 1 1 70 70 VAL CB C 70 34.910 34.910 33.900 1.010 17919 20127 1 49 . 1 1 70 70 VAL H H 70 9.200 9.200 7.844 1.356 17919 20128 1 49 . 1 1 71 71 LEU N N 71 123.130 123.130 123.824 -0.694 17919 20129 1 49 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.721 0.339 17919 20130 1 49 . 1 1 71 71 LEU C C 71 177.830 177.830 176.787 1.043 17919 20131 1 49 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.487 0.453 17919 20132 1 49 . 1 1 71 71 LEU CB C 71 42.850 42.850 41.663 1.187 17919 20133 1 49 . 1 1 71 71 LEU H H 71 8.120 8.120 8.414 -0.294 17919 20134 1 49 . 1 1 72 72 ARG N N 72 123.490 123.490 126.963 -3.473 17919 20135 1 49 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.400 -0.099 17919 20136 1 49 . 1 1 72 72 ARG C C 72 175.350 175.350 174.695 0.655 17919 20137 1 49 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.385 -0.775 17919 20138 1 49 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.881 0.469 17919 20139 1 49 . 1 1 72 72 ARG H H 72 8.580 8.580 8.078 0.502 17919 20140 1 50 . 1 1 2 2 GLN N N 2 123.220 123.220 121.984 1.236 17919 20141 1 50 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.478 -0.229 17919 20142 1 50 . 1 1 2 2 GLN C C 2 175.920 175.920 175.755 0.165 17919 20143 1 50 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.924 0.156 17919 20144 1 50 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.061 0.699 17919 20145 1 50 . 1 1 2 2 GLN H H 2 8.900 8.900 8.435 0.465 17919 20146 1 50 . 1 1 3 3 ILE N N 3 115.340 115.340 117.340 -2.000 17919 20147 1 50 . 1 1 3 3 ILE HA H 3 4.213 4.213 3.991 0.222 17919 20148 1 50 . 1 1 3 3 ILE C C 3 172.450 172.450 173.103 -0.653 17919 20149 1 50 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.136 0.434 17919 20150 1 50 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.240 0.970 17919 20151 1 50 . 1 1 3 3 ILE H H 3 8.320 8.320 7.954 0.366 17919 20152 1 50 . 1 1 4 4 PHE N N 4 118.110 118.110 120.855 -2.745 17919 20153 1 50 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.491 0.139 17919 20154 1 50 . 1 1 4 4 PHE C C 4 175.320 175.320 175.619 -0.299 17919 20155 1 50 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.136 0.073 17919 20156 1 50 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.196 0.284 17919 20157 1 50 . 1 1 4 4 PHE H H 4 8.610 8.610 8.038 0.572 17919 20158 1 50 . 1 1 5 5 VAL N N 5 121.000 121.000 123.929 -2.929 17919 20159 1 50 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.791 -0.066 17919 20160 1 50 . 1 1 5 5 VAL C C 5 174.870 174.870 175.303 -0.433 17919 20161 1 50 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.605 -0.985 17919 20162 1 50 . 1 1 5 5 VAL CB C 5 34.230 34.230 32.678 1.552 17919 20163 1 50 . 1 1 5 5 VAL H H 5 9.300 9.300 9.150 0.150 17919 20164 1 50 . 1 1 6 6 LYS N N 6 127.520 127.520 129.929 -2.409 17919 20165 1 50 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.436 -0.069 17919 20166 1 50 . 1 1 6 6 LYS C C 6 177.140 177.140 176.581 0.559 17919 20167 1 50 . 1 1 6 6 LYS CA C 6 54.520 54.520 53.761 0.758 17919 20168 1 50 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.497 0.553 17919 20169 1 50 . 1 1 6 6 LYS H H 6 8.820 8.820 8.967 -0.147 17919 20170 1 50 . 1 1 7 7 THR N N 7 115.400 115.400 117.853 -2.453 17919 20171 1 50 . 1 1 7 7 THR HA H 7 4.970 4.970 4.686 0.284 17919 20172 1 50 . 1 1 7 7 THR C C 7 176.910 176.910 176.902 0.008 17919 20173 1 50 . 1 1 7 7 THR CA C 7 60.470 60.470 61.068 -0.598 17919 20174 1 50 . 1 1 7 7 THR CB C 7 70.630 70.630 70.398 0.232 17919 20175 1 50 . 1 1 7 7 THR H H 7 8.730 8.730 8.506 0.224 17919 20176 1 50 . 1 1 8 8 LEU N N 8 121.330 121.330 120.641 0.689 17919 20177 1 50 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.531 -0.221 17919 20178 1 50 . 1 1 8 8 LEU C C 8 178.800 178.800 177.498 1.302 17919 20179 1 50 . 1 1 8 8 LEU CA C 8 57.580 57.580 58.070 -0.490 17919 20180 1 50 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.351 0.619 17919 20181 1 50 . 1 1 8 8 LEU H H 8 9.100 9.100 8.691 0.409 17919 20182 1 50 . 1 1 9 9 THR N N 9 105.590 105.590 108.972 -3.382 17919 20183 1 50 . 1 1 9 9 THR HA H 9 4.428 4.428 4.366 0.062 17919 20184 1 50 . 1 1 9 9 THR C C 9 175.520 175.520 175.541 -0.021 17919 20185 1 50 . 1 1 9 9 THR CA C 9 61.400 61.400 61.979 -0.579 17919 20186 1 50 . 1 1 9 9 THR CB C 9 69.140 69.140 69.344 -0.203 17919 20187 1 50 . 1 1 9 9 THR H H 9 7.630 7.630 7.698 -0.068 17919 20188 1 50 . 1 1 10 10 GLY N N 10 108.890 108.890 111.298 -2.408 17919 20189 1 50 . 1 1 10 10 GLY C C 10 174.070 174.070 173.280 0.790 17919 20190 1 50 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.733 0.727 17919 20191 1 50 . 1 1 10 10 GLY H H 10 7.810 7.810 7.982 -0.172 17919 20192 1 50 . 1 1 11 11 LYS N N 11 121.600 121.600 122.153 -0.553 17919 20193 1 50 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.315 0.046 17919 20194 1 50 . 1 1 11 11 LYS C C 11 175.940 175.940 175.671 0.269 17919 20195 1 50 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.593 -0.313 17919 20196 1 50 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.543 -0.343 17919 20197 1 50 . 1 1 11 11 LYS H H 11 7.280 7.280 8.102 -0.822 17919 20198 1 50 . 1 1 12 12 THR N N 12 120.440 120.440 120.869 -0.429 17919 20199 1 50 . 1 1 12 12 THR HA H 12 5.046 5.046 4.382 0.664 17919 20200 1 50 . 1 1 12 12 THR C C 12 174.320 174.320 174.272 0.048 17919 20201 1 50 . 1 1 12 12 THR CA C 12 62.390 62.390 62.453 -0.063 17919 20202 1 50 . 1 1 12 12 THR CB C 12 69.910 69.910 69.356 0.554 17919 20203 1 50 . 1 1 12 12 THR H H 12 8.650 8.650 8.323 0.327 17919 20204 1 50 . 1 1 13 13 ILE N N 13 127.110 127.110 127.872 -0.762 17919 20205 1 50 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.541 0.003 17919 20206 1 50 . 1 1 13 13 ILE C C 13 175.220 175.220 174.806 0.414 17919 20207 1 50 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.363 -0.383 17919 20208 1 50 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.203 -0.252 17919 20209 1 50 . 1 1 13 13 ILE H H 13 9.450 9.450 8.685 0.765 17919 20210 1 50 . 1 1 14 14 THR N N 14 121.520 121.520 122.825 -1.305 17919 20211 1 50 . 1 1 14 14 THR HA H 14 4.964 4.964 4.881 0.083 17919 20212 1 50 . 1 1 14 14 THR C C 14 173.790 173.790 173.856 -0.066 17919 20213 1 50 . 1 1 14 14 THR CA C 14 61.940 61.940 62.875 -0.935 17919 20214 1 50 . 1 1 14 14 THR CB C 14 69.650 69.650 70.094 -0.444 17919 20215 1 50 . 1 1 14 14 THR H H 14 8.710 8.710 8.479 0.231 17919 20216 1 50 . 1 1 15 15 LEU N N 15 124.800 124.800 125.896 -1.096 17919 20217 1 50 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.717 0.063 17919 20218 1 50 . 1 1 15 15 LEU C C 15 174.670 174.670 175.265 -0.595 17919 20219 1 50 . 1 1 15 15 LEU CA C 15 52.830 52.830 54.013 -1.183 17919 20220 1 50 . 1 1 15 15 LEU CB C 15 47.070 47.070 46.157 0.913 17919 20221 1 50 . 1 1 15 15 LEU H H 15 8.710 8.710 8.635 0.075 17919 20222 1 50 . 1 1 16 16 GLU N N 16 122.160 122.160 123.821 -1.661 17919 20223 1 50 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.858 0.059 17919 20224 1 50 . 1 1 16 16 GLU C C 16 175.860 175.860 175.956 -0.096 17919 20225 1 50 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.489 -0.669 17919 20226 1 50 . 1 1 16 16 GLU CB C 16 29.450 29.450 29.805 -0.355 17919 20227 1 50 . 1 1 16 16 GLU H H 16 8.140 8.140 8.749 -0.609 17919 20228 1 50 . 1 1 17 17 VAL N N 17 117.210 117.210 120.506 -3.296 17919 20229 1 50 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.912 -0.198 17919 20230 1 50 . 1 1 17 17 VAL C C 17 174.160 174.160 174.752 -0.592 17919 20231 1 50 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.189 -0.759 17919 20232 1 50 . 1 1 17 17 VAL CB C 17 36.400 36.400 36.107 0.293 17919 20233 1 50 . 1 1 17 17 VAL H H 17 8.900 8.900 8.864 0.036 17919 20234 1 50 . 1 1 18 18 GLU N N 18 118.990 118.990 121.513 -2.523 17919 20235 1 50 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.832 0.247 17919 20236 1 50 . 1 1 18 18 GLU C C 18 176.160 176.160 174.713 1.447 17919 20237 1 50 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.816 -0.096 17919 20238 1 50 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.709 -0.399 17919 20239 1 50 . 1 1 18 18 GLU H H 18 8.640 8.640 8.233 0.407 17919 20240 1 50 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.240 -0.099 17919 20241 1 50 . 1 1 19 19 PRO C C 19 175.310 175.310 177.762 -2.452 17919 20242 1 50 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.485 -0.015 17919 20243 1 50 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.036 -0.086 17919 20244 1 50 . 1 1 20 20 SER N N 20 103.400 103.400 110.154 -6.754 17919 20245 1 50 . 1 1 20 20 SER HA H 20 4.370 4.370 4.353 0.017 17919 20246 1 50 . 1 1 20 20 SER C C 20 174.660 174.660 174.382 0.278 17919 20247 1 50 . 1 1 20 20 SER CA C 20 57.400 57.400 59.316 -1.916 17919 20248 1 50 . 1 1 20 20 SER CB C 20 63.370 63.370 63.073 0.297 17919 20249 1 50 . 1 1 20 20 SER H H 20 7.040 7.040 7.936 -0.896 17919 20250 1 50 . 1 1 21 21 ASP N N 21 123.480 123.480 122.404 1.076 17919 20251 1 50 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.634 0.061 17919 20252 1 50 . 1 1 21 21 ASP C C 21 176.360 176.360 175.584 0.776 17919 20253 1 50 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.523 0.177 17919 20254 1 50 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.419 -0.619 17919 20255 1 50 . 1 1 21 21 ASP H H 21 8.030 8.030 8.137 -0.107 17919 20256 1 50 . 1 1 22 22 THR N N 22 108.800 108.800 110.364 -1.564 17919 20257 1 50 . 1 1 22 22 THR HA H 22 4.920 4.920 4.807 0.113 17919 20258 1 50 . 1 1 22 22 THR C C 22 176.750 176.750 175.964 0.786 17919 20259 1 50 . 1 1 22 22 THR CA C 22 59.690 59.690 61.118 -1.428 17919 20260 1 50 . 1 1 22 22 THR CB C 22 71.200 71.200 70.538 0.662 17919 20261 1 50 . 1 1 22 22 THR H H 22 7.900 7.900 8.275 -0.375 17919 20262 1 50 . 1 1 23 23 ILE N N 23 121.190 121.190 123.043 -1.853 17919 20263 1 50 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.781 -0.124 17919 20264 1 50 . 1 1 23 23 ILE C C 23 179.040 179.040 177.728 1.312 17919 20265 1 50 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.541 -1.281 17919 20266 1 50 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.793 -2.443 17919 20267 1 50 . 1 1 23 23 ILE H H 23 8.560 8.560 9.081 -0.521 17919 20268 1 50 . 1 1 24 24 GLU N N 24 120.830 120.830 120.790 0.040 17919 20269 1 50 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.869 0.048 17919 20270 1 50 . 1 1 24 24 GLU C C 24 178.640 178.640 178.955 -0.315 17919 20271 1 50 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.045 0.175 17919 20272 1 50 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.273 -0.992 17919 20273 1 50 . 1 1 24 24 GLU H H 24 9.760 9.760 8.339 1.421 17919 20274 1 50 . 1 1 25 25 ASN N N 25 120.570 120.570 117.303 3.267 17919 20275 1 50 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.577 -0.052 17919 20276 1 50 . 1 1 25 25 ASN C C 25 178.380 178.380 177.789 0.591 17919 20277 1 50 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.165 -0.105 17919 20278 1 50 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.460 -0.010 17919 20279 1 50 . 1 1 25 25 ASN H H 25 7.920 7.920 8.290 -0.370 17919 20280 1 50 . 1 1 26 26 VAL N N 26 121.710 121.710 120.562 1.148 17919 20281 1 50 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.874 -0.477 17919 20282 1 50 . 1 1 26 26 VAL C C 26 177.950 177.950 177.576 0.374 17919 20283 1 50 . 1 1 26 26 VAL CA C 26 67.660 67.660 65.169 2.491 17919 20284 1 50 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.393 -0.553 17919 20285 1 50 . 1 1 26 26 VAL H H 26 8.070 8.070 8.158 -0.088 17919 20286 1 50 . 1 1 27 27 LYS N N 27 118.860 118.860 121.134 -2.274 17919 20287 1 50 . 1 1 27 27 LYS HA H 27 4.580 4.580 3.983 0.597 17919 20288 1 50 . 1 1 27 27 LYS C C 27 180.550 180.550 178.978 1.572 17919 20289 1 50 . 1 1 27 27 LYS CA C 27 59.250 59.250 60.120 -0.870 17919 20290 1 50 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.183 1.547 17919 20291 1 50 . 1 1 27 27 LYS H H 27 8.560 8.560 8.605 -0.045 17919 20292 1 50 . 1 1 28 28 ALA N N 28 123.440 123.440 122.269 1.171 17919 20293 1 50 . 1 1 28 28 ALA HA H 28 4.160 4.160 3.959 0.201 17919 20294 1 50 . 1 1 28 28 ALA C C 28 180.300 180.300 179.159 1.141 17919 20295 1 50 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.356 0.014 17919 20296 1 50 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.326 -0.616 17919 20297 1 50 . 1 1 28 28 ALA H H 28 8.060 8.060 8.498 -0.438 17919 20298 1 50 . 1 1 29 29 LYS N N 29 119.940 119.940 118.816 1.124 17919 20299 1 50 . 1 1 29 29 LYS HA H 29 4.207 4.207 3.961 0.246 17919 20300 1 50 . 1 1 29 29 LYS C C 29 180.320 180.320 179.474 0.846 17919 20301 1 50 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.452 0.198 17919 20302 1 50 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.246 1.044 17919 20303 1 50 . 1 1 29 29 LYS H H 29 7.850 7.850 7.533 0.317 17919 20304 1 50 . 1 1 30 30 ILE N N 30 121.080 121.080 120.124 0.956 17919 20305 1 50 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.560 -0.053 17919 20306 1 50 . 1 1 30 30 ILE C C 30 178.310 178.310 177.312 0.998 17919 20307 1 50 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.255 0.895 17919 20308 1 50 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.483 -0.683 17919 20309 1 50 . 1 1 30 30 ILE H H 30 8.280 8.280 8.008 0.272 17919 20310 1 50 . 1 1 31 31 GLN N N 31 123.490 123.490 119.607 3.883 17919 20311 1 50 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.847 -0.018 17919 20312 1 50 . 1 1 31 31 GLN C C 31 178.890 178.890 178.480 0.410 17919 20313 1 50 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.441 0.559 17919 20314 1 50 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.422 -0.702 17919 20315 1 50 . 1 1 31 31 GLN H H 31 8.580 8.580 8.145 0.435 17919 20316 1 50 . 1 1 32 32 ASP N N 32 119.360 119.360 119.593 -0.233 17919 20317 1 50 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.357 -0.003 17919 20318 1 50 . 1 1 32 32 ASP C C 32 177.250 177.250 177.814 -0.564 17919 20319 1 50 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.865 0.325 17919 20320 1 50 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.742 -0.162 17919 20321 1 50 . 1 1 32 32 ASP H H 32 8.010 8.010 8.223 -0.213 17919 20322 1 50 . 1 1 33 33 LYS N N 33 115.130 115.130 116.832 -1.702 17919 20323 1 50 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.345 -0.008 17919 20324 1 50 . 1 1 33 33 LYS C C 33 177.870 177.870 178.172 -0.302 17919 20325 1 50 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.910 0.140 17919 20326 1 50 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.876 0.294 17919 20327 1 50 . 1 1 33 33 LYS H H 33 7.430 7.430 7.553 -0.123 17919 20328 1 50 . 1 1 34 34 GLU N N 34 113.870 113.870 115.256 -1.386 17919 20329 1 50 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.428 0.197 17919 20330 1 50 . 1 1 34 34 GLU C C 34 177.840 177.840 177.417 0.423 17919 20331 1 50 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.026 -0.857 17919 20332 1 50 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.475 1.185 17919 20333 1 50 . 1 1 34 34 GLU H H 34 8.740 8.740 8.323 0.417 17919 20334 1 50 . 1 1 35 35 GLY N N 35 108.650 108.650 109.564 -0.914 17919 20335 1 50 . 1 1 35 35 GLY C C 35 173.960 173.960 174.188 -0.228 17919 20336 1 50 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.795 0.285 17919 20337 1 50 . 1 1 35 35 GLY H H 35 8.530 8.530 8.206 0.324 17919 20338 1 50 . 1 1 36 36 ILE N N 36 119.880 119.880 120.783 -0.903 17919 20339 1 50 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.301 0.144 17919 20340 1 50 . 1 1 36 36 ILE C C 36 173.590 173.590 174.358 -0.768 17919 20341 1 50 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.658 0.091 17919 20342 1 50 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.029 2.551 17919 20343 1 50 . 1 1 36 36 ILE H H 36 6.150 6.150 7.600 -1.450 17919 20344 1 50 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.949 -0.315 17919 20345 1 50 . 1 1 37 37 PRO C C 37 176.940 176.940 176.247 0.693 17919 20346 1 50 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.050 0.610 17919 20347 1 50 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.349 0.502 17919 20348 1 50 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.202 -0.085 17919 20349 1 50 . 1 1 38 38 PRO C C 38 178.320 178.320 178.329 -0.009 17919 20350 1 50 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.896 0.364 17919 20351 1 50 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.955 0.935 17919 20352 1 50 . 1 1 39 39 ASP N N 39 113.380 113.380 115.525 -2.145 17919 20353 1 50 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.348 0.082 17919 20354 1 50 . 1 1 39 39 ASP C C 39 177.090 177.090 177.487 -0.397 17919 20355 1 50 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.808 -1.168 17919 20356 1 50 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.353 -0.813 17919 20357 1 50 . 1 1 39 39 ASP H H 39 8.550 8.550 8.749 -0.199 17919 20358 1 50 . 1 1 40 40 GLN N N 40 116.780 116.780 116.108 0.672 17919 20359 1 50 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.368 0.096 17919 20360 1 50 . 1 1 40 40 GLN C C 40 175.380 175.380 175.095 0.285 17919 20361 1 50 . 1 1 40 40 GLN CA C 40 55.640 55.640 54.761 0.879 17919 20362 1 50 . 1 1 40 40 GLN CB C 40 30.140 30.140 27.800 2.340 17919 20363 1 50 . 1 1 40 40 GLN H H 40 7.820 7.820 7.920 -0.100 17919 20364 1 50 . 1 1 41 41 GLN N N 41 117.720 117.720 118.648 -0.928 17919 20365 1 50 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.676 -0.432 17919 20366 1 50 . 1 1 41 41 GLN C C 41 176.300 176.300 174.413 1.887 17919 20367 1 50 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.028 1.442 17919 20368 1 50 . 1 1 41 41 GLN CB C 41 31.650 31.650 31.968 -0.319 17919 20369 1 50 . 1 1 41 41 GLN H H 41 7.480 7.480 7.461 0.019 17919 20370 1 50 . 1 1 42 42 ARG N N 42 122.680 122.680 123.671 -0.991 17919 20371 1 50 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.655 -0.155 17919 20372 1 50 . 1 1 42 42 ARG C C 42 174.050 174.050 174.360 -0.310 17919 20373 1 50 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.831 0.219 17919 20374 1 50 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.538 -0.788 17919 20375 1 50 . 1 1 42 42 ARG H H 42 8.530 8.530 8.366 0.164 17919 20376 1 50 . 1 1 43 43 LEU N N 43 124.040 124.040 125.870 -1.830 17919 20377 1 50 . 1 1 43 43 LEU C C 43 175.290 175.290 175.601 -0.311 17919 20378 1 50 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.737 -0.757 17919 20379 1 50 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.623 1.167 17919 20380 1 50 . 1 1 43 43 LEU H H 43 8.820 8.820 8.761 0.059 17919 20381 1 50 . 1 1 44 44 ILE N N 44 121.920 121.920 122.128 -0.208 17919 20382 1 50 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.786 0.206 17919 20383 1 50 . 1 1 44 44 ILE C C 44 176.060 176.060 173.940 2.120 17919 20384 1 50 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.843 -1.863 17919 20385 1 50 . 1 1 44 44 ILE CB C 44 41.420 41.420 42.294 -0.874 17919 20386 1 50 . 1 1 44 44 ILE H H 44 9.030 9.030 9.053 -0.023 17919 20387 1 50 . 1 1 45 45 PHE N N 45 125.390 125.390 126.837 -1.447 17919 20388 1 50 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.009 0.036 17919 20389 1 50 . 1 1 45 45 PHE C C 45 174.470 174.470 174.321 0.149 17919 20390 1 50 . 1 1 45 45 PHE CA C 45 57.020 57.020 57.346 -0.326 17919 20391 1 50 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.782 0.978 17919 20392 1 50 . 1 1 45 45 PHE H H 45 8.830 8.830 8.984 -0.154 17919 20393 1 50 . 1 1 46 46 ALA N N 46 132.200 132.200 129.629 2.571 17919 20394 1 50 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.642 0.048 17919 20395 1 50 . 1 1 46 46 ALA C C 46 177.290 177.290 177.843 -0.553 17919 20396 1 50 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.213 0.327 17919 20397 1 50 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.490 0.080 17919 20398 1 50 . 1 1 46 46 ALA H H 46 8.810 8.810 8.506 0.304 17919 20399 1 50 . 1 1 47 47 GLY N N 47 102.340 102.340 105.323 -2.983 17919 20400 1 50 . 1 1 47 47 GLY C C 47 173.810 173.810 173.747 0.063 17919 20401 1 50 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.965 0.385 17919 20402 1 50 . 1 1 47 47 GLY H H 47 8.130 8.130 8.604 -0.474 17919 20403 1 50 . 1 1 48 48 LYS N N 48 121.570 121.570 119.513 2.057 17919 20404 1 50 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.606 0.016 17919 20405 1 50 . 1 1 48 48 LYS C C 48 174.700 174.700 175.481 -0.781 17919 20406 1 50 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.694 -0.144 17919 20407 1 50 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.554 -0.024 17919 20408 1 50 . 1 1 48 48 LYS H H 48 7.980 7.980 7.409 0.571 17919 20409 1 50 . 1 1 49 49 GLN N N 49 122.410 122.410 125.341 -2.931 17919 20410 1 50 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.378 0.182 17919 20411 1 50 . 1 1 49 49 GLN C C 49 175.670 175.670 175.495 0.175 17919 20412 1 50 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.574 -0.834 17919 20413 1 50 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.399 -0.399 17919 20414 1 50 . 1 1 49 49 GLN H H 49 8.600 8.600 8.553 0.047 17919 20415 1 50 . 1 1 50 50 LEU N N 50 125.520 125.520 124.826 0.694 17919 20416 1 50 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.243 -0.153 17919 20417 1 50 . 1 1 50 50 LEU C C 50 176.660 176.660 175.836 0.824 17919 20418 1 50 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.214 1.026 17919 20419 1 50 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.974 -1.403 17919 20420 1 50 . 1 1 50 50 LEU H H 50 8.530 8.530 8.467 0.063 17919 20421 1 50 . 1 1 51 51 GLU N N 51 122.940 122.940 121.209 1.731 17919 20422 1 50 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.521 -0.033 17919 20423 1 50 . 1 1 51 51 GLU C C 51 175.870 175.870 176.336 -0.466 17919 20424 1 50 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.075 0.885 17919 20425 1 50 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.995 -0.425 17919 20426 1 50 . 1 1 51 51 GLU H H 51 8.400 8.400 8.305 0.095 17919 20427 1 50 . 1 1 52 52 ASP N N 52 120.030 120.030 126.497 -6.467 17919 20428 1 50 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.535 -0.176 17919 20429 1 50 . 1 1 52 52 ASP C C 52 177.330 177.330 177.451 -0.121 17919 20430 1 50 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.212 -0.252 17919 20431 1 50 . 1 1 52 52 ASP CB C 52 40.850 40.850 41.249 -0.399 17919 20432 1 50 . 1 1 52 52 ASP H H 52 8.160 8.160 8.928 -0.768 17919 20433 1 50 . 1 1 53 53 GLY N N 53 106.660 106.660 106.223 0.437 17919 20434 1 50 . 1 1 53 53 GLY C C 53 174.870 174.870 174.236 0.634 17919 20435 1 50 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.751 0.419 17919 20436 1 50 . 1 1 53 53 GLY H H 53 9.390 9.390 8.393 0.997 17919 20437 1 50 . 1 1 54 54 ARG N N 54 119.050 119.050 120.740 -1.690 17919 20438 1 50 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.669 0.026 17919 20439 1 50 . 1 1 54 54 ARG C C 54 175.350 175.350 174.903 0.447 17919 20440 1 50 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.490 -0.100 17919 20441 1 50 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.869 -0.219 17919 20442 1 50 . 1 1 54 54 ARG H H 54 7.460 7.460 7.842 -0.382 17919 20443 1 50 . 1 1 55 55 THR N N 55 108.400 108.400 111.448 -3.048 17919 20444 1 50 . 1 1 55 55 THR HA H 55 5.240 5.240 5.121 0.119 17919 20445 1 50 . 1 1 55 55 THR C C 55 176.560 176.560 175.976 0.584 17919 20446 1 50 . 1 1 55 55 THR CA C 55 59.690 59.690 60.150 -0.460 17919 20447 1 50 . 1 1 55 55 THR CB C 55 72.260 72.260 71.918 0.342 17919 20448 1 50 . 1 1 55 55 THR H H 55 8.730 8.730 8.955 -0.225 17919 20449 1 50 . 1 1 56 56 LEU N N 56 117.920 117.920 122.831 -4.911 17919 20450 1 50 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.044 0.016 17919 20451 1 50 . 1 1 56 56 LEU C C 56 180.810 180.810 178.787 2.023 17919 20452 1 50 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.204 0.506 17919 20453 1 50 . 1 1 56 56 LEU CB C 56 40.370 40.370 40.692 -0.322 17919 20454 1 50 . 1 1 56 56 LEU H H 56 8.140 8.140 8.558 -0.418 17919 20455 1 50 . 1 1 57 57 SER N N 57 113.330 113.330 114.519 -1.189 17919 20456 1 50 . 1 1 57 57 SER HA H 57 4.370 4.370 4.127 0.243 17919 20457 1 50 . 1 1 57 57 SER C C 57 178.310 178.310 177.058 1.252 17919 20458 1 50 . 1 1 57 57 SER CA C 57 61.080 61.080 61.799 -0.719 17919 20459 1 50 . 1 1 57 57 SER CB C 57 62.530 62.530 62.572 -0.042 17919 20460 1 50 . 1 1 57 57 SER H H 57 8.470 8.470 7.947 0.523 17919 20461 1 50 . 1 1 58 58 ASP N N 58 124.190 124.190 122.851 1.339 17919 20462 1 50 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.177 0.119 17919 20463 1 50 . 1 1 58 58 ASP C C 58 177.400 177.400 177.990 -0.590 17919 20464 1 50 . 1 1 58 58 ASP CA C 58 57.180 57.180 57.322 -0.142 17919 20465 1 50 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.149 -0.049 17919 20466 1 50 . 1 1 58 58 ASP H H 58 7.930 7.930 7.729 0.201 17919 20467 1 50 . 1 1 59 59 TYR N N 59 115.510 115.510 114.835 0.675 17919 20468 1 50 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.635 0.035 17919 20469 1 50 . 1 1 59 59 TYR C C 59 174.700 174.700 175.327 -0.627 17919 20470 1 50 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.072 1.179 17919 20471 1 50 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.334 1.736 17919 20472 1 50 . 1 1 59 59 TYR H H 59 7.250 7.250 7.124 0.126 17919 20473 1 50 . 1 1 60 60 ASN N N 60 115.900 115.900 117.272 -1.372 17919 20474 1 50 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.333 0.022 17919 20475 1 50 . 1 1 60 60 ASN C C 60 174.340 174.340 174.486 -0.146 17919 20476 1 50 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.107 0.013 17919 20477 1 50 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.691 -0.281 17919 20478 1 50 . 1 1 60 60 ASN H H 60 8.150 8.150 7.741 0.409 17919 20479 1 50 . 1 1 61 61 ILE N N 61 118.600 118.600 120.602 -2.002 17919 20480 1 50 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.807 -0.414 17919 20481 1 50 . 1 1 61 61 ILE C C 61 174.610 174.610 175.108 -0.498 17919 20482 1 50 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.650 -0.230 17919 20483 1 50 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.304 -0.564 17919 20484 1 50 . 1 1 61 61 ILE H H 61 7.250 7.250 8.527 -1.277 17919 20485 1 50 . 1 1 62 62 GLN N N 62 124.740 124.740 125.992 -1.252 17919 20486 1 50 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.672 -0.166 17919 20487 1 50 . 1 1 62 62 GLN C C 62 175.970 175.970 175.745 0.225 17919 20488 1 50 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.663 -0.003 17919 20489 1 50 . 1 1 62 62 GLN CB C 62 31.650 31.650 32.466 -0.816 17919 20490 1 50 . 1 1 62 62 GLN H H 62 7.610 7.610 7.784 -0.174 17919 20491 1 50 . 1 1 63 63 LYS N N 63 120.300 120.300 120.431 -0.131 17919 20492 1 50 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.937 0.064 17919 20493 1 50 . 1 1 63 63 LYS C C 63 175.810 175.810 177.003 -1.193 17919 20494 1 50 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.806 -0.016 17919 20495 1 50 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.069 0.581 17919 20496 1 50 . 1 1 63 63 LYS H H 63 8.490 8.490 8.701 -0.211 17919 20497 1 50 . 1 1 64 64 GLU N N 64 113.950 113.950 118.017 -4.067 17919 20498 1 50 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.412 0.053 17919 20499 1 50 . 1 1 64 64 GLU C C 64 175.250 175.250 175.770 -0.520 17919 20500 1 50 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.747 0.143 17919 20501 1 50 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.352 -2.452 17919 20502 1 50 . 1 1 64 64 GLU H H 64 9.280 9.280 8.559 0.721 17919 20503 1 50 . 1 1 65 65 SER N N 65 114.730 114.730 116.709 -1.979 17919 20504 1 50 . 1 1 65 65 SER HA H 65 4.640 4.640 4.198 0.442 17919 20505 1 50 . 1 1 65 65 SER C C 65 172.160 172.160 173.713 -1.553 17919 20506 1 50 . 1 1 65 65 SER CA C 65 60.890 60.890 59.984 0.906 17919 20507 1 50 . 1 1 65 65 SER CB C 65 64.910 64.910 63.098 1.812 17919 20508 1 50 . 1 1 65 65 SER H H 65 7.670 7.670 7.399 0.271 17919 20509 1 50 . 1 1 66 66 THR N N 66 117.110 117.110 121.522 -4.412 17919 20510 1 50 . 1 1 66 66 THR HA H 66 5.270 5.270 4.655 0.615 17919 20511 1 50 . 1 1 66 66 THR C C 66 173.950 173.950 174.487 -0.537 17919 20512 1 50 . 1 1 66 66 THR CA C 66 62.340 62.340 63.136 -0.796 17919 20513 1 50 . 1 1 66 66 THR CB C 66 70.080 70.080 69.796 0.284 17919 20514 1 50 . 1 1 66 66 THR H H 66 8.730 8.730 8.233 0.497 17919 20515 1 50 . 1 1 67 67 LEU N N 67 127.110 127.110 129.284 -2.174 17919 20516 1 50 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.652 0.408 17919 20517 1 50 . 1 1 67 67 LEU C C 67 175.770 175.770 175.275 0.495 17919 20518 1 50 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.120 -0.220 17919 20519 1 50 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.689 -0.429 17919 20520 1 50 . 1 1 67 67 LEU H H 67 9.410 9.410 8.697 0.713 17919 20521 1 50 . 1 1 68 68 HIS N N 68 118.380 118.380 123.056 -4.676 17919 20522 1 50 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.453 -0.213 17919 20523 1 50 . 1 1 68 68 HIS C C 68 173.150 173.150 173.562 -0.412 17919 20524 1 50 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.232 0.768 17919 20525 1 50 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.300 -1.770 17919 20526 1 50 . 1 1 68 68 HIS H H 68 9.230 9.230 9.266 -0.036 17919 20527 1 50 . 1 1 69 69 LEU N N 69 124.460 124.460 128.294 -3.834 17919 20528 1 50 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.223 -0.033 17919 20529 1 50 . 1 1 69 69 LEU C C 69 175.270 175.270 173.994 1.276 17919 20530 1 50 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.094 0.796 17919 20531 1 50 . 1 1 69 69 LEU CB C 69 44.380 44.380 45.592 -1.212 17919 20532 1 50 . 1 1 69 69 LEU H H 69 8.340 8.340 7.972 0.368 17919 20533 1 50 . 1 1 70 70 VAL N N 70 126.940 126.940 125.889 1.051 17919 20534 1 50 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.336 0.014 17919 20535 1 50 . 1 1 70 70 VAL C C 70 174.000 174.000 174.548 -0.548 17919 20536 1 50 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.497 0.303 17919 20537 1 50 . 1 1 70 70 VAL CB C 70 34.910 34.910 34.450 0.460 17919 20538 1 50 . 1 1 70 70 VAL H H 70 9.200 9.200 8.785 0.415 17919 20539 1 50 . 1 1 71 71 LEU N N 71 123.130 123.130 125.050 -1.920 17919 20540 1 50 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.856 0.204 17919 20541 1 50 . 1 1 71 71 LEU C C 71 177.830 177.830 177.373 0.457 17919 20542 1 50 . 1 1 71 71 LEU CA C 71 53.940 53.940 54.242 -0.302 17919 20543 1 50 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.611 0.239 17919 20544 1 50 . 1 1 71 71 LEU H H 71 8.120 8.120 8.597 -0.477 17919 20545 1 50 . 1 1 72 72 ARG N N 72 123.490 123.490 122.443 1.047 17919 20546 1 50 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.776 -0.475 17919 20547 1 50 . 1 1 72 72 ARG C C 72 175.350 175.350 174.803 0.547 17919 20548 1 50 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.006 0.604 17919 20549 1 50 . 1 1 72 72 ARG CB C 72 31.350 31.350 32.341 -0.991 17919 20550 1 50 . 1 1 72 72 ARG H H 72 8.580 8.580 8.160 0.420 17919 20551 1 51 . 1 1 2 2 GLN N N 2 123.220 123.220 126.954 -3.734 17919 20552 1 51 . 1 1 2 2 GLN HA H 2 5.249 5.249 4.897 0.352 17919 20553 1 51 . 1 1 2 2 GLN C C 2 175.920 175.920 174.639 1.281 17919 20554 1 51 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.949 0.131 17919 20555 1 51 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.462 0.298 17919 20556 1 51 . 1 1 2 2 GLN H H 2 8.900 8.900 8.538 0.362 17919 20557 1 51 . 1 1 3 3 ILE N N 3 115.340 115.340 119.732 -4.392 17919 20558 1 51 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.492 -0.279 17919 20559 1 51 . 1 1 3 3 ILE C C 3 172.450 172.450 173.737 -1.287 17919 20560 1 51 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.445 0.125 17919 20561 1 51 . 1 1 3 3 ILE CB C 3 42.210 42.210 40.935 1.275 17919 20562 1 51 . 1 1 3 3 ILE H H 3 8.320 8.320 7.853 0.467 17919 20563 1 51 . 1 1 4 4 PHE N N 4 118.110 118.110 121.739 -3.629 17919 20564 1 51 . 1 1 4 4 PHE HA H 4 5.630 5.630 4.965 0.665 17919 20565 1 51 . 1 1 4 4 PHE C C 4 175.320 175.320 175.353 -0.033 17919 20566 1 51 . 1 1 4 4 PHE CA C 4 55.210 55.210 56.622 -1.412 17919 20567 1 51 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.475 0.005 17919 20568 1 51 . 1 1 4 4 PHE H H 4 8.610 8.610 8.891 -0.281 17919 20569 1 51 . 1 1 5 5 VAL N N 5 121.000 121.000 121.432 -0.432 17919 20570 1 51 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.715 0.010 17919 20571 1 51 . 1 1 5 5 VAL C C 5 174.870 174.870 174.323 0.547 17919 20572 1 51 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.410 -0.790 17919 20573 1 51 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.924 0.306 17919 20574 1 51 . 1 1 5 5 VAL H H 5 9.300 9.300 9.046 0.254 17919 20575 1 51 . 1 1 6 6 LYS N N 6 127.520 127.520 129.194 -1.674 17919 20576 1 51 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.143 0.224 17919 20577 1 51 . 1 1 6 6 LYS C C 6 177.140 177.140 175.809 1.331 17919 20578 1 51 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.831 -0.311 17919 20579 1 51 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.652 -0.602 17919 20580 1 51 . 1 1 6 6 LYS H H 6 8.820 8.820 8.596 0.224 17919 20581 1 51 . 1 1 7 7 THR N N 7 115.400 115.400 120.600 -5.200 17919 20582 1 51 . 1 1 7 7 THR HA H 7 4.970 4.970 4.530 0.440 17919 20583 1 51 . 1 1 7 7 THR C C 7 176.910 176.910 175.825 1.085 17919 20584 1 51 . 1 1 7 7 THR CA C 7 60.470 60.470 60.640 -0.170 17919 20585 1 51 . 1 1 7 7 THR CB C 7 70.630 70.630 70.350 0.279 17919 20586 1 51 . 1 1 7 7 THR H H 7 8.730 8.730 8.502 0.228 17919 20587 1 51 . 1 1 8 8 LEU N N 8 121.330 121.330 121.531 -0.201 17919 20588 1 51 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.323 -0.013 17919 20589 1 51 . 1 1 8 8 LEU C C 8 178.800 178.800 177.570 1.230 17919 20590 1 51 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.490 0.090 17919 20591 1 51 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.144 -0.174 17919 20592 1 51 . 1 1 8 8 LEU H H 8 9.100 9.100 8.422 0.678 17919 20593 1 51 . 1 1 9 9 THR N N 9 105.590 105.590 107.967 -2.377 17919 20594 1 51 . 1 1 9 9 THR HA H 9 4.428 4.428 4.430 -0.002 17919 20595 1 51 . 1 1 9 9 THR C C 9 175.520 175.520 175.121 0.399 17919 20596 1 51 . 1 1 9 9 THR CA C 9 61.400 61.400 61.660 -0.260 17919 20597 1 51 . 1 1 9 9 THR CB C 9 69.140 69.140 68.839 0.301 17919 20598 1 51 . 1 1 9 9 THR H H 9 7.630 7.630 7.809 -0.179 17919 20599 1 51 . 1 1 10 10 GLY N N 10 108.890 108.890 110.981 -2.091 17919 20600 1 51 . 1 1 10 10 GLY C C 10 174.070 174.070 173.575 0.495 17919 20601 1 51 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.954 0.506 17919 20602 1 51 . 1 1 10 10 GLY H H 10 7.810 7.810 8.005 -0.195 17919 20603 1 51 . 1 1 11 11 LYS N N 11 121.600 121.600 121.002 0.598 17919 20604 1 51 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.465 -0.104 17919 20605 1 51 . 1 1 11 11 LYS C C 11 175.940 175.940 175.451 0.489 17919 20606 1 51 . 1 1 11 11 LYS CA C 11 56.280 56.280 55.997 0.283 17919 20607 1 51 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.195 0.005 17919 20608 1 51 . 1 1 11 11 LYS H H 11 7.280 7.280 8.044 -0.764 17919 20609 1 51 . 1 1 12 12 THR N N 12 120.440 120.440 117.741 2.699 17919 20610 1 51 . 1 1 12 12 THR HA H 12 5.046 5.046 5.294 -0.248 17919 20611 1 51 . 1 1 12 12 THR C C 12 174.320 174.320 174.107 0.213 17919 20612 1 51 . 1 1 12 12 THR CA C 12 62.390 62.390 61.218 1.172 17919 20613 1 51 . 1 1 12 12 THR CB C 12 69.910 69.910 70.931 -1.021 17919 20614 1 51 . 1 1 12 12 THR H H 12 8.650 8.650 8.223 0.427 17919 20615 1 51 . 1 1 13 13 ILE N N 13 127.110 127.110 121.794 5.316 17919 20616 1 51 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.841 -0.297 17919 20617 1 51 . 1 1 13 13 ILE C C 13 175.220 175.220 173.748 1.472 17919 20618 1 51 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.745 0.235 17919 20619 1 51 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.825 0.125 17919 20620 1 51 . 1 1 13 13 ILE H H 13 9.450 9.450 9.094 0.356 17919 20621 1 51 . 1 1 14 14 THR N N 14 121.520 121.520 119.538 1.982 17919 20622 1 51 . 1 1 14 14 THR HA H 14 4.964 4.964 5.026 -0.062 17919 20623 1 51 . 1 1 14 14 THR C C 14 173.790 173.790 173.350 0.440 17919 20624 1 51 . 1 1 14 14 THR CA C 14 61.940 61.940 60.784 1.156 17919 20625 1 51 . 1 1 14 14 THR CB C 14 69.650 69.650 70.168 -0.518 17919 20626 1 51 . 1 1 14 14 THR H H 14 8.710 8.710 8.232 0.478 17919 20627 1 51 . 1 1 15 15 LEU N N 15 124.800 124.800 125.778 -0.978 17919 20628 1 51 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.752 0.028 17919 20629 1 51 . 1 1 15 15 LEU C C 15 174.670 174.670 175.348 -0.678 17919 20630 1 51 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.197 -0.367 17919 20631 1 51 . 1 1 15 15 LEU CB C 15 47.070 47.070 44.777 2.293 17919 20632 1 51 . 1 1 15 15 LEU H H 15 8.710 8.710 8.175 0.535 17919 20633 1 51 . 1 1 16 16 GLU N N 16 122.160 122.160 122.665 -0.505 17919 20634 1 51 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.418 0.499 17919 20635 1 51 . 1 1 16 16 GLU C C 16 175.860 175.860 175.344 0.516 17919 20636 1 51 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.514 -0.694 17919 20637 1 51 . 1 1 16 16 GLU CB C 16 29.450 29.450 29.884 -0.434 17919 20638 1 51 . 1 1 16 16 GLU H H 16 8.140 8.140 8.398 -0.258 17919 20639 1 51 . 1 1 17 17 VAL N N 17 117.210 117.210 120.861 -3.651 17919 20640 1 51 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.516 0.198 17919 20641 1 51 . 1 1 17 17 VAL C C 17 174.160 174.160 174.624 -0.464 17919 20642 1 51 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.184 -0.754 17919 20643 1 51 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.224 1.176 17919 20644 1 51 . 1 1 17 17 VAL H H 17 8.900 8.900 8.044 0.856 17919 20645 1 51 . 1 1 18 18 GLU N N 18 118.990 118.990 119.980 -0.990 17919 20646 1 51 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.882 0.197 17919 20647 1 51 . 1 1 18 18 GLU C C 18 176.160 176.160 175.817 0.343 17919 20648 1 51 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.555 0.165 17919 20649 1 51 . 1 1 18 18 GLU CB C 18 30.310 30.310 31.820 -1.510 17919 20650 1 51 . 1 1 18 18 GLU H H 18 8.640 8.640 8.379 0.261 17919 20651 1 51 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.311 -0.170 17919 20652 1 51 . 1 1 19 19 PRO C C 19 175.310 175.310 177.760 -2.450 17919 20653 1 51 . 1 1 19 19 PRO CA C 19 65.470 65.470 64.992 0.478 17919 20654 1 51 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.026 -0.076 17919 20655 1 51 . 1 1 20 20 SER N N 20 103.400 103.400 113.038 -9.638 17919 20656 1 51 . 1 1 20 20 SER HA H 20 4.370 4.370 4.356 0.014 17919 20657 1 51 . 1 1 20 20 SER C C 20 174.660 174.660 174.841 -0.181 17919 20658 1 51 . 1 1 20 20 SER CA C 20 57.400 57.400 59.157 -1.757 17919 20659 1 51 . 1 1 20 20 SER CB C 20 63.370 63.370 63.011 0.359 17919 20660 1 51 . 1 1 20 20 SER H H 20 7.040 7.040 8.206 -1.166 17919 20661 1 51 . 1 1 21 21 ASP N N 21 123.480 123.480 122.524 0.956 17919 20662 1 51 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.766 -0.071 17919 20663 1 51 . 1 1 21 21 ASP C C 21 176.360 176.360 175.133 1.227 17919 20664 1 51 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.153 1.548 17919 20665 1 51 . 1 1 21 21 ASP CB C 21 40.800 40.800 42.049 -1.249 17919 20666 1 51 . 1 1 21 21 ASP H H 21 8.030 8.030 7.956 0.074 17919 20667 1 51 . 1 1 22 22 THR N N 22 108.800 108.800 112.836 -4.036 17919 20668 1 51 . 1 1 22 22 THR HA H 22 4.920 4.920 4.847 0.073 17919 20669 1 51 . 1 1 22 22 THR C C 22 176.750 176.750 176.270 0.480 17919 20670 1 51 . 1 1 22 22 THR CA C 22 59.690 59.690 60.860 -1.170 17919 20671 1 51 . 1 1 22 22 THR CB C 22 71.200 71.200 71.838 -0.638 17919 20672 1 51 . 1 1 22 22 THR H H 22 7.900 7.900 8.114 -0.214 17919 20673 1 51 . 1 1 23 23 ILE N N 23 121.190 121.190 123.458 -2.268 17919 20674 1 51 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.682 -0.025 17919 20675 1 51 . 1 1 23 23 ILE C C 23 179.040 179.040 177.642 1.398 17919 20676 1 51 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.594 -1.334 17919 20677 1 51 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.321 -1.971 17919 20678 1 51 . 1 1 23 23 ILE H H 23 8.560 8.560 9.092 -0.532 17919 20679 1 51 . 1 1 24 24 GLU N N 24 120.830 120.830 120.689 0.141 17919 20680 1 51 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.925 -0.008 17919 20681 1 51 . 1 1 24 24 GLU C C 24 178.640 178.640 178.710 -0.070 17919 20682 1 51 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.059 0.161 17919 20683 1 51 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.317 -1.036 17919 20684 1 51 . 1 1 24 24 GLU H H 24 9.760 9.760 8.269 1.491 17919 20685 1 51 . 1 1 25 25 ASN N N 25 120.570 120.570 118.336 2.234 17919 20686 1 51 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.556 -0.031 17919 20687 1 51 . 1 1 25 25 ASN C C 25 178.380 178.380 178.178 0.202 17919 20688 1 51 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.984 0.076 17919 20689 1 51 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.437 0.013 17919 20690 1 51 . 1 1 25 25 ASN H H 25 7.920 7.920 7.695 0.225 17919 20691 1 51 . 1 1 26 26 VAL N N 26 121.710 121.710 120.951 0.759 17919 20692 1 51 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.538 -0.141 17919 20693 1 51 . 1 1 26 26 VAL C C 26 177.950 177.950 177.686 0.264 17919 20694 1 51 . 1 1 26 26 VAL CA C 26 67.660 67.660 67.117 0.543 17919 20695 1 51 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.534 -0.694 17919 20696 1 51 . 1 1 26 26 VAL H H 26 8.070 8.070 8.127 -0.057 17919 20697 1 51 . 1 1 27 27 LYS N N 27 118.860 118.860 120.928 -2.068 17919 20698 1 51 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.213 0.367 17919 20699 1 51 . 1 1 27 27 LYS C C 27 180.550 180.550 179.180 1.370 17919 20700 1 51 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.806 -0.556 17919 20701 1 51 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.324 1.406 17919 20702 1 51 . 1 1 27 27 LYS H H 27 8.560 8.560 8.540 0.020 17919 20703 1 51 . 1 1 28 28 ALA N N 28 123.440 123.440 118.752 4.688 17919 20704 1 51 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.047 0.113 17919 20705 1 51 . 1 1 28 28 ALA C C 28 180.300 180.300 179.137 1.163 17919 20706 1 51 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.970 0.400 17919 20707 1 51 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.495 -0.785 17919 20708 1 51 . 1 1 28 28 ALA H H 28 8.060 8.060 8.284 -0.224 17919 20709 1 51 . 1 1 29 29 LYS N N 29 119.940 119.940 118.726 1.214 17919 20710 1 51 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.215 -0.008 17919 20711 1 51 . 1 1 29 29 LYS C C 29 180.320 180.320 178.539 1.781 17919 20712 1 51 . 1 1 29 29 LYS CA C 29 59.650 59.650 58.375 1.275 17919 20713 1 51 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.473 0.817 17919 20714 1 51 . 1 1 29 29 LYS H H 29 7.850 7.850 7.209 0.641 17919 20715 1 51 . 1 1 30 30 ILE N N 30 121.080 121.080 121.640 -0.560 17919 20716 1 51 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.537 -0.030 17919 20717 1 51 . 1 1 30 30 ILE C C 30 178.310 178.310 177.616 0.694 17919 20718 1 51 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.384 0.766 17919 20719 1 51 . 1 1 30 30 ILE CB C 30 36.800 36.800 36.807 -0.007 17919 20720 1 51 . 1 1 30 30 ILE H H 30 8.280 8.280 8.796 -0.516 17919 20721 1 51 . 1 1 31 31 GLN N N 31 123.490 123.490 119.358 4.132 17919 20722 1 51 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.938 -0.109 17919 20723 1 51 . 1 1 31 31 GLN C C 31 178.890 178.890 177.939 0.951 17919 20724 1 51 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.190 0.810 17919 20725 1 51 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.445 -0.725 17919 20726 1 51 . 1 1 31 31 GLN H H 31 8.580 8.580 8.002 0.578 17919 20727 1 51 . 1 1 32 32 ASP N N 32 119.360 119.360 118.682 0.678 17919 20728 1 51 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.414 -0.060 17919 20729 1 51 . 1 1 32 32 ASP C C 32 177.250 177.250 177.940 -0.690 17919 20730 1 51 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.559 0.631 17919 20731 1 51 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.907 -0.327 17919 20732 1 51 . 1 1 32 32 ASP H H 32 8.010 8.010 7.709 0.301 17919 20733 1 51 . 1 1 33 33 LYS N N 33 115.130 115.130 118.781 -3.651 17919 20734 1 51 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.212 0.125 17919 20735 1 51 . 1 1 33 33 LYS C C 33 177.870 177.870 178.647 -0.777 17919 20736 1 51 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.318 -0.268 17919 20737 1 51 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.663 0.507 17919 20738 1 51 . 1 1 33 33 LYS H H 33 7.430 7.430 7.803 -0.373 17919 20739 1 51 . 1 1 34 34 GLU N N 34 113.870 113.870 116.093 -2.223 17919 20740 1 51 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.424 0.201 17919 20741 1 51 . 1 1 34 34 GLU C C 34 177.840 177.840 176.860 0.980 17919 20742 1 51 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.207 -1.037 17919 20743 1 51 . 1 1 34 34 GLU CB C 34 32.660 32.660 30.702 1.958 17919 20744 1 51 . 1 1 34 34 GLU H H 34 8.740 8.740 8.156 0.584 17919 20745 1 51 . 1 1 35 35 GLY N N 35 108.650 108.650 108.139 0.511 17919 20746 1 51 . 1 1 35 35 GLY C C 35 173.960 173.960 174.706 -0.746 17919 20747 1 51 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.526 0.554 17919 20748 1 51 . 1 1 35 35 GLY H H 35 8.530 8.530 7.817 0.713 17919 20749 1 51 . 1 1 36 36 ILE N N 36 119.880 119.880 122.619 -2.739 17919 20750 1 51 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.248 0.197 17919 20751 1 51 . 1 1 36 36 ILE C C 36 173.590 173.590 174.323 -0.733 17919 20752 1 51 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.628 -0.878 17919 20753 1 51 . 1 1 36 36 ILE CB C 36 40.580 40.580 37.725 2.855 17919 20754 1 51 . 1 1 36 36 ILE H H 36 6.150 6.150 7.805 -1.655 17919 20755 1 51 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.756 -0.122 17919 20756 1 51 . 1 1 37 37 PRO C C 37 176.940 176.940 176.558 0.382 17919 20757 1 51 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.144 0.516 17919 20758 1 51 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.250 0.600 17919 20759 1 51 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.224 -0.107 17919 20760 1 51 . 1 1 38 38 PRO C C 38 178.320 178.320 178.709 -0.389 17919 20761 1 51 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.154 1.106 17919 20762 1 51 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.852 1.038 17919 20763 1 51 . 1 1 39 39 ASP N N 39 113.380 113.380 119.080 -5.700 17919 20764 1 51 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.166 0.264 17919 20765 1 51 . 1 1 39 39 ASP C C 39 177.090 177.090 178.023 -0.933 17919 20766 1 51 . 1 1 39 39 ASP CA C 39 55.640 55.640 57.123 -1.483 17919 20767 1 51 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.288 -0.748 17919 20768 1 51 . 1 1 39 39 ASP H H 39 8.550 8.550 8.427 0.123 17919 20769 1 51 . 1 1 40 40 GLN N N 40 116.780 116.780 117.693 -0.913 17919 20770 1 51 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.082 0.382 17919 20771 1 51 . 1 1 40 40 GLN C C 40 175.380 175.380 176.651 -1.271 17919 20772 1 51 . 1 1 40 40 GLN CA C 40 55.640 55.640 57.581 -1.941 17919 20773 1 51 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.495 0.645 17919 20774 1 51 . 1 1 40 40 GLN H H 40 7.820 7.820 7.649 0.171 17919 20775 1 51 . 1 1 41 41 GLN N N 41 117.720 117.720 117.856 -0.136 17919 20776 1 51 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.143 0.101 17919 20777 1 51 . 1 1 41 41 GLN C C 41 176.300 176.300 175.794 0.506 17919 20778 1 51 . 1 1 41 41 GLN CA C 41 56.470 56.470 57.182 -0.712 17919 20779 1 51 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.381 2.269 17919 20780 1 51 . 1 1 41 41 GLN H H 41 7.480 7.480 7.335 0.145 17919 20781 1 51 . 1 1 42 42 ARG N N 42 122.680 122.680 121.070 1.610 17919 20782 1 51 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.652 -0.152 17919 20783 1 51 . 1 1 42 42 ARG C C 42 174.050 174.050 174.284 -0.234 17919 20784 1 51 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.276 0.774 17919 20785 1 51 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.654 -1.904 17919 20786 1 51 . 1 1 42 42 ARG H H 42 8.530 8.530 8.243 0.287 17919 20787 1 51 . 1 1 43 43 LEU N N 43 124.040 124.040 124.840 -0.800 17919 20788 1 51 . 1 1 43 43 LEU C C 43 175.290 175.290 176.199 -0.909 17919 20789 1 51 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.234 -1.254 17919 20790 1 51 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.477 2.313 17919 20791 1 51 . 1 1 43 43 LEU H H 43 8.820 8.820 8.823 -0.003 17919 20792 1 51 . 1 1 44 44 ILE N N 44 121.920 121.920 123.449 -1.529 17919 20793 1 51 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.763 0.229 17919 20794 1 51 . 1 1 44 44 ILE C C 44 176.060 176.060 174.272 1.788 17919 20795 1 51 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.810 -1.830 17919 20796 1 51 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.534 -0.114 17919 20797 1 51 . 1 1 44 44 ILE H H 44 9.030 9.030 8.538 0.492 17919 20798 1 51 . 1 1 45 45 PHE N N 45 125.390 125.390 127.703 -2.313 17919 20799 1 51 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.046 -0.001 17919 20800 1 51 . 1 1 45 45 PHE C C 45 174.470 174.470 174.445 0.025 17919 20801 1 51 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.364 0.656 17919 20802 1 51 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.107 0.653 17919 20803 1 51 . 1 1 45 45 PHE H H 45 8.830 8.830 8.952 -0.122 17919 20804 1 51 . 1 1 46 46 ALA N N 46 132.200 132.200 128.512 3.688 17919 20805 1 51 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.542 0.148 17919 20806 1 51 . 1 1 46 46 ALA C C 46 177.290 177.290 176.744 0.546 17919 20807 1 51 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.947 -0.407 17919 20808 1 51 . 1 1 46 46 ALA CB C 46 16.570 16.570 15.984 0.586 17919 20809 1 51 . 1 1 46 46 ALA H H 46 8.810 8.810 8.980 -0.170 17919 20810 1 51 . 1 1 47 47 GLY N N 47 102.340 102.340 103.341 -1.001 17919 20811 1 51 . 1 1 47 47 GLY C C 47 173.810 173.810 174.280 -0.470 17919 20812 1 51 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.058 0.292 17919 20813 1 51 . 1 1 47 47 GLY H H 47 8.130 8.130 8.377 -0.247 17919 20814 1 51 . 1 1 48 48 LYS N N 48 121.570 121.570 122.356 -0.786 17919 20815 1 51 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.554 0.068 17919 20816 1 51 . 1 1 48 48 LYS C C 48 174.700 174.700 175.180 -0.480 17919 20817 1 51 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.860 -0.310 17919 20818 1 51 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.295 0.235 17919 20819 1 51 . 1 1 48 48 LYS H H 48 7.980 7.980 8.117 -0.137 17919 20820 1 51 . 1 1 49 49 GLN N N 49 122.410 122.410 126.191 -3.781 17919 20821 1 51 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.522 0.038 17919 20822 1 51 . 1 1 49 49 GLN C C 49 175.670 175.670 175.459 0.211 17919 20823 1 51 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.725 0.015 17919 20824 1 51 . 1 1 49 49 GLN CB C 49 29.000 29.000 28.964 0.036 17919 20825 1 51 . 1 1 49 49 GLN H H 49 8.600 8.600 8.660 -0.060 17919 20826 1 51 . 1 1 50 50 LEU N N 50 125.520 125.520 129.480 -3.960 17919 20827 1 51 . 1 1 50 50 LEU HA H 50 4.090 4.090 3.997 0.093 17919 20828 1 51 . 1 1 50 50 LEU C C 50 176.660 176.660 175.835 0.825 17919 20829 1 51 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.609 -0.369 17919 20830 1 51 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.862 -0.292 17919 20831 1 51 . 1 1 50 50 LEU H H 50 8.530 8.530 8.698 -0.168 17919 20832 1 51 . 1 1 51 51 GLU N N 51 122.940 122.940 124.020 -1.080 17919 20833 1 51 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.518 -0.030 17919 20834 1 51 . 1 1 51 51 GLU C C 51 175.870 175.870 176.430 -0.560 17919 20835 1 51 . 1 1 51 51 GLU CA C 51 55.960 55.960 54.429 1.531 17919 20836 1 51 . 1 1 51 51 GLU CB C 51 31.570 31.570 33.082 -1.512 17919 20837 1 51 . 1 1 51 51 GLU H H 51 8.400 8.400 7.993 0.407 17919 20838 1 51 . 1 1 52 52 ASP N N 52 120.030 120.030 124.241 -4.211 17919 20839 1 51 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.622 -0.263 17919 20840 1 51 . 1 1 52 52 ASP C C 52 177.330 177.330 176.845 0.485 17919 20841 1 51 . 1 1 52 52 ASP CA C 52 56.960 56.960 56.170 0.790 17919 20842 1 51 . 1 1 52 52 ASP CB C 52 40.850 40.850 41.103 -0.254 17919 20843 1 51 . 1 1 52 52 ASP H H 52 8.160 8.160 8.824 -0.664 17919 20844 1 51 . 1 1 53 53 GLY N N 53 106.660 106.660 105.774 0.886 17919 20845 1 51 . 1 1 53 53 GLY C C 53 174.870 174.870 174.619 0.251 17919 20846 1 51 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.783 0.387 17919 20847 1 51 . 1 1 53 53 GLY H H 53 9.390 9.390 7.911 1.479 17919 20848 1 51 . 1 1 54 54 ARG N N 54 119.050 119.050 120.790 -1.740 17919 20849 1 51 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.638 0.057 17919 20850 1 51 . 1 1 54 54 ARG C C 54 175.350 175.350 175.250 0.100 17919 20851 1 51 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.995 -0.605 17919 20852 1 51 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.783 -0.133 17919 20853 1 51 . 1 1 54 54 ARG H H 54 7.460 7.460 7.356 0.104 17919 20854 1 51 . 1 1 55 55 THR N N 55 108.400 108.400 112.062 -3.662 17919 20855 1 51 . 1 1 55 55 THR HA H 55 5.240 5.240 5.021 0.219 17919 20856 1 51 . 1 1 55 55 THR C C 55 176.560 176.560 176.112 0.448 17919 20857 1 51 . 1 1 55 55 THR CA C 55 59.690 59.690 60.388 -0.698 17919 20858 1 51 . 1 1 55 55 THR CB C 55 72.260 72.260 70.705 1.555 17919 20859 1 51 . 1 1 55 55 THR H H 55 8.730 8.730 8.801 -0.071 17919 20860 1 51 . 1 1 56 56 LEU N N 56 117.920 117.920 121.378 -3.458 17919 20861 1 51 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.993 0.067 17919 20862 1 51 . 1 1 56 56 LEU C C 56 180.810 180.810 179.136 1.674 17919 20863 1 51 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.667 0.043 17919 20864 1 51 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.468 -1.099 17919 20865 1 51 . 1 1 56 56 LEU H H 56 8.140 8.140 8.281 -0.141 17919 20866 1 51 . 1 1 57 57 SER N N 57 113.330 113.330 112.989 0.341 17919 20867 1 51 . 1 1 57 57 SER HA H 57 4.370 4.370 4.161 0.209 17919 20868 1 51 . 1 1 57 57 SER C C 57 178.310 178.310 175.798 2.512 17919 20869 1 51 . 1 1 57 57 SER CA C 57 61.080 61.080 61.645 -0.565 17919 20870 1 51 . 1 1 57 57 SER CB C 57 62.530 62.530 62.666 -0.136 17919 20871 1 51 . 1 1 57 57 SER H H 57 8.470 8.470 8.101 0.369 17919 20872 1 51 . 1 1 58 58 ASP N N 58 124.190 124.190 120.008 4.182 17919 20873 1 51 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.459 -0.163 17919 20874 1 51 . 1 1 58 58 ASP C C 58 177.400 177.400 176.840 0.560 17919 20875 1 51 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.154 1.026 17919 20876 1 51 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.864 -0.764 17919 20877 1 51 . 1 1 58 58 ASP H H 58 7.930 7.930 7.970 -0.040 17919 20878 1 51 . 1 1 59 59 TYR N N 59 115.510 115.510 115.770 -0.260 17919 20879 1 51 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.599 0.071 17919 20880 1 51 . 1 1 59 59 TYR C C 59 174.700 174.700 175.548 -0.848 17919 20881 1 51 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.736 0.514 17919 20882 1 51 . 1 1 59 59 TYR CB C 59 40.070 40.070 39.072 0.998 17919 20883 1 51 . 1 1 59 59 TYR H H 59 7.250 7.250 7.437 -0.187 17919 20884 1 51 . 1 1 60 60 ASN N N 60 115.900 115.900 117.489 -1.589 17919 20885 1 51 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.412 -0.057 17919 20886 1 51 . 1 1 60 60 ASN C C 60 174.340 174.340 174.698 -0.358 17919 20887 1 51 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.036 0.084 17919 20888 1 51 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.317 0.093 17919 20889 1 51 . 1 1 60 60 ASN H H 60 8.150 8.150 7.978 0.172 17919 20890 1 51 . 1 1 61 61 ILE N N 61 118.600 118.600 120.419 -1.819 17919 20891 1 51 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.788 -0.395 17919 20892 1 51 . 1 1 61 61 ILE C C 61 174.610 174.610 175.043 -0.433 17919 20893 1 51 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.597 -0.177 17919 20894 1 51 . 1 1 61 61 ILE CB C 61 36.740 36.740 38.223 -1.483 17919 20895 1 51 . 1 1 61 61 ILE H H 61 7.250 7.250 8.035 -0.785 17919 20896 1 51 . 1 1 62 62 GLN N N 62 124.740 124.740 122.643 2.097 17919 20897 1 51 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.570 -0.064 17919 20898 1 51 . 1 1 62 62 GLN C C 62 175.970 175.970 174.400 1.570 17919 20899 1 51 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.278 0.383 17919 20900 1 51 . 1 1 62 62 GLN CB C 62 31.650 31.650 32.349 -0.699 17919 20901 1 51 . 1 1 62 62 GLN H H 62 7.610 7.610 8.402 -0.792 17919 20902 1 51 . 1 1 63 63 LYS N N 63 120.300 120.300 122.581 -2.281 17919 20903 1 51 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.048 -0.047 17919 20904 1 51 . 1 1 63 63 LYS C C 63 175.810 175.810 177.199 -1.389 17919 20905 1 51 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.966 -0.176 17919 20906 1 51 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.324 0.326 17919 20907 1 51 . 1 1 63 63 LYS H H 63 8.490 8.490 8.739 -0.249 17919 20908 1 51 . 1 1 64 64 GLU N N 64 113.950 113.950 121.630 -7.680 17919 20909 1 51 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.942 -0.477 17919 20910 1 51 . 1 1 64 64 GLU C C 64 175.250 175.250 176.359 -1.109 17919 20911 1 51 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.890 0.000 17919 20912 1 51 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.925 -3.026 17919 20913 1 51 . 1 1 64 64 GLU H H 64 9.280 9.280 8.724 0.556 17919 20914 1 51 . 1 1 65 65 SER N N 65 114.730 114.730 114.929 -0.199 17919 20915 1 51 . 1 1 65 65 SER HA H 65 4.640 4.640 4.461 0.179 17919 20916 1 51 . 1 1 65 65 SER C C 65 172.160 172.160 173.574 -1.414 17919 20917 1 51 . 1 1 65 65 SER CA C 65 60.890 60.890 59.575 1.315 17919 20918 1 51 . 1 1 65 65 SER CB C 65 64.910 64.910 64.241 0.669 17919 20919 1 51 . 1 1 65 65 SER H H 65 7.670 7.670 7.870 -0.200 17919 20920 1 51 . 1 1 66 66 THR N N 66 117.110 117.110 115.653 1.457 17919 20921 1 51 . 1 1 66 66 THR HA H 66 5.270 5.270 4.986 0.284 17919 20922 1 51 . 1 1 66 66 THR C C 66 173.950 173.950 173.300 0.650 17919 20923 1 51 . 1 1 66 66 THR CA C 66 62.340 62.340 62.368 -0.028 17919 20924 1 51 . 1 1 66 66 THR CB C 66 70.080 70.080 70.533 -0.453 17919 20925 1 51 . 1 1 66 66 THR H H 66 8.730 8.730 8.313 0.417 17919 20926 1 51 . 1 1 67 67 LEU N N 67 127.110 127.110 126.944 0.166 17919 20927 1 51 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.753 0.307 17919 20928 1 51 . 1 1 67 67 LEU C C 67 175.770 175.770 175.634 0.136 17919 20929 1 51 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.136 -0.235 17919 20930 1 51 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.887 0.373 17919 20931 1 51 . 1 1 67 67 LEU H H 67 9.410 9.410 9.036 0.374 17919 20932 1 51 . 1 1 68 68 HIS N N 68 118.380 118.380 120.526 -2.146 17919 20933 1 51 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.704 -0.464 17919 20934 1 51 . 1 1 68 68 HIS C C 68 173.150 173.150 174.424 -1.274 17919 20935 1 51 . 1 1 68 68 HIS CA C 68 55.000 55.000 53.814 1.186 17919 20936 1 51 . 1 1 68 68 HIS CB C 68 30.530 30.530 33.412 -2.882 17919 20937 1 51 . 1 1 68 68 HIS H H 68 9.230 9.230 9.100 0.130 17919 20938 1 51 . 1 1 69 69 LEU N N 69 124.460 124.460 122.015 2.445 17919 20939 1 51 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.929 0.261 17919 20940 1 51 . 1 1 69 69 LEU C C 69 175.270 175.270 174.876 0.394 17919 20941 1 51 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.576 -0.686 17919 20942 1 51 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.812 -0.432 17919 20943 1 51 . 1 1 69 69 LEU H H 69 8.340 8.340 7.178 1.162 17919 20944 1 51 . 1 1 70 70 VAL N N 70 126.940 126.940 125.544 1.396 17919 20945 1 51 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.134 0.216 17919 20946 1 51 . 1 1 70 70 VAL C C 70 174.000 174.000 174.879 -0.879 17919 20947 1 51 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.905 -0.105 17919 20948 1 51 . 1 1 70 70 VAL CB C 70 34.910 34.910 33.437 1.473 17919 20949 1 51 . 1 1 70 70 VAL H H 70 9.200 9.200 7.857 1.343 17919 20950 1 51 . 1 1 71 71 LEU N N 71 123.130 123.130 126.033 -2.903 17919 20951 1 51 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.323 0.737 17919 20952 1 51 . 1 1 71 71 LEU C C 71 177.830 177.830 176.816 1.014 17919 20953 1 51 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.984 -0.044 17919 20954 1 51 . 1 1 71 71 LEU CB C 71 42.850 42.850 41.935 0.915 17919 20955 1 51 . 1 1 71 71 LEU H H 71 8.120 8.120 8.352 -0.232 17919 20956 1 51 . 1 1 72 72 ARG N N 72 123.490 123.490 125.311 -1.821 17919 20957 1 51 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.110 0.191 17919 20958 1 51 . 1 1 72 72 ARG C C 72 175.350 175.350 175.449 -0.099 17919 20959 1 51 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.620 -1.010 17919 20960 1 51 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.661 0.689 17919 20961 1 51 . 1 1 72 72 ARG H H 72 8.580 8.580 7.939 0.641 17919 20962 1 52 . 1 1 2 2 GLN N N 2 123.220 123.220 120.286 2.934 17919 20963 1 52 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.465 -0.216 17919 20964 1 52 . 1 1 2 2 GLN C C 2 175.920 175.920 175.619 0.301 17919 20965 1 52 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.111 0.969 17919 20966 1 52 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.983 -0.223 17919 20967 1 52 . 1 1 2 2 GLN H H 2 8.900 8.900 8.262 0.638 17919 20968 1 52 . 1 1 3 3 ILE N N 3 115.340 115.340 116.743 -1.403 17919 20969 1 52 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.282 -0.069 17919 20970 1 52 . 1 1 3 3 ILE C C 3 172.450 172.450 173.609 -1.159 17919 20971 1 52 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.469 0.101 17919 20972 1 52 . 1 1 3 3 ILE CB C 3 42.210 42.210 40.902 1.308 17919 20973 1 52 . 1 1 3 3 ILE H H 3 8.320 8.320 7.888 0.432 17919 20974 1 52 . 1 1 4 4 PHE N N 4 118.110 118.110 120.044 -1.934 17919 20975 1 52 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.557 0.073 17919 20976 1 52 . 1 1 4 4 PHE C C 4 175.320 175.320 175.331 -0.011 17919 20977 1 52 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.330 -0.119 17919 20978 1 52 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.840 -0.360 17919 20979 1 52 . 1 1 4 4 PHE H H 4 8.610 8.610 8.522 0.088 17919 20980 1 52 . 1 1 5 5 VAL N N 5 121.000 121.000 122.464 -1.464 17919 20981 1 52 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.952 -0.227 17919 20982 1 52 . 1 1 5 5 VAL C C 5 174.870 174.870 174.529 0.341 17919 20983 1 52 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.112 -0.492 17919 20984 1 52 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.270 -0.040 17919 20985 1 52 . 1 1 5 5 VAL H H 5 9.300 9.300 8.885 0.415 17919 20986 1 52 . 1 1 6 6 LYS N N 6 127.520 127.520 129.007 -1.487 17919 20987 1 52 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.230 0.137 17919 20988 1 52 . 1 1 6 6 LYS C C 6 177.140 177.140 176.080 1.060 17919 20989 1 52 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.164 0.356 17919 20990 1 52 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.566 -0.516 17919 20991 1 52 . 1 1 6 6 LYS H H 6 8.820 8.820 9.291 -0.471 17919 20992 1 52 . 1 1 7 7 THR N N 7 115.400 115.400 118.885 -3.485 17919 20993 1 52 . 1 1 7 7 THR HA H 7 4.970 4.970 5.023 -0.053 17919 20994 1 52 . 1 1 7 7 THR C C 7 176.910 176.910 176.866 0.044 17919 20995 1 52 . 1 1 7 7 THR CA C 7 60.470 60.470 59.724 0.746 17919 20996 1 52 . 1 1 7 7 THR CB C 7 70.630 70.630 70.279 0.351 17919 20997 1 52 . 1 1 7 7 THR H H 7 8.730 8.730 7.999 0.731 17919 20998 1 52 . 1 1 8 8 LEU N N 8 121.330 121.330 122.737 -1.407 17919 20999 1 52 . 1 1 8 8 LEU HA H 8 4.310 4.310 3.958 0.352 17919 21000 1 52 . 1 1 8 8 LEU C C 8 178.800 178.800 177.889 0.911 17919 21001 1 52 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.562 0.018 17919 21002 1 52 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.006 0.964 17919 21003 1 52 . 1 1 8 8 LEU H H 8 9.100 9.100 8.958 0.142 17919 21004 1 52 . 1 1 9 9 THR N N 9 105.590 105.590 107.903 -2.313 17919 21005 1 52 . 1 1 9 9 THR HA H 9 4.428 4.428 4.299 0.129 17919 21006 1 52 . 1 1 9 9 THR C C 9 175.520 175.520 175.879 -0.359 17919 21007 1 52 . 1 1 9 9 THR CA C 9 61.400 61.400 61.926 -0.526 17919 21008 1 52 . 1 1 9 9 THR CB C 9 69.140 69.140 69.661 -0.521 17919 21009 1 52 . 1 1 9 9 THR H H 9 7.630 7.630 7.590 0.040 17919 21010 1 52 . 1 1 10 10 GLY N N 10 108.890 108.890 111.334 -2.444 17919 21011 1 52 . 1 1 10 10 GLY C C 10 174.070 174.070 174.358 -0.288 17919 21012 1 52 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.761 0.698 17919 21013 1 52 . 1 1 10 10 GLY H H 10 7.810 7.810 8.117 -0.307 17919 21014 1 52 . 1 1 11 11 LYS N N 11 121.600 121.600 122.060 -0.460 17919 21015 1 52 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.157 0.204 17919 21016 1 52 . 1 1 11 11 LYS C C 11 175.940 175.940 175.438 0.502 17919 21017 1 52 . 1 1 11 11 LYS CA C 11 56.280 56.280 57.155 -0.875 17919 21018 1 52 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.304 -0.104 17919 21019 1 52 . 1 1 11 11 LYS H H 11 7.280 7.280 7.660 -0.380 17919 21020 1 52 . 1 1 12 12 THR N N 12 120.440 120.440 118.129 2.311 17919 21021 1 52 . 1 1 12 12 THR HA H 12 5.046 5.046 5.163 -0.117 17919 21022 1 52 . 1 1 12 12 THR C C 12 174.320 174.320 174.123 0.197 17919 21023 1 52 . 1 1 12 12 THR CA C 12 62.390 62.390 60.935 1.455 17919 21024 1 52 . 1 1 12 12 THR CB C 12 69.910 69.910 70.976 -1.066 17919 21025 1 52 . 1 1 12 12 THR H H 12 8.650 8.650 8.202 0.448 17919 21026 1 52 . 1 1 13 13 ILE N N 13 127.110 127.110 124.053 3.057 17919 21027 1 52 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.596 -0.052 17919 21028 1 52 . 1 1 13 13 ILE C C 13 175.220 175.220 174.246 0.974 17919 21029 1 52 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.552 -0.572 17919 21030 1 52 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.712 -0.762 17919 21031 1 52 . 1 1 13 13 ILE H H 13 9.450 9.450 8.668 0.782 17919 21032 1 52 . 1 1 14 14 THR N N 14 121.520 121.520 118.726 2.794 17919 21033 1 52 . 1 1 14 14 THR HA H 14 4.964 4.964 5.113 -0.149 17919 21034 1 52 . 1 1 14 14 THR C C 14 173.790 173.790 172.830 0.960 17919 21035 1 52 . 1 1 14 14 THR CA C 14 61.940 61.940 60.716 1.224 17919 21036 1 52 . 1 1 14 14 THR CB C 14 69.650 69.650 70.860 -1.210 17919 21037 1 52 . 1 1 14 14 THR H H 14 8.710 8.710 8.199 0.511 17919 21038 1 52 . 1 1 15 15 LEU N N 15 124.800 124.800 125.813 -1.013 17919 21039 1 52 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.746 0.034 17919 21040 1 52 . 1 1 15 15 LEU C C 15 174.670 174.670 174.812 -0.142 17919 21041 1 52 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.833 -1.003 17919 21042 1 52 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.884 1.186 17919 21043 1 52 . 1 1 15 15 LEU H H 15 8.710 8.710 7.985 0.725 17919 21044 1 52 . 1 1 16 16 GLU N N 16 122.160 122.160 124.054 -1.894 17919 21045 1 52 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.423 0.494 17919 21046 1 52 . 1 1 16 16 GLU C C 16 175.860 175.860 175.878 -0.018 17919 21047 1 52 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.229 -0.409 17919 21048 1 52 . 1 1 16 16 GLU CB C 16 29.450 29.450 28.946 0.504 17919 21049 1 52 . 1 1 16 16 GLU H H 16 8.140 8.140 8.656 -0.516 17919 21050 1 52 . 1 1 17 17 VAL N N 17 117.210 117.210 120.854 -3.644 17919 21051 1 52 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.982 -0.268 17919 21052 1 52 . 1 1 17 17 VAL C C 17 174.160 174.160 175.020 -0.860 17919 21053 1 52 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.706 -0.276 17919 21054 1 52 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.054 1.346 17919 21055 1 52 . 1 1 17 17 VAL H H 17 8.900 8.900 8.232 0.668 17919 21056 1 52 . 1 1 18 18 GLU N N 18 118.990 118.990 119.378 -0.388 17919 21057 1 52 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.837 0.242 17919 21058 1 52 . 1 1 18 18 GLU C C 18 176.160 176.160 175.146 1.014 17919 21059 1 52 . 1 1 18 18 GLU CA C 18 52.720 52.720 54.256 -1.536 17919 21060 1 52 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.781 -0.471 17919 21061 1 52 . 1 1 18 18 GLU H H 18 8.640 8.640 8.585 0.055 17919 21062 1 52 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.490 -0.349 17919 21063 1 52 . 1 1 19 19 PRO C C 19 175.310 175.310 177.946 -2.636 17919 21064 1 52 . 1 1 19 19 PRO CA C 19 65.470 65.470 64.717 0.753 17919 21065 1 52 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.933 0.017 17919 21066 1 52 . 1 1 20 20 SER N N 20 103.400 103.400 114.380 -10.980 17919 21067 1 52 . 1 1 20 20 SER HA H 20 4.370 4.370 4.224 0.146 17919 21068 1 52 . 1 1 20 20 SER C C 20 174.660 174.660 174.399 0.261 17919 21069 1 52 . 1 1 20 20 SER CA C 20 57.400 57.400 60.120 -2.720 17919 21070 1 52 . 1 1 20 20 SER CB C 20 63.370 63.370 63.127 0.243 17919 21071 1 52 . 1 1 20 20 SER H H 20 7.040 7.040 7.930 -0.890 17919 21072 1 52 . 1 1 21 21 ASP N N 21 123.480 123.480 121.965 1.515 17919 21073 1 52 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.754 -0.059 17919 21074 1 52 . 1 1 21 21 ASP C C 21 176.360 176.360 175.817 0.543 17919 21075 1 52 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.020 0.680 17919 21076 1 52 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.618 -0.818 17919 21077 1 52 . 1 1 21 21 ASP H H 21 8.030 8.030 7.464 0.566 17919 21078 1 52 . 1 1 22 22 THR N N 22 108.800 108.800 112.975 -4.175 17919 21079 1 52 . 1 1 22 22 THR HA H 22 4.920 4.920 4.796 0.124 17919 21080 1 52 . 1 1 22 22 THR C C 22 176.750 176.750 175.853 0.897 17919 21081 1 52 . 1 1 22 22 THR CA C 22 59.690 59.690 61.200 -1.510 17919 21082 1 52 . 1 1 22 22 THR CB C 22 71.200 71.200 70.401 0.799 17919 21083 1 52 . 1 1 22 22 THR H H 22 7.900 7.900 8.152 -0.252 17919 21084 1 52 . 1 1 23 23 ILE N N 23 121.190 121.190 121.730 -0.540 17919 21085 1 52 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.792 -0.135 17919 21086 1 52 . 1 1 23 23 ILE C C 23 179.040 179.040 177.690 1.350 17919 21087 1 52 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.109 0.151 17919 21088 1 52 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.233 -1.883 17919 21089 1 52 . 1 1 23 23 ILE H H 23 8.560 8.560 9.056 -0.496 17919 21090 1 52 . 1 1 24 24 GLU N N 24 120.830 120.830 120.952 -0.122 17919 21091 1 52 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.814 0.102 17919 21092 1 52 . 1 1 24 24 GLU C C 24 178.640 178.640 178.408 0.232 17919 21093 1 52 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.364 -0.144 17919 21094 1 52 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.328 -1.048 17919 21095 1 52 . 1 1 24 24 GLU H H 24 9.760 9.760 8.199 1.561 17919 21096 1 52 . 1 1 25 25 ASN N N 25 120.570 120.570 116.165 4.405 17919 21097 1 52 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.599 -0.074 17919 21098 1 52 . 1 1 25 25 ASN C C 25 178.380 178.380 178.034 0.346 17919 21099 1 52 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.230 0.830 17919 21100 1 52 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.153 0.297 17919 21101 1 52 . 1 1 25 25 ASN H H 25 7.920 7.920 8.492 -0.572 17919 21102 1 52 . 1 1 26 26 VAL N N 26 121.710 121.710 119.596 2.114 17919 21103 1 52 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.658 -0.261 17919 21104 1 52 . 1 1 26 26 VAL C C 26 177.950 177.950 177.535 0.415 17919 21105 1 52 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.131 1.529 17919 21106 1 52 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.316 -0.476 17919 21107 1 52 . 1 1 26 26 VAL H H 26 8.070 8.070 8.166 -0.096 17919 21108 1 52 . 1 1 27 27 LYS N N 27 118.860 118.860 120.276 -1.416 17919 21109 1 52 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.150 0.430 17919 21110 1 52 . 1 1 27 27 LYS C C 27 180.550 180.550 179.174 1.376 17919 21111 1 52 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.473 -0.223 17919 21112 1 52 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.166 1.564 17919 21113 1 52 . 1 1 27 27 LYS H H 27 8.560 8.560 8.404 0.156 17919 21114 1 52 . 1 1 28 28 ALA N N 28 123.440 123.440 121.482 1.958 17919 21115 1 52 . 1 1 28 28 ALA HA H 28 4.160 4.160 3.995 0.165 17919 21116 1 52 . 1 1 28 28 ALA C C 28 180.300 180.300 179.030 1.270 17919 21117 1 52 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.371 -0.001 17919 21118 1 52 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.397 -0.687 17919 21119 1 52 . 1 1 28 28 ALA H H 28 8.060 8.060 8.533 -0.473 17919 21120 1 52 . 1 1 29 29 LYS N N 29 119.940 119.940 119.220 0.720 17919 21121 1 52 . 1 1 29 29 LYS HA H 29 4.207 4.207 3.984 0.223 17919 21122 1 52 . 1 1 29 29 LYS C C 29 180.320 180.320 179.237 1.083 17919 21123 1 52 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.300 0.350 17919 21124 1 52 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.196 1.094 17919 21125 1 52 . 1 1 29 29 LYS H H 29 7.850 7.850 7.492 0.358 17919 21126 1 52 . 1 1 30 30 ILE N N 30 121.080 121.080 119.604 1.476 17919 21127 1 52 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.615 -0.108 17919 21128 1 52 . 1 1 30 30 ILE C C 30 178.310 178.310 177.499 0.811 17919 21129 1 52 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.156 0.994 17919 21130 1 52 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.741 -0.941 17919 21131 1 52 . 1 1 30 30 ILE H H 30 8.280 8.280 7.875 0.406 17919 21132 1 52 . 1 1 31 31 GLN N N 31 123.490 123.490 119.545 3.945 17919 21133 1 52 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.007 -0.178 17919 21134 1 52 . 1 1 31 31 GLN C C 31 178.890 178.890 178.063 0.827 17919 21135 1 52 . 1 1 31 31 GLN CA C 31 60.000 60.000 58.743 1.257 17919 21136 1 52 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.246 -0.526 17919 21137 1 52 . 1 1 31 31 GLN H H 31 8.580 8.580 7.954 0.626 17919 21138 1 52 . 1 1 32 32 ASP N N 32 119.360 119.360 120.194 -0.834 17919 21139 1 52 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.376 -0.022 17919 21140 1 52 . 1 1 32 32 ASP C C 32 177.250 177.250 178.002 -0.752 17919 21141 1 52 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.954 0.236 17919 21142 1 52 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.793 -0.213 17919 21143 1 52 . 1 1 32 32 ASP H H 32 8.010 8.010 8.471 -0.461 17919 21144 1 52 . 1 1 33 33 LYS N N 33 115.130 115.130 117.614 -2.484 17919 21145 1 52 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.315 0.022 17919 21146 1 52 . 1 1 33 33 LYS C C 33 177.870 177.870 178.245 -0.375 17919 21147 1 52 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.441 -0.391 17919 21148 1 52 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.434 0.736 17919 21149 1 52 . 1 1 33 33 LYS H H 33 7.430 7.430 7.697 -0.268 17919 21150 1 52 . 1 1 34 34 GLU N N 34 113.870 113.870 115.276 -1.406 17919 21151 1 52 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.418 0.207 17919 21152 1 52 . 1 1 34 34 GLU C C 34 177.840 177.840 177.611 0.229 17919 21153 1 52 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.095 -0.925 17919 21154 1 52 . 1 1 34 34 GLU CB C 34 32.660 32.660 30.902 1.758 17919 21155 1 52 . 1 1 34 34 GLU H H 34 8.740 8.740 7.792 0.948 17919 21156 1 52 . 1 1 35 35 GLY N N 35 108.650 108.650 109.216 -0.566 17919 21157 1 52 . 1 1 35 35 GLY C C 35 173.960 173.960 174.437 -0.477 17919 21158 1 52 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.897 0.183 17919 21159 1 52 . 1 1 35 35 GLY H H 35 8.530 8.530 8.065 0.465 17919 21160 1 52 . 1 1 36 36 ILE N N 36 119.880 119.880 121.663 -1.783 17919 21161 1 52 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.343 0.102 17919 21162 1 52 . 1 1 36 36 ILE C C 36 173.590 173.590 174.281 -0.691 17919 21163 1 52 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.937 -0.187 17919 21164 1 52 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.760 1.821 17919 21165 1 52 . 1 1 36 36 ILE H H 36 6.150 6.150 7.691 -1.541 17919 21166 1 52 . 1 1 37 37 PRO HA H 37 4.634 4.634 5.073 -0.439 17919 21167 1 52 . 1 1 37 37 PRO C C 37 176.940 176.940 175.973 0.967 17919 21168 1 52 . 1 1 37 37 PRO CA C 37 61.660 61.660 60.715 0.945 17919 21169 1 52 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.341 0.509 17919 21170 1 52 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.105 0.012 17919 21171 1 52 . 1 1 38 38 PRO C C 38 178.320 178.320 178.554 -0.234 17919 21172 1 52 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.894 0.366 17919 21173 1 52 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.696 1.194 17919 21174 1 52 . 1 1 39 39 ASP N N 39 113.380 113.380 116.326 -2.946 17919 21175 1 52 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.305 0.125 17919 21176 1 52 . 1 1 39 39 ASP C C 39 177.090 177.090 177.450 -0.360 17919 21177 1 52 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.563 -0.923 17919 21178 1 52 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.235 -0.695 17919 21179 1 52 . 1 1 39 39 ASP H H 39 8.550 8.550 8.764 -0.214 17919 21180 1 52 . 1 1 40 40 GLN N N 40 116.780 116.780 115.849 0.931 17919 21181 1 52 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.409 0.055 17919 21182 1 52 . 1 1 40 40 GLN C C 40 175.380 175.380 175.659 -0.279 17919 21183 1 52 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.687 -0.047 17919 21184 1 52 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.316 0.824 17919 21185 1 52 . 1 1 40 40 GLN H H 40 7.820 7.820 8.132 -0.312 17919 21186 1 52 . 1 1 41 41 GLN N N 41 117.720 117.720 119.139 -1.419 17919 21187 1 52 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.726 -0.482 17919 21188 1 52 . 1 1 41 41 GLN C C 41 176.300 176.300 174.497 1.803 17919 21189 1 52 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.150 1.320 17919 21190 1 52 . 1 1 41 41 GLN CB C 41 31.650 31.650 30.337 1.313 17919 21191 1 52 . 1 1 41 41 GLN H H 41 7.480 7.480 7.615 -0.135 17919 21192 1 52 . 1 1 42 42 ARG N N 42 122.680 122.680 122.688 -0.008 17919 21193 1 52 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.769 -0.269 17919 21194 1 52 . 1 1 42 42 ARG C C 42 174.050 174.050 173.974 0.076 17919 21195 1 52 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.385 0.665 17919 21196 1 52 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.494 -1.744 17919 21197 1 52 . 1 1 42 42 ARG H H 42 8.530 8.530 8.317 0.213 17919 21198 1 52 . 1 1 43 43 LEU N N 43 124.040 124.040 122.457 1.583 17919 21199 1 52 . 1 1 43 43 LEU C C 43 175.290 175.290 175.417 -0.127 17919 21200 1 52 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.678 -0.698 17919 21201 1 52 . 1 1 43 43 LEU CB C 43 45.790 45.790 45.078 0.713 17919 21202 1 52 . 1 1 43 43 LEU H H 43 8.820 8.820 8.747 0.073 17919 21203 1 52 . 1 1 44 44 ILE N N 44 121.920 121.920 122.436 -0.516 17919 21204 1 52 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.227 -0.235 17919 21205 1 52 . 1 1 44 44 ILE C C 44 176.060 176.060 174.334 1.726 17919 21206 1 52 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.667 -0.687 17919 21207 1 52 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.565 -0.145 17919 21208 1 52 . 1 1 44 44 ILE H H 44 9.030 9.030 8.320 0.710 17919 21209 1 52 . 1 1 45 45 PHE N N 45 125.390 125.390 128.200 -2.810 17919 21210 1 52 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.972 0.073 17919 21211 1 52 . 1 1 45 45 PHE C C 45 174.470 174.470 174.231 0.239 17919 21212 1 52 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.267 0.752 17919 21213 1 52 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.614 1.146 17919 21214 1 52 . 1 1 45 45 PHE H H 45 8.830 8.830 8.901 -0.071 17919 21215 1 52 . 1 1 46 46 ALA N N 46 132.200 132.200 129.688 2.512 17919 21216 1 52 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.679 0.011 17919 21217 1 52 . 1 1 46 46 ALA C C 46 177.290 177.290 177.284 0.006 17919 21218 1 52 . 1 1 46 46 ALA CA C 46 52.540 52.540 53.075 -0.535 17919 21219 1 52 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.690 -0.120 17919 21220 1 52 . 1 1 46 46 ALA H H 46 8.810 8.810 8.833 -0.023 17919 21221 1 52 . 1 1 47 47 GLY N N 47 102.340 102.340 103.411 -1.071 17919 21222 1 52 . 1 1 47 47 GLY C C 47 173.810 173.810 174.950 -1.140 17919 21223 1 52 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.520 -0.170 17919 21224 1 52 . 1 1 47 47 GLY H H 47 8.130 8.130 8.476 -0.346 17919 21225 1 52 . 1 1 48 48 LYS N N 48 121.570 121.570 122.285 -0.715 17919 21226 1 52 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.290 0.332 17919 21227 1 52 . 1 1 48 48 LYS C C 48 174.700 174.700 175.820 -1.120 17919 21228 1 52 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.737 -1.187 17919 21229 1 52 . 1 1 48 48 LYS CB C 48 34.530 34.530 32.894 1.636 17919 21230 1 52 . 1 1 48 48 LYS H H 48 7.980 7.980 7.981 -0.001 17919 21231 1 52 . 1 1 49 49 GLN N N 49 122.410 122.410 124.753 -2.343 17919 21232 1 52 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.530 0.030 17919 21233 1 52 . 1 1 49 49 GLN C C 49 175.670 175.670 175.313 0.357 17919 21234 1 52 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.954 -0.214 17919 21235 1 52 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.621 -0.621 17919 21236 1 52 . 1 1 49 49 GLN H H 49 8.600 8.600 8.605 -0.005 17919 21237 1 52 . 1 1 50 50 LEU N N 50 125.520 125.520 128.249 -2.729 17919 21238 1 52 . 1 1 50 50 LEU HA H 50 4.090 4.090 3.953 0.137 17919 21239 1 52 . 1 1 50 50 LEU C C 50 176.660 176.660 175.208 1.452 17919 21240 1 52 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.946 0.294 17919 21241 1 52 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.886 -1.316 17919 21242 1 52 . 1 1 50 50 LEU H H 50 8.530 8.530 7.956 0.574 17919 21243 1 52 . 1 1 51 51 GLU N N 51 122.940 122.940 122.896 0.044 17919 21244 1 52 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.637 -0.149 17919 21245 1 52 . 1 1 51 51 GLU C C 51 175.870 175.870 176.175 -0.305 17919 21246 1 52 . 1 1 51 51 GLU CA C 51 55.960 55.960 54.658 1.302 17919 21247 1 52 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.660 -1.091 17919 21248 1 52 . 1 1 51 51 GLU H H 51 8.400 8.400 8.285 0.115 17919 21249 1 52 . 1 1 52 52 ASP N N 52 120.030 120.030 120.622 -0.592 17919 21250 1 52 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.531 -0.172 17919 21251 1 52 . 1 1 52 52 ASP C C 52 177.330 177.330 177.851 -0.521 17919 21252 1 52 . 1 1 52 52 ASP CA C 52 56.960 56.960 56.725 0.235 17919 21253 1 52 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.712 0.138 17919 21254 1 52 . 1 1 52 52 ASP H H 52 8.160 8.160 8.795 -0.635 17919 21255 1 52 . 1 1 53 53 GLY N N 53 106.660 106.660 106.512 0.148 17919 21256 1 52 . 1 1 53 53 GLY C C 53 174.870 174.870 175.000 -0.130 17919 21257 1 52 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.241 -0.071 17919 21258 1 52 . 1 1 53 53 GLY H H 53 9.390 9.390 8.592 0.798 17919 21259 1 52 . 1 1 54 54 ARG N N 54 119.050 119.050 119.650 -0.600 17919 21260 1 52 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.576 0.119 17919 21261 1 52 . 1 1 54 54 ARG C C 54 175.350 175.350 175.510 -0.160 17919 21262 1 52 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.017 0.373 17919 21263 1 52 . 1 1 54 54 ARG CB C 54 32.650 32.650 31.603 1.047 17919 21264 1 52 . 1 1 54 54 ARG H H 54 7.460 7.460 7.530 -0.070 17919 21265 1 52 . 1 1 55 55 THR N N 55 108.400 108.400 110.712 -2.312 17919 21266 1 52 . 1 1 55 55 THR HA H 55 5.240 5.240 5.169 0.071 17919 21267 1 52 . 1 1 55 55 THR C C 55 176.560 176.560 176.202 0.358 17919 21268 1 52 . 1 1 55 55 THR CA C 55 59.690 59.690 59.624 0.066 17919 21269 1 52 . 1 1 55 55 THR CB C 55 72.260 72.260 71.830 0.430 17919 21270 1 52 . 1 1 55 55 THR H H 55 8.730 8.730 9.041 -0.311 17919 21271 1 52 . 1 1 56 56 LEU N N 56 117.920 117.920 121.563 -3.643 17919 21272 1 52 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.933 0.127 17919 21273 1 52 . 1 1 56 56 LEU C C 56 180.810 180.810 178.742 2.068 17919 21274 1 52 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.800 -0.090 17919 21275 1 52 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.562 -1.192 17919 21276 1 52 . 1 1 56 56 LEU H H 56 8.140 8.140 8.235 -0.095 17919 21277 1 52 . 1 1 57 57 SER N N 57 113.330 113.330 114.750 -1.420 17919 21278 1 52 . 1 1 57 57 SER HA H 57 4.370 4.370 4.145 0.225 17919 21279 1 52 . 1 1 57 57 SER C C 57 178.310 178.310 176.789 1.521 17919 21280 1 52 . 1 1 57 57 SER CA C 57 61.080 61.080 62.159 -1.079 17919 21281 1 52 . 1 1 57 57 SER CB C 57 62.530 62.530 62.641 -0.111 17919 21282 1 52 . 1 1 57 57 SER H H 57 8.470 8.470 7.973 0.497 17919 21283 1 52 . 1 1 58 58 ASP N N 58 124.190 124.190 122.239 1.951 17919 21284 1 52 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.238 0.058 17919 21285 1 52 . 1 1 58 58 ASP C C 58 177.400 177.400 177.396 0.004 17919 21286 1 52 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.845 0.335 17919 21287 1 52 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.375 -0.275 17919 21288 1 52 . 1 1 58 58 ASP H H 58 7.930 7.930 7.679 0.251 17919 21289 1 52 . 1 1 59 59 TYR N N 59 115.510 115.510 114.959 0.551 17919 21290 1 52 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.756 -0.086 17919 21291 1 52 . 1 1 59 59 TYR C C 59 174.700 174.700 175.127 -0.427 17919 21292 1 52 . 1 1 59 59 TYR CA C 59 58.250 58.250 55.996 2.254 17919 21293 1 52 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.806 1.264 17919 21294 1 52 . 1 1 59 59 TYR H H 59 7.250 7.250 7.322 -0.072 17919 21295 1 52 . 1 1 60 60 ASN N N 60 115.900 115.900 118.842 -2.942 17919 21296 1 52 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.388 -0.033 17919 21297 1 52 . 1 1 60 60 ASN C C 60 174.340 174.340 174.315 0.025 17919 21298 1 52 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.657 -0.537 17919 21299 1 52 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.644 -0.234 17919 21300 1 52 . 1 1 60 60 ASN H H 60 8.150 8.150 8.136 0.014 17919 21301 1 52 . 1 1 61 61 ILE N N 61 118.600 118.600 120.149 -1.549 17919 21302 1 52 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.965 -0.572 17919 21303 1 52 . 1 1 61 61 ILE C C 61 174.610 174.610 175.031 -0.421 17919 21304 1 52 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.084 0.336 17919 21305 1 52 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.240 -0.500 17919 21306 1 52 . 1 1 61 61 ILE H H 61 7.250 7.250 8.415 -1.165 17919 21307 1 52 . 1 1 62 62 GLN N N 62 124.740 124.740 127.653 -2.913 17919 21308 1 52 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.696 -0.190 17919 21309 1 52 . 1 1 62 62 GLN C C 62 175.970 175.970 175.448 0.522 17919 21310 1 52 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.664 -0.004 17919 21311 1 52 . 1 1 62 62 GLN CB C 62 31.650 31.650 30.763 0.887 17919 21312 1 52 . 1 1 62 62 GLN H H 62 7.610 7.610 8.090 -0.480 17919 21313 1 52 . 1 1 63 63 LYS N N 63 120.300 120.300 119.243 1.057 17919 21314 1 52 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.910 0.091 17919 21315 1 52 . 1 1 63 63 LYS C C 63 175.810 175.810 176.344 -0.534 17919 21316 1 52 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.015 -0.225 17919 21317 1 52 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.054 0.596 17919 21318 1 52 . 1 1 63 63 LYS H H 63 8.490 8.490 8.408 0.082 17919 21319 1 52 . 1 1 64 64 GLU N N 64 113.950 113.950 118.363 -4.413 17919 21320 1 52 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.716 -0.251 17919 21321 1 52 . 1 1 64 64 GLU C C 64 175.250 175.250 175.792 -0.542 17919 21322 1 52 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.377 0.513 17919 21323 1 52 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.253 -2.353 17919 21324 1 52 . 1 1 64 64 GLU H H 64 9.280 9.280 8.677 0.603 17919 21325 1 52 . 1 1 65 65 SER N N 65 114.730 114.730 114.808 -0.078 17919 21326 1 52 . 1 1 65 65 SER HA H 65 4.640 4.640 4.515 0.125 17919 21327 1 52 . 1 1 65 65 SER C C 65 172.160 172.160 173.985 -1.825 17919 21328 1 52 . 1 1 65 65 SER CA C 65 60.890 60.890 59.971 0.919 17919 21329 1 52 . 1 1 65 65 SER CB C 65 64.910 64.910 63.883 1.027 17919 21330 1 52 . 1 1 65 65 SER H H 65 7.670 7.670 7.337 0.333 17919 21331 1 52 . 1 1 66 66 THR N N 66 117.110 117.110 118.219 -1.109 17919 21332 1 52 . 1 1 66 66 THR HA H 66 5.270 5.270 5.012 0.258 17919 21333 1 52 . 1 1 66 66 THR C C 66 173.950 173.950 174.006 -0.056 17919 21334 1 52 . 1 1 66 66 THR CA C 66 62.340 62.340 61.901 0.439 17919 21335 1 52 . 1 1 66 66 THR CB C 66 70.080 70.080 69.746 0.334 17919 21336 1 52 . 1 1 66 66 THR H H 66 8.730 8.730 8.355 0.375 17919 21337 1 52 . 1 1 67 67 LEU N N 67 127.110 127.110 127.630 -0.520 17919 21338 1 52 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.433 0.627 17919 21339 1 52 . 1 1 67 67 LEU C C 67 175.770 175.770 175.486 0.284 17919 21340 1 52 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.435 0.465 17919 21341 1 52 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.318 -0.058 17919 21342 1 52 . 1 1 67 67 LEU H H 67 9.410 9.410 9.025 0.385 17919 21343 1 52 . 1 1 68 68 HIS N N 68 118.380 118.380 122.371 -3.991 17919 21344 1 52 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.225 0.015 17919 21345 1 52 . 1 1 68 68 HIS C C 68 173.150 173.150 174.599 -1.449 17919 21346 1 52 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.413 0.587 17919 21347 1 52 . 1 1 68 68 HIS CB C 68 30.530 30.530 29.374 1.156 17919 21348 1 52 . 1 1 68 68 HIS H H 68 9.230 9.230 8.183 1.047 17919 21349 1 52 . 1 1 69 69 LEU N N 69 124.460 124.460 128.861 -4.401 17919 21350 1 52 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.797 0.393 17919 21351 1 52 . 1 1 69 69 LEU C C 69 175.270 175.270 174.705 0.565 17919 21352 1 52 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.755 -0.866 17919 21353 1 52 . 1 1 69 69 LEU CB C 69 44.380 44.380 42.925 1.456 17919 21354 1 52 . 1 1 69 69 LEU H H 69 8.340 8.340 8.442 -0.102 17919 21355 1 52 . 1 1 70 70 VAL N N 70 126.940 126.940 127.919 -0.979 17919 21356 1 52 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.441 -0.091 17919 21357 1 52 . 1 1 70 70 VAL C C 70 174.000 174.000 174.679 -0.679 17919 21358 1 52 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.398 0.402 17919 21359 1 52 . 1 1 70 70 VAL CB C 70 34.910 34.910 34.421 0.489 17919 21360 1 52 . 1 1 70 70 VAL H H 70 9.200 9.200 8.694 0.506 17919 21361 1 52 . 1 1 71 71 LEU N N 71 123.130 123.130 126.862 -3.732 17919 21362 1 52 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.966 0.094 17919 21363 1 52 . 1 1 71 71 LEU C C 71 177.830 177.830 177.305 0.525 17919 21364 1 52 . 1 1 71 71 LEU CA C 71 53.940 53.940 54.545 -0.605 17919 21365 1 52 . 1 1 71 71 LEU CB C 71 42.850 42.850 41.969 0.881 17919 21366 1 52 . 1 1 71 71 LEU H H 71 8.120 8.120 8.442 -0.322 17919 21367 1 52 . 1 1 72 72 ARG N N 72 123.490 123.490 121.971 1.519 17919 21368 1 52 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.628 -0.327 17919 21369 1 52 . 1 1 72 72 ARG C C 72 175.350 175.350 175.898 -0.548 17919 21370 1 52 . 1 1 72 72 ARG CA C 72 55.610 55.610 54.102 1.508 17919 21371 1 52 . 1 1 72 72 ARG CB C 72 31.350 31.350 32.018 -0.668 17919 21372 1 52 . 1 1 72 72 ARG H H 72 8.580 8.580 8.103 0.477 17919 21373 1 53 . 1 1 2 2 GLN N N 2 123.220 123.220 122.634 0.586 17919 21374 1 53 . 1 1 2 2 GLN HA H 2 5.249 5.249 4.952 0.297 17919 21375 1 53 . 1 1 2 2 GLN C C 2 175.920 175.920 175.158 0.762 17919 21376 1 53 . 1 1 2 2 GLN CA C 2 55.080 55.080 55.849 -0.769 17919 21377 1 53 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.147 0.613 17919 21378 1 53 . 1 1 2 2 GLN H H 2 8.900 8.900 8.762 0.138 17919 21379 1 53 . 1 1 3 3 ILE N N 3 115.340 115.340 116.257 -0.917 17919 21380 1 53 . 1 1 3 3 ILE HA H 3 4.213 4.213 3.740 0.473 17919 21381 1 53 . 1 1 3 3 ILE C C 3 172.450 172.450 172.748 -0.298 17919 21382 1 53 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.568 0.002 17919 21383 1 53 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.153 1.057 17919 21384 1 53 . 1 1 3 3 ILE H H 3 8.320 8.320 7.479 0.841 17919 21385 1 53 . 1 1 4 4 PHE N N 4 118.110 118.110 118.201 -0.091 17919 21386 1 53 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.154 0.476 17919 21387 1 53 . 1 1 4 4 PHE C C 4 175.320 175.320 174.735 0.585 17919 21388 1 53 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.645 -0.435 17919 21389 1 53 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.161 -0.681 17919 21390 1 53 . 1 1 4 4 PHE H H 4 8.610 8.610 7.505 1.105 17919 21391 1 53 . 1 1 5 5 VAL N N 5 121.000 121.000 120.952 0.048 17919 21392 1 53 . 1 1 5 5 VAL HA H 5 4.725 4.725 5.051 -0.326 17919 21393 1 53 . 1 1 5 5 VAL C C 5 174.870 174.870 175.719 -0.849 17919 21394 1 53 . 1 1 5 5 VAL CA C 5 60.620 60.620 60.876 -0.256 17919 21395 1 53 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.466 -0.236 17919 21396 1 53 . 1 1 5 5 VAL H H 5 9.300 9.300 8.720 0.580 17919 21397 1 53 . 1 1 6 6 LYS N N 6 127.520 127.520 126.634 0.886 17919 21398 1 53 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.141 0.226 17919 21399 1 53 . 1 1 6 6 LYS C C 6 177.140 177.140 176.964 0.176 17919 21400 1 53 . 1 1 6 6 LYS CA C 6 54.520 54.520 53.453 1.067 17919 21401 1 53 . 1 1 6 6 LYS CB C 6 35.050 35.050 33.458 1.593 17919 21402 1 53 . 1 1 6 6 LYS H H 6 8.820 8.820 8.750 0.070 17919 21403 1 53 . 1 1 7 7 THR N N 7 115.400 115.400 117.738 -2.338 17919 21404 1 53 . 1 1 7 7 THR HA H 7 4.970 4.970 4.309 0.661 17919 21405 1 53 . 1 1 7 7 THR C C 7 176.910 176.910 176.491 0.419 17919 21406 1 53 . 1 1 7 7 THR CA C 7 60.470 60.470 61.606 -1.136 17919 21407 1 53 . 1 1 7 7 THR CB C 7 70.630 70.630 69.637 0.993 17919 21408 1 53 . 1 1 7 7 THR H H 7 8.730 8.730 8.561 0.169 17919 21409 1 53 . 1 1 8 8 LEU N N 8 121.330 121.330 121.317 0.013 17919 21410 1 53 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.215 0.095 17919 21411 1 53 . 1 1 8 8 LEU C C 8 178.800 178.800 177.291 1.509 17919 21412 1 53 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.619 -0.039 17919 21413 1 53 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.273 0.697 17919 21414 1 53 . 1 1 8 8 LEU H H 8 9.100 9.100 8.659 0.441 17919 21415 1 53 . 1 1 9 9 THR N N 9 105.590 105.590 106.546 -0.956 17919 21416 1 53 . 1 1 9 9 THR HA H 9 4.428 4.428 4.355 0.073 17919 21417 1 53 . 1 1 9 9 THR C C 9 175.520 175.520 175.445 0.075 17919 21418 1 53 . 1 1 9 9 THR CA C 9 61.400 61.400 61.549 -0.149 17919 21419 1 53 . 1 1 9 9 THR CB C 9 69.140 69.140 69.449 -0.309 17919 21420 1 53 . 1 1 9 9 THR H H 9 7.630 7.630 7.542 0.088 17919 21421 1 53 . 1 1 10 10 GLY N N 10 108.890 108.890 111.260 -2.370 17919 21422 1 53 . 1 1 10 10 GLY C C 10 174.070 174.070 173.558 0.512 17919 21423 1 53 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.801 0.659 17919 21424 1 53 . 1 1 10 10 GLY H H 10 7.810 7.810 8.080 -0.270 17919 21425 1 53 . 1 1 11 11 LYS N N 11 121.600 121.600 121.640 -0.040 17919 21426 1 53 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.186 0.175 17919 21427 1 53 . 1 1 11 11 LYS C C 11 175.940 175.940 176.020 -0.080 17919 21428 1 53 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.581 -0.301 17919 21429 1 53 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.227 -0.027 17919 21430 1 53 . 1 1 11 11 LYS H H 11 7.280 7.280 7.671 -0.391 17919 21431 1 53 . 1 1 12 12 THR N N 12 120.440 120.440 122.507 -2.067 17919 21432 1 53 . 1 1 12 12 THR HA H 12 5.046 5.046 4.555 0.491 17919 21433 1 53 . 1 1 12 12 THR C C 12 174.320 174.320 174.371 -0.051 17919 21434 1 53 . 1 1 12 12 THR CA C 12 62.390 62.390 63.081 -0.691 17919 21435 1 53 . 1 1 12 12 THR CB C 12 69.910 69.910 69.399 0.511 17919 21436 1 53 . 1 1 12 12 THR H H 12 8.650 8.650 8.356 0.294 17919 21437 1 53 . 1 1 13 13 ILE N N 13 127.110 127.110 129.570 -2.460 17919 21438 1 53 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.452 0.092 17919 21439 1 53 . 1 1 13 13 ILE C C 13 175.220 175.220 175.313 -0.093 17919 21440 1 53 . 1 1 13 13 ILE CA C 13 59.980 59.980 57.929 2.051 17919 21441 1 53 . 1 1 13 13 ILE CB C 13 40.950 40.950 36.116 4.834 17919 21442 1 53 . 1 1 13 13 ILE H H 13 9.450 9.450 9.333 0.117 17919 21443 1 53 . 1 1 14 14 THR N N 14 121.520 121.520 123.975 -2.455 17919 21444 1 53 . 1 1 14 14 THR HA H 14 4.964 4.964 4.498 0.466 17919 21445 1 53 . 1 1 14 14 THR C C 14 173.790 173.790 174.178 -0.388 17919 21446 1 53 . 1 1 14 14 THR CA C 14 61.940 61.940 63.801 -1.861 17919 21447 1 53 . 1 1 14 14 THR CB C 14 69.650 69.650 69.429 0.221 17919 21448 1 53 . 1 1 14 14 THR H H 14 8.710 8.710 8.500 0.210 17919 21449 1 53 . 1 1 15 15 LEU N N 15 124.800 124.800 127.676 -2.876 17919 21450 1 53 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.672 0.108 17919 21451 1 53 . 1 1 15 15 LEU C C 15 174.670 174.670 175.554 -0.884 17919 21452 1 53 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.725 -0.895 17919 21453 1 53 . 1 1 15 15 LEU CB C 15 47.070 47.070 44.364 2.706 17919 21454 1 53 . 1 1 15 15 LEU H H 15 8.710 8.710 8.233 0.477 17919 21455 1 53 . 1 1 16 16 GLU N N 16 122.160 122.160 124.228 -2.068 17919 21456 1 53 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.505 0.412 17919 21457 1 53 . 1 1 16 16 GLU C C 16 175.860 175.860 175.670 0.190 17919 21458 1 53 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.468 -0.648 17919 21459 1 53 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.773 -1.323 17919 21460 1 53 . 1 1 16 16 GLU H H 16 8.140 8.140 8.660 -0.520 17919 21461 1 53 . 1 1 17 17 VAL N N 17 117.210 117.210 120.542 -3.332 17919 21462 1 53 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.575 0.139 17919 21463 1 53 . 1 1 17 17 VAL C C 17 174.160 174.160 174.278 -0.118 17919 21464 1 53 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.898 -0.468 17919 21465 1 53 . 1 1 17 17 VAL CB C 17 36.400 36.400 34.659 1.741 17919 21466 1 53 . 1 1 17 17 VAL H H 17 8.900 8.900 8.875 0.025 17919 21467 1 53 . 1 1 18 18 GLU N N 18 118.990 118.990 122.122 -3.132 17919 21468 1 53 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.786 0.293 17919 21469 1 53 . 1 1 18 18 GLU C C 18 176.160 176.160 175.771 0.389 17919 21470 1 53 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.844 -0.124 17919 21471 1 53 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.155 0.155 17919 21472 1 53 . 1 1 18 18 GLU H H 18 8.640 8.640 8.169 0.471 17919 21473 1 53 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.140 0.001 17919 21474 1 53 . 1 1 19 19 PRO C C 19 175.310 175.310 177.872 -2.562 17919 21475 1 53 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.949 -0.479 17919 21476 1 53 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.055 -0.105 17919 21477 1 53 . 1 1 20 20 SER N N 20 103.400 103.400 108.350 -4.950 17919 21478 1 53 . 1 1 20 20 SER HA H 20 4.370 4.370 4.239 0.131 17919 21479 1 53 . 1 1 20 20 SER C C 20 174.660 174.660 174.265 0.395 17919 21480 1 53 . 1 1 20 20 SER CA C 20 57.400 57.400 58.948 -1.548 17919 21481 1 53 . 1 1 20 20 SER CB C 20 63.370 63.370 62.666 0.704 17919 21482 1 53 . 1 1 20 20 SER H H 20 7.040 7.040 8.053 -1.013 17919 21483 1 53 . 1 1 21 21 ASP N N 21 123.480 123.480 123.859 -0.379 17919 21484 1 53 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.581 0.114 17919 21485 1 53 . 1 1 21 21 ASP C C 21 176.360 176.360 175.854 0.506 17919 21486 1 53 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.132 0.568 17919 21487 1 53 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.727 -0.927 17919 21488 1 53 . 1 1 21 21 ASP H H 21 8.030 8.030 7.489 0.541 17919 21489 1 53 . 1 1 22 22 THR N N 22 108.800 108.800 112.819 -4.019 17919 21490 1 53 . 1 1 22 22 THR HA H 22 4.920 4.920 4.999 -0.079 17919 21491 1 53 . 1 1 22 22 THR C C 22 176.750 176.750 175.880 0.870 17919 21492 1 53 . 1 1 22 22 THR CA C 22 59.690 59.690 60.389 -0.699 17919 21493 1 53 . 1 1 22 22 THR CB C 22 71.200 71.200 70.918 0.282 17919 21494 1 53 . 1 1 22 22 THR H H 22 7.900 7.900 8.236 -0.336 17919 21495 1 53 . 1 1 23 23 ILE N N 23 121.190 121.190 121.461 -0.271 17919 21496 1 53 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.891 -0.234 17919 21497 1 53 . 1 1 23 23 ILE C C 23 179.040 179.040 177.662 1.378 17919 21498 1 53 . 1 1 23 23 ILE CA C 23 62.260 62.260 61.940 0.320 17919 21499 1 53 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.465 -2.115 17919 21500 1 53 . 1 1 23 23 ILE H H 23 8.560 8.560 8.689 -0.129 17919 21501 1 53 . 1 1 24 24 GLU N N 24 120.830 120.830 120.259 0.571 17919 21502 1 53 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.916 0.001 17919 21503 1 53 . 1 1 24 24 GLU C C 24 178.640 178.640 178.695 -0.055 17919 21504 1 53 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.578 0.642 17919 21505 1 53 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.482 -1.202 17919 21506 1 53 . 1 1 24 24 GLU H H 24 9.760 9.760 8.270 1.490 17919 21507 1 53 . 1 1 25 25 ASN N N 25 120.570 120.570 117.708 2.862 17919 21508 1 53 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.500 0.025 17919 21509 1 53 . 1 1 25 25 ASN C C 25 178.380 178.380 177.918 0.462 17919 21510 1 53 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.955 0.105 17919 21511 1 53 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.548 -0.098 17919 21512 1 53 . 1 1 25 25 ASN H H 25 7.920 7.920 7.690 0.230 17919 21513 1 53 . 1 1 26 26 VAL N N 26 121.710 121.710 120.208 1.502 17919 21514 1 53 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.752 -0.355 17919 21515 1 53 . 1 1 26 26 VAL C C 26 177.950 177.950 176.933 1.017 17919 21516 1 53 . 1 1 26 26 VAL CA C 26 67.660 67.660 64.379 3.281 17919 21517 1 53 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.871 -1.031 17919 21518 1 53 . 1 1 26 26 VAL H H 26 8.070 8.070 7.688 0.382 17919 21519 1 53 . 1 1 27 27 LYS N N 27 118.860 118.860 120.360 -1.500 17919 21520 1 53 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.241 0.339 17919 21521 1 53 . 1 1 27 27 LYS C C 27 180.550 180.550 178.699 1.851 17919 21522 1 53 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.481 -0.231 17919 21523 1 53 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.234 1.496 17919 21524 1 53 . 1 1 27 27 LYS H H 27 8.560 8.560 7.849 0.711 17919 21525 1 53 . 1 1 28 28 ALA N N 28 123.440 123.440 120.569 2.871 17919 21526 1 53 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.119 0.041 17919 21527 1 53 . 1 1 28 28 ALA C C 28 180.300 180.300 178.656 1.644 17919 21528 1 53 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.437 0.933 17919 21529 1 53 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.256 -0.546 17919 21530 1 53 . 1 1 28 28 ALA H H 28 8.060 8.060 7.893 0.167 17919 21531 1 53 . 1 1 29 29 LYS N N 29 119.940 119.940 118.929 1.011 17919 21532 1 53 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.101 0.106 17919 21533 1 53 . 1 1 29 29 LYS C C 29 180.320 180.320 178.926 1.394 17919 21534 1 53 . 1 1 29 29 LYS CA C 29 59.650 59.650 58.983 0.667 17919 21535 1 53 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.534 0.756 17919 21536 1 53 . 1 1 29 29 LYS H H 29 7.850 7.850 7.589 0.261 17919 21537 1 53 . 1 1 30 30 ILE N N 30 121.080 121.080 120.092 0.988 17919 21538 1 53 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.675 -0.168 17919 21539 1 53 . 1 1 30 30 ILE C C 30 178.310 178.310 177.731 0.579 17919 21540 1 53 . 1 1 30 30 ILE CA C 30 66.150 66.150 64.841 1.309 17919 21541 1 53 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.124 -0.324 17919 21542 1 53 . 1 1 30 30 ILE H H 30 8.280 8.280 7.819 0.461 17919 21543 1 53 . 1 1 31 31 GLN N N 31 123.490 123.490 120.185 3.305 17919 21544 1 53 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.061 -0.232 17919 21545 1 53 . 1 1 31 31 GLN C C 31 178.890 178.890 178.251 0.639 17919 21546 1 53 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.253 0.747 17919 21547 1 53 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.395 -0.675 17919 21548 1 53 . 1 1 31 31 GLN H H 31 8.580 8.580 8.189 0.391 17919 21549 1 53 . 1 1 32 32 ASP N N 32 119.360 119.360 119.061 0.299 17919 21550 1 53 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.436 -0.082 17919 21551 1 53 . 1 1 32 32 ASP C C 32 177.250 177.250 177.200 0.050 17919 21552 1 53 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.666 0.524 17919 21553 1 53 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.537 0.043 17919 21554 1 53 . 1 1 32 32 ASP H H 32 8.010 8.010 7.929 0.081 17919 21555 1 53 . 1 1 33 33 LYS N N 33 115.130 115.130 117.634 -2.504 17919 21556 1 53 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.426 -0.089 17919 21557 1 53 . 1 1 33 33 LYS C C 33 177.870 177.870 178.106 -0.236 17919 21558 1 53 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.487 0.562 17919 21559 1 53 . 1 1 33 33 LYS CB C 33 34.170 34.170 34.529 -0.359 17919 21560 1 53 . 1 1 33 33 LYS H H 33 7.430 7.430 7.321 0.109 17919 21561 1 53 . 1 1 34 34 GLU N N 34 113.870 113.870 116.887 -3.017 17919 21562 1 53 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.380 0.245 17919 21563 1 53 . 1 1 34 34 GLU C C 34 177.840 177.840 177.520 0.320 17919 21564 1 53 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.617 -0.447 17919 21565 1 53 . 1 1 34 34 GLU CB C 34 32.660 32.660 30.138 2.522 17919 21566 1 53 . 1 1 34 34 GLU H H 34 8.740 8.740 8.366 0.374 17919 21567 1 53 . 1 1 35 35 GLY N N 35 108.650 108.650 109.252 -0.602 17919 21568 1 53 . 1 1 35 35 GLY C C 35 173.960 173.960 174.070 -0.110 17919 21569 1 53 . 1 1 35 35 GLY CA C 35 46.080 46.080 46.135 -0.055 17919 21570 1 53 . 1 1 35 35 GLY H H 35 8.530 8.530 7.874 0.656 17919 21571 1 53 . 1 1 36 36 ILE N N 36 119.880 119.880 121.861 -1.981 17919 21572 1 53 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.392 0.053 17919 21573 1 53 . 1 1 36 36 ILE C C 36 173.590 173.590 174.374 -0.784 17919 21574 1 53 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.681 0.069 17919 21575 1 53 . 1 1 36 36 ILE CB C 36 40.580 40.580 39.592 0.988 17919 21576 1 53 . 1 1 36 36 ILE H H 36 6.150 6.150 7.777 -1.627 17919 21577 1 53 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.871 -0.237 17919 21578 1 53 . 1 1 37 37 PRO C C 37 176.940 176.940 176.147 0.793 17919 21579 1 53 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.057 0.603 17919 21580 1 53 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.110 0.740 17919 21581 1 53 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.091 0.026 17919 21582 1 53 . 1 1 38 38 PRO C C 38 178.320 178.320 177.973 0.347 17919 21583 1 53 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.886 0.374 17919 21584 1 53 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.608 1.282 17919 21585 1 53 . 1 1 39 39 ASP N N 39 113.380 113.380 115.108 -1.728 17919 21586 1 53 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.341 0.089 17919 21587 1 53 . 1 1 39 39 ASP C C 39 177.090 177.090 177.247 -0.157 17919 21588 1 53 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.624 -0.985 17919 21589 1 53 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.218 -0.678 17919 21590 1 53 . 1 1 39 39 ASP H H 39 8.550 8.550 8.665 -0.115 17919 21591 1 53 . 1 1 40 40 GLN N N 40 116.780 116.780 116.254 0.526 17919 21592 1 53 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.536 -0.072 17919 21593 1 53 . 1 1 40 40 GLN C C 40 175.380 175.380 175.935 -0.555 17919 21594 1 53 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.204 0.436 17919 21595 1 53 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.611 0.529 17919 21596 1 53 . 1 1 40 40 GLN H H 40 7.820 7.820 7.952 -0.132 17919 21597 1 53 . 1 1 41 41 GLN N N 41 117.720 117.720 119.924 -2.204 17919 21598 1 53 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.399 -0.155 17919 21599 1 53 . 1 1 41 41 GLN C C 41 176.300 176.300 175.154 1.146 17919 21600 1 53 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.237 0.233 17919 21601 1 53 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.816 1.834 17919 21602 1 53 . 1 1 41 41 GLN H H 41 7.480 7.480 7.423 0.057 17919 21603 1 53 . 1 1 42 42 ARG N N 42 122.680 122.680 122.960 -0.280 17919 21604 1 53 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.626 -0.126 17919 21605 1 53 . 1 1 42 42 ARG C C 42 174.050 174.050 174.471 -0.421 17919 21606 1 53 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.788 0.262 17919 21607 1 53 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.403 -1.653 17919 21608 1 53 . 1 1 42 42 ARG H H 42 8.530 8.530 8.248 0.282 17919 21609 1 53 . 1 1 43 43 LEU N N 43 124.040 124.040 124.461 -0.421 17919 21610 1 53 . 1 1 43 43 LEU C C 43 175.290 175.290 175.870 -0.580 17919 21611 1 53 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.623 -0.643 17919 21612 1 53 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.793 0.997 17919 21613 1 53 . 1 1 43 43 LEU H H 43 8.820 8.820 8.758 0.062 17919 21614 1 53 . 1 1 44 44 ILE N N 44 121.920 121.920 117.751 4.169 17919 21615 1 53 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.203 -0.211 17919 21616 1 53 . 1 1 44 44 ILE C C 44 176.060 176.060 173.559 2.501 17919 21617 1 53 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.799 -0.819 17919 21618 1 53 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.520 -0.101 17919 21619 1 53 . 1 1 44 44 ILE H H 44 9.030 9.030 9.059 -0.029 17919 21620 1 53 . 1 1 45 45 PHE N N 45 125.390 125.390 128.059 -2.669 17919 21621 1 53 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.128 -0.083 17919 21622 1 53 . 1 1 45 45 PHE C C 45 174.470 174.470 174.440 0.030 17919 21623 1 53 . 1 1 45 45 PHE CA C 45 57.020 57.020 57.018 0.002 17919 21624 1 53 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.795 0.965 17919 21625 1 53 . 1 1 45 45 PHE H H 45 8.830 8.830 8.197 0.633 17919 21626 1 53 . 1 1 46 46 ALA N N 46 132.200 132.200 128.215 3.985 17919 21627 1 53 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.561 0.129 17919 21628 1 53 . 1 1 46 46 ALA C C 46 177.290 177.290 177.409 -0.119 17919 21629 1 53 . 1 1 46 46 ALA CA C 46 52.540 52.540 53.334 -0.793 17919 21630 1 53 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.892 -0.322 17919 21631 1 53 . 1 1 46 46 ALA H H 46 8.810 8.810 8.832 -0.022 17919 21632 1 53 . 1 1 47 47 GLY N N 47 102.340 102.340 103.221 -0.881 17919 21633 1 53 . 1 1 47 47 GLY C C 47 173.810 173.810 174.518 -0.708 17919 21634 1 53 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.410 -0.061 17919 21635 1 53 . 1 1 47 47 GLY H H 47 8.130 8.130 8.578 -0.448 17919 21636 1 53 . 1 1 48 48 LYS N N 48 121.570 121.570 121.360 0.210 17919 21637 1 53 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.579 0.043 17919 21638 1 53 . 1 1 48 48 LYS C C 48 174.700 174.700 175.284 -0.584 17919 21639 1 53 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.764 -0.214 17919 21640 1 53 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.337 0.193 17919 21641 1 53 . 1 1 48 48 LYS H H 48 7.980 7.980 8.047 -0.067 17919 21642 1 53 . 1 1 49 49 GLN N N 49 122.410 122.410 124.612 -2.202 17919 21643 1 53 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.590 -0.029 17919 21644 1 53 . 1 1 49 49 GLN C C 49 175.670 175.670 175.936 -0.266 17919 21645 1 53 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.675 0.065 17919 21646 1 53 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.397 -0.397 17919 21647 1 53 . 1 1 49 49 GLN H H 49 8.600 8.600 8.585 0.015 17919 21648 1 53 . 1 1 50 50 LEU N N 50 125.520 125.520 130.095 -4.575 17919 21649 1 53 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.262 -0.172 17919 21650 1 53 . 1 1 50 50 LEU C C 50 176.660 176.660 176.589 0.071 17919 21651 1 53 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.386 -0.146 17919 21652 1 53 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.131 0.439 17919 21653 1 53 . 1 1 50 50 LEU H H 50 8.530 8.530 8.112 0.418 17919 21654 1 53 . 1 1 51 51 GLU N N 51 122.940 122.940 124.282 -1.342 17919 21655 1 53 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.248 0.240 17919 21656 1 53 . 1 1 51 51 GLU C C 51 175.870 175.870 176.720 -0.850 17919 21657 1 53 . 1 1 51 51 GLU CA C 51 55.960 55.960 56.495 -0.535 17919 21658 1 53 . 1 1 51 51 GLU CB C 51 31.570 31.570 30.569 1.001 17919 21659 1 53 . 1 1 51 51 GLU H H 51 8.400 8.400 8.398 0.002 17919 21660 1 53 . 1 1 52 52 ASP N N 52 120.030 120.030 124.242 -4.212 17919 21661 1 53 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.400 -0.041 17919 21662 1 53 . 1 1 52 52 ASP C C 52 177.330 177.330 178.556 -1.226 17919 21663 1 53 . 1 1 52 52 ASP CA C 52 56.960 56.960 58.005 -1.045 17919 21664 1 53 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.670 0.179 17919 21665 1 53 . 1 1 52 52 ASP H H 52 8.160 8.160 8.800 -0.640 17919 21666 1 53 . 1 1 53 53 GLY N N 53 106.660 106.660 105.769 0.891 17919 21667 1 53 . 1 1 53 53 GLY C C 53 174.870 174.870 174.485 0.385 17919 21668 1 53 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.240 -0.071 17919 21669 1 53 . 1 1 53 53 GLY H H 53 9.390 9.390 8.478 0.912 17919 21670 1 53 . 1 1 54 54 ARG N N 54 119.050 119.050 119.497 -0.447 17919 21671 1 53 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.446 0.249 17919 21672 1 53 . 1 1 54 54 ARG C C 54 175.350 175.350 175.319 0.031 17919 21673 1 53 . 1 1 54 54 ARG CA C 54 54.390 54.390 55.365 -0.975 17919 21674 1 53 . 1 1 54 54 ARG CB C 54 32.650 32.650 31.836 0.814 17919 21675 1 53 . 1 1 54 54 ARG H H 54 7.460 7.460 7.534 -0.074 17919 21676 1 53 . 1 1 55 55 THR N N 55 108.400 108.400 110.916 -2.516 17919 21677 1 53 . 1 1 55 55 THR HA H 55 5.240 5.240 5.141 0.099 17919 21678 1 53 . 1 1 55 55 THR C C 55 176.560 176.560 176.305 0.255 17919 21679 1 53 . 1 1 55 55 THR CA C 55 59.690 59.690 59.785 -0.095 17919 21680 1 53 . 1 1 55 55 THR CB C 55 72.260 72.260 71.340 0.920 17919 21681 1 53 . 1 1 55 55 THR H H 55 8.730 8.730 8.091 0.639 17919 21682 1 53 . 1 1 56 56 LEU N N 56 117.920 117.920 121.349 -3.429 17919 21683 1 53 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.184 -0.124 17919 21684 1 53 . 1 1 56 56 LEU C C 56 180.810 180.810 178.721 2.089 17919 21685 1 53 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.472 0.238 17919 21686 1 53 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.401 -1.031 17919 21687 1 53 . 1 1 56 56 LEU H H 56 8.140 8.140 8.245 -0.105 17919 21688 1 53 . 1 1 57 57 SER N N 57 113.330 113.330 113.298 0.032 17919 21689 1 53 . 1 1 57 57 SER HA H 57 4.370 4.370 4.121 0.249 17919 21690 1 53 . 1 1 57 57 SER C C 57 178.310 178.310 176.631 1.679 17919 21691 1 53 . 1 1 57 57 SER CA C 57 61.080 61.080 61.252 -0.172 17919 21692 1 53 . 1 1 57 57 SER CB C 57 62.530 62.530 62.641 -0.111 17919 21693 1 53 . 1 1 57 57 SER H H 57 8.470 8.470 7.917 0.553 17919 21694 1 53 . 1 1 58 58 ASP N N 58 124.190 124.190 123.682 0.508 17919 21695 1 53 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.205 0.091 17919 21696 1 53 . 1 1 58 58 ASP C C 58 177.400 177.400 177.134 0.266 17919 21697 1 53 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.425 0.756 17919 21698 1 53 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.285 -0.185 17919 21699 1 53 . 1 1 58 58 ASP H H 58 7.930 7.930 7.901 0.029 17919 21700 1 53 . 1 1 59 59 TYR N N 59 115.510 115.510 115.892 -0.382 17919 21701 1 53 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.600 0.070 17919 21702 1 53 . 1 1 59 59 TYR C C 59 174.700 174.700 175.263 -0.563 17919 21703 1 53 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.971 0.279 17919 21704 1 53 . 1 1 59 59 TYR CB C 59 40.070 40.070 39.273 0.797 17919 21705 1 53 . 1 1 59 59 TYR H H 59 7.250 7.250 7.310 -0.060 17919 21706 1 53 . 1 1 60 60 ASN N N 60 115.900 115.900 116.171 -0.271 17919 21707 1 53 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.396 -0.041 17919 21708 1 53 . 1 1 60 60 ASN C C 60 174.340 174.340 174.793 -0.453 17919 21709 1 53 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.422 -0.302 17919 21710 1 53 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.588 -0.178 17919 21711 1 53 . 1 1 60 60 ASN H H 60 8.150 8.150 7.799 0.351 17919 21712 1 53 . 1 1 61 61 ILE N N 61 118.600 118.600 120.152 -1.552 17919 21713 1 53 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.978 -0.585 17919 21714 1 53 . 1 1 61 61 ILE C C 61 174.610 174.610 175.341 -0.731 17919 21715 1 53 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.424 -0.004 17919 21716 1 53 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.758 -1.018 17919 21717 1 53 . 1 1 61 61 ILE H H 61 7.250 7.250 7.791 -0.541 17919 21718 1 53 . 1 1 62 62 GLN N N 62 124.740 124.740 126.623 -1.883 17919 21719 1 53 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.732 -0.226 17919 21720 1 53 . 1 1 62 62 GLN C C 62 175.970 175.970 175.703 0.267 17919 21721 1 53 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.552 0.108 17919 21722 1 53 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.212 0.438 17919 21723 1 53 . 1 1 62 62 GLN H H 62 7.610 7.610 8.287 -0.677 17919 21724 1 53 . 1 1 63 63 LYS N N 63 120.300 120.300 119.955 0.345 17919 21725 1 53 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.019 -0.018 17919 21726 1 53 . 1 1 63 63 LYS C C 63 175.810 175.810 176.663 -0.853 17919 21727 1 53 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.933 -0.143 17919 21728 1 53 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.717 0.933 17919 21729 1 53 . 1 1 63 63 LYS H H 63 8.490 8.490 8.532 -0.042 17919 21730 1 53 . 1 1 64 64 GLU N N 64 113.950 113.950 118.130 -4.180 17919 21731 1 53 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.516 -0.051 17919 21732 1 53 . 1 1 64 64 GLU C C 64 175.250 175.250 175.519 -0.269 17919 21733 1 53 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.810 0.080 17919 21734 1 53 . 1 1 64 64 GLU CB C 64 25.900 25.900 27.939 -2.038 17919 21735 1 53 . 1 1 64 64 GLU H H 64 9.280 9.280 8.780 0.500 17919 21736 1 53 . 1 1 65 65 SER N N 65 114.730 114.730 114.666 0.064 17919 21737 1 53 . 1 1 65 65 SER HA H 65 4.640 4.640 4.437 0.203 17919 21738 1 53 . 1 1 65 65 SER C C 65 172.160 172.160 173.822 -1.662 17919 21739 1 53 . 1 1 65 65 SER CA C 65 60.890 60.890 59.017 1.873 17919 21740 1 53 . 1 1 65 65 SER CB C 65 64.910 64.910 63.353 1.557 17919 21741 1 53 . 1 1 65 65 SER H H 65 7.670 7.670 7.313 0.357 17919 21742 1 53 . 1 1 66 66 THR N N 66 117.110 117.110 122.223 -5.113 17919 21743 1 53 . 1 1 66 66 THR HA H 66 5.270 5.270 4.677 0.593 17919 21744 1 53 . 1 1 66 66 THR C C 66 173.950 173.950 174.201 -0.251 17919 21745 1 53 . 1 1 66 66 THR CA C 66 62.340 62.340 62.863 -0.523 17919 21746 1 53 . 1 1 66 66 THR CB C 66 70.080 70.080 69.273 0.807 17919 21747 1 53 . 1 1 66 66 THR H H 66 8.730 8.730 8.282 0.448 17919 21748 1 53 . 1 1 67 67 LEU N N 67 127.110 127.110 127.312 -0.202 17919 21749 1 53 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.355 0.705 17919 21750 1 53 . 1 1 67 67 LEU C C 67 175.770 175.770 175.486 0.284 17919 21751 1 53 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.714 0.187 17919 21752 1 53 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.122 1.138 17919 21753 1 53 . 1 1 67 67 LEU H H 67 9.410 9.410 8.733 0.677 17919 21754 1 53 . 1 1 68 68 HIS N N 68 118.380 118.380 118.381 -0.001 17919 21755 1 53 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.106 0.134 17919 21756 1 53 . 1 1 68 68 HIS C C 68 173.150 173.150 173.916 -0.766 17919 21757 1 53 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.926 0.074 17919 21758 1 53 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.525 -1.995 17919 21759 1 53 . 1 1 68 68 HIS H H 68 9.230 9.230 8.396 0.834 17919 21760 1 53 . 1 1 69 69 LEU N N 69 124.460 124.460 124.715 -0.255 17919 21761 1 53 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.508 -0.318 17919 21762 1 53 . 1 1 69 69 LEU C C 69 175.270 175.270 174.182 1.088 17919 21763 1 53 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.432 0.458 17919 21764 1 53 . 1 1 69 69 LEU CB C 69 44.380 44.380 45.409 -1.029 17919 21765 1 53 . 1 1 69 69 LEU H H 69 8.340 8.340 8.177 0.163 17919 21766 1 53 . 1 1 70 70 VAL N N 70 126.940 126.940 122.969 3.971 17919 21767 1 53 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.522 -0.172 17919 21768 1 53 . 1 1 70 70 VAL C C 70 174.000 174.000 173.725 0.275 17919 21769 1 53 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.874 0.926 17919 21770 1 53 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.869 -0.959 17919 21771 1 53 . 1 1 70 70 VAL H H 70 9.200 9.200 8.610 0.590 17919 21772 1 53 . 1 1 71 71 LEU N N 71 123.130 123.130 125.923 -2.793 17919 21773 1 53 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.835 0.225 17919 21774 1 53 . 1 1 71 71 LEU C C 71 177.830 177.830 176.996 0.834 17919 21775 1 53 . 1 1 71 71 LEU CA C 71 53.940 53.940 54.330 -0.390 17919 21776 1 53 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.251 0.599 17919 21777 1 53 . 1 1 71 71 LEU H H 71 8.120 8.120 8.286 -0.166 17919 21778 1 53 . 1 1 72 72 ARG N N 72 123.490 123.490 124.332 -0.842 17919 21779 1 53 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.307 -0.006 17919 21780 1 53 . 1 1 72 72 ARG C C 72 175.350 175.350 175.313 0.037 17919 21781 1 53 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.537 -0.927 17919 21782 1 53 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.941 0.409 17919 21783 1 53 . 1 1 72 72 ARG H H 72 8.580 8.580 8.103 0.477 17919 21784 1 54 . 1 1 2 2 GLN N N 2 123.220 123.220 127.458 -4.238 17919 21785 1 54 . 1 1 2 2 GLN HA H 2 5.249 5.249 4.620 0.629 17919 21786 1 54 . 1 1 2 2 GLN C C 2 175.920 175.920 174.363 1.557 17919 21787 1 54 . 1 1 2 2 GLN CA C 2 55.080 55.080 56.415 -1.335 17919 21788 1 54 . 1 1 2 2 GLN CB C 2 30.760 30.760 29.727 1.033 17919 21789 1 54 . 1 1 2 2 GLN H H 2 8.900 8.900 8.147 0.753 17919 21790 1 54 . 1 1 3 3 ILE N N 3 115.340 115.340 116.343 -1.003 17919 21791 1 54 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.143 0.070 17919 21792 1 54 . 1 1 3 3 ILE C C 3 172.450 172.450 173.530 -1.080 17919 21793 1 54 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.628 -0.058 17919 21794 1 54 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.842 0.368 17919 21795 1 54 . 1 1 3 3 ILE H H 3 8.320 8.320 8.006 0.314 17919 21796 1 54 . 1 1 4 4 PHE N N 4 118.110 118.110 119.811 -1.701 17919 21797 1 54 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.253 0.377 17919 21798 1 54 . 1 1 4 4 PHE C C 4 175.320 175.320 174.886 0.434 17919 21799 1 54 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.270 -0.060 17919 21800 1 54 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.415 0.065 17919 21801 1 54 . 1 1 4 4 PHE H H 4 8.610 8.610 7.984 0.626 17919 21802 1 54 . 1 1 5 5 VAL N N 5 121.000 121.000 123.981 -2.981 17919 21803 1 54 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.892 -0.167 17919 21804 1 54 . 1 1 5 5 VAL C C 5 174.870 174.870 175.289 -0.419 17919 21805 1 54 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.153 -0.533 17919 21806 1 54 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.405 0.825 17919 21807 1 54 . 1 1 5 5 VAL H H 5 9.300 9.300 9.031 0.269 17919 21808 1 54 . 1 1 6 6 LYS N N 6 127.520 127.520 129.199 -1.679 17919 21809 1 54 . 1 1 6 6 LYS HA H 6 5.367 5.367 4.953 0.414 17919 21810 1 54 . 1 1 6 6 LYS C C 6 177.140 177.140 176.803 0.337 17919 21811 1 54 . 1 1 6 6 LYS CA C 6 54.520 54.520 55.230 -0.710 17919 21812 1 54 . 1 1 6 6 LYS CB C 6 35.050 35.050 33.217 1.833 17919 21813 1 54 . 1 1 6 6 LYS H H 6 8.820 8.820 8.393 0.427 17919 21814 1 54 . 1 1 7 7 THR N N 7 115.400 115.400 116.503 -1.103 17919 21815 1 54 . 1 1 7 7 THR HA H 7 4.970 4.970 4.103 0.867 17919 21816 1 54 . 1 1 7 7 THR C C 7 176.910 176.910 175.892 1.018 17919 21817 1 54 . 1 1 7 7 THR CA C 7 60.470 60.470 62.034 -1.564 17919 21818 1 54 . 1 1 7 7 THR CB C 7 70.630 70.630 69.657 0.972 17919 21819 1 54 . 1 1 7 7 THR H H 7 8.730 8.730 8.008 0.722 17919 21820 1 54 . 1 1 8 8 LEU N N 8 121.330 121.330 119.590 1.740 17919 21821 1 54 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.310 -0.000 17919 21822 1 54 . 1 1 8 8 LEU C C 8 178.800 178.800 177.901 0.899 17919 21823 1 54 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.210 0.370 17919 21824 1 54 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.005 -0.035 17919 21825 1 54 . 1 1 8 8 LEU H H 8 9.100 9.100 8.743 0.357 17919 21826 1 54 . 1 1 9 9 THR N N 9 105.590 105.590 107.789 -2.199 17919 21827 1 54 . 1 1 9 9 THR HA H 9 4.428 4.428 4.439 -0.011 17919 21828 1 54 . 1 1 9 9 THR C C 9 175.520 175.520 175.334 0.186 17919 21829 1 54 . 1 1 9 9 THR CA C 9 61.400 61.400 60.279 1.121 17919 21830 1 54 . 1 1 9 9 THR CB C 9 69.140 69.140 67.229 1.911 17919 21831 1 54 . 1 1 9 9 THR H H 9 7.630 7.630 7.618 0.012 17919 21832 1 54 . 1 1 10 10 GLY N N 10 108.890 108.890 111.503 -2.613 17919 21833 1 54 . 1 1 10 10 GLY C C 10 174.070 174.070 173.701 0.369 17919 21834 1 54 . 1 1 10 10 GLY CA C 10 45.460 45.460 46.116 -0.656 17919 21835 1 54 . 1 1 10 10 GLY H H 10 7.810 7.810 8.077 -0.267 17919 21836 1 54 . 1 1 11 11 LYS N N 11 121.600 121.600 121.272 0.328 17919 21837 1 54 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.633 -0.272 17919 21838 1 54 . 1 1 11 11 LYS C C 11 175.940 175.940 175.760 0.180 17919 21839 1 54 . 1 1 11 11 LYS CA C 11 56.280 56.280 54.549 1.731 17919 21840 1 54 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.984 -0.784 17919 21841 1 54 . 1 1 11 11 LYS H H 11 7.280 7.280 7.507 -0.227 17919 21842 1 54 . 1 1 12 12 THR N N 12 120.440 120.440 120.672 -0.232 17919 21843 1 54 . 1 1 12 12 THR HA H 12 5.046 5.046 4.884 0.162 17919 21844 1 54 . 1 1 12 12 THR C C 12 174.320 174.320 174.556 -0.236 17919 21845 1 54 . 1 1 12 12 THR CA C 12 62.390 62.390 62.766 -0.376 17919 21846 1 54 . 1 1 12 12 THR CB C 12 69.910 69.910 69.493 0.417 17919 21847 1 54 . 1 1 12 12 THR H H 12 8.650 8.650 8.552 0.098 17919 21848 1 54 . 1 1 13 13 ILE N N 13 127.110 127.110 129.410 -2.300 17919 21849 1 54 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.349 0.195 17919 21850 1 54 . 1 1 13 13 ILE C C 13 175.220 175.220 175.475 -0.255 17919 21851 1 54 . 1 1 13 13 ILE CA C 13 59.980 59.980 61.055 -1.075 17919 21852 1 54 . 1 1 13 13 ILE CB C 13 40.950 40.950 39.740 1.210 17919 21853 1 54 . 1 1 13 13 ILE H H 13 9.450 9.450 9.166 0.284 17919 21854 1 54 . 1 1 14 14 THR N N 14 121.520 121.520 122.968 -1.448 17919 21855 1 54 . 1 1 14 14 THR HA H 14 4.964 4.964 5.069 -0.105 17919 21856 1 54 . 1 1 14 14 THR C C 14 173.790 173.790 173.594 0.196 17919 21857 1 54 . 1 1 14 14 THR CA C 14 61.940 61.940 61.681 0.259 17919 21858 1 54 . 1 1 14 14 THR CB C 14 69.650 69.650 70.326 -0.676 17919 21859 1 54 . 1 1 14 14 THR H H 14 8.710 8.710 8.426 0.284 17919 21860 1 54 . 1 1 15 15 LEU N N 15 124.800 124.800 125.974 -1.174 17919 21861 1 54 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.673 0.107 17919 21862 1 54 . 1 1 15 15 LEU C C 15 174.670 174.670 174.918 -0.248 17919 21863 1 54 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.979 -1.149 17919 21864 1 54 . 1 1 15 15 LEU CB C 15 47.070 47.070 46.709 0.361 17919 21865 1 54 . 1 1 15 15 LEU H H 15 8.710 8.710 8.591 0.119 17919 21866 1 54 . 1 1 16 16 GLU N N 16 122.160 122.160 124.182 -2.022 17919 21867 1 54 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.715 0.202 17919 21868 1 54 . 1 1 16 16 GLU C C 16 175.860 175.860 174.874 0.986 17919 21869 1 54 . 1 1 16 16 GLU CA C 16 54.820 54.820 54.896 -0.076 17919 21870 1 54 . 1 1 16 16 GLU CB C 16 29.450 29.450 29.860 -0.410 17919 21871 1 54 . 1 1 16 16 GLU H H 16 8.140 8.140 8.676 -0.536 17919 21872 1 54 . 1 1 17 17 VAL N N 17 117.210 117.210 121.195 -3.985 17919 21873 1 54 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.767 -0.053 17919 21874 1 54 . 1 1 17 17 VAL C C 17 174.160 174.160 175.120 -0.960 17919 21875 1 54 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.854 -0.424 17919 21876 1 54 . 1 1 17 17 VAL CB C 17 36.400 36.400 34.610 1.790 17919 21877 1 54 . 1 1 17 17 VAL H H 17 8.900 8.900 8.357 0.543 17919 21878 1 54 . 1 1 18 18 GLU N N 18 118.990 118.990 119.303 -0.313 17919 21879 1 54 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.936 0.143 17919 21880 1 54 . 1 1 18 18 GLU C C 18 176.160 176.160 175.701 0.459 17919 21881 1 54 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.901 -0.180 17919 21882 1 54 . 1 1 18 18 GLU CB C 18 30.310 30.310 31.074 -0.764 17919 21883 1 54 . 1 1 18 18 GLU H H 18 8.640 8.640 8.817 -0.177 17919 21884 1 54 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.284 -0.143 17919 21885 1 54 . 1 1 19 19 PRO C C 19 175.310 175.310 177.886 -2.576 17919 21886 1 54 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.535 -0.065 17919 21887 1 54 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.886 0.064 17919 21888 1 54 . 1 1 20 20 SER N N 20 103.400 103.400 110.584 -7.184 17919 21889 1 54 . 1 1 20 20 SER HA H 20 4.370 4.370 4.265 0.105 17919 21890 1 54 . 1 1 20 20 SER C C 20 174.660 174.660 174.571 0.089 17919 21891 1 54 . 1 1 20 20 SER CA C 20 57.400 57.400 59.094 -1.694 17919 21892 1 54 . 1 1 20 20 SER CB C 20 63.370 63.370 62.549 0.821 17919 21893 1 54 . 1 1 20 20 SER H H 20 7.040 7.040 8.001 -0.961 17919 21894 1 54 . 1 1 21 21 ASP N N 21 123.480 123.480 123.960 -0.480 17919 21895 1 54 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.646 0.049 17919 21896 1 54 . 1 1 21 21 ASP C C 21 176.360 176.360 175.938 0.422 17919 21897 1 54 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.918 -0.218 17919 21898 1 54 . 1 1 21 21 ASP CB C 21 40.800 40.800 42.008 -1.208 17919 21899 1 54 . 1 1 21 21 ASP H H 21 8.030 8.030 7.663 0.367 17919 21900 1 54 . 1 1 22 22 THR N N 22 108.800 108.800 113.178 -4.378 17919 21901 1 54 . 1 1 22 22 THR HA H 22 4.920 4.920 4.677 0.243 17919 21902 1 54 . 1 1 22 22 THR C C 22 176.750 176.750 176.512 0.238 17919 21903 1 54 . 1 1 22 22 THR CA C 22 59.690 59.690 61.328 -1.639 17919 21904 1 54 . 1 1 22 22 THR CB C 22 71.200 71.200 70.882 0.318 17919 21905 1 54 . 1 1 22 22 THR H H 22 7.900 7.900 8.397 -0.497 17919 21906 1 54 . 1 1 23 23 ILE N N 23 121.190 121.190 124.950 -3.760 17919 21907 1 54 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.644 0.013 17919 21908 1 54 . 1 1 23 23 ILE C C 23 179.040 179.040 177.795 1.245 17919 21909 1 54 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.693 -1.433 17919 21910 1 54 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.234 -1.884 17919 21911 1 54 . 1 1 23 23 ILE H H 23 8.560 8.560 9.390 -0.830 17919 21912 1 54 . 1 1 24 24 GLU N N 24 120.830 120.830 120.233 0.597 17919 21913 1 54 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.890 0.027 17919 21914 1 54 . 1 1 24 24 GLU C C 24 178.640 178.640 178.697 -0.057 17919 21915 1 54 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.124 0.096 17919 21916 1 54 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.415 -1.135 17919 21917 1 54 . 1 1 24 24 GLU H H 24 9.760 9.760 8.624 1.136 17919 21918 1 54 . 1 1 25 25 ASN N N 25 120.570 120.570 117.779 2.791 17919 21919 1 54 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.500 0.025 17919 21920 1 54 . 1 1 25 25 ASN C C 25 178.380 178.380 178.109 0.271 17919 21921 1 54 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.406 -0.346 17919 21922 1 54 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.706 -0.256 17919 21923 1 54 . 1 1 25 25 ASN H H 25 7.920 7.920 7.859 0.061 17919 21924 1 54 . 1 1 26 26 VAL N N 26 121.710 121.710 121.315 0.395 17919 21925 1 54 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.507 -0.110 17919 21926 1 54 . 1 1 26 26 VAL C C 26 177.950 177.950 177.558 0.392 17919 21927 1 54 . 1 1 26 26 VAL CA C 26 67.660 67.660 67.121 0.539 17919 21928 1 54 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.634 -0.794 17919 21929 1 54 . 1 1 26 26 VAL H H 26 8.070 8.070 8.279 -0.209 17919 21930 1 54 . 1 1 27 27 LYS N N 27 118.860 118.860 119.654 -0.794 17919 21931 1 54 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.032 0.548 17919 21932 1 54 . 1 1 27 27 LYS C C 27 180.550 180.550 179.163 1.387 17919 21933 1 54 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.578 -0.328 17919 21934 1 54 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.181 1.548 17919 21935 1 54 . 1 1 27 27 LYS H H 27 8.560 8.560 8.196 0.364 17919 21936 1 54 . 1 1 28 28 ALA N N 28 123.440 123.440 121.044 2.396 17919 21937 1 54 . 1 1 28 28 ALA HA H 28 4.160 4.160 3.983 0.177 17919 21938 1 54 . 1 1 28 28 ALA C C 28 180.300 180.300 179.131 1.169 17919 21939 1 54 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.399 -0.029 17919 21940 1 54 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.352 -0.643 17919 21941 1 54 . 1 1 28 28 ALA H H 28 8.060 8.060 8.589 -0.529 17919 21942 1 54 . 1 1 29 29 LYS N N 29 119.940 119.940 119.403 0.537 17919 21943 1 54 . 1 1 29 29 LYS HA H 29 4.207 4.207 3.982 0.225 17919 21944 1 54 . 1 1 29 29 LYS C C 29 180.320 180.320 179.125 1.195 17919 21945 1 54 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.405 0.245 17919 21946 1 54 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.133 1.157 17919 21947 1 54 . 1 1 29 29 LYS H H 29 7.850 7.850 7.596 0.254 17919 21948 1 54 . 1 1 30 30 ILE N N 30 121.080 121.080 119.726 1.354 17919 21949 1 54 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.695 -0.188 17919 21950 1 54 . 1 1 30 30 ILE C C 30 178.310 178.310 177.359 0.951 17919 21951 1 54 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.121 1.029 17919 21952 1 54 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.325 -0.525 17919 21953 1 54 . 1 1 30 30 ILE H H 30 8.280 8.280 7.584 0.696 17919 21954 1 54 . 1 1 31 31 GLN N N 31 123.490 123.490 119.988 3.502 17919 21955 1 54 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.076 -0.247 17919 21956 1 54 . 1 1 31 31 GLN C C 31 178.890 178.890 177.845 1.045 17919 21957 1 54 . 1 1 31 31 GLN CA C 31 60.000 60.000 58.917 1.083 17919 21958 1 54 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.371 -0.651 17919 21959 1 54 . 1 1 31 31 GLN H H 31 8.580 8.580 8.150 0.430 17919 21960 1 54 . 1 1 32 32 ASP N N 32 119.360 119.360 119.543 -0.183 17919 21961 1 54 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.482 -0.128 17919 21962 1 54 . 1 1 32 32 ASP C C 32 177.250 177.250 177.966 -0.716 17919 21963 1 54 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.188 1.002 17919 21964 1 54 . 1 1 32 32 ASP CB C 32 40.580 40.580 41.071 -0.491 17919 21965 1 54 . 1 1 32 32 ASP H H 32 8.010 8.010 8.114 -0.104 17919 21966 1 54 . 1 1 33 33 LYS N N 33 115.130 115.130 118.840 -3.710 17919 21967 1 54 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.262 0.075 17919 21968 1 54 . 1 1 33 33 LYS C C 33 177.870 177.870 177.663 0.207 17919 21969 1 54 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.805 0.245 17919 21970 1 54 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.470 0.700 17919 21971 1 54 . 1 1 33 33 LYS H H 33 7.430 7.430 7.881 -0.451 17919 21972 1 54 . 1 1 34 34 GLU N N 34 113.870 113.870 115.051 -1.181 17919 21973 1 54 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.505 0.120 17919 21974 1 54 . 1 1 34 34 GLU C C 34 177.840 177.840 176.585 1.255 17919 21975 1 54 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.282 -1.112 17919 21976 1 54 . 1 1 34 34 GLU CB C 34 32.660 32.660 32.180 0.480 17919 21977 1 54 . 1 1 34 34 GLU H H 34 8.740 8.740 7.907 0.833 17919 21978 1 54 . 1 1 35 35 GLY N N 35 108.650 108.650 108.975 -0.325 17919 21979 1 54 . 1 1 35 35 GLY C C 35 173.960 173.960 174.670 -0.710 17919 21980 1 54 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.657 0.423 17919 21981 1 54 . 1 1 35 35 GLY H H 35 8.530 8.530 7.862 0.668 17919 21982 1 54 . 1 1 36 36 ILE N N 36 119.880 119.880 121.657 -1.777 17919 21983 1 54 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.272 0.173 17919 21984 1 54 . 1 1 36 36 ILE C C 36 173.590 173.590 174.453 -0.863 17919 21985 1 54 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.646 0.104 17919 21986 1 54 . 1 1 36 36 ILE CB C 36 40.580 40.580 37.311 3.269 17919 21987 1 54 . 1 1 36 36 ILE H H 36 6.150 6.150 7.588 -1.438 17919 21988 1 54 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.892 -0.258 17919 21989 1 54 . 1 1 37 37 PRO C C 37 176.940 176.940 176.246 0.694 17919 21990 1 54 . 1 1 37 37 PRO CA C 37 61.660 61.660 60.815 0.845 17919 21991 1 54 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.828 0.022 17919 21992 1 54 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.183 -0.066 17919 21993 1 54 . 1 1 38 38 PRO C C 38 178.320 178.320 178.675 -0.355 17919 21994 1 54 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.606 0.654 17919 21995 1 54 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.978 0.912 17919 21996 1 54 . 1 1 39 39 ASP N N 39 113.380 113.380 117.768 -4.388 17919 21997 1 54 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.292 0.138 17919 21998 1 54 . 1 1 39 39 ASP C C 39 177.090 177.090 177.964 -0.874 17919 21999 1 54 . 1 1 39 39 ASP CA C 39 55.640 55.640 57.299 -1.659 17919 22000 1 54 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.694 -1.154 17919 22001 1 54 . 1 1 39 39 ASP H H 39 8.550 8.550 8.535 0.015 17919 22002 1 54 . 1 1 40 40 GLN N N 40 116.780 116.780 116.237 0.543 17919 22003 1 54 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.077 0.387 17919 22004 1 54 . 1 1 40 40 GLN C C 40 175.380 175.380 176.655 -1.275 17919 22005 1 54 . 1 1 40 40 GLN CA C 40 55.640 55.640 57.395 -1.755 17919 22006 1 54 . 1 1 40 40 GLN CB C 40 30.140 30.140 28.972 1.168 17919 22007 1 54 . 1 1 40 40 GLN H H 40 7.820 7.820 7.724 0.096 17919 22008 1 54 . 1 1 41 41 GLN N N 41 117.720 117.720 118.741 -1.021 17919 22009 1 54 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.382 -0.138 17919 22010 1 54 . 1 1 41 41 GLN C C 41 176.300 176.300 175.011 1.289 17919 22011 1 54 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.863 0.607 17919 22012 1 54 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.485 2.165 17919 22013 1 54 . 1 1 41 41 GLN H H 41 7.480 7.480 7.393 0.087 17919 22014 1 54 . 1 1 42 42 ARG N N 42 122.680 122.680 124.511 -1.831 17919 22015 1 54 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.542 -0.042 17919 22016 1 54 . 1 1 42 42 ARG C C 42 174.050 174.050 174.892 -0.842 17919 22017 1 54 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.128 -0.078 17919 22018 1 54 . 1 1 42 42 ARG CB C 42 31.750 31.750 31.818 -0.068 17919 22019 1 54 . 1 1 42 42 ARG H H 42 8.530 8.530 7.948 0.582 17919 22020 1 54 . 1 1 43 43 LEU N N 43 124.040 124.040 126.258 -2.218 17919 22021 1 54 . 1 1 43 43 LEU C C 43 175.290 175.290 176.017 -0.727 17919 22022 1 54 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.558 -0.578 17919 22023 1 54 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.598 2.192 17919 22024 1 54 . 1 1 43 43 LEU H H 43 8.820 8.820 8.781 0.039 17919 22025 1 54 . 1 1 44 44 ILE N N 44 121.920 121.920 123.742 -1.822 17919 22026 1 54 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.118 -0.126 17919 22027 1 54 . 1 1 44 44 ILE C C 44 176.060 176.060 174.566 1.494 17919 22028 1 54 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.431 -1.451 17919 22029 1 54 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.340 0.080 17919 22030 1 54 . 1 1 44 44 ILE H H 44 9.030 9.030 8.133 0.897 17919 22031 1 54 . 1 1 45 45 PHE N N 45 125.390 125.390 126.948 -1.558 17919 22032 1 54 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.928 0.117 17919 22033 1 54 . 1 1 45 45 PHE C C 45 174.470 174.470 174.089 0.381 17919 22034 1 54 . 1 1 45 45 PHE CA C 45 57.020 57.020 57.721 -0.701 17919 22035 1 54 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.798 0.962 17919 22036 1 54 . 1 1 45 45 PHE H H 45 8.830 8.830 9.205 -0.375 17919 22037 1 54 . 1 1 46 46 ALA N N 46 132.200 132.200 129.461 2.739 17919 22038 1 54 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.580 0.110 17919 22039 1 54 . 1 1 46 46 ALA C C 46 177.290 177.290 177.762 -0.472 17919 22040 1 54 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.597 -0.057 17919 22041 1 54 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.417 0.153 17919 22042 1 54 . 1 1 46 46 ALA H H 46 8.810 8.810 8.714 0.096 17919 22043 1 54 . 1 1 47 47 GLY N N 47 102.340 102.340 103.896 -1.556 17919 22044 1 54 . 1 1 47 47 GLY C C 47 173.810 173.810 174.526 -0.716 17919 22045 1 54 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.936 0.414 17919 22046 1 54 . 1 1 47 47 GLY H H 47 8.130 8.130 8.381 -0.251 17919 22047 1 54 . 1 1 48 48 LYS N N 48 121.570 121.570 121.567 0.003 17919 22048 1 54 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.476 0.146 17919 22049 1 54 . 1 1 48 48 LYS C C 48 174.700 174.700 175.442 -0.742 17919 22050 1 54 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.324 -0.774 17919 22051 1 54 . 1 1 48 48 LYS CB C 48 34.530 34.530 33.766 0.764 17919 22052 1 54 . 1 1 48 48 LYS H H 48 7.980 7.980 7.728 0.252 17919 22053 1 54 . 1 1 49 49 GLN N N 49 122.410 122.410 123.852 -1.442 17919 22054 1 54 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.627 -0.067 17919 22055 1 54 . 1 1 49 49 GLN C C 49 175.670 175.670 175.800 -0.130 17919 22056 1 54 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.716 0.024 17919 22057 1 54 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.611 -0.611 17919 22058 1 54 . 1 1 49 49 GLN H H 49 8.600 8.600 8.579 0.021 17919 22059 1 54 . 1 1 50 50 LEU N N 50 125.520 125.520 127.379 -1.859 17919 22060 1 54 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.245 -0.155 17919 22061 1 54 . 1 1 50 50 LEU C C 50 176.660 176.660 176.868 -0.208 17919 22062 1 54 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.286 -0.046 17919 22063 1 54 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.654 -0.084 17919 22064 1 54 . 1 1 50 50 LEU H H 50 8.530 8.530 8.826 -0.296 17919 22065 1 54 . 1 1 51 51 GLU N N 51 122.940 122.940 122.681 0.259 17919 22066 1 54 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.430 0.058 17919 22067 1 54 . 1 1 51 51 GLU C C 51 175.870 175.870 176.576 -0.706 17919 22068 1 54 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.332 0.628 17919 22069 1 54 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.300 0.270 17919 22070 1 54 . 1 1 51 51 GLU H H 51 8.400 8.400 8.455 -0.055 17919 22071 1 54 . 1 1 52 52 ASP N N 52 120.030 120.030 123.898 -3.868 17919 22072 1 54 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.511 -0.152 17919 22073 1 54 . 1 1 52 52 ASP C C 52 177.330 177.330 178.151 -0.821 17919 22074 1 54 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.392 -0.432 17919 22075 1 54 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.595 0.255 17919 22076 1 54 . 1 1 52 52 ASP H H 52 8.160 8.160 8.873 -0.713 17919 22077 1 54 . 1 1 53 53 GLY N N 53 106.660 106.660 105.338 1.322 17919 22078 1 54 . 1 1 53 53 GLY C C 53 174.870 174.870 174.500 0.370 17919 22079 1 54 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.810 0.360 17919 22080 1 54 . 1 1 53 53 GLY H H 53 9.390 9.390 8.344 1.046 17919 22081 1 54 . 1 1 54 54 ARG N N 54 119.050 119.050 120.655 -1.605 17919 22082 1 54 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.464 0.231 17919 22083 1 54 . 1 1 54 54 ARG C C 54 175.350 175.350 174.879 0.471 17919 22084 1 54 . 1 1 54 54 ARG CA C 54 54.390 54.390 55.899 -1.509 17919 22085 1 54 . 1 1 54 54 ARG CB C 54 32.650 32.650 31.532 1.118 17919 22086 1 54 . 1 1 54 54 ARG H H 54 7.460 7.460 7.552 -0.092 17919 22087 1 54 . 1 1 55 55 THR N N 55 108.400 108.400 112.767 -4.367 17919 22088 1 54 . 1 1 55 55 THR HA H 55 5.240 5.240 5.118 0.122 17919 22089 1 54 . 1 1 55 55 THR C C 55 176.560 176.560 175.385 1.175 17919 22090 1 54 . 1 1 55 55 THR CA C 55 59.690 59.690 60.182 -0.492 17919 22091 1 54 . 1 1 55 55 THR CB C 55 72.260 72.260 71.624 0.636 17919 22092 1 54 . 1 1 55 55 THR H H 55 8.730 8.730 7.885 0.845 17919 22093 1 54 . 1 1 56 56 LEU N N 56 117.920 117.920 121.536 -3.616 17919 22094 1 54 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.167 -0.107 17919 22095 1 54 . 1 1 56 56 LEU C C 56 180.810 180.810 178.493 2.317 17919 22096 1 54 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.313 0.397 17919 22097 1 54 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.592 -1.222 17919 22098 1 54 . 1 1 56 56 LEU H H 56 8.140 8.140 8.379 -0.239 17919 22099 1 54 . 1 1 57 57 SER N N 57 113.330 113.330 113.641 -0.311 17919 22100 1 54 . 1 1 57 57 SER HA H 57 4.370 4.370 4.192 0.178 17919 22101 1 54 . 1 1 57 57 SER C C 57 178.310 178.310 176.374 1.936 17919 22102 1 54 . 1 1 57 57 SER CA C 57 61.080 61.080 60.833 0.247 17919 22103 1 54 . 1 1 57 57 SER CB C 57 62.530 62.530 62.838 -0.308 17919 22104 1 54 . 1 1 57 57 SER H H 57 8.470 8.470 7.733 0.737 17919 22105 1 54 . 1 1 58 58 ASP N N 58 124.190 124.190 123.655 0.535 17919 22106 1 54 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.269 0.028 17919 22107 1 54 . 1 1 58 58 ASP C C 58 177.400 177.400 176.962 0.438 17919 22108 1 54 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.268 0.912 17919 22109 1 54 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.608 -0.509 17919 22110 1 54 . 1 1 58 58 ASP H H 58 7.930 7.930 8.246 -0.316 17919 22111 1 54 . 1 1 59 59 TYR N N 59 115.510 115.510 116.569 -1.059 17919 22112 1 54 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.604 0.066 17919 22113 1 54 . 1 1 59 59 TYR C C 59 174.700 174.700 175.668 -0.968 17919 22114 1 54 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.256 0.994 17919 22115 1 54 . 1 1 59 59 TYR CB C 59 40.070 40.070 37.927 2.143 17919 22116 1 54 . 1 1 59 59 TYR H H 59 7.250 7.250 7.292 -0.042 17919 22117 1 54 . 1 1 60 60 ASN N N 60 115.900 115.900 116.484 -0.584 17919 22118 1 54 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.357 -0.002 17919 22119 1 54 . 1 1 60 60 ASN C C 60 174.340 174.340 174.034 0.306 17919 22120 1 54 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.637 -0.517 17919 22121 1 54 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.787 -0.377 17919 22122 1 54 . 1 1 60 60 ASN H H 60 8.150 8.150 7.921 0.229 17919 22123 1 54 . 1 1 61 61 ILE N N 61 118.600 118.600 120.318 -1.718 17919 22124 1 54 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.844 -0.451 17919 22125 1 54 . 1 1 61 61 ILE C C 61 174.610 174.610 175.110 -0.500 17919 22126 1 54 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.942 0.478 17919 22127 1 54 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.550 -0.810 17919 22128 1 54 . 1 1 61 61 ILE H H 61 7.250 7.250 7.494 -0.244 17919 22129 1 54 . 1 1 62 62 GLN N N 62 124.740 124.740 126.433 -1.693 17919 22130 1 54 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.657 -0.151 17919 22131 1 54 . 1 1 62 62 GLN C C 62 175.970 175.970 175.752 0.218 17919 22132 1 54 . 1 1 62 62 GLN CA C 62 53.660 53.660 54.097 -0.437 17919 22133 1 54 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.537 0.113 17919 22134 1 54 . 1 1 62 62 GLN H H 62 7.610 7.610 8.029 -0.419 17919 22135 1 54 . 1 1 63 63 LYS N N 63 120.300 120.300 120.038 0.262 17919 22136 1 54 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.913 0.088 17919 22137 1 54 . 1 1 63 63 LYS C C 63 175.810 175.810 176.694 -0.884 17919 22138 1 54 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.529 0.261 17919 22139 1 54 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.338 0.312 17919 22140 1 54 . 1 1 63 63 LYS H H 63 8.490 8.490 8.479 0.011 17919 22141 1 54 . 1 1 64 64 GLU N N 64 113.950 113.950 119.445 -5.495 17919 22142 1 54 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.299 0.166 17919 22143 1 54 . 1 1 64 64 GLU C C 64 175.250 175.250 176.256 -1.006 17919 22144 1 54 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.871 0.019 17919 22145 1 54 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.514 -2.614 17919 22146 1 54 . 1 1 64 64 GLU H H 64 9.280 9.280 8.735 0.545 17919 22147 1 54 . 1 1 65 65 SER N N 65 114.730 114.730 115.343 -0.613 17919 22148 1 54 . 1 1 65 65 SER HA H 65 4.640 4.640 4.418 0.222 17919 22149 1 54 . 1 1 65 65 SER C C 65 172.160 172.160 174.482 -2.322 17919 22150 1 54 . 1 1 65 65 SER CA C 65 60.890 60.890 59.874 1.016 17919 22151 1 54 . 1 1 65 65 SER CB C 65 64.910 64.910 63.622 1.288 17919 22152 1 54 . 1 1 65 65 SER H H 65 7.670 7.670 7.508 0.162 17919 22153 1 54 . 1 1 66 66 THR N N 66 117.110 117.110 122.210 -5.100 17919 22154 1 54 . 1 1 66 66 THR HA H 66 5.270 5.270 4.641 0.629 17919 22155 1 54 . 1 1 66 66 THR C C 66 173.950 173.950 174.712 -0.762 17919 22156 1 54 . 1 1 66 66 THR CA C 66 62.340 62.340 63.312 -0.972 17919 22157 1 54 . 1 1 66 66 THR CB C 66 70.080 70.080 68.901 1.179 17919 22158 1 54 . 1 1 66 66 THR H H 66 8.730 8.730 8.415 0.315 17919 22159 1 54 . 1 1 67 67 LEU N N 67 127.110 127.110 128.573 -1.463 17919 22160 1 54 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.902 0.158 17919 22161 1 54 . 1 1 67 67 LEU C C 67 175.770 175.770 176.255 -0.485 17919 22162 1 54 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.597 -0.697 17919 22163 1 54 . 1 1 67 67 LEU CB C 67 44.260 44.260 42.931 1.329 17919 22164 1 54 . 1 1 67 67 LEU H H 67 9.410 9.410 8.860 0.550 17919 22165 1 54 . 1 1 68 68 HIS N N 68 118.380 118.380 119.684 -1.304 17919 22166 1 54 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.427 -0.187 17919 22167 1 54 . 1 1 68 68 HIS C C 68 173.150 173.150 174.387 -1.237 17919 22168 1 54 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.492 0.508 17919 22169 1 54 . 1 1 68 68 HIS CB C 68 30.530 30.530 33.836 -3.306 17919 22170 1 54 . 1 1 68 68 HIS H H 68 9.230 9.230 8.970 0.260 17919 22171 1 54 . 1 1 69 69 LEU N N 69 124.460 124.460 122.113 2.347 17919 22172 1 54 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.018 0.172 17919 22173 1 54 . 1 1 69 69 LEU C C 69 175.270 175.270 173.970 1.300 17919 22174 1 54 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.718 -0.828 17919 22175 1 54 . 1 1 69 69 LEU CB C 69 44.380 44.380 45.469 -1.089 17919 22176 1 54 . 1 1 69 69 LEU H H 69 8.340 8.340 6.885 1.455 17919 22177 1 54 . 1 1 70 70 VAL N N 70 126.940 126.940 124.031 2.909 17919 22178 1 54 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.527 -0.177 17919 22179 1 54 . 1 1 70 70 VAL C C 70 174.000 174.000 174.252 -0.252 17919 22180 1 54 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.808 0.992 17919 22181 1 54 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.326 -0.416 17919 22182 1 54 . 1 1 70 70 VAL H H 70 9.200 9.200 7.989 1.211 17919 22183 1 54 . 1 1 71 71 LEU N N 71 123.130 123.130 120.894 2.236 17919 22184 1 54 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.838 0.222 17919 22185 1 54 . 1 1 71 71 LEU C C 71 177.830 177.830 176.832 0.998 17919 22186 1 54 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.410 0.530 17919 22187 1 54 . 1 1 71 71 LEU CB C 71 42.850 42.850 45.192 -2.342 17919 22188 1 54 . 1 1 71 71 LEU H H 71 8.120 8.120 8.185 -0.065 17919 22189 1 54 . 1 1 72 72 ARG N N 72 123.490 123.490 123.709 -0.219 17919 22190 1 54 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.438 -0.137 17919 22191 1 54 . 1 1 72 72 ARG C C 72 175.350 175.350 175.786 -0.436 17919 22192 1 54 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.690 -1.080 17919 22193 1 54 . 1 1 72 72 ARG CB C 72 31.350 31.350 31.118 0.232 17919 22194 1 54 . 1 1 72 72 ARG H H 72 8.580 8.580 8.120 0.460 17919 22195 1 55 . 1 1 2 2 GLN N N 2 123.220 123.220 119.692 3.528 17919 22196 1 55 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.393 -0.144 17919 22197 1 55 . 1 1 2 2 GLN C C 2 175.920 175.920 175.473 0.447 17919 22198 1 55 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.603 0.477 17919 22199 1 55 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.469 0.291 17919 22200 1 55 . 1 1 2 2 GLN H H 2 8.900 8.900 8.326 0.574 17919 22201 1 55 . 1 1 3 3 ILE N N 3 115.340 115.340 115.683 -0.343 17919 22202 1 55 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.319 -0.106 17919 22203 1 55 . 1 1 3 3 ILE C C 3 172.450 172.450 173.281 -0.831 17919 22204 1 55 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.628 -0.058 17919 22205 1 55 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.879 0.331 17919 22206 1 55 . 1 1 3 3 ILE H H 3 8.320 8.320 8.727 -0.407 17919 22207 1 55 . 1 1 4 4 PHE N N 4 118.110 118.110 121.138 -3.028 17919 22208 1 55 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.130 0.500 17919 22209 1 55 . 1 1 4 4 PHE C C 4 175.320 175.320 175.354 -0.034 17919 22210 1 55 . 1 1 4 4 PHE CA C 4 55.210 55.210 56.078 -0.868 17919 22211 1 55 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.051 0.429 17919 22212 1 55 . 1 1 4 4 PHE H H 4 8.610 8.610 8.583 0.027 17919 22213 1 55 . 1 1 5 5 VAL N N 5 121.000 121.000 122.292 -1.292 17919 22214 1 55 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.984 -0.259 17919 22215 1 55 . 1 1 5 5 VAL C C 5 174.870 174.870 174.979 -0.109 17919 22216 1 55 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.097 -0.477 17919 22217 1 55 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.375 0.855 17919 22218 1 55 . 1 1 5 5 VAL H H 5 9.300 9.300 8.887 0.413 17919 22219 1 55 . 1 1 6 6 LYS N N 6 127.520 127.520 129.456 -1.936 17919 22220 1 55 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.040 0.327 17919 22221 1 55 . 1 1 6 6 LYS C C 6 177.140 177.140 175.978 1.162 17919 22222 1 55 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.581 -0.061 17919 22223 1 55 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.843 -0.793 17919 22224 1 55 . 1 1 6 6 LYS H H 6 8.820 8.820 8.835 -0.015 17919 22225 1 55 . 1 1 7 7 THR N N 7 115.400 115.400 117.200 -1.800 17919 22226 1 55 . 1 1 7 7 THR HA H 7 4.970 4.970 4.667 0.303 17919 22227 1 55 . 1 1 7 7 THR C C 7 176.910 176.910 175.555 1.355 17919 22228 1 55 . 1 1 7 7 THR CA C 7 60.470 60.470 60.285 0.185 17919 22229 1 55 . 1 1 7 7 THR CB C 7 70.630 70.630 71.011 -0.381 17919 22230 1 55 . 1 1 7 7 THR H H 7 8.730 8.730 8.631 0.099 17919 22231 1 55 . 1 1 8 8 LEU N N 8 121.330 121.330 122.162 -0.832 17919 22232 1 55 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.257 0.053 17919 22233 1 55 . 1 1 8 8 LEU C C 8 178.800 178.800 177.673 1.127 17919 22234 1 55 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.108 0.472 17919 22235 1 55 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.134 -0.164 17919 22236 1 55 . 1 1 8 8 LEU H H 8 9.100 9.100 9.132 -0.032 17919 22237 1 55 . 1 1 9 9 THR N N 9 105.590 105.590 107.021 -1.431 17919 22238 1 55 . 1 1 9 9 THR HA H 9 4.428 4.428 4.220 0.208 17919 22239 1 55 . 1 1 9 9 THR C C 9 175.520 175.520 175.549 -0.029 17919 22240 1 55 . 1 1 9 9 THR CA C 9 61.400 61.400 63.018 -1.618 17919 22241 1 55 . 1 1 9 9 THR CB C 9 69.140 69.140 68.714 0.426 17919 22242 1 55 . 1 1 9 9 THR H H 9 7.630 7.630 7.917 -0.287 17919 22243 1 55 . 1 1 10 10 GLY N N 10 108.890 108.890 109.486 -0.596 17919 22244 1 55 . 1 1 10 10 GLY C C 10 174.070 174.070 173.856 0.214 17919 22245 1 55 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.761 0.699 17919 22246 1 55 . 1 1 10 10 GLY H H 10 7.810 7.810 7.693 0.117 17919 22247 1 55 . 1 1 11 11 LYS N N 11 121.600 121.600 121.693 -0.093 17919 22248 1 55 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.703 -0.342 17919 22249 1 55 . 1 1 11 11 LYS C C 11 175.940 175.940 175.501 0.439 17919 22250 1 55 . 1 1 11 11 LYS CA C 11 56.280 56.280 54.987 1.293 17919 22251 1 55 . 1 1 11 11 LYS CB C 11 33.200 33.200 34.623 -1.423 17919 22252 1 55 . 1 1 11 11 LYS H H 11 7.280 7.280 7.861 -0.581 17919 22253 1 55 . 1 1 12 12 THR N N 12 120.440 120.440 117.915 2.525 17919 22254 1 55 . 1 1 12 12 THR HA H 12 5.046 5.046 4.995 0.051 17919 22255 1 55 . 1 1 12 12 THR C C 12 174.320 174.320 173.739 0.581 17919 22256 1 55 . 1 1 12 12 THR CA C 12 62.390 62.390 61.222 1.168 17919 22257 1 55 . 1 1 12 12 THR CB C 12 69.910 69.910 71.139 -1.229 17919 22258 1 55 . 1 1 12 12 THR H H 12 8.650 8.650 8.397 0.253 17919 22259 1 55 . 1 1 13 13 ILE N N 13 127.110 127.110 124.852 2.258 17919 22260 1 55 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.534 0.010 17919 22261 1 55 . 1 1 13 13 ILE C C 13 175.220 175.220 174.308 0.912 17919 22262 1 55 . 1 1 13 13 ILE CA C 13 59.980 59.980 61.053 -1.073 17919 22263 1 55 . 1 1 13 13 ILE CB C 13 40.950 40.950 42.005 -1.055 17919 22264 1 55 . 1 1 13 13 ILE H H 13 9.450 9.450 8.550 0.900 17919 22265 1 55 . 1 1 14 14 THR N N 14 121.520 121.520 123.523 -2.003 17919 22266 1 55 . 1 1 14 14 THR HA H 14 4.964 4.964 4.661 0.303 17919 22267 1 55 . 1 1 14 14 THR C C 14 173.790 173.790 173.603 0.187 17919 22268 1 55 . 1 1 14 14 THR CA C 14 61.940 61.940 61.952 -0.012 17919 22269 1 55 . 1 1 14 14 THR CB C 14 69.650 69.650 69.784 -0.134 17919 22270 1 55 . 1 1 14 14 THR H H 14 8.710 8.710 8.363 0.347 17919 22271 1 55 . 1 1 15 15 LEU N N 15 124.800 124.800 128.424 -3.624 17919 22272 1 55 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.722 0.058 17919 22273 1 55 . 1 1 15 15 LEU C C 15 174.670 174.670 174.982 -0.312 17919 22274 1 55 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.690 -0.859 17919 22275 1 55 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.550 1.520 17919 22276 1 55 . 1 1 15 15 LEU H H 15 8.710 8.710 8.669 0.041 17919 22277 1 55 . 1 1 16 16 GLU N N 16 122.160 122.160 122.962 -0.802 17919 22278 1 55 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.036 -0.119 17919 22279 1 55 . 1 1 16 16 GLU C C 16 175.860 175.860 175.767 0.093 17919 22280 1 55 . 1 1 16 16 GLU CA C 16 54.820 54.820 54.928 -0.108 17919 22281 1 55 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.794 -1.344 17919 22282 1 55 . 1 1 16 16 GLU H H 16 8.140 8.140 8.492 -0.352 17919 22283 1 55 . 1 1 17 17 VAL N N 17 117.210 117.210 118.803 -1.593 17919 22284 1 55 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.676 0.038 17919 22285 1 55 . 1 1 17 17 VAL C C 17 174.160 174.160 174.800 -0.640 17919 22286 1 55 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.116 -0.686 17919 22287 1 55 . 1 1 17 17 VAL CB C 17 36.400 36.400 34.744 1.656 17919 22288 1 55 . 1 1 17 17 VAL H H 17 8.900 8.900 8.806 0.093 17919 22289 1 55 . 1 1 18 18 GLU N N 18 118.990 118.990 119.889 -0.899 17919 22290 1 55 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.857 0.222 17919 22291 1 55 . 1 1 18 18 GLU C C 18 176.160 176.160 175.266 0.894 17919 22292 1 55 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.474 0.246 17919 22293 1 55 . 1 1 18 18 GLU CB C 18 30.310 30.310 29.913 0.397 17919 22294 1 55 . 1 1 18 18 GLU H H 18 8.640 8.640 8.340 0.300 17919 22295 1 55 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.125 0.016 17919 22296 1 55 . 1 1 19 19 PRO C C 19 175.310 175.310 178.300 -2.990 17919 22297 1 55 . 1 1 19 19 PRO CA C 19 65.470 65.470 66.082 -0.612 17919 22298 1 55 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.987 -0.037 17919 22299 1 55 . 1 1 20 20 SER N N 20 103.400 103.400 110.154 -6.754 17919 22300 1 55 . 1 1 20 20 SER HA H 20 4.370 4.370 4.227 0.143 17919 22301 1 55 . 1 1 20 20 SER C C 20 174.660 174.660 174.734 -0.074 17919 22302 1 55 . 1 1 20 20 SER CA C 20 57.400 57.400 59.182 -1.782 17919 22303 1 55 . 1 1 20 20 SER CB C 20 63.370 63.370 62.918 0.452 17919 22304 1 55 . 1 1 20 20 SER H H 20 7.040 7.040 8.120 -1.080 17919 22305 1 55 . 1 1 21 21 ASP N N 21 123.480 123.480 121.738 1.742 17919 22306 1 55 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.710 -0.015 17919 22307 1 55 . 1 1 21 21 ASP C C 21 176.360 176.360 175.722 0.638 17919 22308 1 55 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.992 0.708 17919 22309 1 55 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.563 -0.763 17919 22310 1 55 . 1 1 21 21 ASP H H 21 8.030 8.030 7.678 0.352 17919 22311 1 55 . 1 1 22 22 THR N N 22 108.800 108.800 111.411 -2.611 17919 22312 1 55 . 1 1 22 22 THR HA H 22 4.920 4.920 4.649 0.271 17919 22313 1 55 . 1 1 22 22 THR C C 22 176.750 176.750 176.001 0.749 17919 22314 1 55 . 1 1 22 22 THR CA C 22 59.690 59.690 61.415 -1.725 17919 22315 1 55 . 1 1 22 22 THR CB C 22 71.200 71.200 70.958 0.242 17919 22316 1 55 . 1 1 22 22 THR H H 22 7.900 7.900 8.158 -0.258 17919 22317 1 55 . 1 1 23 23 ILE N N 23 121.190 121.190 123.299 -2.109 17919 22318 1 55 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.692 -0.035 17919 22319 1 55 . 1 1 23 23 ILE C C 23 179.040 179.040 177.685 1.355 17919 22320 1 55 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.159 -0.899 17919 22321 1 55 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.822 -2.472 17919 22322 1 55 . 1 1 23 23 ILE H H 23 8.560 8.560 9.085 -0.525 17919 22323 1 55 . 1 1 24 24 GLU N N 24 120.830 120.830 119.630 1.200 17919 22324 1 55 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.890 0.027 17919 22325 1 55 . 1 1 24 24 GLU C C 24 178.640 178.640 178.568 0.072 17919 22326 1 55 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.915 0.305 17919 22327 1 55 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.464 -1.184 17919 22328 1 55 . 1 1 24 24 GLU H H 24 9.760 9.760 7.896 1.864 17919 22329 1 55 . 1 1 25 25 ASN N N 25 120.570 120.570 117.766 2.804 17919 22330 1 55 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.526 -0.001 17919 22331 1 55 . 1 1 25 25 ASN C C 25 178.380 178.380 178.021 0.359 17919 22332 1 55 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.085 -0.025 17919 22333 1 55 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.369 0.081 17919 22334 1 55 . 1 1 25 25 ASN H H 25 7.920 7.920 7.508 0.412 17919 22335 1 55 . 1 1 26 26 VAL N N 26 121.710 121.710 117.092 4.618 17919 22336 1 55 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.670 -0.273 17919 22337 1 55 . 1 1 26 26 VAL C C 26 177.950 177.950 177.822 0.128 17919 22338 1 55 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.072 1.588 17919 22339 1 55 . 1 1 26 26 VAL CB C 26 30.840 30.840 30.081 0.759 17919 22340 1 55 . 1 1 26 26 VAL H H 26 8.070 8.070 7.727 0.343 17919 22341 1 55 . 1 1 27 27 LYS N N 27 118.860 118.860 120.651 -1.791 17919 22342 1 55 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.306 0.274 17919 22343 1 55 . 1 1 27 27 LYS C C 27 180.550 180.550 178.972 1.578 17919 22344 1 55 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.417 -0.167 17919 22345 1 55 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.139 1.591 17919 22346 1 55 . 1 1 27 27 LYS H H 27 8.560 8.560 7.586 0.974 17919 22347 1 55 . 1 1 28 28 ALA N N 28 123.440 123.440 122.216 1.224 17919 22348 1 55 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.118 0.042 17919 22349 1 55 . 1 1 28 28 ALA C C 28 180.300 180.300 179.095 1.205 17919 22350 1 55 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.879 0.491 17919 22351 1 55 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.312 -0.602 17919 22352 1 55 . 1 1 28 28 ALA H H 28 8.060 8.060 8.123 -0.063 17919 22353 1 55 . 1 1 29 29 LYS N N 29 119.940 119.940 120.599 -0.659 17919 22354 1 55 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.053 0.154 17919 22355 1 55 . 1 1 29 29 LYS C C 29 180.320 180.320 179.216 1.104 17919 22356 1 55 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.365 0.285 17919 22357 1 55 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.437 0.853 17919 22358 1 55 . 1 1 29 29 LYS H H 29 7.850 7.850 7.427 0.423 17919 22359 1 55 . 1 1 30 30 ILE N N 30 121.080 121.080 120.452 0.628 17919 22360 1 55 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.528 -0.021 17919 22361 1 55 . 1 1 30 30 ILE C C 30 178.310 178.310 177.544 0.766 17919 22362 1 55 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.593 0.557 17919 22363 1 55 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.745 -0.945 17919 22364 1 55 . 1 1 30 30 ILE H H 30 8.280 8.280 8.671 -0.391 17919 22365 1 55 . 1 1 31 31 GLN N N 31 123.490 123.490 119.543 3.947 17919 22366 1 55 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.910 -0.081 17919 22367 1 55 . 1 1 31 31 GLN C C 31 178.890 178.890 177.986 0.904 17919 22368 1 55 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.593 0.407 17919 22369 1 55 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.437 -0.717 17919 22370 1 55 . 1 1 31 31 GLN H H 31 8.580 8.580 8.123 0.457 17919 22371 1 55 . 1 1 32 32 ASP N N 32 119.360 119.360 119.166 0.194 17919 22372 1 55 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.369 -0.015 17919 22373 1 55 . 1 1 32 32 ASP C C 32 177.250 177.250 177.859 -0.609 17919 22374 1 55 . 1 1 32 32 ASP CA C 32 57.190 57.190 57.036 0.154 17919 22375 1 55 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.570 0.010 17919 22376 1 55 . 1 1 32 32 ASP H H 32 8.010 8.010 8.142 -0.132 17919 22377 1 55 . 1 1 33 33 LYS N N 33 115.130 115.130 118.365 -3.235 17919 22378 1 55 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.202 0.135 17919 22379 1 55 . 1 1 33 33 LYS C C 33 177.870 177.870 178.112 -0.242 17919 22380 1 55 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.092 -0.042 17919 22381 1 55 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.242 0.928 17919 22382 1 55 . 1 1 33 33 LYS H H 33 7.430 7.430 7.589 -0.159 17919 22383 1 55 . 1 1 34 34 GLU N N 34 113.870 113.870 113.782 0.088 17919 22384 1 55 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.506 0.119 17919 22385 1 55 . 1 1 34 34 GLU C C 34 177.840 177.840 177.488 0.352 17919 22386 1 55 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.698 -0.528 17919 22387 1 55 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.172 1.488 17919 22388 1 55 . 1 1 34 34 GLU H H 34 8.740 8.740 8.268 0.472 17919 22389 1 55 . 1 1 35 35 GLY N N 35 108.650 108.650 109.727 -1.077 17919 22390 1 55 . 1 1 35 35 GLY C C 35 173.960 173.960 174.299 -0.339 17919 22391 1 55 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.970 0.110 17919 22392 1 55 . 1 1 35 35 GLY H H 35 8.530 8.530 8.404 0.126 17919 22393 1 55 . 1 1 36 36 ILE N N 36 119.880 119.880 121.451 -1.571 17919 22394 1 55 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.291 0.154 17919 22395 1 55 . 1 1 36 36 ILE C C 36 173.590 173.590 173.980 -0.390 17919 22396 1 55 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.866 -0.116 17919 22397 1 55 . 1 1 36 36 ILE CB C 36 40.580 40.580 39.066 1.514 17919 22398 1 55 . 1 1 36 36 ILE H H 36 6.150 6.150 7.524 -1.374 17919 22399 1 55 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.746 -0.112 17919 22400 1 55 . 1 1 37 37 PRO C C 37 176.940 176.940 176.129 0.811 17919 22401 1 55 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.250 0.410 17919 22402 1 55 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.489 0.361 17919 22403 1 55 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.164 -0.047 17919 22404 1 55 . 1 1 38 38 PRO C C 38 178.320 178.320 177.241 1.079 17919 22405 1 55 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.614 0.646 17919 22406 1 55 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.699 1.191 17919 22407 1 55 . 1 1 39 39 ASP N N 39 113.380 113.380 114.261 -0.881 17919 22408 1 55 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.447 -0.017 17919 22409 1 55 . 1 1 39 39 ASP C C 39 177.090 177.090 177.149 -0.059 17919 22410 1 55 . 1 1 39 39 ASP CA C 39 55.640 55.640 55.556 0.084 17919 22411 1 55 . 1 1 39 39 ASP CB C 39 39.540 39.540 39.638 -0.098 17919 22412 1 55 . 1 1 39 39 ASP H H 39 8.550 8.550 8.604 -0.054 17919 22413 1 55 . 1 1 40 40 GLN N N 40 116.780 116.780 118.405 -1.625 17919 22414 1 55 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.257 0.207 17919 22415 1 55 . 1 1 40 40 GLN C C 40 175.380 175.380 175.864 -0.484 17919 22416 1 55 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.708 -1.067 17919 22417 1 55 . 1 1 40 40 GLN CB C 40 30.140 30.140 28.931 1.209 17919 22418 1 55 . 1 1 40 40 GLN H H 40 7.820 7.820 8.308 -0.488 17919 22419 1 55 . 1 1 41 41 GLN N N 41 117.720 117.720 117.288 0.432 17919 22420 1 55 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.962 -0.718 17919 22421 1 55 . 1 1 41 41 GLN C C 41 176.300 176.300 175.384 0.916 17919 22422 1 55 . 1 1 41 41 GLN CA C 41 56.470 56.470 54.803 1.667 17919 22423 1 55 . 1 1 41 41 GLN CB C 41 31.650 31.650 30.130 1.520 17919 22424 1 55 . 1 1 41 41 GLN H H 41 7.480 7.480 7.425 0.055 17919 22425 1 55 . 1 1 42 42 ARG N N 42 122.680 122.680 122.251 0.429 17919 22426 1 55 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.618 -0.118 17919 22427 1 55 . 1 1 42 42 ARG C C 42 174.050 174.050 174.519 -0.469 17919 22428 1 55 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.467 0.583 17919 22429 1 55 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.483 -1.733 17919 22430 1 55 . 1 1 42 42 ARG H H 42 8.530 8.530 8.788 -0.258 17919 22431 1 55 . 1 1 43 43 LEU N N 43 124.040 124.040 122.813 1.227 17919 22432 1 55 . 1 1 43 43 LEU C C 43 175.290 175.290 175.192 0.098 17919 22433 1 55 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.694 -0.714 17919 22434 1 55 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.026 1.764 17919 22435 1 55 . 1 1 43 43 LEU H H 43 8.820 8.820 8.637 0.183 17919 22436 1 55 . 1 1 44 44 ILE N N 44 121.920 121.920 122.833 -0.913 17919 22437 1 55 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.239 -0.247 17919 22438 1 55 . 1 1 44 44 ILE C C 44 176.060 176.060 174.522 1.538 17919 22439 1 55 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.194 -0.214 17919 22440 1 55 . 1 1 44 44 ILE CB C 44 41.420 41.420 40.351 1.069 17919 22441 1 55 . 1 1 44 44 ILE H H 44 9.030 9.030 9.202 -0.172 17919 22442 1 55 . 1 1 45 45 PHE N N 45 125.390 125.390 127.248 -1.858 17919 22443 1 55 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.969 0.076 17919 22444 1 55 . 1 1 45 45 PHE C C 45 174.470 174.470 174.391 0.079 17919 22445 1 55 . 1 1 45 45 PHE CA C 45 57.020 57.020 55.850 1.170 17919 22446 1 55 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.815 0.945 17919 22447 1 55 . 1 1 45 45 PHE H H 45 8.830 8.830 8.889 -0.059 17919 22448 1 55 . 1 1 46 46 ALA N N 46 132.200 132.200 129.087 3.113 17919 22449 1 55 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.663 0.027 17919 22450 1 55 . 1 1 46 46 ALA C C 46 177.290 177.290 177.592 -0.302 17919 22451 1 55 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.664 -0.124 17919 22452 1 55 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.504 0.066 17919 22453 1 55 . 1 1 46 46 ALA H H 46 8.810 8.810 8.995 -0.185 17919 22454 1 55 . 1 1 47 47 GLY N N 47 102.340 102.340 103.474 -1.134 17919 22455 1 55 . 1 1 47 47 GLY C C 47 173.810 173.810 174.160 -0.350 17919 22456 1 55 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.795 0.555 17919 22457 1 55 . 1 1 47 47 GLY H H 47 8.130 8.130 8.319 -0.189 17919 22458 1 55 . 1 1 48 48 LYS N N 48 121.570 121.570 122.149 -0.579 17919 22459 1 55 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.634 -0.012 17919 22460 1 55 . 1 1 48 48 LYS C C 48 174.700 174.700 175.473 -0.773 17919 22461 1 55 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.827 -0.277 17919 22462 1 55 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.539 -0.009 17919 22463 1 55 . 1 1 48 48 LYS H H 48 7.980 7.980 7.908 0.072 17919 22464 1 55 . 1 1 49 49 GLN N N 49 122.410 122.410 124.561 -2.151 17919 22465 1 55 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.680 -0.120 17919 22466 1 55 . 1 1 49 49 GLN C C 49 175.670 175.670 175.013 0.657 17919 22467 1 55 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.592 -0.852 17919 22468 1 55 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.520 -0.520 17919 22469 1 55 . 1 1 49 49 GLN H H 49 8.600 8.600 8.525 0.075 17919 22470 1 55 . 1 1 50 50 LEU N N 50 125.520 125.520 123.261 2.259 17919 22471 1 55 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.306 -0.216 17919 22472 1 55 . 1 1 50 50 LEU C C 50 176.660 176.660 175.449 1.211 17919 22473 1 55 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.831 0.409 17919 22474 1 55 . 1 1 50 50 LEU CB C 50 41.570 41.570 43.483 -1.913 17919 22475 1 55 . 1 1 50 50 LEU H H 50 8.530 8.530 8.542 -0.012 17919 22476 1 55 . 1 1 51 51 GLU N N 51 122.940 122.940 122.926 0.014 17919 22477 1 55 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.648 -0.160 17919 22478 1 55 . 1 1 51 51 GLU C C 51 175.870 175.870 176.215 -0.345 17919 22479 1 55 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.205 0.755 17919 22480 1 55 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.366 -0.796 17919 22481 1 55 . 1 1 51 51 GLU H H 51 8.400 8.400 8.331 0.069 17919 22482 1 55 . 1 1 52 52 ASP N N 52 120.030 120.030 123.083 -3.053 17919 22483 1 55 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.498 -0.139 17919 22484 1 55 . 1 1 52 52 ASP C C 52 177.330 177.330 177.555 -0.225 17919 22485 1 55 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.119 -0.159 17919 22486 1 55 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.930 -0.080 17919 22487 1 55 . 1 1 52 52 ASP H H 52 8.160 8.160 8.823 -0.663 17919 22488 1 55 . 1 1 53 53 GLY N N 53 106.660 106.660 105.639 1.021 17919 22489 1 55 . 1 1 53 53 GLY C C 53 174.870 174.870 174.140 0.730 17919 22490 1 55 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.926 0.244 17919 22491 1 55 . 1 1 53 53 GLY H H 53 9.390 9.390 8.552 0.838 17919 22492 1 55 . 1 1 54 54 ARG N N 54 119.050 119.050 120.445 -1.395 17919 22493 1 55 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.776 -0.081 17919 22494 1 55 . 1 1 54 54 ARG C C 54 175.350 175.350 175.174 0.176 17919 22495 1 55 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.286 0.104 17919 22496 1 55 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.878 -1.228 17919 22497 1 55 . 1 1 54 54 ARG H H 54 7.460 7.460 7.373 0.087 17919 22498 1 55 . 1 1 55 55 THR N N 55 108.400 108.400 111.567 -3.167 17919 22499 1 55 . 1 1 55 55 THR HA H 55 5.240 5.240 5.228 0.012 17919 22500 1 55 . 1 1 55 55 THR C C 55 176.560 176.560 176.057 0.503 17919 22501 1 55 . 1 1 55 55 THR CA C 55 59.690 59.690 59.768 -0.078 17919 22502 1 55 . 1 1 55 55 THR CB C 55 72.260 72.260 71.660 0.600 17919 22503 1 55 . 1 1 55 55 THR H H 55 8.730 8.730 8.970 -0.240 17919 22504 1 55 . 1 1 56 56 LEU N N 56 117.920 117.920 121.490 -3.570 17919 22505 1 55 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.091 -0.031 17919 22506 1 55 . 1 1 56 56 LEU C C 56 180.810 180.810 178.755 2.055 17919 22507 1 55 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.955 -0.245 17919 22508 1 55 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.503 -1.133 17919 22509 1 55 . 1 1 56 56 LEU H H 56 8.140 8.140 8.584 -0.444 17919 22510 1 55 . 1 1 57 57 SER N N 57 113.330 113.330 113.692 -0.362 17919 22511 1 55 . 1 1 57 57 SER HA H 57 4.370 4.370 4.194 0.176 17919 22512 1 55 . 1 1 57 57 SER C C 57 178.310 178.310 176.862 1.448 17919 22513 1 55 . 1 1 57 57 SER CA C 57 61.080 61.080 61.676 -0.596 17919 22514 1 55 . 1 1 57 57 SER CB C 57 62.530 62.530 62.779 -0.249 17919 22515 1 55 . 1 1 57 57 SER H H 57 8.470 8.470 7.940 0.530 17919 22516 1 55 . 1 1 58 58 ASP N N 58 124.190 124.190 123.022 1.168 17919 22517 1 55 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.290 0.006 17919 22518 1 55 . 1 1 58 58 ASP C C 58 177.400 177.400 177.709 -0.309 17919 22519 1 55 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.741 0.439 17919 22520 1 55 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.422 -0.322 17919 22521 1 55 . 1 1 58 58 ASP H H 58 7.930 7.930 7.634 0.296 17919 22522 1 55 . 1 1 59 59 TYR N N 59 115.510 115.510 116.273 -0.763 17919 22523 1 55 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.656 0.014 17919 22524 1 55 . 1 1 59 59 TYR C C 59 174.700 174.700 175.119 -0.419 17919 22525 1 55 . 1 1 59 59 TYR CA C 59 58.250 58.250 56.555 1.695 17919 22526 1 55 . 1 1 59 59 TYR CB C 59 40.070 40.070 37.120 2.950 17919 22527 1 55 . 1 1 59 59 TYR H H 59 7.250 7.250 7.395 -0.145 17919 22528 1 55 . 1 1 60 60 ASN N N 60 115.900 115.900 116.453 -0.553 17919 22529 1 55 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.353 0.002 17919 22530 1 55 . 1 1 60 60 ASN C C 60 174.340 174.340 174.519 -0.179 17919 22531 1 55 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.820 -0.700 17919 22532 1 55 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.769 -0.359 17919 22533 1 55 . 1 1 60 60 ASN H H 60 8.150 8.150 7.850 0.300 17919 22534 1 55 . 1 1 61 61 ILE N N 61 118.600 118.600 119.376 -0.776 17919 22535 1 55 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.841 -0.448 17919 22536 1 55 . 1 1 61 61 ILE C C 61 174.610 174.610 175.710 -1.100 17919 22537 1 55 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.265 1.155 17919 22538 1 55 . 1 1 61 61 ILE CB C 61 36.740 36.740 36.021 0.719 17919 22539 1 55 . 1 1 61 61 ILE H H 61 7.250 7.250 8.234 -0.984 17919 22540 1 55 . 1 1 62 62 GLN N N 62 124.740 124.740 126.796 -2.056 17919 22541 1 55 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.617 -0.111 17919 22542 1 55 . 1 1 62 62 GLN C C 62 175.970 175.970 176.308 -0.338 17919 22543 1 55 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.108 0.552 17919 22544 1 55 . 1 1 62 62 GLN CB C 62 31.650 31.650 30.703 0.947 17919 22545 1 55 . 1 1 62 62 GLN H H 62 7.610 7.610 8.129 -0.519 17919 22546 1 55 . 1 1 63 63 LYS N N 63 120.300 120.300 124.307 -4.007 17919 22547 1 55 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.864 0.137 17919 22548 1 55 . 1 1 63 63 LYS C C 63 175.810 175.810 176.688 -0.878 17919 22549 1 55 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.715 0.075 17919 22550 1 55 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.624 1.026 17919 22551 1 55 . 1 1 63 63 LYS H H 63 8.490 8.490 8.788 -0.298 17919 22552 1 55 . 1 1 64 64 GLU N N 64 113.950 113.950 118.289 -4.339 17919 22553 1 55 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.826 -0.361 17919 22554 1 55 . 1 1 64 64 GLU C C 64 175.250 175.250 175.779 -0.529 17919 22555 1 55 . 1 1 64 64 GLU CA C 64 57.890 57.890 58.091 -0.201 17919 22556 1 55 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.667 -2.767 17919 22557 1 55 . 1 1 64 64 GLU H H 64 9.280 9.280 8.667 0.613 17919 22558 1 55 . 1 1 65 65 SER N N 65 114.730 114.730 115.851 -1.121 17919 22559 1 55 . 1 1 65 65 SER HA H 65 4.640 4.640 4.397 0.243 17919 22560 1 55 . 1 1 65 65 SER C C 65 172.160 172.160 173.638 -1.478 17919 22561 1 55 . 1 1 65 65 SER CA C 65 60.890 60.890 59.950 0.940 17919 22562 1 55 . 1 1 65 65 SER CB C 65 64.910 64.910 64.060 0.850 17919 22563 1 55 . 1 1 65 65 SER H H 65 7.670 7.670 7.761 -0.091 17919 22564 1 55 . 1 1 66 66 THR N N 66 117.110 117.110 117.331 -0.221 17919 22565 1 55 . 1 1 66 66 THR HA H 66 5.270 5.270 5.061 0.209 17919 22566 1 55 . 1 1 66 66 THR C C 66 173.950 173.950 173.789 0.161 17919 22567 1 55 . 1 1 66 66 THR CA C 66 62.340 62.340 61.875 0.465 17919 22568 1 55 . 1 1 66 66 THR CB C 66 70.080 70.080 70.200 -0.120 17919 22569 1 55 . 1 1 66 66 THR H H 66 8.730 8.730 8.391 0.339 17919 22570 1 55 . 1 1 67 67 LEU N N 67 127.110 127.110 128.590 -1.480 17919 22571 1 55 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.583 0.477 17919 22572 1 55 . 1 1 67 67 LEU C C 67 175.770 175.770 175.547 0.223 17919 22573 1 55 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.822 0.078 17919 22574 1 55 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.667 0.593 17919 22575 1 55 . 1 1 67 67 LEU H H 67 9.410 9.410 9.256 0.154 17919 22576 1 55 . 1 1 68 68 HIS N N 68 118.380 118.380 123.588 -5.208 17919 22577 1 55 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.057 0.183 17919 22578 1 55 . 1 1 68 68 HIS C C 68 173.150 173.150 173.674 -0.524 17919 22579 1 55 . 1 1 68 68 HIS CA C 68 55.000 55.000 55.524 -0.524 17919 22580 1 55 . 1 1 68 68 HIS CB C 68 30.530 30.530 31.905 -1.375 17919 22581 1 55 . 1 1 68 68 HIS H H 68 9.230 9.230 9.289 -0.059 17919 22582 1 55 . 1 1 69 69 LEU N N 69 124.460 124.460 128.720 -4.260 17919 22583 1 55 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.061 0.129 17919 22584 1 55 . 1 1 69 69 LEU C C 69 175.270 175.270 174.518 0.752 17919 22585 1 55 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.657 0.233 17919 22586 1 55 . 1 1 69 69 LEU CB C 69 44.380 44.380 45.009 -0.629 17919 22587 1 55 . 1 1 69 69 LEU H H 69 8.340 8.340 7.784 0.556 17919 22588 1 55 . 1 1 70 70 VAL N N 70 126.940 126.940 127.229 -0.289 17919 22589 1 55 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.341 0.009 17919 22590 1 55 . 1 1 70 70 VAL C C 70 174.000 174.000 174.709 -0.709 17919 22591 1 55 . 1 1 70 70 VAL CA C 70 60.800 60.800 61.153 -0.353 17919 22592 1 55 . 1 1 70 70 VAL CB C 70 34.910 34.910 33.248 1.663 17919 22593 1 55 . 1 1 70 70 VAL H H 70 9.200 9.200 8.278 0.922 17919 22594 1 55 . 1 1 71 71 LEU N N 71 123.130 123.130 126.334 -3.204 17919 22595 1 55 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.205 -0.145 17919 22596 1 55 . 1 1 71 71 LEU C C 71 177.830 177.830 177.331 0.499 17919 22597 1 55 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.042 0.898 17919 22598 1 55 . 1 1 71 71 LEU CB C 71 42.850 42.850 44.169 -1.319 17919 22599 1 55 . 1 1 71 71 LEU H H 71 8.120 8.120 8.374 -0.254 17919 22600 1 55 . 1 1 72 72 ARG N N 72 123.490 123.490 122.465 1.025 17919 22601 1 55 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.258 0.043 17919 22602 1 55 . 1 1 72 72 ARG C C 72 175.350 175.350 175.747 -0.397 17919 22603 1 55 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.951 -0.341 17919 22604 1 55 . 1 1 72 72 ARG CB C 72 31.350 31.350 31.100 0.250 17919 22605 1 55 . 1 1 72 72 ARG H H 72 8.580 8.580 8.273 0.307 17919 22606 1 56 . 1 1 2 2 GLN N N 2 123.220 123.220 121.734 1.486 17919 22607 1 56 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.137 0.112 17919 22608 1 56 . 1 1 2 2 GLN C C 2 175.920 175.920 174.474 1.446 17919 22609 1 56 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.647 0.433 17919 22610 1 56 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.011 0.750 17919 22611 1 56 . 1 1 2 2 GLN H H 2 8.900 8.900 8.350 0.550 17919 22612 1 56 . 1 1 3 3 ILE N N 3 115.340 115.340 118.253 -2.913 17919 22613 1 56 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.543 -0.330 17919 22614 1 56 . 1 1 3 3 ILE C C 3 172.450 172.450 173.404 -0.954 17919 22615 1 56 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.117 0.453 17919 22616 1 56 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.813 0.397 17919 22617 1 56 . 1 1 3 3 ILE H H 3 8.320 8.320 8.642 -0.322 17919 22618 1 56 . 1 1 4 4 PHE N N 4 118.110 118.110 120.907 -2.797 17919 22619 1 56 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.147 0.483 17919 22620 1 56 . 1 1 4 4 PHE C C 4 175.320 175.320 175.533 -0.213 17919 22621 1 56 . 1 1 4 4 PHE CA C 4 55.210 55.210 56.255 -1.046 17919 22622 1 56 . 1 1 4 4 PHE CB C 4 41.480 41.480 40.221 1.259 17919 22623 1 56 . 1 1 4 4 PHE H H 4 8.610 8.610 8.419 0.191 17919 22624 1 56 . 1 1 5 5 VAL N N 5 121.000 121.000 125.226 -4.226 17919 22625 1 56 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.277 0.448 17919 22626 1 56 . 1 1 5 5 VAL C C 5 174.870 174.870 174.626 0.244 17919 22627 1 56 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.926 -1.306 17919 22628 1 56 . 1 1 5 5 VAL CB C 5 34.230 34.230 32.265 1.965 17919 22629 1 56 . 1 1 5 5 VAL H H 5 9.300 9.300 8.517 0.783 17919 22630 1 56 . 1 1 6 6 LYS N N 6 127.520 127.520 129.417 -1.897 17919 22631 1 56 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.076 0.291 17919 22632 1 56 . 1 1 6 6 LYS C C 6 177.140 177.140 176.684 0.456 17919 22633 1 56 . 1 1 6 6 LYS CA C 6 54.520 54.520 55.067 -0.547 17919 22634 1 56 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.053 -0.003 17919 22635 1 56 . 1 1 6 6 LYS H H 6 8.820 8.820 8.709 0.111 17919 22636 1 56 . 1 1 7 7 THR N N 7 115.400 115.400 117.177 -1.777 17919 22637 1 56 . 1 1 7 7 THR HA H 7 4.970 4.970 4.486 0.484 17919 22638 1 56 . 1 1 7 7 THR C C 7 176.910 176.910 176.252 0.658 17919 22639 1 56 . 1 1 7 7 THR CA C 7 60.470 60.470 61.169 -0.699 17919 22640 1 56 . 1 1 7 7 THR CB C 7 70.630 70.630 69.870 0.760 17919 22641 1 56 . 1 1 7 7 THR H H 7 8.730 8.730 8.334 0.396 17919 22642 1 56 . 1 1 8 8 LEU N N 8 121.330 121.330 122.248 -0.918 17919 22643 1 56 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.129 0.181 17919 22644 1 56 . 1 1 8 8 LEU C C 8 178.800 178.800 177.912 0.888 17919 22645 1 56 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.814 -0.234 17919 22646 1 56 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.844 0.126 17919 22647 1 56 . 1 1 8 8 LEU H H 8 9.100 9.100 8.965 0.135 17919 22648 1 56 . 1 1 9 9 THR N N 9 105.590 105.590 107.153 -1.563 17919 22649 1 56 . 1 1 9 9 THR HA H 9 4.428 4.428 4.340 0.088 17919 22650 1 56 . 1 1 9 9 THR C C 9 175.520 175.520 175.160 0.360 17919 22651 1 56 . 1 1 9 9 THR CA C 9 61.400 61.400 62.351 -0.951 17919 22652 1 56 . 1 1 9 9 THR CB C 9 69.140 69.140 69.095 0.045 17919 22653 1 56 . 1 1 9 9 THR H H 9 7.630 7.630 8.023 -0.393 17919 22654 1 56 . 1 1 10 10 GLY N N 10 108.890 108.890 111.194 -2.304 17919 22655 1 56 . 1 1 10 10 GLY C C 10 174.070 174.070 173.432 0.638 17919 22656 1 56 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.178 0.282 17919 22657 1 56 . 1 1 10 10 GLY H H 10 7.810 7.810 7.823 -0.013 17919 22658 1 56 . 1 1 11 11 LYS N N 11 121.600 121.600 121.458 0.142 17919 22659 1 56 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.643 -0.282 17919 22660 1 56 . 1 1 11 11 LYS C C 11 175.940 175.940 175.988 -0.048 17919 22661 1 56 . 1 1 11 11 LYS CA C 11 56.280 56.280 54.187 2.093 17919 22662 1 56 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.285 -0.085 17919 22663 1 56 . 1 1 11 11 LYS H H 11 7.280 7.280 8.329 -1.049 17919 22664 1 56 . 1 1 12 12 THR N N 12 120.440 120.440 121.898 -1.458 17919 22665 1 56 . 1 1 12 12 THR HA H 12 5.046 5.046 4.254 0.792 17919 22666 1 56 . 1 1 12 12 THR C C 12 174.320 174.320 174.284 0.036 17919 22667 1 56 . 1 1 12 12 THR CA C 12 62.390 62.390 63.093 -0.703 17919 22668 1 56 . 1 1 12 12 THR CB C 12 69.910 69.910 68.931 0.979 17919 22669 1 56 . 1 1 12 12 THR H H 12 8.650 8.650 8.648 0.002 17919 22670 1 56 . 1 1 13 13 ILE N N 13 127.110 127.110 130.585 -3.475 17919 22671 1 56 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.051 0.493 17919 22672 1 56 . 1 1 13 13 ILE C C 13 175.220 175.220 175.507 -0.287 17919 22673 1 56 . 1 1 13 13 ILE CA C 13 59.980 59.980 61.582 -1.602 17919 22674 1 56 . 1 1 13 13 ILE CB C 13 40.950 40.950 38.629 2.321 17919 22675 1 56 . 1 1 13 13 ILE H H 13 9.450 9.450 8.534 0.916 17919 22676 1 56 . 1 1 14 14 THR N N 14 121.520 121.520 123.089 -1.569 17919 22677 1 56 . 1 1 14 14 THR HA H 14 4.964 4.964 4.175 0.789 17919 22678 1 56 . 1 1 14 14 THR C C 14 173.790 173.790 174.068 -0.278 17919 22679 1 56 . 1 1 14 14 THR CA C 14 61.940 61.940 63.126 -1.186 17919 22680 1 56 . 1 1 14 14 THR CB C 14 69.650 69.650 69.079 0.571 17919 22681 1 56 . 1 1 14 14 THR H H 14 8.710 8.710 8.439 0.271 17919 22682 1 56 . 1 1 15 15 LEU N N 15 124.800 124.800 128.077 -3.277 17919 22683 1 56 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.575 0.205 17919 22684 1 56 . 1 1 15 15 LEU C C 15 174.670 174.670 175.619 -0.949 17919 22685 1 56 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.576 -0.746 17919 22686 1 56 . 1 1 15 15 LEU CB C 15 47.070 47.070 44.692 2.378 17919 22687 1 56 . 1 1 15 15 LEU H H 15 8.710 8.710 8.778 -0.068 17919 22688 1 56 . 1 1 16 16 GLU N N 16 122.160 122.160 123.229 -1.069 17919 22689 1 56 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.794 0.123 17919 22690 1 56 . 1 1 16 16 GLU C C 16 175.860 175.860 176.122 -0.262 17919 22691 1 56 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.755 -0.936 17919 22692 1 56 . 1 1 16 16 GLU CB C 16 29.450 29.450 29.984 -0.534 17919 22693 1 56 . 1 1 16 16 GLU H H 16 8.140 8.140 8.676 -0.536 17919 22694 1 56 . 1 1 17 17 VAL N N 17 117.210 117.210 119.973 -2.763 17919 22695 1 56 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.625 0.089 17919 22696 1 56 . 1 1 17 17 VAL C C 17 174.160 174.160 174.091 0.069 17919 22697 1 56 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.508 -1.078 17919 22698 1 56 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.302 1.098 17919 22699 1 56 . 1 1 17 17 VAL H H 17 8.900 8.900 8.906 -0.006 17919 22700 1 56 . 1 1 18 18 GLU N N 18 118.990 118.990 117.396 1.594 17919 22701 1 56 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.884 0.195 17919 22702 1 56 . 1 1 18 18 GLU C C 18 176.160 176.160 174.679 1.481 17919 22703 1 56 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.060 -0.340 17919 22704 1 56 . 1 1 18 18 GLU CB C 18 30.310 30.310 32.081 -1.771 17919 22705 1 56 . 1 1 18 18 GLU H H 18 8.640 8.640 8.365 0.275 17919 22706 1 56 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.409 -0.268 17919 22707 1 56 . 1 1 19 19 PRO C C 19 175.310 175.310 177.618 -2.308 17919 22708 1 56 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.087 0.383 17919 22709 1 56 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.079 -0.129 17919 22710 1 56 . 1 1 20 20 SER N N 20 103.400 103.400 109.477 -6.077 17919 22711 1 56 . 1 1 20 20 SER HA H 20 4.370 4.370 4.270 0.100 17919 22712 1 56 . 1 1 20 20 SER C C 20 174.660 174.660 174.426 0.234 17919 22713 1 56 . 1 1 20 20 SER CA C 20 57.400 57.400 59.256 -1.856 17919 22714 1 56 . 1 1 20 20 SER CB C 20 63.370 63.370 62.862 0.508 17919 22715 1 56 . 1 1 20 20 SER H H 20 7.040 7.040 7.989 -0.949 17919 22716 1 56 . 1 1 21 21 ASP N N 21 123.480 123.480 123.565 -0.085 17919 22717 1 56 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.803 -0.108 17919 22718 1 56 . 1 1 21 21 ASP C C 21 176.360 176.360 175.450 0.910 17919 22719 1 56 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.096 1.604 17919 22720 1 56 . 1 1 21 21 ASP CB C 21 40.800 40.800 42.675 -1.875 17919 22721 1 56 . 1 1 21 21 ASP H H 21 8.030 8.030 7.828 0.202 17919 22722 1 56 . 1 1 22 22 THR N N 22 108.800 108.800 113.280 -4.480 17919 22723 1 56 . 1 1 22 22 THR HA H 22 4.920 4.920 4.824 0.096 17919 22724 1 56 . 1 1 22 22 THR C C 22 176.750 176.750 175.396 1.354 17919 22725 1 56 . 1 1 22 22 THR CA C 22 59.690 59.690 60.877 -1.187 17919 22726 1 56 . 1 1 22 22 THR CB C 22 71.200 71.200 70.876 0.324 17919 22727 1 56 . 1 1 22 22 THR H H 22 7.900 7.900 8.187 -0.287 17919 22728 1 56 . 1 1 23 23 ILE N N 23 121.190 121.190 123.479 -2.289 17919 22729 1 56 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.678 -0.021 17919 22730 1 56 . 1 1 23 23 ILE C C 23 179.040 179.040 177.362 1.678 17919 22731 1 56 . 1 1 23 23 ILE CA C 23 62.260 62.260 65.345 -3.085 17919 22732 1 56 . 1 1 23 23 ILE CB C 23 34.350 34.350 37.606 -3.256 17919 22733 1 56 . 1 1 23 23 ILE H H 23 8.560 8.560 8.561 -0.001 17919 22734 1 56 . 1 1 24 24 GLU N N 24 120.830 120.830 121.321 -0.491 17919 22735 1 56 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.781 0.136 17919 22736 1 56 . 1 1 24 24 GLU C C 24 178.640 178.640 178.344 0.296 17919 22737 1 56 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.304 -0.084 17919 22738 1 56 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.390 -1.111 17919 22739 1 56 . 1 1 24 24 GLU H H 24 9.760 9.760 8.447 1.313 17919 22740 1 56 . 1 1 25 25 ASN N N 25 120.570 120.570 117.396 3.174 17919 22741 1 56 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.530 -0.005 17919 22742 1 56 . 1 1 25 25 ASN C C 25 178.380 178.380 177.899 0.481 17919 22743 1 56 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.745 0.315 17919 22744 1 56 . 1 1 25 25 ASN CB C 25 38.450 38.450 37.733 0.717 17919 22745 1 56 . 1 1 25 25 ASN H H 25 7.920 7.920 8.256 -0.336 17919 22746 1 56 . 1 1 26 26 VAL N N 26 121.710 121.710 120.346 1.364 17919 22747 1 56 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.554 -0.157 17919 22748 1 56 . 1 1 26 26 VAL C C 26 177.950 177.950 178.058 -0.108 17919 22749 1 56 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.630 1.030 17919 22750 1 56 . 1 1 26 26 VAL CB C 26 30.840 30.840 30.997 -0.157 17919 22751 1 56 . 1 1 26 26 VAL H H 26 8.070 8.070 8.160 -0.090 17919 22752 1 56 . 1 1 27 27 LYS N N 27 118.860 118.860 119.767 -0.907 17919 22753 1 56 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.136 0.444 17919 22754 1 56 . 1 1 27 27 LYS C C 27 180.550 180.550 179.077 1.473 17919 22755 1 56 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.607 -0.357 17919 22756 1 56 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.164 1.566 17919 22757 1 56 . 1 1 27 27 LYS H H 27 8.560 8.560 8.188 0.372 17919 22758 1 56 . 1 1 28 28 ALA N N 28 123.440 123.440 122.230 1.210 17919 22759 1 56 . 1 1 28 28 ALA HA H 28 4.160 4.160 3.889 0.271 17919 22760 1 56 . 1 1 28 28 ALA C C 28 180.300 180.300 179.502 0.798 17919 22761 1 56 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.465 -0.096 17919 22762 1 56 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.246 -0.536 17919 22763 1 56 . 1 1 28 28 ALA H H 28 8.060 8.060 8.300 -0.240 17919 22764 1 56 . 1 1 29 29 LYS N N 29 119.940 119.940 118.517 1.423 17919 22765 1 56 . 1 1 29 29 LYS HA H 29 4.207 4.207 3.937 0.270 17919 22766 1 56 . 1 1 29 29 LYS C C 29 180.320 180.320 178.923 1.397 17919 22767 1 56 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.313 0.337 17919 22768 1 56 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.302 0.988 17919 22769 1 56 . 1 1 29 29 LYS H H 29 7.850 7.850 7.416 0.434 17919 22770 1 56 . 1 1 30 30 ILE N N 30 121.080 121.080 118.900 2.180 17919 22771 1 56 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.673 -0.166 17919 22772 1 56 . 1 1 30 30 ILE C C 30 178.310 178.310 178.082 0.228 17919 22773 1 56 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.246 0.904 17919 22774 1 56 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.472 -0.672 17919 22775 1 56 . 1 1 30 30 ILE H H 30 8.280 8.280 7.595 0.685 17919 22776 1 56 . 1 1 31 31 GLN N N 31 123.490 123.490 120.526 2.964 17919 22777 1 56 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.938 -0.109 17919 22778 1 56 . 1 1 31 31 GLN C C 31 178.890 178.890 177.712 1.178 17919 22779 1 56 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.192 0.808 17919 22780 1 56 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.425 -0.705 17919 22781 1 56 . 1 1 31 31 GLN H H 31 8.580 8.580 8.277 0.303 17919 22782 1 56 . 1 1 32 32 ASP N N 32 119.360 119.360 118.789 0.571 17919 22783 1 56 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.351 0.003 17919 22784 1 56 . 1 1 32 32 ASP C C 32 177.250 177.250 177.992 -0.742 17919 22785 1 56 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.857 0.333 17919 22786 1 56 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.906 -0.326 17919 22787 1 56 . 1 1 32 32 ASP H H 32 8.010 8.010 7.985 0.025 17919 22788 1 56 . 1 1 33 33 LYS N N 33 115.130 115.130 117.146 -2.016 17919 22789 1 56 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.402 -0.065 17919 22790 1 56 . 1 1 33 33 LYS C C 33 177.870 177.870 178.102 -0.232 17919 22791 1 56 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.388 0.662 17919 22792 1 56 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.603 0.567 17919 22793 1 56 . 1 1 33 33 LYS H H 33 7.430 7.430 7.776 -0.346 17919 22794 1 56 . 1 1 34 34 GLU N N 34 113.870 113.870 117.337 -3.467 17919 22795 1 56 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.379 0.246 17919 22796 1 56 . 1 1 34 34 GLU C C 34 177.840 177.840 176.620 1.220 17919 22797 1 56 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.222 -1.052 17919 22798 1 56 . 1 1 34 34 GLU CB C 34 32.660 32.660 30.293 2.367 17919 22799 1 56 . 1 1 34 34 GLU H H 34 8.740 8.740 7.766 0.974 17919 22800 1 56 . 1 1 35 35 GLY N N 35 108.650 108.650 108.504 0.146 17919 22801 1 56 . 1 1 35 35 GLY C C 35 173.960 173.960 174.196 -0.236 17919 22802 1 56 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.604 0.476 17919 22803 1 56 . 1 1 35 35 GLY H H 35 8.530 8.530 7.777 0.753 17919 22804 1 56 . 1 1 36 36 ILE N N 36 119.880 119.880 120.200 -0.320 17919 22805 1 56 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.408 0.037 17919 22806 1 56 . 1 1 36 36 ILE C C 36 173.590 173.590 173.703 -0.113 17919 22807 1 56 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.397 0.353 17919 22808 1 56 . 1 1 36 36 ILE CB C 36 40.580 40.580 39.113 1.467 17919 22809 1 56 . 1 1 36 36 ILE H H 36 6.150 6.150 7.632 -1.482 17919 22810 1 56 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.987 -0.353 17919 22811 1 56 . 1 1 37 37 PRO C C 37 176.940 176.940 176.071 0.869 17919 22812 1 56 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.088 0.572 17919 22813 1 56 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.195 0.655 17919 22814 1 56 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.249 -0.132 17919 22815 1 56 . 1 1 38 38 PRO C C 38 178.320 178.320 178.523 -0.203 17919 22816 1 56 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.646 0.614 17919 22817 1 56 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.921 0.969 17919 22818 1 56 . 1 1 39 39 ASP N N 39 113.380 113.380 118.328 -4.948 17919 22819 1 56 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.221 0.209 17919 22820 1 56 . 1 1 39 39 ASP C C 39 177.090 177.090 178.024 -0.934 17919 22821 1 56 . 1 1 39 39 ASP CA C 39 55.640 55.640 57.522 -1.882 17919 22822 1 56 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.418 -0.878 17919 22823 1 56 . 1 1 39 39 ASP H H 39 8.550 8.550 8.560 -0.010 17919 22824 1 56 . 1 1 40 40 GLN N N 40 116.780 116.780 118.590 -1.810 17919 22825 1 56 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.062 0.402 17919 22826 1 56 . 1 1 40 40 GLN C C 40 175.380 175.380 176.233 -0.853 17919 22827 1 56 . 1 1 40 40 GLN CA C 40 55.640 55.640 57.658 -2.018 17919 22828 1 56 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.315 0.825 17919 22829 1 56 . 1 1 40 40 GLN H H 40 7.820 7.820 8.194 -0.374 17919 22830 1 56 . 1 1 41 41 GLN N N 41 117.720 117.720 119.208 -1.488 17919 22831 1 56 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.629 -0.385 17919 22832 1 56 . 1 1 41 41 GLN C C 41 176.300 176.300 175.130 1.170 17919 22833 1 56 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.127 0.343 17919 22834 1 56 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.303 2.347 17919 22835 1 56 . 1 1 41 41 GLN H H 41 7.480 7.480 7.438 0.042 17919 22836 1 56 . 1 1 42 42 ARG N N 42 122.680 122.680 124.465 -1.785 17919 22837 1 56 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.566 -0.066 17919 22838 1 56 . 1 1 42 42 ARG C C 42 174.050 174.050 174.156 -0.106 17919 22839 1 56 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.003 0.047 17919 22840 1 56 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.015 -1.265 17919 22841 1 56 . 1 1 42 42 ARG H H 42 8.530 8.530 8.651 -0.121 17919 22842 1 56 . 1 1 43 43 LEU N N 43 124.040 124.040 125.263 -1.223 17919 22843 1 56 . 1 1 43 43 LEU C C 43 175.290 175.290 175.320 -0.030 17919 22844 1 56 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.760 -0.780 17919 22845 1 56 . 1 1 43 43 LEU CB C 43 45.790 45.790 45.641 0.149 17919 22846 1 56 . 1 1 43 43 LEU H H 43 8.820 8.820 8.749 0.071 17919 22847 1 56 . 1 1 44 44 ILE N N 44 121.920 121.920 120.481 1.439 17919 22848 1 56 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.209 -0.217 17919 22849 1 56 . 1 1 44 44 ILE C C 44 176.060 176.060 174.539 1.521 17919 22850 1 56 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.059 -1.079 17919 22851 1 56 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.824 -0.404 17919 22852 1 56 . 1 1 44 44 ILE H H 44 9.030 9.030 8.370 0.660 17919 22853 1 56 . 1 1 45 45 PHE N N 45 125.390 125.390 126.398 -1.008 17919 22854 1 56 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.110 -0.065 17919 22855 1 56 . 1 1 45 45 PHE C C 45 174.470 174.470 174.496 -0.026 17919 22856 1 56 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.486 0.534 17919 22857 1 56 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.383 0.376 17919 22858 1 56 . 1 1 45 45 PHE H H 45 8.830 8.830 9.279 -0.449 17919 22859 1 56 . 1 1 46 46 ALA N N 46 132.200 132.200 129.547 2.653 17919 22860 1 56 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.654 0.036 17919 22861 1 56 . 1 1 46 46 ALA C C 46 177.290 177.290 177.524 -0.234 17919 22862 1 56 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.901 -0.361 17919 22863 1 56 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.232 0.338 17919 22864 1 56 . 1 1 46 46 ALA H H 46 8.810 8.810 9.015 -0.205 17919 22865 1 56 . 1 1 47 47 GLY N N 47 102.340 102.340 103.589 -1.249 17919 22866 1 56 . 1 1 47 47 GLY C C 47 173.810 173.810 174.407 -0.597 17919 22867 1 56 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.819 0.531 17919 22868 1 56 . 1 1 47 47 GLY H H 47 8.130 8.130 8.381 -0.251 17919 22869 1 56 . 1 1 48 48 LYS N N 48 121.570 121.570 122.617 -1.047 17919 22870 1 56 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.645 -0.023 17919 22871 1 56 . 1 1 48 48 LYS C C 48 174.700 174.700 175.699 -0.999 17919 22872 1 56 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.771 -0.221 17919 22873 1 56 . 1 1 48 48 LYS CB C 48 34.530 34.530 33.859 0.671 17919 22874 1 56 . 1 1 48 48 LYS H H 48 7.980 7.980 8.100 -0.120 17919 22875 1 56 . 1 1 49 49 GLN N N 49 122.410 122.410 125.436 -3.026 17919 22876 1 56 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.173 0.387 17919 22877 1 56 . 1 1 49 49 GLN C C 49 175.670 175.670 175.150 0.520 17919 22878 1 56 . 1 1 49 49 GLN CA C 49 55.740 55.740 57.073 -1.333 17919 22879 1 56 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.111 -0.111 17919 22880 1 56 . 1 1 49 49 GLN H H 49 8.600 8.600 8.713 -0.113 17919 22881 1 56 . 1 1 50 50 LEU N N 50 125.520 125.520 127.319 -1.799 17919 22882 1 56 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.093 -0.003 17919 22883 1 56 . 1 1 50 50 LEU C C 50 176.660 176.660 175.531 1.129 17919 22884 1 56 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.658 0.582 17919 22885 1 56 . 1 1 50 50 LEU CB C 50 41.570 41.570 43.559 -1.990 17919 22886 1 56 . 1 1 50 50 LEU H H 50 8.530 8.530 8.979 -0.449 17919 22887 1 56 . 1 1 51 51 GLU N N 51 122.940 122.940 119.681 3.259 17919 22888 1 56 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.421 0.067 17919 22889 1 56 . 1 1 51 51 GLU C C 51 175.870 175.870 175.722 0.148 17919 22890 1 56 . 1 1 51 51 GLU CA C 51 55.960 55.960 54.964 0.996 17919 22891 1 56 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.207 -0.637 17919 22892 1 56 . 1 1 51 51 GLU H H 51 8.400 8.400 8.138 0.262 17919 22893 1 56 . 1 1 52 52 ASP N N 52 120.030 120.030 124.277 -4.247 17919 22894 1 56 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.380 -0.021 17919 22895 1 56 . 1 1 52 52 ASP C C 52 177.330 177.330 177.213 0.117 17919 22896 1 56 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.690 -0.730 17919 22897 1 56 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.838 0.012 17919 22898 1 56 . 1 1 52 52 ASP H H 52 8.160 8.160 8.757 -0.597 17919 22899 1 56 . 1 1 53 53 GLY N N 53 106.660 106.660 104.383 2.277 17919 22900 1 56 . 1 1 53 53 GLY C C 53 174.870 174.870 174.007 0.863 17919 22901 1 56 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.492 0.678 17919 22902 1 56 . 1 1 53 53 GLY H H 53 9.390 9.390 8.203 1.187 17919 22903 1 56 . 1 1 54 54 ARG N N 54 119.050 119.050 121.447 -2.397 17919 22904 1 56 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.800 -0.104 17919 22905 1 56 . 1 1 54 54 ARG C C 54 175.350 175.350 175.540 -0.190 17919 22906 1 56 . 1 1 54 54 ARG CA C 54 54.390 54.390 53.779 0.611 17919 22907 1 56 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.350 0.300 17919 22908 1 56 . 1 1 54 54 ARG H H 54 7.460 7.460 7.622 -0.162 17919 22909 1 56 . 1 1 55 55 THR N N 55 108.400 108.400 111.356 -2.956 17919 22910 1 56 . 1 1 55 55 THR HA H 55 5.240 5.240 5.062 0.178 17919 22911 1 56 . 1 1 55 55 THR C C 55 176.560 176.560 175.758 0.802 17919 22912 1 56 . 1 1 55 55 THR CA C 55 59.690 59.690 59.743 -0.053 17919 22913 1 56 . 1 1 55 55 THR CB C 55 72.260 72.260 72.085 0.175 17919 22914 1 56 . 1 1 55 55 THR H H 55 8.730 8.730 9.020 -0.290 17919 22915 1 56 . 1 1 56 56 LEU N N 56 117.920 117.920 120.490 -2.570 17919 22916 1 56 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.050 0.010 17919 22917 1 56 . 1 1 56 56 LEU C C 56 180.810 180.810 178.898 1.912 17919 22918 1 56 . 1 1 56 56 LEU CA C 56 58.710 58.710 57.977 0.733 17919 22919 1 56 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.593 -1.223 17919 22920 1 56 . 1 1 56 56 LEU H H 56 8.140 8.140 8.403 -0.263 17919 22921 1 56 . 1 1 57 57 SER N N 57 113.330 113.330 114.848 -1.518 17919 22922 1 56 . 1 1 57 57 SER HA H 57 4.370 4.370 4.143 0.227 17919 22923 1 56 . 1 1 57 57 SER C C 57 178.310 178.310 176.562 1.748 17919 22924 1 56 . 1 1 57 57 SER CA C 57 61.080 61.080 61.586 -0.505 17919 22925 1 56 . 1 1 57 57 SER CB C 57 62.530 62.530 62.013 0.517 17919 22926 1 56 . 1 1 57 57 SER H H 57 8.470 8.470 8.487 -0.017 17919 22927 1 56 . 1 1 58 58 ASP N N 58 124.190 124.190 123.156 1.034 17919 22928 1 56 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.439 -0.143 17919 22929 1 56 . 1 1 58 58 ASP C C 58 177.400 177.400 177.718 -0.318 17919 22930 1 56 . 1 1 58 58 ASP CA C 58 57.180 57.180 57.106 0.074 17919 22931 1 56 . 1 1 58 58 ASP CB C 58 40.100 40.100 41.026 -0.926 17919 22932 1 56 . 1 1 58 58 ASP H H 58 7.930 7.930 7.599 0.331 17919 22933 1 56 . 1 1 59 59 TYR N N 59 115.510 115.510 116.977 -1.467 17919 22934 1 56 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.616 0.054 17919 22935 1 56 . 1 1 59 59 TYR C C 59 174.700 174.700 174.777 -0.077 17919 22936 1 56 . 1 1 59 59 TYR CA C 59 58.250 58.250 58.428 -0.178 17919 22937 1 56 . 1 1 59 59 TYR CB C 59 40.070 40.070 39.043 1.027 17919 22938 1 56 . 1 1 59 59 TYR H H 59 7.250 7.250 7.691 -0.441 17919 22939 1 56 . 1 1 60 60 ASN N N 60 115.900 115.900 114.492 1.408 17919 22940 1 56 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.446 -0.091 17919 22941 1 56 . 1 1 60 60 ASN C C 60 174.340 174.340 174.205 0.135 17919 22942 1 56 . 1 1 60 60 ASN CA C 60 54.120 54.120 53.778 0.342 17919 22943 1 56 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.157 0.252 17919 22944 1 56 . 1 1 60 60 ASN H H 60 8.150 8.150 7.556 0.594 17919 22945 1 56 . 1 1 61 61 ILE N N 61 118.600 118.600 120.822 -2.222 17919 22946 1 56 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.507 -0.114 17919 22947 1 56 . 1 1 61 61 ILE C C 61 174.610 174.610 175.404 -0.794 17919 22948 1 56 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.525 0.895 17919 22949 1 56 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.050 -0.310 17919 22950 1 56 . 1 1 61 61 ILE H H 61 7.250 7.250 8.354 -1.104 17919 22951 1 56 . 1 1 62 62 GLN N N 62 124.740 124.740 126.916 -2.176 17919 22952 1 56 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.678 -0.172 17919 22953 1 56 . 1 1 62 62 GLN C C 62 175.970 175.970 175.454 0.516 17919 22954 1 56 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.001 0.659 17919 22955 1 56 . 1 1 62 62 GLN CB C 62 31.650 31.650 30.842 0.808 17919 22956 1 56 . 1 1 62 62 GLN H H 62 7.610 7.610 8.332 -0.722 17919 22957 1 56 . 1 1 63 63 LYS N N 63 120.300 120.300 120.499 -0.199 17919 22958 1 56 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.905 0.096 17919 22959 1 56 . 1 1 63 63 LYS C C 63 175.810 175.810 176.347 -0.537 17919 22960 1 56 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.450 -0.660 17919 22961 1 56 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.235 1.415 17919 22962 1 56 . 1 1 63 63 LYS H H 63 8.490 8.490 8.723 -0.233 17919 22963 1 56 . 1 1 64 64 GLU N N 64 113.950 113.950 116.841 -2.891 17919 22964 1 56 . 1 1 64 64 GLU HA H 64 3.465 3.465 4.222 -0.757 17919 22965 1 56 . 1 1 64 64 GLU C C 64 175.250 175.250 176.067 -0.817 17919 22966 1 56 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.845 0.045 17919 22967 1 56 . 1 1 64 64 GLU CB C 64 25.900 25.900 27.278 -1.378 17919 22968 1 56 . 1 1 64 64 GLU H H 64 9.280 9.280 8.619 0.661 17919 22969 1 56 . 1 1 65 65 SER N N 65 114.730 114.730 116.077 -1.347 17919 22970 1 56 . 1 1 65 65 SER HA H 65 4.640 4.640 4.516 0.124 17919 22971 1 56 . 1 1 65 65 SER C C 65 172.160 172.160 174.695 -2.535 17919 22972 1 56 . 1 1 65 65 SER CA C 65 60.890 60.890 59.929 0.961 17919 22973 1 56 . 1 1 65 65 SER CB C 65 64.910 64.910 63.681 1.229 17919 22974 1 56 . 1 1 65 65 SER H H 65 7.670 7.670 8.213 -0.543 17919 22975 1 56 . 1 1 66 66 THR N N 66 117.110 117.110 122.218 -5.108 17919 22976 1 56 . 1 1 66 66 THR HA H 66 5.270 5.270 4.872 0.398 17919 22977 1 56 . 1 1 66 66 THR C C 66 173.950 173.950 174.479 -0.529 17919 22978 1 56 . 1 1 66 66 THR CA C 66 62.340 62.340 63.318 -0.978 17919 22979 1 56 . 1 1 66 66 THR CB C 66 70.080 70.080 69.624 0.456 17919 22980 1 56 . 1 1 66 66 THR H H 66 8.730 8.730 8.466 0.264 17919 22981 1 56 . 1 1 67 67 LEU N N 67 127.110 127.110 126.610 0.500 17919 22982 1 56 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.744 0.317 17919 22983 1 56 . 1 1 67 67 LEU C C 67 175.770 175.770 175.563 0.207 17919 22984 1 56 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.625 0.275 17919 22985 1 56 . 1 1 67 67 LEU CB C 67 44.260 44.260 45.126 -0.866 17919 22986 1 56 . 1 1 67 67 LEU H H 67 9.410 9.410 8.687 0.723 17919 22987 1 56 . 1 1 68 68 HIS N N 68 118.380 118.380 118.928 -0.548 17919 22988 1 56 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.041 0.199 17919 22989 1 56 . 1 1 68 68 HIS C C 68 173.150 173.150 175.321 -2.171 17919 22990 1 56 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.343 0.658 17919 22991 1 56 . 1 1 68 68 HIS CB C 68 30.530 30.530 29.071 1.459 17919 22992 1 56 . 1 1 68 68 HIS H H 68 9.230 9.230 8.624 0.606 17919 22993 1 56 . 1 1 69 69 LEU N N 69 124.460 124.460 128.299 -3.839 17919 22994 1 56 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.800 0.390 17919 22995 1 56 . 1 1 69 69 LEU C C 69 175.270 175.270 175.205 0.065 17919 22996 1 56 . 1 1 69 69 LEU CA C 69 53.890 53.890 55.983 -2.094 17919 22997 1 56 . 1 1 69 69 LEU CB C 69 44.380 44.380 42.206 2.174 17919 22998 1 56 . 1 1 69 69 LEU H H 69 8.340 8.340 7.828 0.512 17919 22999 1 56 . 1 1 70 70 VAL N N 70 126.940 126.940 122.469 4.471 17919 23000 1 56 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.638 -0.288 17919 23001 1 56 . 1 1 70 70 VAL C C 70 174.000 174.000 174.074 -0.074 17919 23002 1 56 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.492 1.308 17919 23003 1 56 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.719 -0.809 17919 23004 1 56 . 1 1 70 70 VAL H H 70 9.200 9.200 8.971 0.229 17919 23005 1 56 . 1 1 71 71 LEU N N 71 123.130 123.130 120.858 2.272 17919 23006 1 56 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.017 0.043 17919 23007 1 56 . 1 1 71 71 LEU C C 71 177.830 177.830 176.849 0.981 17919 23008 1 56 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.730 0.210 17919 23009 1 56 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.706 -0.856 17919 23010 1 56 . 1 1 71 71 LEU H H 71 8.120 8.120 8.370 -0.250 17919 23011 1 56 . 1 1 72 72 ARG N N 72 123.490 123.490 124.478 -0.988 17919 23012 1 56 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.526 -0.225 17919 23013 1 56 . 1 1 72 72 ARG C C 72 175.350 175.350 176.014 -0.664 17919 23014 1 56 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.016 -0.406 17919 23015 1 56 . 1 1 72 72 ARG CB C 72 31.350 31.350 29.048 2.302 17919 23016 1 56 . 1 1 72 72 ARG H H 72 8.580 8.580 8.928 -0.348 17919 23017 1 57 . 1 1 2 2 GLN N N 2 123.220 123.220 118.299 4.921 17919 23018 1 57 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.034 0.215 17919 23019 1 57 . 1 1 2 2 GLN C C 2 175.920 175.920 174.678 1.242 17919 23020 1 57 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.553 0.527 17919 23021 1 57 . 1 1 2 2 GLN CB C 2 30.760 30.760 32.429 -1.669 17919 23022 1 57 . 1 1 2 2 GLN H H 2 8.900 8.900 8.137 0.763 17919 23023 1 57 . 1 1 3 3 ILE N N 3 115.340 115.340 117.373 -2.033 17919 23024 1 57 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.139 0.074 17919 23025 1 57 . 1 1 3 3 ILE C C 3 172.450 172.450 173.613 -1.163 17919 23026 1 57 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.637 -0.067 17919 23027 1 57 . 1 1 3 3 ILE CB C 3 42.210 42.210 39.969 2.240 17919 23028 1 57 . 1 1 3 3 ILE H H 3 8.320 8.320 7.761 0.559 17919 23029 1 57 . 1 1 4 4 PHE N N 4 118.110 118.110 119.347 -1.237 17919 23030 1 57 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.117 0.513 17919 23031 1 57 . 1 1 4 4 PHE C C 4 175.320 175.320 175.390 -0.070 17919 23032 1 57 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.849 -0.639 17919 23033 1 57 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.694 -0.214 17919 23034 1 57 . 1 1 4 4 PHE H H 4 8.610 8.610 7.590 1.020 17919 23035 1 57 . 1 1 5 5 VAL N N 5 121.000 121.000 119.887 1.113 17919 23036 1 57 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.947 -0.222 17919 23037 1 57 . 1 1 5 5 VAL C C 5 174.870 174.870 174.956 -0.086 17919 23038 1 57 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.046 -0.426 17919 23039 1 57 . 1 1 5 5 VAL CB C 5 34.230 34.230 35.767 -1.538 17919 23040 1 57 . 1 1 5 5 VAL H H 5 9.300 9.300 8.435 0.865 17919 23041 1 57 . 1 1 6 6 LYS N N 6 127.520 127.520 127.500 0.020 17919 23042 1 57 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.057 0.310 17919 23043 1 57 . 1 1 6 6 LYS C C 6 177.140 177.140 176.707 0.433 17919 23044 1 57 . 1 1 6 6 LYS CA C 6 54.520 54.520 55.386 -0.866 17919 23045 1 57 . 1 1 6 6 LYS CB C 6 35.050 35.050 33.948 1.102 17919 23046 1 57 . 1 1 6 6 LYS H H 6 8.820 8.820 8.768 0.052 17919 23047 1 57 . 1 1 7 7 THR N N 7 115.400 115.400 117.558 -2.158 17919 23048 1 57 . 1 1 7 7 THR HA H 7 4.970 4.970 4.567 0.403 17919 23049 1 57 . 1 1 7 7 THR C C 7 176.910 176.910 176.044 0.866 17919 23050 1 57 . 1 1 7 7 THR CA C 7 60.470 60.470 60.498 -0.028 17919 23051 1 57 . 1 1 7 7 THR CB C 7 70.630 70.630 70.059 0.571 17919 23052 1 57 . 1 1 7 7 THR H H 7 8.730 8.730 8.894 -0.164 17919 23053 1 57 . 1 1 8 8 LEU N N 8 121.330 121.330 120.077 1.253 17919 23054 1 57 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.491 -0.181 17919 23055 1 57 . 1 1 8 8 LEU C C 8 178.800 178.800 177.220 1.580 17919 23056 1 57 . 1 1 8 8 LEU CA C 8 57.580 57.580 56.655 0.925 17919 23057 1 57 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.637 -0.667 17919 23058 1 57 . 1 1 8 8 LEU H H 8 9.100 9.100 8.525 0.575 17919 23059 1 57 . 1 1 9 9 THR N N 9 105.590 105.590 110.430 -4.840 17919 23060 1 57 . 1 1 9 9 THR HA H 9 4.428 4.428 4.416 0.012 17919 23061 1 57 . 1 1 9 9 THR C C 9 175.520 175.520 175.378 0.142 17919 23062 1 57 . 1 1 9 9 THR CA C 9 61.400 61.400 61.672 -0.272 17919 23063 1 57 . 1 1 9 9 THR CB C 9 69.140 69.140 69.173 -0.033 17919 23064 1 57 . 1 1 9 9 THR H H 9 7.630 7.630 7.641 -0.011 17919 23065 1 57 . 1 1 10 10 GLY N N 10 108.890 108.890 111.768 -2.878 17919 23066 1 57 . 1 1 10 10 GLY C C 10 174.070 174.070 173.689 0.381 17919 23067 1 57 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.403 0.057 17919 23068 1 57 . 1 1 10 10 GLY H H 10 7.810 7.810 8.766 -0.956 17919 23069 1 57 . 1 1 11 11 LYS N N 11 121.600 121.600 119.964 1.636 17919 23070 1 57 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.728 -0.367 17919 23071 1 57 . 1 1 11 11 LYS C C 11 175.940 175.940 175.210 0.730 17919 23072 1 57 . 1 1 11 11 LYS CA C 11 56.280 56.280 54.615 1.665 17919 23073 1 57 . 1 1 11 11 LYS CB C 11 33.200 33.200 34.312 -1.113 17919 23074 1 57 . 1 1 11 11 LYS H H 11 7.280 7.280 7.717 -0.437 17919 23075 1 57 . 1 1 12 12 THR N N 12 120.440 120.440 120.229 0.211 17919 23076 1 57 . 1 1 12 12 THR HA H 12 5.046 5.046 4.822 0.224 17919 23077 1 57 . 1 1 12 12 THR C C 12 174.320 174.320 174.738 -0.418 17919 23078 1 57 . 1 1 12 12 THR CA C 12 62.390 62.390 62.506 -0.116 17919 23079 1 57 . 1 1 12 12 THR CB C 12 69.910 69.910 68.710 1.200 17919 23080 1 57 . 1 1 12 12 THR H H 12 8.650 8.650 8.501 0.149 17919 23081 1 57 . 1 1 13 13 ILE N N 13 127.110 127.110 125.374 1.736 17919 23082 1 57 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.670 -0.126 17919 23083 1 57 . 1 1 13 13 ILE C C 13 175.220 175.220 175.173 0.047 17919 23084 1 57 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.639 0.341 17919 23085 1 57 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.596 0.354 17919 23086 1 57 . 1 1 13 13 ILE H H 13 9.450 9.450 8.800 0.650 17919 23087 1 57 . 1 1 14 14 THR N N 14 121.520 121.520 122.626 -1.106 17919 23088 1 57 . 1 1 14 14 THR HA H 14 4.964 4.964 4.640 0.324 17919 23089 1 57 . 1 1 14 14 THR C C 14 173.790 173.790 174.291 -0.501 17919 23090 1 57 . 1 1 14 14 THR CA C 14 61.940 61.940 63.059 -1.119 17919 23091 1 57 . 1 1 14 14 THR CB C 14 69.650 69.650 69.053 0.597 17919 23092 1 57 . 1 1 14 14 THR H H 14 8.710 8.710 8.497 0.213 17919 23093 1 57 . 1 1 15 15 LEU N N 15 124.800 124.800 127.186 -2.386 17919 23094 1 57 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.661 0.119 17919 23095 1 57 . 1 1 15 15 LEU C C 15 174.670 174.670 176.048 -1.378 17919 23096 1 57 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.513 -0.683 17919 23097 1 57 . 1 1 15 15 LEU CB C 15 47.070 47.070 43.034 4.036 17919 23098 1 57 . 1 1 15 15 LEU H H 15 8.710 8.710 8.188 0.522 17919 23099 1 57 . 1 1 16 16 GLU N N 16 122.160 122.160 122.480 -0.320 17919 23100 1 57 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.018 -0.101 17919 23101 1 57 . 1 1 16 16 GLU C C 16 175.860 175.860 175.646 0.214 17919 23102 1 57 . 1 1 16 16 GLU CA C 16 54.820 54.820 54.815 0.005 17919 23103 1 57 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.149 -0.699 17919 23104 1 57 . 1 1 16 16 GLU H H 16 8.140 8.140 8.636 -0.496 17919 23105 1 57 . 1 1 17 17 VAL N N 17 117.210 117.210 117.974 -0.764 17919 23106 1 57 . 1 1 17 17 VAL HA H 17 4.714 4.714 5.059 -0.345 17919 23107 1 57 . 1 1 17 17 VAL C C 17 174.160 174.160 174.264 -0.104 17919 23108 1 57 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.977 -1.547 17919 23109 1 57 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.679 0.721 17919 23110 1 57 . 1 1 17 17 VAL H H 17 8.900 8.900 8.501 0.399 17919 23111 1 57 . 1 1 18 18 GLU N N 18 118.990 118.990 122.107 -3.117 17919 23112 1 57 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.902 0.177 17919 23113 1 57 . 1 1 18 18 GLU C C 18 176.160 176.160 175.231 0.929 17919 23114 1 57 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.259 -0.539 17919 23115 1 57 . 1 1 18 18 GLU CB C 18 30.310 30.310 31.704 -1.395 17919 23116 1 57 . 1 1 18 18 GLU H H 18 8.640 8.640 9.605 -0.965 17919 23117 1 57 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.177 -0.036 17919 23118 1 57 . 1 1 19 19 PRO C C 19 175.310 175.310 178.036 -2.726 17919 23119 1 57 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.955 -0.485 17919 23120 1 57 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.002 -0.051 17919 23121 1 57 . 1 1 20 20 SER N N 20 103.400 103.400 108.478 -5.078 17919 23122 1 57 . 1 1 20 20 SER HA H 20 4.370 4.370 4.332 0.038 17919 23123 1 57 . 1 1 20 20 SER C C 20 174.660 174.660 174.512 0.148 17919 23124 1 57 . 1 1 20 20 SER CA C 20 57.400 57.400 59.040 -1.640 17919 23125 1 57 . 1 1 20 20 SER CB C 20 63.370 63.370 63.026 0.344 17919 23126 1 57 . 1 1 20 20 SER H H 20 7.040 7.040 7.957 -0.917 17919 23127 1 57 . 1 1 21 21 ASP N N 21 123.480 123.480 125.134 -1.654 17919 23128 1 57 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.494 0.201 17919 23129 1 57 . 1 1 21 21 ASP C C 21 176.360 176.360 176.316 0.044 17919 23130 1 57 . 1 1 21 21 ASP CA C 21 55.700 55.700 56.177 -0.477 17919 23131 1 57 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.470 -0.670 17919 23132 1 57 . 1 1 21 21 ASP H H 21 8.030 8.030 8.154 -0.124 17919 23133 1 57 . 1 1 22 22 THR N N 22 108.800 108.800 114.081 -5.281 17919 23134 1 57 . 1 1 22 22 THR HA H 22 4.920 4.920 4.597 0.323 17919 23135 1 57 . 1 1 22 22 THR C C 22 176.750 176.750 176.287 0.463 17919 23136 1 57 . 1 1 22 22 THR CA C 22 59.690 59.690 61.831 -2.141 17919 23137 1 57 . 1 1 22 22 THR CB C 22 71.200 71.200 70.614 0.586 17919 23138 1 57 . 1 1 22 22 THR H H 22 7.900 7.900 8.050 -0.150 17919 23139 1 57 . 1 1 23 23 ILE N N 23 121.190 121.190 121.909 -0.719 17919 23140 1 57 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.721 -0.064 17919 23141 1 57 . 1 1 23 23 ILE C C 23 179.040 179.040 177.791 1.249 17919 23142 1 57 . 1 1 23 23 ILE CA C 23 62.260 62.260 64.102 -1.841 17919 23143 1 57 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.742 -2.392 17919 23144 1 57 . 1 1 23 23 ILE H H 23 8.560 8.560 9.195 -0.635 17919 23145 1 57 . 1 1 24 24 GLU N N 24 120.830 120.830 119.090 1.740 17919 23146 1 57 . 1 1 24 24 GLU HA H 24 3.917 3.917 4.124 -0.207 17919 23147 1 57 . 1 1 24 24 GLU C C 24 178.640 178.640 179.007 -0.367 17919 23148 1 57 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.094 1.126 17919 23149 1 57 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.158 -0.878 17919 23150 1 57 . 1 1 24 24 GLU H H 24 9.760 9.760 8.159 1.601 17919 23151 1 57 . 1 1 25 25 ASN N N 25 120.570 120.570 119.835 0.735 17919 23152 1 57 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.519 0.006 17919 23153 1 57 . 1 1 25 25 ASN C C 25 178.380 178.380 177.801 0.579 17919 23154 1 57 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.494 -0.434 17919 23155 1 57 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.475 -0.025 17919 23156 1 57 . 1 1 25 25 ASN H H 25 7.920 7.920 7.717 0.203 17919 23157 1 57 . 1 1 26 26 VAL N N 26 121.710 121.710 121.599 0.111 17919 23158 1 57 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.631 -0.234 17919 23159 1 57 . 1 1 26 26 VAL C C 26 177.950 177.950 177.440 0.510 17919 23160 1 57 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.336 1.324 17919 23161 1 57 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.364 -0.524 17919 23162 1 57 . 1 1 26 26 VAL H H 26 8.070 8.070 7.946 0.124 17919 23163 1 57 . 1 1 27 27 LYS N N 27 118.860 118.860 118.937 -0.077 17919 23164 1 57 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.014 0.566 17919 23165 1 57 . 1 1 27 27 LYS C C 27 180.550 180.550 178.761 1.789 17919 23166 1 57 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.584 -0.334 17919 23167 1 57 . 1 1 27 27 LYS CB C 27 33.730 33.730 31.988 1.742 17919 23168 1 57 . 1 1 27 27 LYS H H 27 8.560 8.560 8.317 0.243 17919 23169 1 57 . 1 1 28 28 ALA N N 28 123.440 123.440 122.020 1.420 17919 23170 1 57 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.139 0.021 17919 23171 1 57 . 1 1 28 28 ALA C C 28 180.300 180.300 179.492 0.808 17919 23172 1 57 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.988 0.382 17919 23173 1 57 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.225 -0.515 17919 23174 1 57 . 1 1 28 28 ALA H H 28 8.060 8.060 7.846 0.214 17919 23175 1 57 . 1 1 29 29 LYS N N 29 119.940 119.940 119.757 0.183 17919 23176 1 57 . 1 1 29 29 LYS HA H 29 4.207 4.207 3.976 0.231 17919 23177 1 57 . 1 1 29 29 LYS C C 29 180.320 180.320 179.333 0.987 17919 23178 1 57 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.682 -0.032 17919 23179 1 57 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.332 0.958 17919 23180 1 57 . 1 1 29 29 LYS H H 29 7.850 7.850 7.598 0.252 17919 23181 1 57 . 1 1 30 30 ILE N N 30 121.080 121.080 120.166 0.914 17919 23182 1 57 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.569 -0.062 17919 23183 1 57 . 1 1 30 30 ILE C C 30 178.310 178.310 177.461 0.849 17919 23184 1 57 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.562 0.588 17919 23185 1 57 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.538 -0.738 17919 23186 1 57 . 1 1 30 30 ILE H H 30 8.280 8.280 8.010 0.270 17919 23187 1 57 . 1 1 31 31 GLN N N 31 123.490 123.490 119.310 4.180 17919 23188 1 57 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.988 -0.159 17919 23189 1 57 . 1 1 31 31 GLN C C 31 178.890 178.890 178.000 0.890 17919 23190 1 57 . 1 1 31 31 GLN CA C 31 60.000 60.000 58.977 1.024 17919 23191 1 57 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.195 -0.475 17919 23192 1 57 . 1 1 31 31 GLN H H 31 8.580 8.580 8.002 0.578 17919 23193 1 57 . 1 1 32 32 ASP N N 32 119.360 119.360 119.243 0.117 17919 23194 1 57 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.443 -0.089 17919 23195 1 57 . 1 1 32 32 ASP C C 32 177.250 177.250 177.676 -0.426 17919 23196 1 57 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.787 0.403 17919 23197 1 57 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.967 -0.387 17919 23198 1 57 . 1 1 32 32 ASP H H 32 8.010 8.010 8.050 -0.040 17919 23199 1 57 . 1 1 33 33 LYS N N 33 115.130 115.130 117.197 -2.067 17919 23200 1 57 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.412 -0.075 17919 23201 1 57 . 1 1 33 33 LYS C C 33 177.870 177.870 177.455 0.415 17919 23202 1 57 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.933 0.117 17919 23203 1 57 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.722 0.448 17919 23204 1 57 . 1 1 33 33 LYS H H 33 7.430 7.430 7.269 0.161 17919 23205 1 57 . 1 1 34 34 GLU N N 34 113.870 113.870 115.010 -1.140 17919 23206 1 57 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.504 0.121 17919 23207 1 57 . 1 1 34 34 GLU C C 34 177.840 177.840 176.507 1.333 17919 23208 1 57 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.844 -0.674 17919 23209 1 57 . 1 1 34 34 GLU CB C 34 32.660 32.660 32.563 0.097 17919 23210 1 57 . 1 1 34 34 GLU H H 34 8.740 8.740 8.387 0.353 17919 23211 1 57 . 1 1 35 35 GLY N N 35 108.650 108.650 109.365 -0.715 17919 23212 1 57 . 1 1 35 35 GLY C C 35 173.960 173.960 174.661 -0.701 17919 23213 1 57 . 1 1 35 35 GLY CA C 35 46.080 46.080 46.147 -0.067 17919 23214 1 57 . 1 1 35 35 GLY H H 35 8.530 8.530 7.762 0.768 17919 23215 1 57 . 1 1 36 36 ILE N N 36 119.880 119.880 120.470 -0.590 17919 23216 1 57 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.266 0.179 17919 23217 1 57 . 1 1 36 36 ILE C C 36 173.590 173.590 173.803 -0.213 17919 23218 1 57 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.126 -0.376 17919 23219 1 57 . 1 1 36 36 ILE CB C 36 40.580 40.580 37.792 2.788 17919 23220 1 57 . 1 1 36 36 ILE H H 36 6.150 6.150 7.676 -1.526 17919 23221 1 57 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.755 -0.121 17919 23222 1 57 . 1 1 37 37 PRO C C 37 176.940 176.940 176.175 0.765 17919 23223 1 57 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.452 0.208 17919 23224 1 57 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.468 0.382 17919 23225 1 57 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.226 -0.109 17919 23226 1 57 . 1 1 38 38 PRO C C 38 178.320 178.320 178.494 -0.174 17919 23227 1 57 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.624 0.636 17919 23228 1 57 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.951 0.939 17919 23229 1 57 . 1 1 39 39 ASP N N 39 113.380 113.380 116.616 -3.236 17919 23230 1 57 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.325 0.105 17919 23231 1 57 . 1 1 39 39 ASP C C 39 177.090 177.090 177.081 0.009 17919 23232 1 57 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.300 -0.660 17919 23233 1 57 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.323 -0.783 17919 23234 1 57 . 1 1 39 39 ASP H H 39 8.550 8.550 8.747 -0.197 17919 23235 1 57 . 1 1 40 40 GLN N N 40 116.780 116.780 116.375 0.405 17919 23236 1 57 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.308 0.156 17919 23237 1 57 . 1 1 40 40 GLN C C 40 175.380 175.380 176.019 -0.639 17919 23238 1 57 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.511 -0.871 17919 23239 1 57 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.634 0.506 17919 23240 1 57 . 1 1 40 40 GLN H H 40 7.820 7.820 7.891 -0.071 17919 23241 1 57 . 1 1 41 41 GLN N N 41 117.720 117.720 118.798 -1.078 17919 23242 1 57 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.548 -0.304 17919 23243 1 57 . 1 1 41 41 GLN C C 41 176.300 176.300 174.541 1.759 17919 23244 1 57 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.602 0.868 17919 23245 1 57 . 1 1 41 41 GLN CB C 41 31.650 31.650 30.431 1.219 17919 23246 1 57 . 1 1 41 41 GLN H H 41 7.480 7.480 7.777 -0.297 17919 23247 1 57 . 1 1 42 42 ARG N N 42 122.680 122.680 120.638 2.042 17919 23248 1 57 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.796 -0.296 17919 23249 1 57 . 1 1 42 42 ARG C C 42 174.050 174.050 173.912 0.138 17919 23250 1 57 . 1 1 42 42 ARG CA C 42 55.050 55.050 53.904 1.146 17919 23251 1 57 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.624 -1.875 17919 23252 1 57 . 1 1 42 42 ARG H H 42 8.530 8.530 8.079 0.451 17919 23253 1 57 . 1 1 43 43 LEU N N 43 124.040 124.040 124.180 -0.140 17919 23254 1 57 . 1 1 43 43 LEU C C 43 175.290 175.290 175.036 0.254 17919 23255 1 57 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.692 -0.712 17919 23256 1 57 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.674 1.116 17919 23257 1 57 . 1 1 43 43 LEU H H 43 8.820 8.820 8.930 -0.110 17919 23258 1 57 . 1 1 44 44 ILE N N 44 121.920 121.920 122.888 -0.968 17919 23259 1 57 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.767 0.225 17919 23260 1 57 . 1 1 44 44 ILE C C 44 176.060 176.060 174.591 1.469 17919 23261 1 57 . 1 1 44 44 ILE CA C 44 58.980 58.980 58.406 0.574 17919 23262 1 57 . 1 1 44 44 ILE CB C 44 41.420 41.420 37.480 3.940 17919 23263 1 57 . 1 1 44 44 ILE H H 44 9.030 9.030 8.064 0.966 17919 23264 1 57 . 1 1 45 45 PHE N N 45 125.390 125.390 128.106 -2.716 17919 23265 1 57 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.010 0.035 17919 23266 1 57 . 1 1 45 45 PHE C C 45 174.470 174.470 174.766 -0.296 17919 23267 1 57 . 1 1 45 45 PHE CA C 45 57.020 57.020 55.502 1.518 17919 23268 1 57 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.929 0.831 17919 23269 1 57 . 1 1 45 45 PHE H H 45 8.830 8.830 8.852 -0.022 17919 23270 1 57 . 1 1 46 46 ALA N N 46 132.200 132.200 130.139 2.061 17919 23271 1 57 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.708 -0.018 17919 23272 1 57 . 1 1 46 46 ALA C C 46 177.290 177.290 177.695 -0.405 17919 23273 1 57 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.283 0.257 17919 23274 1 57 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.599 -0.030 17919 23275 1 57 . 1 1 46 46 ALA H H 46 8.810 8.810 8.554 0.256 17919 23276 1 57 . 1 1 47 47 GLY N N 47 102.340 102.340 103.399 -1.059 17919 23277 1 57 . 1 1 47 47 GLY C C 47 173.810 173.810 174.035 -0.225 17919 23278 1 57 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.255 0.094 17919 23279 1 57 . 1 1 47 47 GLY H H 47 8.130 8.130 8.570 -0.440 17919 23280 1 57 . 1 1 48 48 LYS N N 48 121.570 121.570 120.056 1.514 17919 23281 1 57 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.552 0.070 17919 23282 1 57 . 1 1 48 48 LYS C C 48 174.700 174.700 175.119 -0.419 17919 23283 1 57 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.841 -0.291 17919 23284 1 57 . 1 1 48 48 LYS CB C 48 34.530 34.530 35.115 -0.585 17919 23285 1 57 . 1 1 48 48 LYS H H 48 7.980 7.980 7.767 0.213 17919 23286 1 57 . 1 1 49 49 GLN N N 49 122.410 122.410 125.136 -2.726 17919 23287 1 57 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.498 0.062 17919 23288 1 57 . 1 1 49 49 GLN C C 49 175.670 175.670 175.899 -0.229 17919 23289 1 57 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.959 -0.219 17919 23290 1 57 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.364 -0.364 17919 23291 1 57 . 1 1 49 49 GLN H H 49 8.600 8.600 8.740 -0.140 17919 23292 1 57 . 1 1 50 50 LEU N N 50 125.520 125.520 128.355 -2.835 17919 23293 1 57 . 1 1 50 50 LEU HA H 50 4.090 4.090 3.553 0.537 17919 23294 1 57 . 1 1 50 50 LEU C C 50 176.660 176.660 175.903 0.757 17919 23295 1 57 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.918 0.322 17919 23296 1 57 . 1 1 50 50 LEU CB C 50 41.570 41.570 40.572 0.998 17919 23297 1 57 . 1 1 50 50 LEU H H 50 8.530 8.530 8.456 0.074 17919 23298 1 57 . 1 1 51 51 GLU N N 51 122.940 122.940 126.270 -3.330 17919 23299 1 57 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.101 0.387 17919 23300 1 57 . 1 1 51 51 GLU C C 51 175.870 175.870 176.484 -0.614 17919 23301 1 57 . 1 1 51 51 GLU CA C 51 55.960 55.960 56.988 -1.028 17919 23302 1 57 . 1 1 51 51 GLU CB C 51 31.570 31.570 30.578 0.991 17919 23303 1 57 . 1 1 51 51 GLU H H 51 8.400 8.400 7.783 0.617 17919 23304 1 57 . 1 1 52 52 ASP N N 52 120.030 120.030 124.426 -4.396 17919 23305 1 57 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.645 -0.286 17919 23306 1 57 . 1 1 52 52 ASP C C 52 177.330 177.330 176.707 0.623 17919 23307 1 57 . 1 1 52 52 ASP CA C 52 56.960 56.960 55.971 0.989 17919 23308 1 57 . 1 1 52 52 ASP CB C 52 40.850 40.850 41.023 -0.173 17919 23309 1 57 . 1 1 52 52 ASP H H 52 8.160 8.160 8.550 -0.390 17919 23310 1 57 . 1 1 53 53 GLY N N 53 106.660 106.660 104.931 1.729 17919 23311 1 57 . 1 1 53 53 GLY C C 53 174.870 174.870 174.530 0.340 17919 23312 1 57 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.452 0.718 17919 23313 1 57 . 1 1 53 53 GLY H H 53 9.390 9.390 8.020 1.370 17919 23314 1 57 . 1 1 54 54 ARG N N 54 119.050 119.050 120.849 -1.799 17919 23315 1 57 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.567 0.128 17919 23316 1 57 . 1 1 54 54 ARG C C 54 175.350 175.350 176.513 -1.163 17919 23317 1 57 . 1 1 54 54 ARG CA C 54 54.390 54.390 55.198 -0.808 17919 23318 1 57 . 1 1 54 54 ARG CB C 54 32.650 32.650 31.451 1.199 17919 23319 1 57 . 1 1 54 54 ARG H H 54 7.460 7.460 7.404 0.056 17919 23320 1 57 . 1 1 55 55 THR N N 55 108.400 108.400 113.168 -4.768 17919 23321 1 57 . 1 1 55 55 THR HA H 55 5.240 5.240 4.580 0.660 17919 23322 1 57 . 1 1 55 55 THR C C 55 176.560 176.560 176.207 0.353 17919 23323 1 57 . 1 1 55 55 THR CA C 55 59.690 59.690 62.117 -2.427 17919 23324 1 57 . 1 1 55 55 THR CB C 55 72.260 72.260 70.272 1.988 17919 23325 1 57 . 1 1 55 55 THR H H 55 8.730 8.730 8.965 -0.235 17919 23326 1 57 . 1 1 56 56 LEU N N 56 117.920 117.920 123.269 -5.349 17919 23327 1 57 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.951 0.109 17919 23328 1 57 . 1 1 56 56 LEU C C 56 180.810 180.810 178.646 2.164 17919 23329 1 57 . 1 1 56 56 LEU CA C 56 58.710 58.710 59.020 -0.310 17919 23330 1 57 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.710 -1.340 17919 23331 1 57 . 1 1 56 56 LEU H H 56 8.140 8.140 8.282 -0.142 17919 23332 1 57 . 1 1 57 57 SER N N 57 113.330 113.330 113.410 -0.080 17919 23333 1 57 . 1 1 57 57 SER HA H 57 4.370 4.370 4.306 0.064 17919 23334 1 57 . 1 1 57 57 SER C C 57 178.310 178.310 176.664 1.646 17919 23335 1 57 . 1 1 57 57 SER CA C 57 61.080 61.080 61.085 -0.005 17919 23336 1 57 . 1 1 57 57 SER CB C 57 62.530 62.530 62.490 0.040 17919 23337 1 57 . 1 1 57 57 SER H H 57 8.470 8.470 7.878 0.592 17919 23338 1 57 . 1 1 58 58 ASP N N 58 124.190 124.190 121.868 2.322 17919 23339 1 57 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.416 -0.120 17919 23340 1 57 . 1 1 58 58 ASP C C 58 177.400 177.400 176.998 0.402 17919 23341 1 57 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.812 0.368 17919 23342 1 57 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.728 -0.628 17919 23343 1 57 . 1 1 58 58 ASP H H 58 7.930 7.930 8.005 -0.075 17919 23344 1 57 . 1 1 59 59 TYR N N 59 115.510 115.510 115.834 -0.324 17919 23345 1 57 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.523 0.147 17919 23346 1 57 . 1 1 59 59 TYR C C 59 174.700 174.700 174.749 -0.049 17919 23347 1 57 . 1 1 59 59 TYR CA C 59 58.250 58.250 58.643 -0.393 17919 23348 1 57 . 1 1 59 59 TYR CB C 59 40.070 40.070 39.071 0.999 17919 23349 1 57 . 1 1 59 59 TYR H H 59 7.250 7.250 7.439 -0.189 17919 23350 1 57 . 1 1 60 60 ASN N N 60 115.900 115.900 118.161 -2.261 17919 23351 1 57 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.381 -0.026 17919 23352 1 57 . 1 1 60 60 ASN C C 60 174.340 174.340 174.732 -0.392 17919 23353 1 57 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.124 -0.004 17919 23354 1 57 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.079 0.331 17919 23355 1 57 . 1 1 60 60 ASN H H 60 8.150 8.150 7.512 0.638 17919 23356 1 57 . 1 1 61 61 ILE N N 61 118.600 118.600 119.893 -1.293 17919 23357 1 57 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.679 -0.286 17919 23358 1 57 . 1 1 61 61 ILE C C 61 174.610 174.610 175.737 -1.127 17919 23359 1 57 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.998 0.422 17919 23360 1 57 . 1 1 61 61 ILE CB C 61 36.740 36.740 36.566 0.174 17919 23361 1 57 . 1 1 61 61 ILE H H 61 7.250 7.250 8.448 -1.198 17919 23362 1 57 . 1 1 62 62 GLN N N 62 124.740 124.740 127.180 -2.440 17919 23363 1 57 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.459 0.047 17919 23364 1 57 . 1 1 62 62 GLN C C 62 175.970 175.970 176.413 -0.443 17919 23365 1 57 . 1 1 62 62 GLN CA C 62 53.660 53.660 54.061 -0.401 17919 23366 1 57 . 1 1 62 62 GLN CB C 62 31.650 31.650 30.167 1.483 17919 23367 1 57 . 1 1 62 62 GLN H H 62 7.610 7.610 8.056 -0.446 17919 23368 1 57 . 1 1 63 63 LYS N N 63 120.300 120.300 119.375 0.925 17919 23369 1 57 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.067 -0.066 17919 23370 1 57 . 1 1 63 63 LYS C C 63 175.810 175.810 177.270 -1.460 17919 23371 1 57 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.837 -0.047 17919 23372 1 57 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.919 0.731 17919 23373 1 57 . 1 1 63 63 LYS H H 63 8.490 8.490 8.637 -0.147 17919 23374 1 57 . 1 1 64 64 GLU N N 64 113.950 113.950 118.575 -4.625 17919 23375 1 57 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.372 0.093 17919 23376 1 57 . 1 1 64 64 GLU C C 64 175.250 175.250 175.624 -0.374 17919 23377 1 57 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.813 0.077 17919 23378 1 57 . 1 1 64 64 GLU CB C 64 25.900 25.900 29.023 -3.123 17919 23379 1 57 . 1 1 64 64 GLU H H 64 9.280 9.280 8.720 0.560 17919 23380 1 57 . 1 1 65 65 SER N N 65 114.730 114.730 116.346 -1.616 17919 23381 1 57 . 1 1 65 65 SER HA H 65 4.640 4.640 4.306 0.334 17919 23382 1 57 . 1 1 65 65 SER C C 65 172.160 172.160 174.053 -1.893 17919 23383 1 57 . 1 1 65 65 SER CA C 65 60.890 60.890 60.078 0.812 17919 23384 1 57 . 1 1 65 65 SER CB C 65 64.910 64.910 63.053 1.857 17919 23385 1 57 . 1 1 65 65 SER H H 65 7.670 7.670 7.456 0.214 17919 23386 1 57 . 1 1 66 66 THR N N 66 117.110 117.110 122.547 -5.437 17919 23387 1 57 . 1 1 66 66 THR HA H 66 5.270 5.270 5.051 0.219 17919 23388 1 57 . 1 1 66 66 THR C C 66 173.950 173.950 174.532 -0.582 17919 23389 1 57 . 1 1 66 66 THR CA C 66 62.340 62.340 62.800 -0.460 17919 23390 1 57 . 1 1 66 66 THR CB C 66 70.080 70.080 69.724 0.356 17919 23391 1 57 . 1 1 66 66 THR H H 66 8.730 8.730 8.306 0.424 17919 23392 1 57 . 1 1 67 67 LEU N N 67 127.110 127.110 127.036 0.074 17919 23393 1 57 . 1 1 67 67 LEU HA H 67 5.060 5.060 5.103 -0.043 17919 23394 1 57 . 1 1 67 67 LEU C C 67 175.770 175.770 175.753 0.017 17919 23395 1 57 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.510 0.390 17919 23396 1 57 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.758 -0.498 17919 23397 1 57 . 1 1 67 67 LEU H H 67 9.410 9.410 8.412 0.998 17919 23398 1 57 . 1 1 68 68 HIS N N 68 118.380 118.380 119.344 -0.964 17919 23399 1 57 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.226 0.014 17919 23400 1 57 . 1 1 68 68 HIS C C 68 173.150 173.150 174.277 -1.127 17919 23401 1 57 . 1 1 68 68 HIS CA C 68 55.000 55.000 53.136 1.864 17919 23402 1 57 . 1 1 68 68 HIS CB C 68 30.530 30.530 29.558 0.972 17919 23403 1 57 . 1 1 68 68 HIS H H 68 9.230 9.230 8.742 0.488 17919 23404 1 57 . 1 1 69 69 LEU N N 69 124.460 124.460 129.253 -4.793 17919 23405 1 57 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.398 0.792 17919 23406 1 57 . 1 1 69 69 LEU C C 69 175.270 175.270 175.678 -0.408 17919 23407 1 57 . 1 1 69 69 LEU CA C 69 53.890 53.890 56.213 -2.323 17919 23408 1 57 . 1 1 69 69 LEU CB C 69 44.380 44.380 42.505 1.875 17919 23409 1 57 . 1 1 69 69 LEU H H 69 8.340 8.340 8.242 0.098 17919 23410 1 57 . 1 1 70 70 VAL N N 70 126.940 126.940 122.324 4.616 17919 23411 1 57 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.533 -0.183 17919 23412 1 57 . 1 1 70 70 VAL C C 70 174.000 174.000 173.909 0.091 17919 23413 1 57 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.184 1.615 17919 23414 1 57 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.732 -0.822 17919 23415 1 57 . 1 1 70 70 VAL H H 70 9.200 9.200 8.445 0.755 17919 23416 1 57 . 1 1 71 71 LEU N N 71 123.130 123.130 122.256 0.874 17919 23417 1 57 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.484 0.576 17919 23418 1 57 . 1 1 71 71 LEU C C 71 177.830 177.830 177.249 0.581 17919 23419 1 57 . 1 1 71 71 LEU CA C 71 53.940 53.940 55.002 -1.062 17919 23420 1 57 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.642 0.208 17919 23421 1 57 . 1 1 71 71 LEU H H 71 8.120 8.120 8.485 -0.365 17919 23422 1 57 . 1 1 72 72 ARG N N 72 123.490 123.490 121.532 1.958 17919 23423 1 57 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.450 -0.149 17919 23424 1 57 . 1 1 72 72 ARG C C 72 175.350 175.350 175.110 0.240 17919 23425 1 57 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.992 -0.382 17919 23426 1 57 . 1 1 72 72 ARG CB C 72 31.350 31.350 31.522 -0.172 17919 23427 1 57 . 1 1 72 72 ARG H H 72 8.580 8.580 8.013 0.567 17919 23428 1 58 . 1 1 2 2 GLN N N 2 123.220 123.220 120.322 2.898 17919 23429 1 58 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.298 -0.049 17919 23430 1 58 . 1 1 2 2 GLN C C 2 175.920 175.920 175.860 0.060 17919 23431 1 58 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.944 0.137 17919 23432 1 58 . 1 1 2 2 GLN CB C 2 30.760 30.760 29.949 0.811 17919 23433 1 58 . 1 1 2 2 GLN H H 2 8.900 8.900 8.427 0.473 17919 23434 1 58 . 1 1 3 3 ILE N N 3 115.340 115.340 114.753 0.587 17919 23435 1 58 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.544 -0.331 17919 23436 1 58 . 1 1 3 3 ILE C C 3 172.450 172.450 173.767 -1.317 17919 23437 1 58 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.245 0.325 17919 23438 1 58 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.581 0.629 17919 23439 1 58 . 1 1 3 3 ILE H H 3 8.320 8.320 7.951 0.369 17919 23440 1 58 . 1 1 4 4 PHE N N 4 118.110 118.110 120.686 -2.576 17919 23441 1 58 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.324 0.306 17919 23442 1 58 . 1 1 4 4 PHE C C 4 175.320 175.320 175.316 0.004 17919 23443 1 58 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.185 0.024 17919 23444 1 58 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.231 0.249 17919 23445 1 58 . 1 1 4 4 PHE H H 4 8.610 8.610 8.750 -0.140 17919 23446 1 58 . 1 1 5 5 VAL N N 5 121.000 121.000 121.826 -0.826 17919 23447 1 58 . 1 1 5 5 VAL HA H 5 4.725 4.725 5.095 -0.370 17919 23448 1 58 . 1 1 5 5 VAL C C 5 174.870 174.870 175.599 -0.729 17919 23449 1 58 . 1 1 5 5 VAL CA C 5 60.620 60.620 60.843 -0.223 17919 23450 1 58 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.394 0.836 17919 23451 1 58 . 1 1 5 5 VAL H H 5 9.300 9.300 9.084 0.216 17919 23452 1 58 . 1 1 6 6 LYS N N 6 127.520 127.520 127.945 -0.425 17919 23453 1 58 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.269 0.098 17919 23454 1 58 . 1 1 6 6 LYS C C 6 177.140 177.140 177.237 -0.097 17919 23455 1 58 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.312 0.208 17919 23456 1 58 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.209 0.841 17919 23457 1 58 . 1 1 6 6 LYS H H 6 8.820 8.820 8.502 0.318 17919 23458 1 58 . 1 1 7 7 THR N N 7 115.400 115.400 116.599 -1.199 17919 23459 1 58 . 1 1 7 7 THR HA H 7 4.970 4.970 4.212 0.758 17919 23460 1 58 . 1 1 7 7 THR C C 7 176.910 176.910 176.562 0.348 17919 23461 1 58 . 1 1 7 7 THR CA C 7 60.470 60.470 61.521 -1.051 17919 23462 1 58 . 1 1 7 7 THR CB C 7 70.630 70.630 69.745 0.885 17919 23463 1 58 . 1 1 7 7 THR H H 7 8.730 8.730 8.102 0.628 17919 23464 1 58 . 1 1 8 8 LEU N N 8 121.330 121.330 116.837 4.493 17919 23465 1 58 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.310 0.000 17919 23466 1 58 . 1 1 8 8 LEU C C 8 178.800 178.800 177.486 1.314 17919 23467 1 58 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.510 0.070 17919 23468 1 58 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.611 0.359 17919 23469 1 58 . 1 1 8 8 LEU H H 8 9.100 9.100 8.424 0.676 17919 23470 1 58 . 1 1 9 9 THR N N 9 105.590 105.590 107.544 -1.954 17919 23471 1 58 . 1 1 9 9 THR HA H 9 4.428 4.428 4.341 0.087 17919 23472 1 58 . 1 1 9 9 THR C C 9 175.520 175.520 175.620 -0.100 17919 23473 1 58 . 1 1 9 9 THR CA C 9 61.400 61.400 61.268 0.132 17919 23474 1 58 . 1 1 9 9 THR CB C 9 69.140 69.140 68.609 0.531 17919 23475 1 58 . 1 1 9 9 THR H H 9 7.630 7.630 7.488 0.142 17919 23476 1 58 . 1 1 10 10 GLY N N 10 108.890 108.890 110.831 -1.941 17919 23477 1 58 . 1 1 10 10 GLY C C 10 174.070 174.070 173.797 0.273 17919 23478 1 58 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.181 0.279 17919 23479 1 58 . 1 1 10 10 GLY H H 10 7.810 7.810 7.884 -0.074 17919 23480 1 58 . 1 1 11 11 LYS N N 11 121.600 121.600 121.091 0.509 17919 23481 1 58 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.402 -0.041 17919 23482 1 58 . 1 1 11 11 LYS C C 11 175.940 175.940 176.095 -0.155 17919 23483 1 58 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.169 0.111 17919 23484 1 58 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.000 0.200 17919 23485 1 58 . 1 1 11 11 LYS H H 11 7.280 7.280 7.921 -0.641 17919 23486 1 58 . 1 1 12 12 THR N N 12 120.440 120.440 118.102 2.338 17919 23487 1 58 . 1 1 12 12 THR HA H 12 5.046 5.046 4.833 0.213 17919 23488 1 58 . 1 1 12 12 THR C C 12 174.320 174.320 174.324 -0.004 17919 23489 1 58 . 1 1 12 12 THR CA C 12 62.390 62.390 62.489 -0.099 17919 23490 1 58 . 1 1 12 12 THR CB C 12 69.910 69.910 69.514 0.396 17919 23491 1 58 . 1 1 12 12 THR H H 12 8.650 8.650 8.285 0.365 17919 23492 1 58 . 1 1 13 13 ILE N N 13 127.110 127.110 127.077 0.033 17919 23493 1 58 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.566 -0.022 17919 23494 1 58 . 1 1 13 13 ILE C C 13 175.220 175.220 174.398 0.822 17919 23495 1 58 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.271 -0.291 17919 23496 1 58 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.649 0.301 17919 23497 1 58 . 1 1 13 13 ILE H H 13 9.450 9.450 8.769 0.681 17919 23498 1 58 . 1 1 14 14 THR N N 14 121.520 121.520 123.569 -2.049 17919 23499 1 58 . 1 1 14 14 THR HA H 14 4.964 4.964 4.925 0.039 17919 23500 1 58 . 1 1 14 14 THR C C 14 173.790 173.790 174.204 -0.414 17919 23501 1 58 . 1 1 14 14 THR CA C 14 61.940 61.940 62.255 -0.315 17919 23502 1 58 . 1 1 14 14 THR CB C 14 69.650 69.650 69.662 -0.012 17919 23503 1 58 . 1 1 14 14 THR H H 14 8.710 8.710 8.429 0.281 17919 23504 1 58 . 1 1 15 15 LEU N N 15 124.800 124.800 129.057 -4.257 17919 23505 1 58 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.702 0.078 17919 23506 1 58 . 1 1 15 15 LEU C C 15 174.670 174.670 175.211 -0.541 17919 23507 1 58 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.832 -1.002 17919 23508 1 58 . 1 1 15 15 LEU CB C 15 47.070 47.070 44.898 2.172 17919 23509 1 58 . 1 1 15 15 LEU H H 15 8.710 8.710 8.528 0.182 17919 23510 1 58 . 1 1 16 16 GLU N N 16 122.160 122.160 123.863 -1.703 17919 23511 1 58 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.546 0.371 17919 23512 1 58 . 1 1 16 16 GLU C C 16 175.860 175.860 175.847 0.013 17919 23513 1 58 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.736 -0.916 17919 23514 1 58 . 1 1 16 16 GLU CB C 16 29.450 29.450 29.826 -0.376 17919 23515 1 58 . 1 1 16 16 GLU H H 16 8.140 8.140 8.688 -0.548 17919 23516 1 58 . 1 1 17 17 VAL N N 17 117.210 117.210 119.936 -2.726 17919 23517 1 58 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.548 0.166 17919 23518 1 58 . 1 1 17 17 VAL C C 17 174.160 174.160 174.663 -0.503 17919 23519 1 58 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.964 -0.534 17919 23520 1 58 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.507 0.893 17919 23521 1 58 . 1 1 17 17 VAL H H 17 8.900 8.900 8.939 -0.039 17919 23522 1 58 . 1 1 18 18 GLU N N 18 118.990 118.990 121.818 -2.828 17919 23523 1 58 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.936 0.143 17919 23524 1 58 . 1 1 18 18 GLU C C 18 176.160 176.160 175.856 0.304 17919 23525 1 58 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.868 -0.148 17919 23526 1 58 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.227 0.083 17919 23527 1 58 . 1 1 18 18 GLU H H 18 8.640 8.640 8.923 -0.283 17919 23528 1 58 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.203 -0.062 17919 23529 1 58 . 1 1 19 19 PRO C C 19 175.310 175.310 177.816 -2.506 17919 23530 1 58 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.945 -0.475 17919 23531 1 58 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.027 -0.077 17919 23532 1 58 . 1 1 20 20 SER N N 20 103.400 103.400 110.550 -7.150 17919 23533 1 58 . 1 1 20 20 SER HA H 20 4.370 4.370 4.345 0.025 17919 23534 1 58 . 1 1 20 20 SER C C 20 174.660 174.660 174.594 0.066 17919 23535 1 58 . 1 1 20 20 SER CA C 20 57.400 57.400 59.518 -2.118 17919 23536 1 58 . 1 1 20 20 SER CB C 20 63.370 63.370 62.697 0.673 17919 23537 1 58 . 1 1 20 20 SER H H 20 7.040 7.040 8.100 -1.060 17919 23538 1 58 . 1 1 21 21 ASP N N 21 123.480 123.480 123.021 0.459 17919 23539 1 58 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.516 0.179 17919 23540 1 58 . 1 1 21 21 ASP C C 21 176.360 176.360 175.472 0.888 17919 23541 1 58 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.903 -0.203 17919 23542 1 58 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.114 -0.314 17919 23543 1 58 . 1 1 21 21 ASP H H 21 8.030 8.030 7.542 0.488 17919 23544 1 58 . 1 1 22 22 THR N N 22 108.800 108.800 114.546 -5.746 17919 23545 1 58 . 1 1 22 22 THR HA H 22 4.920 4.920 4.211 0.709 17919 23546 1 58 . 1 1 22 22 THR C C 22 176.750 176.750 175.412 1.338 17919 23547 1 58 . 1 1 22 22 THR CA C 22 59.690 59.690 62.239 -2.549 17919 23548 1 58 . 1 1 22 22 THR CB C 22 71.200 71.200 70.043 1.157 17919 23549 1 58 . 1 1 22 22 THR H H 22 7.900 7.900 8.183 -0.283 17919 23550 1 58 . 1 1 23 23 ILE N N 23 121.190 121.190 124.991 -3.801 17919 23551 1 58 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.653 0.004 17919 23552 1 58 . 1 1 23 23 ILE C C 23 179.040 179.040 177.523 1.517 17919 23553 1 58 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.821 -0.561 17919 23554 1 58 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.490 -2.140 17919 23555 1 58 . 1 1 23 23 ILE H H 23 8.560 8.560 8.505 0.055 17919 23556 1 58 . 1 1 24 24 GLU N N 24 120.830 120.830 120.807 0.023 17919 23557 1 58 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.801 0.116 17919 23558 1 58 . 1 1 24 24 GLU C C 24 178.640 178.640 178.604 0.036 17919 23559 1 58 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.208 0.012 17919 23560 1 58 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.124 -0.844 17919 23561 1 58 . 1 1 24 24 GLU H H 24 9.760 9.760 7.907 1.853 17919 23562 1 58 . 1 1 25 25 ASN N N 25 120.570 120.570 116.566 4.004 17919 23563 1 58 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.604 -0.079 17919 23564 1 58 . 1 1 25 25 ASN C C 25 178.380 178.380 177.905 0.475 17919 23565 1 58 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.721 0.339 17919 23566 1 58 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.515 -0.065 17919 23567 1 58 . 1 1 25 25 ASN H H 25 7.920 7.920 8.253 -0.333 17919 23568 1 58 . 1 1 26 26 VAL N N 26 121.710 121.710 120.680 1.030 17919 23569 1 58 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.741 -0.344 17919 23570 1 58 . 1 1 26 26 VAL C C 26 177.950 177.950 177.885 0.065 17919 23571 1 58 . 1 1 26 26 VAL CA C 26 67.660 67.660 65.777 1.883 17919 23572 1 58 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.184 -0.344 17919 23573 1 58 . 1 1 26 26 VAL H H 26 8.070 8.070 7.765 0.305 17919 23574 1 58 . 1 1 27 27 LYS N N 27 118.860 118.860 120.801 -1.941 17919 23575 1 58 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.057 0.523 17919 23576 1 58 . 1 1 27 27 LYS C C 27 180.550 180.550 179.022 1.528 17919 23577 1 58 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.870 -0.620 17919 23578 1 58 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.239 1.491 17919 23579 1 58 . 1 1 27 27 LYS H H 27 8.560 8.560 8.444 0.116 17919 23580 1 58 . 1 1 28 28 ALA N N 28 123.440 123.440 120.446 2.994 17919 23581 1 58 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.141 0.019 17919 23582 1 58 . 1 1 28 28 ALA C C 28 180.300 180.300 179.345 0.955 17919 23583 1 58 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.932 0.438 17919 23584 1 58 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.318 -0.608 17919 23585 1 58 . 1 1 28 28 ALA H H 28 8.060 8.060 8.363 -0.303 17919 23586 1 58 . 1 1 29 29 LYS N N 29 119.940 119.940 119.660 0.280 17919 23587 1 58 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.014 0.193 17919 23588 1 58 . 1 1 29 29 LYS C C 29 180.320 180.320 179.046 1.274 17919 23589 1 58 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.291 0.359 17919 23590 1 58 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.308 0.982 17919 23591 1 58 . 1 1 29 29 LYS H H 29 7.850 7.850 7.515 0.335 17919 23592 1 58 . 1 1 30 30 ILE N N 30 121.080 121.080 120.916 0.164 17919 23593 1 58 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.544 -0.037 17919 23594 1 58 . 1 1 30 30 ILE C C 30 178.310 178.310 177.583 0.727 17919 23595 1 58 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.759 0.391 17919 23596 1 58 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.681 -0.881 17919 23597 1 58 . 1 1 30 30 ILE H H 30 8.280 8.280 7.802 0.478 17919 23598 1 58 . 1 1 31 31 GLN N N 31 123.490 123.490 119.894 3.596 17919 23599 1 58 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.006 -0.177 17919 23600 1 58 . 1 1 31 31 GLN C C 31 178.890 178.890 177.949 0.941 17919 23601 1 58 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.128 0.872 17919 23602 1 58 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.503 -0.783 17919 23603 1 58 . 1 1 31 31 GLN H H 31 8.580 8.580 8.335 0.245 17919 23604 1 58 . 1 1 32 32 ASP N N 32 119.360 119.360 118.113 1.247 17919 23605 1 58 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.411 -0.057 17919 23606 1 58 . 1 1 32 32 ASP C C 32 177.250 177.250 178.137 -0.887 17919 23607 1 58 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.677 0.513 17919 23608 1 58 . 1 1 32 32 ASP CB C 32 40.580 40.580 41.032 -0.452 17919 23609 1 58 . 1 1 32 32 ASP H H 32 8.010 8.010 8.050 -0.040 17919 23610 1 58 . 1 1 33 33 LYS N N 33 115.130 115.130 118.719 -3.589 17919 23611 1 58 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.243 0.094 17919 23612 1 58 . 1 1 33 33 LYS C C 33 177.870 177.870 177.964 -0.094 17919 23613 1 58 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.771 0.279 17919 23614 1 58 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.274 0.896 17919 23615 1 58 . 1 1 33 33 LYS H H 33 7.430 7.430 7.700 -0.270 17919 23616 1 58 . 1 1 34 34 GLU N N 34 113.870 113.870 114.354 -0.484 17919 23617 1 58 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.521 0.104 17919 23618 1 58 . 1 1 34 34 GLU C C 34 177.840 177.840 176.818 1.022 17919 23619 1 58 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.063 -0.893 17919 23620 1 58 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.348 1.312 17919 23621 1 58 . 1 1 34 34 GLU H H 34 8.740 8.740 8.170 0.570 17919 23622 1 58 . 1 1 35 35 GLY N N 35 108.650 108.650 108.542 0.108 17919 23623 1 58 . 1 1 35 35 GLY C C 35 173.960 173.960 174.547 -0.587 17919 23624 1 58 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.585 0.495 17919 23625 1 58 . 1 1 35 35 GLY H H 35 8.530 8.530 7.984 0.546 17919 23626 1 58 . 1 1 36 36 ILE N N 36 119.880 119.880 121.327 -1.447 17919 23627 1 58 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.301 0.144 17919 23628 1 58 . 1 1 36 36 ILE C C 36 173.590 173.590 174.221 -0.631 17919 23629 1 58 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.300 -0.550 17919 23630 1 58 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.055 2.525 17919 23631 1 58 . 1 1 36 36 ILE H H 36 6.150 6.150 7.601 -1.451 17919 23632 1 58 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.566 0.068 17919 23633 1 58 . 1 1 37 37 PRO C C 37 176.940 176.940 176.228 0.712 17919 23634 1 58 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.676 -0.016 17919 23635 1 58 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.455 0.395 17919 23636 1 58 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.338 -0.221 17919 23637 1 58 . 1 1 38 38 PRO C C 38 178.320 178.320 177.446 0.874 17919 23638 1 58 . 1 1 38 38 PRO CA C 38 66.260 66.260 64.925 1.335 17919 23639 1 58 . 1 1 38 38 PRO CB C 38 32.890 32.890 32.010 0.880 17919 23640 1 58 . 1 1 39 39 ASP N N 39 113.380 113.380 116.664 -3.284 17919 23641 1 58 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.388 0.042 17919 23642 1 58 . 1 1 39 39 ASP C C 39 177.090 177.090 177.869 -0.779 17919 23643 1 58 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.782 -1.142 17919 23644 1 58 . 1 1 39 39 ASP CB C 39 39.540 39.540 39.388 0.152 17919 23645 1 58 . 1 1 39 39 ASP H H 39 8.550 8.550 8.939 -0.389 17919 23646 1 58 . 1 1 40 40 GLN N N 40 116.780 116.780 119.554 -2.774 17919 23647 1 58 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.275 0.189 17919 23648 1 58 . 1 1 40 40 GLN C C 40 175.380 175.380 176.118 -0.738 17919 23649 1 58 . 1 1 40 40 GLN CA C 40 55.640 55.640 57.007 -1.367 17919 23650 1 58 . 1 1 40 40 GLN CB C 40 30.140 30.140 30.205 -0.065 17919 23651 1 58 . 1 1 40 40 GLN H H 40 7.820 7.820 7.539 0.281 17919 23652 1 58 . 1 1 41 41 GLN N N 41 117.720 117.720 120.341 -2.621 17919 23653 1 58 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.218 0.026 17919 23654 1 58 . 1 1 41 41 GLN C C 41 176.300 176.300 175.225 1.075 17919 23655 1 58 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.821 -0.351 17919 23656 1 58 . 1 1 41 41 GLN CB C 41 31.650 31.650 28.552 3.098 17919 23657 1 58 . 1 1 41 41 GLN H H 41 7.480 7.480 7.407 0.073 17919 23658 1 58 . 1 1 42 42 ARG N N 42 122.680 122.680 124.366 -1.686 17919 23659 1 58 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.560 -0.060 17919 23660 1 58 . 1 1 42 42 ARG C C 42 174.050 174.050 174.757 -0.707 17919 23661 1 58 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.170 -0.120 17919 23662 1 58 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.446 -0.696 17919 23663 1 58 . 1 1 42 42 ARG H H 42 8.530 8.530 8.234 0.296 17919 23664 1 58 . 1 1 43 43 LEU N N 43 124.040 124.040 124.552 -0.512 17919 23665 1 58 . 1 1 43 43 LEU C C 43 175.290 175.290 175.771 -0.481 17919 23666 1 58 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.770 -0.790 17919 23667 1 58 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.283 1.507 17919 23668 1 58 . 1 1 43 43 LEU H H 43 8.820 8.820 8.651 0.169 17919 23669 1 58 . 1 1 44 44 ILE N N 44 121.920 121.920 122.166 -0.246 17919 23670 1 58 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.441 0.551 17919 23671 1 58 . 1 1 44 44 ILE C C 44 176.060 176.060 174.154 1.906 17919 23672 1 58 . 1 1 44 44 ILE CA C 44 58.980 58.980 61.188 -2.208 17919 23673 1 58 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.573 -0.153 17919 23674 1 58 . 1 1 44 44 ILE H H 44 9.030 9.030 9.141 -0.111 17919 23675 1 58 . 1 1 45 45 PHE N N 45 125.390 125.390 129.064 -3.674 17919 23676 1 58 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.102 -0.057 17919 23677 1 58 . 1 1 45 45 PHE C C 45 174.470 174.470 175.255 -0.785 17919 23678 1 58 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.999 0.021 17919 23679 1 58 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.307 1.453 17919 23680 1 58 . 1 1 45 45 PHE H H 45 8.830 8.830 8.168 0.662 17919 23681 1 58 . 1 1 46 46 ALA N N 46 132.200 132.200 122.680 9.520 17919 23682 1 58 . 1 1 46 46 ALA HA H 46 3.690 3.690 4.309 -0.619 17919 23683 1 58 . 1 1 46 46 ALA C C 46 177.290 177.290 177.460 -0.170 17919 23684 1 58 . 1 1 46 46 ALA CA C 46 52.540 52.540 51.412 1.128 17919 23685 1 58 . 1 1 46 46 ALA CB C 46 16.570 16.570 17.416 -0.846 17919 23686 1 58 . 1 1 46 46 ALA H H 46 8.810 8.810 8.405 0.405 17919 23687 1 58 . 1 1 47 47 GLY N N 47 102.340 102.340 107.710 -5.370 17919 23688 1 58 . 1 1 47 47 GLY C C 47 173.810 173.810 174.217 -0.407 17919 23689 1 58 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.289 0.061 17919 23690 1 58 . 1 1 47 47 GLY H H 47 8.130 8.130 8.207 -0.077 17919 23691 1 58 . 1 1 48 48 LYS N N 48 121.570 121.570 121.765 -0.195 17919 23692 1 58 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.615 0.007 17919 23693 1 58 . 1 1 48 48 LYS C C 48 174.700 174.700 175.404 -0.704 17919 23694 1 58 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.286 -0.737 17919 23695 1 58 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.150 0.380 17919 23696 1 58 . 1 1 48 48 LYS H H 48 7.980 7.980 7.751 0.229 17919 23697 1 58 . 1 1 49 49 GLN N N 49 122.410 122.410 123.490 -1.080 17919 23698 1 58 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.662 -0.102 17919 23699 1 58 . 1 1 49 49 GLN C C 49 175.670 175.670 175.695 -0.025 17919 23700 1 58 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.404 0.337 17919 23701 1 58 . 1 1 49 49 GLN CB C 49 29.000 29.000 28.985 0.015 17919 23702 1 58 . 1 1 49 49 GLN H H 49 8.600 8.600 8.493 0.107 17919 23703 1 58 . 1 1 50 50 LEU N N 50 125.520 125.520 125.847 -0.327 17919 23704 1 58 . 1 1 50 50 LEU HA H 50 4.090 4.090 3.946 0.144 17919 23705 1 58 . 1 1 50 50 LEU C C 50 176.660 176.660 176.491 0.169 17919 23706 1 58 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.359 -0.119 17919 23707 1 58 . 1 1 50 50 LEU CB C 50 41.570 41.570 40.521 1.049 17919 23708 1 58 . 1 1 50 50 LEU H H 50 8.530 8.530 8.133 0.397 17919 23709 1 58 . 1 1 51 51 GLU N N 51 122.940 122.940 124.305 -1.365 17919 23710 1 58 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.398 0.090 17919 23711 1 58 . 1 1 51 51 GLU C C 51 175.870 175.870 177.308 -1.438 17919 23712 1 58 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.051 0.909 17919 23713 1 58 . 1 1 51 51 GLU CB C 51 31.570 31.570 30.795 0.775 17919 23714 1 58 . 1 1 51 51 GLU H H 51 8.400 8.400 8.415 -0.015 17919 23715 1 58 . 1 1 52 52 ASP N N 52 120.030 120.030 122.503 -2.473 17919 23716 1 58 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.469 -0.110 17919 23717 1 58 . 1 1 52 52 ASP C C 52 177.330 177.330 177.835 -0.505 17919 23718 1 58 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.753 -0.793 17919 23719 1 58 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.887 -0.037 17919 23720 1 58 . 1 1 52 52 ASP H H 52 8.160 8.160 8.885 -0.725 17919 23721 1 58 . 1 1 53 53 GLY N N 53 106.660 106.660 105.416 1.244 17919 23722 1 58 . 1 1 53 53 GLY C C 53 174.870 174.870 174.084 0.786 17919 23723 1 58 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.536 0.633 17919 23724 1 58 . 1 1 53 53 GLY H H 53 9.390 9.390 8.209 1.181 17919 23725 1 58 . 1 1 54 54 ARG N N 54 119.050 119.050 121.781 -2.731 17919 23726 1 58 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.582 0.113 17919 23727 1 58 . 1 1 54 54 ARG C C 54 175.350 175.350 175.405 -0.055 17919 23728 1 58 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.774 -0.384 17919 23729 1 58 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.258 0.392 17919 23730 1 58 . 1 1 54 54 ARG H H 54 7.460 7.460 7.337 0.123 17919 23731 1 58 . 1 1 55 55 THR N N 55 108.400 108.400 115.819 -7.419 17919 23732 1 58 . 1 1 55 55 THR HA H 55 5.240 5.240 5.148 0.092 17919 23733 1 58 . 1 1 55 55 THR C C 55 176.560 176.560 175.730 0.830 17919 23734 1 58 . 1 1 55 55 THR CA C 55 59.690 59.690 59.970 -0.280 17919 23735 1 58 . 1 1 55 55 THR CB C 55 72.260 72.260 71.308 0.952 17919 23736 1 58 . 1 1 55 55 THR H H 55 8.730 8.730 8.170 0.560 17919 23737 1 58 . 1 1 56 56 LEU N N 56 117.920 117.920 121.520 -3.600 17919 23738 1 58 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.163 -0.103 17919 23739 1 58 . 1 1 56 56 LEU C C 56 180.810 180.810 178.748 2.062 17919 23740 1 58 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.083 0.627 17919 23741 1 58 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.454 -1.084 17919 23742 1 58 . 1 1 56 56 LEU H H 56 8.140 8.140 8.494 -0.354 17919 23743 1 58 . 1 1 57 57 SER N N 57 113.330 113.330 113.824 -0.494 17919 23744 1 58 . 1 1 57 57 SER HA H 57 4.370 4.370 4.221 0.149 17919 23745 1 58 . 1 1 57 57 SER C C 57 178.310 178.310 176.675 1.635 17919 23746 1 58 . 1 1 57 57 SER CA C 57 61.080 61.080 60.983 0.097 17919 23747 1 58 . 1 1 57 57 SER CB C 57 62.530 62.530 62.948 -0.418 17919 23748 1 58 . 1 1 57 57 SER H H 57 8.470 8.470 7.947 0.523 17919 23749 1 58 . 1 1 58 58 ASP N N 58 124.190 124.190 122.822 1.368 17919 23750 1 58 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.416 -0.120 17919 23751 1 58 . 1 1 58 58 ASP C C 58 177.400 177.400 177.896 -0.496 17919 23752 1 58 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.797 0.383 17919 23753 1 58 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.533 -0.433 17919 23754 1 58 . 1 1 58 58 ASP H H 58 7.930 7.930 7.669 0.261 17919 23755 1 58 . 1 1 59 59 TYR N N 59 115.510 115.510 117.448 -1.938 17919 23756 1 58 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.579 0.091 17919 23757 1 58 . 1 1 59 59 TYR C C 59 174.700 174.700 174.721 -0.021 17919 23758 1 58 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.282 0.968 17919 23759 1 58 . 1 1 59 59 TYR CB C 59 40.070 40.070 37.686 2.384 17919 23760 1 58 . 1 1 59 59 TYR H H 59 7.250 7.250 7.362 -0.112 17919 23761 1 58 . 1 1 60 60 ASN N N 60 115.900 115.900 115.587 0.313 17919 23762 1 58 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.377 -0.022 17919 23763 1 58 . 1 1 60 60 ASN C C 60 174.340 174.340 174.430 -0.090 17919 23764 1 58 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.147 -0.027 17919 23765 1 58 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.224 0.186 17919 23766 1 58 . 1 1 60 60 ASN H H 60 8.150 8.150 7.836 0.314 17919 23767 1 58 . 1 1 61 61 ILE N N 61 118.600 118.600 119.961 -1.361 17919 23768 1 58 . 1 1 61 61 ILE HA H 61 3.393 3.393 4.045 -0.652 17919 23769 1 58 . 1 1 61 61 ILE C C 61 174.610 174.610 175.704 -1.094 17919 23770 1 58 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.584 0.836 17919 23771 1 58 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.039 -0.299 17919 23772 1 58 . 1 1 61 61 ILE H H 61 7.250 7.250 8.258 -1.008 17919 23773 1 58 . 1 1 62 62 GLN N N 62 124.740 124.740 126.719 -1.979 17919 23774 1 58 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.681 -0.175 17919 23775 1 58 . 1 1 62 62 GLN C C 62 175.970 175.970 175.819 0.151 17919 23776 1 58 . 1 1 62 62 GLN CA C 62 53.660 53.660 54.268 -0.608 17919 23777 1 58 . 1 1 62 62 GLN CB C 62 31.650 31.650 30.662 0.988 17919 23778 1 58 . 1 1 62 62 GLN H H 62 7.610 7.610 8.016 -0.406 17919 23779 1 58 . 1 1 63 63 LYS N N 63 120.300 120.300 122.223 -1.923 17919 23780 1 58 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.059 -0.058 17919 23781 1 58 . 1 1 63 63 LYS C C 63 175.810 175.810 176.681 -0.871 17919 23782 1 58 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.538 0.252 17919 23783 1 58 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.881 0.769 17919 23784 1 58 . 1 1 63 63 LYS H H 63 8.490 8.490 8.666 -0.176 17919 23785 1 58 . 1 1 64 64 GLU N N 64 113.950 113.950 118.316 -4.366 17919 23786 1 58 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.470 -0.005 17919 23787 1 58 . 1 1 64 64 GLU C C 64 175.250 175.250 175.602 -0.352 17919 23788 1 58 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.349 0.541 17919 23789 1 58 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.016 -2.116 17919 23790 1 58 . 1 1 64 64 GLU H H 64 9.280 9.280 8.681 0.599 17919 23791 1 58 . 1 1 65 65 SER N N 65 114.730 114.730 114.114 0.616 17919 23792 1 58 . 1 1 65 65 SER HA H 65 4.640 4.640 4.759 -0.119 17919 23793 1 58 . 1 1 65 65 SER C C 65 172.160 172.160 173.350 -1.190 17919 23794 1 58 . 1 1 65 65 SER CA C 65 60.890 60.890 58.750 2.140 17919 23795 1 58 . 1 1 65 65 SER CB C 65 64.910 64.910 64.677 0.233 17919 23796 1 58 . 1 1 65 65 SER H H 65 7.670 7.670 7.566 0.104 17919 23797 1 58 . 1 1 66 66 THR N N 66 117.110 117.110 117.356 -0.246 17919 23798 1 58 . 1 1 66 66 THR HA H 66 5.270 5.270 5.302 -0.032 17919 23799 1 58 . 1 1 66 66 THR C C 66 173.950 173.950 173.554 0.396 17919 23800 1 58 . 1 1 66 66 THR CA C 66 62.340 62.340 61.976 0.364 17919 23801 1 58 . 1 1 66 66 THR CB C 66 70.080 70.080 70.577 -0.497 17919 23802 1 58 . 1 1 66 66 THR H H 66 8.730 8.730 8.119 0.611 17919 23803 1 58 . 1 1 67 67 LEU N N 67 127.110 127.110 126.539 0.571 17919 23804 1 58 . 1 1 67 67 LEU HA H 67 5.060 5.060 5.174 -0.114 17919 23805 1 58 . 1 1 67 67 LEU C C 67 175.770 175.770 175.367 0.403 17919 23806 1 58 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.600 0.300 17919 23807 1 58 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.902 0.358 17919 23808 1 58 . 1 1 67 67 LEU H H 67 9.410 9.410 8.935 0.474 17919 23809 1 58 . 1 1 68 68 HIS N N 68 118.380 118.380 122.576 -4.196 17919 23810 1 58 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.481 -0.241 17919 23811 1 58 . 1 1 68 68 HIS C C 68 173.150 173.150 173.669 -0.519 17919 23812 1 58 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.459 0.541 17919 23813 1 58 . 1 1 68 68 HIS CB C 68 30.530 30.530 33.107 -2.577 17919 23814 1 58 . 1 1 68 68 HIS H H 68 9.230 9.230 8.965 0.265 17919 23815 1 58 . 1 1 69 69 LEU N N 69 124.460 124.460 127.472 -3.012 17919 23816 1 58 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.236 -0.046 17919 23817 1 58 . 1 1 69 69 LEU C C 69 175.270 175.270 174.122 1.148 17919 23818 1 58 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.677 0.213 17919 23819 1 58 . 1 1 69 69 LEU CB C 69 44.380 44.380 45.197 -0.817 17919 23820 1 58 . 1 1 69 69 LEU H H 69 8.340 8.340 7.438 0.902 17919 23821 1 58 . 1 1 70 70 VAL N N 70 126.940 126.940 122.619 4.321 17919 23822 1 58 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.399 -0.049 17919 23823 1 58 . 1 1 70 70 VAL C C 70 174.000 174.000 173.967 0.033 17919 23824 1 58 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.457 0.343 17919 23825 1 58 . 1 1 70 70 VAL CB C 70 34.910 34.910 36.155 -1.245 17919 23826 1 58 . 1 1 70 70 VAL H H 70 9.200 9.200 8.446 0.754 17919 23827 1 58 . 1 1 71 71 LEU N N 71 123.130 123.130 122.628 0.502 17919 23828 1 58 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.069 -0.009 17919 23829 1 58 . 1 1 71 71 LEU C C 71 177.830 177.830 176.215 1.615 17919 23830 1 58 . 1 1 71 71 LEU CA C 71 53.940 53.940 52.806 1.134 17919 23831 1 58 . 1 1 71 71 LEU CB C 71 42.850 42.850 44.408 -1.558 17919 23832 1 58 . 1 1 71 71 LEU H H 71 8.120 8.120 8.209 -0.089 17919 23833 1 58 . 1 1 72 72 ARG N N 72 123.490 123.490 125.691 -2.201 17919 23834 1 58 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.129 0.172 17919 23835 1 58 . 1 1 72 72 ARG C C 72 175.350 175.350 174.970 0.380 17919 23836 1 58 . 1 1 72 72 ARG CA C 72 55.610 55.610 57.087 -1.477 17919 23837 1 58 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.550 0.800 17919 23838 1 58 . 1 1 72 72 ARG H H 72 8.580 8.580 8.079 0.501 17919 23839 1 59 . 1 1 2 2 GLN N N 2 123.220 123.220 122.658 0.562 17919 23840 1 59 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.065 0.184 17919 23841 1 59 . 1 1 2 2 GLN C C 2 175.920 175.920 175.662 0.258 17919 23842 1 59 . 1 1 2 2 GLN CA C 2 55.080 55.080 55.506 -0.426 17919 23843 1 59 . 1 1 2 2 GLN CB C 2 30.760 30.760 29.630 1.130 17919 23844 1 59 . 1 1 2 2 GLN H H 2 8.900 8.900 8.654 0.246 17919 23845 1 59 . 1 1 3 3 ILE N N 3 115.340 115.340 117.158 -1.818 17919 23846 1 59 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.345 -0.132 17919 23847 1 59 . 1 1 3 3 ILE C C 3 172.450 172.450 173.832 -1.382 17919 23848 1 59 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.331 0.239 17919 23849 1 59 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.046 1.164 17919 23850 1 59 . 1 1 3 3 ILE H H 3 8.320 8.320 8.554 -0.234 17919 23851 1 59 . 1 1 4 4 PHE N N 4 118.110 118.110 120.786 -2.676 17919 23852 1 59 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.441 0.189 17919 23853 1 59 . 1 1 4 4 PHE C C 4 175.320 175.320 175.618 -0.298 17919 23854 1 59 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.568 -0.358 17919 23855 1 59 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.381 0.099 17919 23856 1 59 . 1 1 4 4 PHE H H 4 8.610 8.610 8.670 -0.060 17919 23857 1 59 . 1 1 5 5 VAL N N 5 121.000 121.000 120.611 0.389 17919 23858 1 59 . 1 1 5 5 VAL HA H 5 4.725 4.725 5.051 -0.326 17919 23859 1 59 . 1 1 5 5 VAL C C 5 174.870 174.870 174.741 0.129 17919 23860 1 59 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.092 -0.472 17919 23861 1 59 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.359 -0.129 17919 23862 1 59 . 1 1 5 5 VAL H H 5 9.300 9.300 8.805 0.495 17919 23863 1 59 . 1 1 6 6 LYS N N 6 127.520 127.520 129.423 -1.903 17919 23864 1 59 . 1 1 6 6 LYS HA H 6 5.367 5.367 4.990 0.377 17919 23865 1 59 . 1 1 6 6 LYS C C 6 177.140 177.140 176.432 0.708 17919 23866 1 59 . 1 1 6 6 LYS CA C 6 54.520 54.520 55.168 -0.648 17919 23867 1 59 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.970 0.080 17919 23868 1 59 . 1 1 6 6 LYS H H 6 8.820 8.820 8.838 -0.018 17919 23869 1 59 . 1 1 7 7 THR N N 7 115.400 115.400 117.685 -2.285 17919 23870 1 59 . 1 1 7 7 THR HA H 7 4.970 4.970 4.451 0.519 17919 23871 1 59 . 1 1 7 7 THR C C 7 176.910 176.910 176.223 0.687 17919 23872 1 59 . 1 1 7 7 THR CA C 7 60.470 60.470 60.837 -0.366 17919 23873 1 59 . 1 1 7 7 THR CB C 7 70.630 70.630 70.707 -0.076 17919 23874 1 59 . 1 1 7 7 THR H H 7 8.730 8.730 8.835 -0.105 17919 23875 1 59 . 1 1 8 8 LEU N N 8 121.330 121.330 122.060 -0.730 17919 23876 1 59 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.219 0.091 17919 23877 1 59 . 1 1 8 8 LEU C C 8 178.800 178.800 177.961 0.839 17919 23878 1 59 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.896 -0.316 17919 23879 1 59 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.266 -0.295 17919 23880 1 59 . 1 1 8 8 LEU H H 8 9.100 9.100 8.833 0.267 17919 23881 1 59 . 1 1 9 9 THR N N 9 105.590 105.590 105.847 -0.257 17919 23882 1 59 . 1 1 9 9 THR HA H 9 4.428 4.428 4.299 0.129 17919 23883 1 59 . 1 1 9 9 THR C C 9 175.520 175.520 175.445 0.075 17919 23884 1 59 . 1 1 9 9 THR CA C 9 61.400 61.400 62.073 -0.673 17919 23885 1 59 . 1 1 9 9 THR CB C 9 69.140 69.140 68.893 0.247 17919 23886 1 59 . 1 1 9 9 THR H H 9 7.630 7.630 7.802 -0.172 17919 23887 1 59 . 1 1 10 10 GLY N N 10 108.890 108.890 110.237 -1.347 17919 23888 1 59 . 1 1 10 10 GLY C C 10 174.070 174.070 173.588 0.482 17919 23889 1 59 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.746 0.714 17919 23890 1 59 . 1 1 10 10 GLY H H 10 7.810 7.810 7.583 0.227 17919 23891 1 59 . 1 1 11 11 LYS N N 11 121.600 121.600 122.701 -1.101 17919 23892 1 59 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.586 -0.225 17919 23893 1 59 . 1 1 11 11 LYS C C 11 175.940 175.940 175.492 0.448 17919 23894 1 59 . 1 1 11 11 LYS CA C 11 56.280 56.280 55.697 0.583 17919 23895 1 59 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.684 -0.484 17919 23896 1 59 . 1 1 11 11 LYS H H 11 7.280 7.280 7.892 -0.612 17919 23897 1 59 . 1 1 12 12 THR N N 12 120.440 120.440 119.999 0.441 17919 23898 1 59 . 1 1 12 12 THR HA H 12 5.046 5.046 5.404 -0.358 17919 23899 1 59 . 1 1 12 12 THR C C 12 174.320 174.320 174.140 0.180 17919 23900 1 59 . 1 1 12 12 THR CA C 12 62.390 62.390 60.961 1.429 17919 23901 1 59 . 1 1 12 12 THR CB C 12 69.910 69.910 70.636 -0.726 17919 23902 1 59 . 1 1 12 12 THR H H 12 8.650 8.650 8.391 0.259 17919 23903 1 59 . 1 1 13 13 ILE N N 13 127.110 127.110 120.195 6.915 17919 23904 1 59 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.760 -0.216 17919 23905 1 59 . 1 1 13 13 ILE C C 13 175.220 175.220 174.291 0.929 17919 23906 1 59 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.150 0.830 17919 23907 1 59 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.794 0.156 17919 23908 1 59 . 1 1 13 13 ILE H H 13 9.450 9.450 8.967 0.483 17919 23909 1 59 . 1 1 14 14 THR N N 14 121.520 121.520 119.286 2.234 17919 23910 1 59 . 1 1 14 14 THR HA H 14 4.964 4.964 5.344 -0.380 17919 23911 1 59 . 1 1 14 14 THR C C 14 173.790 173.790 174.571 -0.781 17919 23912 1 59 . 1 1 14 14 THR CA C 14 61.940 61.940 61.580 0.360 17919 23913 1 59 . 1 1 14 14 THR CB C 14 69.650 69.650 69.690 -0.040 17919 23914 1 59 . 1 1 14 14 THR H H 14 8.710 8.710 8.293 0.417 17919 23915 1 59 . 1 1 15 15 LEU N N 15 124.800 124.800 125.915 -1.115 17919 23916 1 59 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.751 0.029 17919 23917 1 59 . 1 1 15 15 LEU C C 15 174.670 174.670 175.238 -0.568 17919 23918 1 59 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.510 -0.680 17919 23919 1 59 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.489 1.581 17919 23920 1 59 . 1 1 15 15 LEU H H 15 8.710 8.710 8.620 0.090 17919 23921 1 59 . 1 1 16 16 GLU N N 16 122.160 122.160 123.937 -1.777 17919 23922 1 59 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.540 0.377 17919 23923 1 59 . 1 1 16 16 GLU C C 16 175.860 175.860 175.242 0.618 17919 23924 1 59 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.073 -0.253 17919 23925 1 59 . 1 1 16 16 GLU CB C 16 29.450 29.450 29.453 -0.003 17919 23926 1 59 . 1 1 16 16 GLU H H 16 8.140 8.140 8.734 -0.594 17919 23927 1 59 . 1 1 17 17 VAL N N 17 117.210 117.210 122.290 -5.080 17919 23928 1 59 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.724 -0.010 17919 23929 1 59 . 1 1 17 17 VAL C C 17 174.160 174.160 174.986 -0.826 17919 23930 1 59 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.881 -1.451 17919 23931 1 59 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.245 1.155 17919 23932 1 59 . 1 1 17 17 VAL H H 17 8.900 8.900 8.217 0.683 17919 23933 1 59 . 1 1 18 18 GLU N N 18 118.990 118.990 124.514 -5.524 17919 23934 1 59 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.788 0.291 17919 23935 1 59 . 1 1 18 18 GLU C C 18 176.160 176.160 176.133 0.027 17919 23936 1 59 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.366 -0.646 17919 23937 1 59 . 1 1 18 18 GLU CB C 18 30.310 30.310 29.710 0.600 17919 23938 1 59 . 1 1 18 18 GLU H H 18 8.640 8.640 8.146 0.494 17919 23939 1 59 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.289 -0.148 17919 23940 1 59 . 1 1 19 19 PRO C C 19 175.310 175.310 177.646 -2.336 17919 23941 1 59 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.924 -0.454 17919 23942 1 59 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.016 -0.066 17919 23943 1 59 . 1 1 20 20 SER N N 20 103.400 103.400 109.175 -5.775 17919 23944 1 59 . 1 1 20 20 SER HA H 20 4.370 4.370 4.413 -0.043 17919 23945 1 59 . 1 1 20 20 SER C C 20 174.660 174.660 174.185 0.475 17919 23946 1 59 . 1 1 20 20 SER CA C 20 57.400 57.400 58.537 -1.137 17919 23947 1 59 . 1 1 20 20 SER CB C 20 63.370 63.370 62.623 0.747 17919 23948 1 59 . 1 1 20 20 SER H H 20 7.040 7.040 8.080 -1.040 17919 23949 1 59 . 1 1 21 21 ASP N N 21 123.480 123.480 124.064 -0.584 17919 23950 1 59 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.478 0.217 17919 23951 1 59 . 1 1 21 21 ASP C C 21 176.360 176.360 175.744 0.616 17919 23952 1 59 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.982 -0.282 17919 23953 1 59 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.447 -0.647 17919 23954 1 59 . 1 1 21 21 ASP H H 21 8.030 8.030 7.512 0.518 17919 23955 1 59 . 1 1 22 22 THR N N 22 108.800 108.800 114.845 -6.045 17919 23956 1 59 . 1 1 22 22 THR HA H 22 4.920 4.920 4.607 0.313 17919 23957 1 59 . 1 1 22 22 THR C C 22 176.750 176.750 176.230 0.520 17919 23958 1 59 . 1 1 22 22 THR CA C 22 59.690 59.690 62.002 -2.312 17919 23959 1 59 . 1 1 22 22 THR CB C 22 71.200 71.200 69.755 1.445 17919 23960 1 59 . 1 1 22 22 THR H H 22 7.900 7.900 8.337 -0.437 17919 23961 1 59 . 1 1 23 23 ILE N N 23 121.190 121.190 123.046 -1.856 17919 23962 1 59 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.690 -0.033 17919 23963 1 59 . 1 1 23 23 ILE C C 23 179.040 179.040 177.785 1.255 17919 23964 1 59 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.749 -0.489 17919 23965 1 59 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.036 -1.686 17919 23966 1 59 . 1 1 23 23 ILE H H 23 8.560 8.560 8.778 -0.218 17919 23967 1 59 . 1 1 24 24 GLU N N 24 120.830 120.830 120.133 0.697 17919 23968 1 59 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.900 0.017 17919 23969 1 59 . 1 1 24 24 GLU C C 24 178.640 178.640 178.717 -0.077 17919 23970 1 59 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.706 0.514 17919 23971 1 59 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.436 -1.156 17919 23972 1 59 . 1 1 24 24 GLU H H 24 9.760 9.760 8.235 1.525 17919 23973 1 59 . 1 1 25 25 ASN N N 25 120.570 120.570 118.289 2.281 17919 23974 1 59 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.466 0.059 17919 23975 1 59 . 1 1 25 25 ASN C C 25 178.380 178.380 177.979 0.401 17919 23976 1 59 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.289 -0.230 17919 23977 1 59 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.184 0.266 17919 23978 1 59 . 1 1 25 25 ASN H H 25 7.920 7.920 8.231 -0.311 17919 23979 1 59 . 1 1 26 26 VAL N N 26 121.710 121.710 119.541 2.169 17919 23980 1 59 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.587 -0.190 17919 23981 1 59 . 1 1 26 26 VAL C C 26 177.950 177.950 178.251 -0.301 17919 23982 1 59 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.802 0.858 17919 23983 1 59 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.117 -0.277 17919 23984 1 59 . 1 1 26 26 VAL H H 26 8.070 8.070 8.013 0.057 17919 23985 1 59 . 1 1 27 27 LYS N N 27 118.860 118.860 118.465 0.395 17919 23986 1 59 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.312 0.268 17919 23987 1 59 . 1 1 27 27 LYS C C 27 180.550 180.550 179.143 1.407 17919 23988 1 59 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.066 0.183 17919 23989 1 59 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.202 1.528 17919 23990 1 59 . 1 1 27 27 LYS H H 27 8.560 8.560 8.115 0.445 17919 23991 1 59 . 1 1 28 28 ALA N N 28 123.440 123.440 122.326 1.114 17919 23992 1 59 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.080 0.080 17919 23993 1 59 . 1 1 28 28 ALA C C 28 180.300 180.300 178.792 1.508 17919 23994 1 59 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.242 0.128 17919 23995 1 59 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.352 -0.642 17919 23996 1 59 . 1 1 28 28 ALA H H 28 8.060 8.060 7.968 0.092 17919 23997 1 59 . 1 1 29 29 LYS N N 29 119.940 119.940 120.008 -0.068 17919 23998 1 59 . 1 1 29 29 LYS HA H 29 4.207 4.207 3.987 0.220 17919 23999 1 59 . 1 1 29 29 LYS C C 29 180.320 180.320 179.002 1.318 17919 24000 1 59 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.416 0.234 17919 24001 1 59 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.276 1.014 17919 24002 1 59 . 1 1 29 29 LYS H H 29 7.850 7.850 7.422 0.428 17919 24003 1 59 . 1 1 30 30 ILE N N 30 121.080 121.080 120.225 0.855 17919 24004 1 59 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.511 -0.004 17919 24005 1 59 . 1 1 30 30 ILE C C 30 178.310 178.310 177.484 0.826 17919 24006 1 59 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.862 0.288 17919 24007 1 59 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.225 -0.425 17919 24008 1 59 . 1 1 30 30 ILE H H 30 8.280 8.280 8.236 0.044 17919 24009 1 59 . 1 1 31 31 GLN N N 31 123.490 123.490 120.223 3.267 17919 24010 1 59 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.075 -0.246 17919 24011 1 59 . 1 1 31 31 GLN C C 31 178.890 178.890 178.092 0.798 17919 24012 1 59 . 1 1 31 31 GLN CA C 31 60.000 60.000 58.977 1.023 17919 24013 1 59 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.354 -0.634 17919 24014 1 59 . 1 1 31 31 GLN H H 31 8.580 8.580 7.912 0.668 17919 24015 1 59 . 1 1 32 32 ASP N N 32 119.360 119.360 118.612 0.748 17919 24016 1 59 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.405 -0.051 17919 24017 1 59 . 1 1 32 32 ASP C C 32 177.250 177.250 178.272 -1.022 17919 24018 1 59 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.719 0.471 17919 24019 1 59 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.995 -0.415 17919 24020 1 59 . 1 1 32 32 ASP H H 32 8.010 8.010 8.237 -0.227 17919 24021 1 59 . 1 1 33 33 LYS N N 33 115.130 115.130 118.820 -3.690 17919 24022 1 59 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.274 0.063 17919 24023 1 59 . 1 1 33 33 LYS C C 33 177.870 177.870 177.907 -0.037 17919 24024 1 59 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.544 0.506 17919 24025 1 59 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.428 0.741 17919 24026 1 59 . 1 1 33 33 LYS H H 33 7.430 7.430 7.953 -0.523 17919 24027 1 59 . 1 1 34 34 GLU N N 34 113.870 113.870 115.191 -1.321 17919 24028 1 59 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.514 0.111 17919 24029 1 59 . 1 1 34 34 GLU C C 34 177.840 177.840 176.710 1.130 17919 24030 1 59 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.922 -0.752 17919 24031 1 59 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.922 0.738 17919 24032 1 59 . 1 1 34 34 GLU H H 34 8.740 8.740 8.262 0.478 17919 24033 1 59 . 1 1 35 35 GLY N N 35 108.650 108.650 108.864 -0.214 17919 24034 1 59 . 1 1 35 35 GLY C C 35 173.960 173.960 174.321 -0.361 17919 24035 1 59 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.961 0.120 17919 24036 1 59 . 1 1 35 35 GLY H H 35 8.530 8.530 7.953 0.577 17919 24037 1 59 . 1 1 36 36 ILE N N 36 119.880 119.880 122.323 -2.443 17919 24038 1 59 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.420 0.025 17919 24039 1 59 . 1 1 36 36 ILE C C 36 173.590 173.590 174.205 -0.615 17919 24040 1 59 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.839 -0.089 17919 24041 1 59 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.827 1.753 17919 24042 1 59 . 1 1 36 36 ILE H H 36 6.150 6.150 7.632 -1.482 17919 24043 1 59 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.922 -0.288 17919 24044 1 59 . 1 1 37 37 PRO C C 37 176.940 176.940 175.984 0.956 17919 24045 1 59 . 1 1 37 37 PRO CA C 37 61.660 61.660 60.979 0.681 17919 24046 1 59 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.598 0.252 17919 24047 1 59 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.210 -0.093 17919 24048 1 59 . 1 1 38 38 PRO C C 38 178.320 178.320 178.397 -0.077 17919 24049 1 59 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.636 0.624 17919 24050 1 59 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.887 1.003 17919 24051 1 59 . 1 1 39 39 ASP N N 39 113.380 113.380 116.648 -3.268 17919 24052 1 59 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.328 0.102 17919 24053 1 59 . 1 1 39 39 ASP C C 39 177.090 177.090 177.381 -0.291 17919 24054 1 59 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.814 -1.174 17919 24055 1 59 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.565 -1.025 17919 24056 1 59 . 1 1 39 39 ASP H H 39 8.550 8.550 8.511 0.039 17919 24057 1 59 . 1 1 40 40 GLN N N 40 116.780 116.780 117.236 -0.456 17919 24058 1 59 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.312 0.152 17919 24059 1 59 . 1 1 40 40 GLN C C 40 175.380 175.380 175.298 0.082 17919 24060 1 59 . 1 1 40 40 GLN CA C 40 55.640 55.640 54.890 0.750 17919 24061 1 59 . 1 1 40 40 GLN CB C 40 30.140 30.140 28.316 1.824 17919 24062 1 59 . 1 1 40 40 GLN H H 40 7.820 7.820 7.875 -0.055 17919 24063 1 59 . 1 1 41 41 GLN N N 41 117.720 117.720 119.144 -1.424 17919 24064 1 59 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.586 -0.342 17919 24065 1 59 . 1 1 41 41 GLN C C 41 176.300 176.300 174.585 1.715 17919 24066 1 59 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.177 1.293 17919 24067 1 59 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.881 1.769 17919 24068 1 59 . 1 1 41 41 GLN H H 41 7.480 7.480 7.284 0.196 17919 24069 1 59 . 1 1 42 42 ARG N N 42 122.680 122.680 126.419 -3.739 17919 24070 1 59 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.621 -0.121 17919 24071 1 59 . 1 1 42 42 ARG C C 42 174.050 174.050 173.924 0.126 17919 24072 1 59 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.023 0.027 17919 24073 1 59 . 1 1 42 42 ARG CB C 42 31.750 31.750 31.891 -0.141 17919 24074 1 59 . 1 1 42 42 ARG H H 42 8.530 8.530 8.341 0.189 17919 24075 1 59 . 1 1 43 43 LEU N N 43 124.040 124.040 126.806 -2.766 17919 24076 1 59 . 1 1 43 43 LEU C C 43 175.290 175.290 176.040 -0.750 17919 24077 1 59 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.227 -0.247 17919 24078 1 59 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.968 0.822 17919 24079 1 59 . 1 1 43 43 LEU H H 43 8.820 8.820 8.713 0.107 17919 24080 1 59 . 1 1 44 44 ILE N N 44 121.920 121.920 118.705 3.215 17919 24081 1 59 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.974 0.018 17919 24082 1 59 . 1 1 44 44 ILE C C 44 176.060 176.060 174.235 1.825 17919 24083 1 59 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.406 -1.426 17919 24084 1 59 . 1 1 44 44 ILE CB C 44 41.420 41.420 42.405 -0.985 17919 24085 1 59 . 1 1 44 44 ILE H H 44 9.030 9.030 8.693 0.337 17919 24086 1 59 . 1 1 45 45 PHE N N 45 125.390 125.390 124.785 0.605 17919 24087 1 59 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.041 0.004 17919 24088 1 59 . 1 1 45 45 PHE C C 45 174.470 174.470 174.469 0.001 17919 24089 1 59 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.775 0.245 17919 24090 1 59 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.704 1.056 17919 24091 1 59 . 1 1 45 45 PHE H H 45 8.830 8.830 9.100 -0.270 17919 24092 1 59 . 1 1 46 46 ALA N N 46 132.200 132.200 130.656 1.544 17919 24093 1 59 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.694 -0.004 17919 24094 1 59 . 1 1 46 46 ALA C C 46 177.290 177.290 177.518 -0.228 17919 24095 1 59 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.532 0.008 17919 24096 1 59 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.292 0.278 17919 24097 1 59 . 1 1 46 46 ALA H H 46 8.810 8.810 9.017 -0.207 17919 24098 1 59 . 1 1 47 47 GLY N N 47 102.340 102.340 104.303 -1.963 17919 24099 1 59 . 1 1 47 47 GLY C C 47 173.810 173.810 174.091 -0.281 17919 24100 1 59 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.953 0.397 17919 24101 1 59 . 1 1 47 47 GLY H H 47 8.130 8.130 8.490 -0.360 17919 24102 1 59 . 1 1 48 48 LYS N N 48 121.570 121.570 121.070 0.500 17919 24103 1 59 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.581 0.041 17919 24104 1 59 . 1 1 48 48 LYS C C 48 174.700 174.700 174.972 -0.272 17919 24105 1 59 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.110 -0.560 17919 24106 1 59 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.961 -0.430 17919 24107 1 59 . 1 1 48 48 LYS H H 48 7.980 7.980 7.703 0.277 17919 24108 1 59 . 1 1 49 49 GLN N N 49 122.410 122.410 124.863 -2.453 17919 24109 1 59 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.534 0.026 17919 24110 1 59 . 1 1 49 49 GLN C C 49 175.670 175.670 175.672 -0.002 17919 24111 1 59 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.072 -0.331 17919 24112 1 59 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.453 -0.453 17919 24113 1 59 . 1 1 49 49 GLN H H 49 8.600 8.600 8.713 -0.113 17919 24114 1 59 . 1 1 50 50 LEU N N 50 125.520 125.520 127.920 -2.400 17919 24115 1 59 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.277 -0.187 17919 24116 1 59 . 1 1 50 50 LEU C C 50 176.660 176.660 176.412 0.248 17919 24117 1 59 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.695 -0.455 17919 24118 1 59 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.779 -1.209 17919 24119 1 59 . 1 1 50 50 LEU H H 50 8.530 8.530 8.327 0.203 17919 24120 1 59 . 1 1 51 51 GLU N N 51 122.940 122.940 121.548 1.392 17919 24121 1 59 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.586 -0.098 17919 24122 1 59 . 1 1 51 51 GLU C C 51 175.870 175.870 176.400 -0.530 17919 24123 1 59 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.629 0.331 17919 24124 1 59 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.241 -0.671 17919 24125 1 59 . 1 1 51 51 GLU H H 51 8.400 8.400 8.269 0.131 17919 24126 1 59 . 1 1 52 52 ASP N N 52 120.030 120.030 124.843 -4.813 17919 24127 1 59 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.321 0.038 17919 24128 1 59 . 1 1 52 52 ASP C C 52 177.330 177.330 177.911 -0.581 17919 24129 1 59 . 1 1 52 52 ASP CA C 52 56.960 56.960 58.329 -1.369 17919 24130 1 59 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.699 0.151 17919 24131 1 59 . 1 1 52 52 ASP H H 52 8.160 8.160 8.919 -0.759 17919 24132 1 59 . 1 1 53 53 GLY N N 53 106.660 106.660 103.819 2.841 17919 24133 1 59 . 1 1 53 53 GLY C C 53 174.870 174.870 174.556 0.314 17919 24134 1 59 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.604 0.566 17919 24135 1 59 . 1 1 53 53 GLY H H 53 9.390 9.390 8.142 1.248 17919 24136 1 59 . 1 1 54 54 ARG N N 54 119.050 119.050 121.879 -2.829 17919 24137 1 59 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.273 0.422 17919 24138 1 59 . 1 1 54 54 ARG C C 54 175.350 175.350 175.671 -0.321 17919 24139 1 59 . 1 1 54 54 ARG CA C 54 54.390 54.390 56.268 -1.878 17919 24140 1 59 . 1 1 54 54 ARG CB C 54 32.650 32.650 31.425 1.225 17919 24141 1 59 . 1 1 54 54 ARG H H 54 7.460 7.460 7.619 -0.159 17919 24142 1 59 . 1 1 55 55 THR N N 55 108.400 108.400 116.305 -7.905 17919 24143 1 59 . 1 1 55 55 THR HA H 55 5.240 5.240 4.397 0.843 17919 24144 1 59 . 1 1 55 55 THR C C 55 176.560 176.560 176.086 0.474 17919 24145 1 59 . 1 1 55 55 THR CA C 55 59.690 59.690 61.596 -1.905 17919 24146 1 59 . 1 1 55 55 THR CB C 55 72.260 72.260 69.974 2.286 17919 24147 1 59 . 1 1 55 55 THR H H 55 8.730 8.730 8.531 0.199 17919 24148 1 59 . 1 1 56 56 LEU N N 56 117.920 117.920 125.609 -7.689 17919 24149 1 59 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.109 -0.049 17919 24150 1 59 . 1 1 56 56 LEU C C 56 180.810 180.810 178.128 2.682 17919 24151 1 59 . 1 1 56 56 LEU CA C 56 58.710 58.710 57.875 0.835 17919 24152 1 59 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.130 -0.760 17919 24153 1 59 . 1 1 56 56 LEU H H 56 8.140 8.140 8.884 -0.744 17919 24154 1 59 . 1 1 57 57 SER N N 57 113.330 113.330 111.751 1.579 17919 24155 1 59 . 1 1 57 57 SER HA H 57 4.370 4.370 4.139 0.231 17919 24156 1 59 . 1 1 57 57 SER C C 57 178.310 178.310 175.811 2.499 17919 24157 1 59 . 1 1 57 57 SER CA C 57 61.080 61.080 60.844 0.236 17919 24158 1 59 . 1 1 57 57 SER CB C 57 62.530 62.530 62.744 -0.214 17919 24159 1 59 . 1 1 57 57 SER H H 57 8.470 8.470 7.982 0.488 17919 24160 1 59 . 1 1 58 58 ASP N N 58 124.190 124.190 121.814 2.376 17919 24161 1 59 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.435 -0.139 17919 24162 1 59 . 1 1 58 58 ASP C C 58 177.400 177.400 177.680 -0.280 17919 24163 1 59 . 1 1 58 58 ASP CA C 58 57.180 57.180 55.840 1.340 17919 24164 1 59 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.742 -0.642 17919 24165 1 59 . 1 1 58 58 ASP H H 58 7.930 7.930 7.556 0.374 17919 24166 1 59 . 1 1 59 59 TYR N N 59 115.510 115.510 116.069 -0.559 17919 24167 1 59 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.392 0.278 17919 24168 1 59 . 1 1 59 59 TYR C C 59 174.700 174.700 175.695 -0.995 17919 24169 1 59 . 1 1 59 59 TYR CA C 59 58.250 58.250 58.340 -0.090 17919 24170 1 59 . 1 1 59 59 TYR CB C 59 40.070 40.070 37.788 2.282 17919 24171 1 59 . 1 1 59 59 TYR H H 59 7.250 7.250 7.512 -0.262 17919 24172 1 59 . 1 1 60 60 ASN N N 60 115.900 115.900 116.095 -0.195 17919 24173 1 59 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.362 -0.007 17919 24174 1 59 . 1 1 60 60 ASN C C 60 174.340 174.340 174.458 -0.118 17919 24175 1 59 . 1 1 60 60 ASN CA C 60 54.120 54.120 53.781 0.339 17919 24176 1 59 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.354 0.056 17919 24177 1 59 . 1 1 60 60 ASN H H 60 8.150 8.150 7.624 0.526 17919 24178 1 59 . 1 1 61 61 ILE N N 61 118.600 118.600 120.107 -1.507 17919 24179 1 59 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.870 -0.477 17919 24180 1 59 . 1 1 61 61 ILE C C 61 174.610 174.610 175.266 -0.656 17919 24181 1 59 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.351 1.069 17919 24182 1 59 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.367 -0.627 17919 24183 1 59 . 1 1 61 61 ILE H H 61 7.250 7.250 7.489 -0.239 17919 24184 1 59 . 1 1 62 62 GLN N N 62 124.740 124.740 126.066 -1.326 17919 24185 1 59 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.571 -0.064 17919 24186 1 59 . 1 1 62 62 GLN C C 62 175.970 175.970 176.041 -0.071 17919 24187 1 59 . 1 1 62 62 GLN CA C 62 53.660 53.660 54.112 -0.452 17919 24188 1 59 . 1 1 62 62 GLN CB C 62 31.650 31.650 30.298 1.352 17919 24189 1 59 . 1 1 62 62 GLN H H 62 7.610 7.610 8.080 -0.470 17919 24190 1 59 . 1 1 63 63 LYS N N 63 120.300 120.300 122.431 -2.131 17919 24191 1 59 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.800 0.201 17919 24192 1 59 . 1 1 63 63 LYS C C 63 175.810 175.810 176.825 -1.015 17919 24193 1 59 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.917 -0.127 17919 24194 1 59 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.411 0.239 17919 24195 1 59 . 1 1 63 63 LYS H H 63 8.490 8.490 8.700 -0.210 17919 24196 1 59 . 1 1 64 64 GLU N N 64 113.950 113.950 121.758 -7.808 17919 24197 1 59 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.745 -0.280 17919 24198 1 59 . 1 1 64 64 GLU C C 64 175.250 175.250 175.700 -0.450 17919 24199 1 59 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.869 0.021 17919 24200 1 59 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.890 -2.990 17919 24201 1 59 . 1 1 64 64 GLU H H 64 9.280 9.280 8.573 0.707 17919 24202 1 59 . 1 1 65 65 SER N N 65 114.730 114.730 113.600 1.130 17919 24203 1 59 . 1 1 65 65 SER HA H 65 4.640 4.640 4.559 0.081 17919 24204 1 59 . 1 1 65 65 SER C C 65 172.160 172.160 173.950 -1.790 17919 24205 1 59 . 1 1 65 65 SER CA C 65 60.890 60.890 59.947 0.943 17919 24206 1 59 . 1 1 65 65 SER CB C 65 64.910 64.910 64.503 0.407 17919 24207 1 59 . 1 1 65 65 SER H H 65 7.670 7.670 7.505 0.165 17919 24208 1 59 . 1 1 66 66 THR N N 66 117.110 117.110 117.787 -0.677 17919 24209 1 59 . 1 1 66 66 THR HA H 66 5.270 5.270 5.305 -0.035 17919 24210 1 59 . 1 1 66 66 THR C C 66 173.950 173.950 174.020 -0.070 17919 24211 1 59 . 1 1 66 66 THR CA C 66 62.340 62.340 62.144 0.196 17919 24212 1 59 . 1 1 66 66 THR CB C 66 70.080 70.080 70.537 -0.457 17919 24213 1 59 . 1 1 66 66 THR H H 66 8.730 8.730 8.564 0.166 17919 24214 1 59 . 1 1 67 67 LEU N N 67 127.110 127.110 126.852 0.258 17919 24215 1 59 . 1 1 67 67 LEU HA H 67 5.060 5.060 5.107 -0.047 17919 24216 1 59 . 1 1 67 67 LEU C C 67 175.770 175.770 175.112 0.658 17919 24217 1 59 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.777 0.123 17919 24218 1 59 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.800 -0.540 17919 24219 1 59 . 1 1 67 67 LEU H H 67 9.410 9.410 9.286 0.124 17919 24220 1 59 . 1 1 68 68 HIS N N 68 118.380 118.380 120.926 -2.546 17919 24221 1 59 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.498 -0.258 17919 24222 1 59 . 1 1 68 68 HIS C C 68 173.150 173.150 173.617 -0.467 17919 24223 1 59 . 1 1 68 68 HIS CA C 68 55.000 55.000 53.840 1.160 17919 24224 1 59 . 1 1 68 68 HIS CB C 68 30.530 30.530 33.549 -3.019 17919 24225 1 59 . 1 1 68 68 HIS H H 68 9.230 9.230 8.944 0.286 17919 24226 1 59 . 1 1 69 69 LEU N N 69 124.460 124.460 127.093 -2.633 17919 24227 1 59 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.019 0.171 17919 24228 1 59 . 1 1 69 69 LEU C C 69 175.270 175.270 174.116 1.154 17919 24229 1 59 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.712 0.178 17919 24230 1 59 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.483 -0.103 17919 24231 1 59 . 1 1 69 69 LEU H H 69 8.340 8.340 7.567 0.773 17919 24232 1 59 . 1 1 70 70 VAL N N 70 126.940 126.940 125.850 1.090 17919 24233 1 59 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.373 -0.023 17919 24234 1 59 . 1 1 70 70 VAL C C 70 174.000 174.000 174.491 -0.491 17919 24235 1 59 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.090 0.710 17919 24236 1 59 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.741 -0.831 17919 24237 1 59 . 1 1 70 70 VAL H H 70 9.200 9.200 9.021 0.179 17919 24238 1 59 . 1 1 71 71 LEU N N 71 123.130 123.130 122.269 0.861 17919 24239 1 59 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.061 -0.001 17919 24240 1 59 . 1 1 71 71 LEU C C 71 177.830 177.830 177.592 0.238 17919 24241 1 59 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.113 0.827 17919 24242 1 59 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.663 0.187 17919 24243 1 59 . 1 1 71 71 LEU H H 71 8.120 8.120 8.520 -0.400 17919 24244 1 59 . 1 1 72 72 ARG N N 72 123.490 123.490 121.048 2.442 17919 24245 1 59 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.374 -0.073 17919 24246 1 59 . 1 1 72 72 ARG C C 72 175.350 175.350 175.638 -0.288 17919 24247 1 59 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.990 -0.380 17919 24248 1 59 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.887 0.463 17919 24249 1 59 . 1 1 72 72 ARG H H 72 8.580 8.580 8.247 0.333 17919 24250 1 60 . 1 1 2 2 GLN N N 2 123.220 123.220 120.753 2.467 17919 24251 1 60 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.240 0.009 17919 24252 1 60 . 1 1 2 2 GLN C C 2 175.920 175.920 174.928 0.992 17919 24253 1 60 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.278 0.802 17919 24254 1 60 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.676 0.084 17919 24255 1 60 . 1 1 2 2 GLN H H 2 8.900 8.900 8.344 0.556 17919 24256 1 60 . 1 1 3 3 ILE N N 3 115.340 115.340 119.238 -3.898 17919 24257 1 60 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.225 -0.012 17919 24258 1 60 . 1 1 3 3 ILE C C 3 172.450 172.450 173.409 -0.959 17919 24259 1 60 . 1 1 3 3 ILE CA C 3 59.570 59.570 58.981 0.589 17919 24260 1 60 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.067 1.143 17919 24261 1 60 . 1 1 3 3 ILE H H 3 8.320 8.320 7.840 0.480 17919 24262 1 60 . 1 1 4 4 PHE N N 4 118.110 118.110 117.769 0.341 17919 24263 1 60 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.331 0.299 17919 24264 1 60 . 1 1 4 4 PHE C C 4 175.320 175.320 175.340 -0.020 17919 24265 1 60 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.666 -0.456 17919 24266 1 60 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.075 -0.595 17919 24267 1 60 . 1 1 4 4 PHE H H 4 8.610 8.610 8.074 0.536 17919 24268 1 60 . 1 1 5 5 VAL N N 5 121.000 121.000 121.072 -0.072 17919 24269 1 60 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.739 -0.014 17919 24270 1 60 . 1 1 5 5 VAL C C 5 174.870 174.870 174.899 -0.029 17919 24271 1 60 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.187 -0.567 17919 24272 1 60 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.423 -0.193 17919 24273 1 60 . 1 1 5 5 VAL H H 5 9.300 9.300 8.410 0.890 17919 24274 1 60 . 1 1 6 6 LYS N N 6 127.520 127.520 128.740 -1.220 17919 24275 1 60 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.229 0.138 17919 24276 1 60 . 1 1 6 6 LYS C C 6 177.140 177.140 177.062 0.078 17919 24277 1 60 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.893 -0.373 17919 24278 1 60 . 1 1 6 6 LYS CB C 6 35.050 35.050 33.825 1.225 17919 24279 1 60 . 1 1 6 6 LYS H H 6 8.820 8.820 8.628 0.192 17919 24280 1 60 . 1 1 7 7 THR N N 7 115.400 115.400 117.869 -2.469 17919 24281 1 60 . 1 1 7 7 THR HA H 7 4.970 4.970 4.254 0.716 17919 24282 1 60 . 1 1 7 7 THR C C 7 176.910 176.910 176.792 0.118 17919 24283 1 60 . 1 1 7 7 THR CA C 7 60.470 60.470 62.505 -2.034 17919 24284 1 60 . 1 1 7 7 THR CB C 7 70.630 70.630 69.695 0.935 17919 24285 1 60 . 1 1 7 7 THR H H 7 8.730 8.730 8.441 0.289 17919 24286 1 60 . 1 1 8 8 LEU N N 8 121.330 121.330 121.583 -0.253 17919 24287 1 60 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.149 0.161 17919 24288 1 60 . 1 1 8 8 LEU C C 8 178.800 178.800 178.454 0.346 17919 24289 1 60 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.875 -0.295 17919 24290 1 60 . 1 1 8 8 LEU CB C 8 41.970 41.970 39.979 1.991 17919 24291 1 60 . 1 1 8 8 LEU H H 8 9.100 9.100 8.639 0.461 17919 24292 1 60 . 1 1 9 9 THR N N 9 105.590 105.590 108.417 -2.827 17919 24293 1 60 . 1 1 9 9 THR HA H 9 4.428 4.428 4.338 0.090 17919 24294 1 60 . 1 1 9 9 THR C C 9 175.520 175.520 175.197 0.323 17919 24295 1 60 . 1 1 9 9 THR CA C 9 61.400 61.400 62.178 -0.778 17919 24296 1 60 . 1 1 9 9 THR CB C 9 69.140 69.140 69.183 -0.043 17919 24297 1 60 . 1 1 9 9 THR H H 9 7.630 7.630 8.089 -0.459 17919 24298 1 60 . 1 1 10 10 GLY N N 10 108.890 108.890 111.360 -2.470 17919 24299 1 60 . 1 1 10 10 GLY C C 10 174.070 174.070 173.716 0.354 17919 24300 1 60 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.003 0.457 17919 24301 1 60 . 1 1 10 10 GLY H H 10 7.810 7.810 7.742 0.068 17919 24302 1 60 . 1 1 11 11 LYS N N 11 121.600 121.600 121.076 0.524 17919 24303 1 60 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.255 0.106 17919 24304 1 60 . 1 1 11 11 LYS C C 11 175.940 175.940 175.271 0.669 17919 24305 1 60 . 1 1 11 11 LYS CA C 11 56.280 56.280 57.269 -0.989 17919 24306 1 60 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.382 -0.182 17919 24307 1 60 . 1 1 11 11 LYS H H 11 7.280 7.280 7.638 -0.358 17919 24308 1 60 . 1 1 12 12 THR N N 12 120.440 120.440 117.335 3.105 17919 24309 1 60 . 1 1 12 12 THR HA H 12 5.046 5.046 5.537 -0.491 17919 24310 1 60 . 1 1 12 12 THR C C 12 174.320 174.320 173.965 0.355 17919 24311 1 60 . 1 1 12 12 THR CA C 12 62.390 62.390 60.761 1.629 17919 24312 1 60 . 1 1 12 12 THR CB C 12 69.910 69.910 71.417 -1.507 17919 24313 1 60 . 1 1 12 12 THR H H 12 8.650 8.650 7.966 0.684 17919 24314 1 60 . 1 1 13 13 ILE N N 13 127.110 127.110 124.190 2.920 17919 24315 1 60 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.407 0.137 17919 24316 1 60 . 1 1 13 13 ILE C C 13 175.220 175.220 174.748 0.472 17919 24317 1 60 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.736 -0.756 17919 24318 1 60 . 1 1 13 13 ILE CB C 13 40.950 40.950 42.075 -1.125 17919 24319 1 60 . 1 1 13 13 ILE H H 13 9.450 9.450 8.387 1.063 17919 24320 1 60 . 1 1 14 14 THR N N 14 121.520 121.520 122.646 -1.126 17919 24321 1 60 . 1 1 14 14 THR HA H 14 4.964 4.964 4.778 0.186 17919 24322 1 60 . 1 1 14 14 THR C C 14 173.790 173.790 173.145 0.645 17919 24323 1 60 . 1 1 14 14 THR CA C 14 61.940 61.940 62.285 -0.345 17919 24324 1 60 . 1 1 14 14 THR CB C 14 69.650 69.650 69.600 0.050 17919 24325 1 60 . 1 1 14 14 THR H H 14 8.710 8.710 8.550 0.160 17919 24326 1 60 . 1 1 15 15 LEU N N 15 124.800 124.800 127.965 -3.165 17919 24327 1 60 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.654 0.126 17919 24328 1 60 . 1 1 15 15 LEU C C 15 174.670 174.670 175.106 -0.436 17919 24329 1 60 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.564 -0.734 17919 24330 1 60 . 1 1 15 15 LEU CB C 15 47.070 47.070 44.948 2.122 17919 24331 1 60 . 1 1 15 15 LEU H H 15 8.710 8.710 8.017 0.693 17919 24332 1 60 . 1 1 16 16 GLU N N 16 122.160 122.160 123.801 -1.641 17919 24333 1 60 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.466 0.451 17919 24334 1 60 . 1 1 16 16 GLU C C 16 175.860 175.860 176.316 -0.456 17919 24335 1 60 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.350 -0.530 17919 24336 1 60 . 1 1 16 16 GLU CB C 16 29.450 29.450 29.464 -0.014 17919 24337 1 60 . 1 1 16 16 GLU H H 16 8.140 8.140 8.586 -0.446 17919 24338 1 60 . 1 1 17 17 VAL N N 17 117.210 117.210 121.838 -4.628 17919 24339 1 60 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.860 -0.146 17919 24340 1 60 . 1 1 17 17 VAL C C 17 174.160 174.160 174.956 -0.796 17919 24341 1 60 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.370 -0.940 17919 24342 1 60 . 1 1 17 17 VAL CB C 17 36.400 36.400 34.571 1.829 17919 24343 1 60 . 1 1 17 17 VAL H H 17 8.900 8.900 8.420 0.480 17919 24344 1 60 . 1 1 18 18 GLU N N 18 118.990 118.990 117.768 1.222 17919 24345 1 60 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.837 0.242 17919 24346 1 60 . 1 1 18 18 GLU C C 18 176.160 176.160 174.267 1.893 17919 24347 1 60 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.315 -0.595 17919 24348 1 60 . 1 1 18 18 GLU CB C 18 30.310 30.310 32.183 -1.873 17919 24349 1 60 . 1 1 18 18 GLU H H 18 8.640 8.640 8.515 0.125 17919 24350 1 60 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.443 -0.302 17919 24351 1 60 . 1 1 19 19 PRO C C 19 175.310 175.310 177.235 -1.925 17919 24352 1 60 . 1 1 19 19 PRO CA C 19 65.470 65.470 64.461 1.009 17919 24353 1 60 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.022 -0.072 17919 24354 1 60 . 1 1 20 20 SER N N 20 103.400 103.400 110.039 -6.639 17919 24355 1 60 . 1 1 20 20 SER HA H 20 4.370 4.370 4.363 0.007 17919 24356 1 60 . 1 1 20 20 SER C C 20 174.660 174.660 174.301 0.359 17919 24357 1 60 . 1 1 20 20 SER CA C 20 57.400 57.400 58.389 -0.989 17919 24358 1 60 . 1 1 20 20 SER CB C 20 63.370 63.370 63.031 0.339 17919 24359 1 60 . 1 1 20 20 SER H H 20 7.040 7.040 7.939 -0.899 17919 24360 1 60 . 1 1 21 21 ASP N N 21 123.480 123.480 124.034 -0.554 17919 24361 1 60 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.803 -0.108 17919 24362 1 60 . 1 1 21 21 ASP C C 21 176.360 176.360 175.855 0.505 17919 24363 1 60 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.417 1.283 17919 24364 1 60 . 1 1 21 21 ASP CB C 21 40.800 40.800 42.270 -1.470 17919 24365 1 60 . 1 1 21 21 ASP H H 21 8.030 8.030 7.951 0.079 17919 24366 1 60 . 1 1 22 22 THR N N 22 108.800 108.800 113.337 -4.537 17919 24367 1 60 . 1 1 22 22 THR HA H 22 4.920 4.920 4.664 0.256 17919 24368 1 60 . 1 1 22 22 THR C C 22 176.750 176.750 175.849 0.901 17919 24369 1 60 . 1 1 22 22 THR CA C 22 59.690 59.690 61.815 -2.125 17919 24370 1 60 . 1 1 22 22 THR CB C 22 71.200 71.200 70.108 1.092 17919 24371 1 60 . 1 1 22 22 THR H H 22 7.900 7.900 8.471 -0.571 17919 24372 1 60 . 1 1 23 23 ILE N N 23 121.190 121.190 122.586 -1.396 17919 24373 1 60 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.771 -0.114 17919 24374 1 60 . 1 1 23 23 ILE C C 23 179.040 179.040 177.662 1.378 17919 24375 1 60 . 1 1 23 23 ILE CA C 23 62.260 62.260 61.328 0.932 17919 24376 1 60 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.481 -2.131 17919 24377 1 60 . 1 1 23 23 ILE H H 23 8.560 8.560 8.986 -0.426 17919 24378 1 60 . 1 1 24 24 GLU N N 24 120.830 120.830 120.273 0.557 17919 24379 1 60 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.796 0.121 17919 24380 1 60 . 1 1 24 24 GLU C C 24 178.640 178.640 178.808 -0.168 17919 24381 1 60 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.987 0.233 17919 24382 1 60 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.355 -1.075 17919 24383 1 60 . 1 1 24 24 GLU H H 24 9.760 9.760 8.315 1.445 17919 24384 1 60 . 1 1 25 25 ASN N N 25 120.570 120.570 117.125 3.445 17919 24385 1 60 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.487 0.038 17919 24386 1 60 . 1 1 25 25 ASN C C 25 178.380 178.380 177.951 0.429 17919 24387 1 60 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.128 -0.068 17919 24388 1 60 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.666 -0.216 17919 24389 1 60 . 1 1 25 25 ASN H H 25 7.920 7.920 7.661 0.259 17919 24390 1 60 . 1 1 26 26 VAL N N 26 121.710 121.710 119.237 2.473 17919 24391 1 60 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.612 -0.215 17919 24392 1 60 . 1 1 26 26 VAL C C 26 177.950 177.950 177.671 0.279 17919 24393 1 60 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.354 1.306 17919 24394 1 60 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.434 -0.594 17919 24395 1 60 . 1 1 26 26 VAL H H 26 8.070 8.070 7.502 0.568 17919 24396 1 60 . 1 1 27 27 LYS N N 27 118.860 118.860 119.339 -0.479 17919 24397 1 60 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.195 0.385 17919 24398 1 60 . 1 1 27 27 LYS C C 27 180.550 180.550 179.115 1.435 17919 24399 1 60 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.170 0.080 17919 24400 1 60 . 1 1 27 27 LYS CB C 27 33.730 33.730 31.970 1.760 17919 24401 1 60 . 1 1 27 27 LYS H H 27 8.560 8.560 7.683 0.877 17919 24402 1 60 . 1 1 28 28 ALA N N 28 123.440 123.440 123.057 0.383 17919 24403 1 60 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.035 0.125 17919 24404 1 60 . 1 1 28 28 ALA C C 28 180.300 180.300 178.788 1.512 17919 24405 1 60 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.566 -0.196 17919 24406 1 60 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.429 -0.719 17919 24407 1 60 . 1 1 28 28 ALA H H 28 8.060 8.060 8.141 -0.081 17919 24408 1 60 . 1 1 29 29 LYS N N 29 119.940 119.940 120.268 -0.328 17919 24409 1 60 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.137 0.070 17919 24410 1 60 . 1 1 29 29 LYS C C 29 180.320 180.320 179.363 0.957 17919 24411 1 60 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.551 0.099 17919 24412 1 60 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.148 1.143 17919 24413 1 60 . 1 1 29 29 LYS H H 29 7.850 7.850 7.367 0.483 17919 24414 1 60 . 1 1 30 30 ILE N N 30 121.080 121.080 118.713 2.367 17919 24415 1 60 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.573 -0.066 17919 24416 1 60 . 1 1 30 30 ILE C C 30 178.310 178.310 177.687 0.623 17919 24417 1 60 . 1 1 30 30 ILE CA C 30 66.150 66.150 64.901 1.249 17919 24418 1 60 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.759 -0.959 17919 24419 1 60 . 1 1 30 30 ILE H H 30 8.280 8.280 8.676 -0.396 17919 24420 1 60 . 1 1 31 31 GLN N N 31 123.490 123.490 119.451 4.039 17919 24421 1 60 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.045 -0.216 17919 24422 1 60 . 1 1 31 31 GLN C C 31 178.890 178.890 178.148 0.742 17919 24423 1 60 . 1 1 31 31 GLN CA C 31 60.000 60.000 58.538 1.462 17919 24424 1 60 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.111 -0.391 17919 24425 1 60 . 1 1 31 31 GLN H H 31 8.580 8.580 7.547 1.033 17919 24426 1 60 . 1 1 32 32 ASP N N 32 119.360 119.360 121.449 -2.089 17919 24427 1 60 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.296 0.058 17919 24428 1 60 . 1 1 32 32 ASP C C 32 177.250 177.250 178.410 -1.160 17919 24429 1 60 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.963 0.227 17919 24430 1 60 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.440 0.140 17919 24431 1 60 . 1 1 32 32 ASP H H 32 8.010 8.010 8.652 -0.642 17919 24432 1 60 . 1 1 33 33 LYS N N 33 115.130 115.130 117.231 -2.101 17919 24433 1 60 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.279 0.058 17919 24434 1 60 . 1 1 33 33 LYS C C 33 177.870 177.870 177.852 0.018 17919 24435 1 60 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.691 0.359 17919 24436 1 60 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.116 1.054 17919 24437 1 60 . 1 1 33 33 LYS H H 33 7.430 7.430 7.594 -0.164 17919 24438 1 60 . 1 1 34 34 GLU N N 34 113.870 113.870 114.763 -0.893 17919 24439 1 60 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.534 0.091 17919 24440 1 60 . 1 1 34 34 GLU C C 34 177.840 177.840 176.968 0.872 17919 24441 1 60 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.847 -0.677 17919 24442 1 60 . 1 1 34 34 GLU CB C 34 32.660 32.660 32.207 0.453 17919 24443 1 60 . 1 1 34 34 GLU H H 34 8.740 8.740 7.869 0.871 17919 24444 1 60 . 1 1 35 35 GLY N N 35 108.650 108.650 109.269 -0.619 17919 24445 1 60 . 1 1 35 35 GLY C C 35 173.960 173.960 174.371 -0.411 17919 24446 1 60 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.725 0.355 17919 24447 1 60 . 1 1 35 35 GLY H H 35 8.530 8.530 8.336 0.194 17919 24448 1 60 . 1 1 36 36 ILE N N 36 119.880 119.880 120.986 -1.106 17919 24449 1 60 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.213 0.232 17919 24450 1 60 . 1 1 36 36 ILE C C 36 173.590 173.590 174.127 -0.537 17919 24451 1 60 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.308 -0.558 17919 24452 1 60 . 1 1 36 36 ILE CB C 36 40.580 40.580 37.850 2.729 17919 24453 1 60 . 1 1 36 36 ILE H H 36 6.150 6.150 7.564 -1.414 17919 24454 1 60 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.958 -0.324 17919 24455 1 60 . 1 1 37 37 PRO C C 37 176.940 176.940 176.246 0.694 17919 24456 1 60 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.486 0.173 17919 24457 1 60 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.638 0.212 17919 24458 1 60 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.195 -0.078 17919 24459 1 60 . 1 1 38 38 PRO C C 38 178.320 178.320 178.803 -0.483 17919 24460 1 60 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.403 0.857 17919 24461 1 60 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.904 0.987 17919 24462 1 60 . 1 1 39 39 ASP N N 39 113.380 113.380 115.824 -2.444 17919 24463 1 60 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.394 0.036 17919 24464 1 60 . 1 1 39 39 ASP C C 39 177.090 177.090 177.192 -0.102 17919 24465 1 60 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.499 -0.859 17919 24466 1 60 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.306 -0.766 17919 24467 1 60 . 1 1 39 39 ASP H H 39 8.550 8.550 8.896 -0.346 17919 24468 1 60 . 1 1 40 40 GLN N N 40 116.780 116.780 115.197 1.583 17919 24469 1 60 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.865 -0.401 17919 24470 1 60 . 1 1 40 40 GLN C C 40 175.380 175.380 175.234 0.146 17919 24471 1 60 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.063 0.577 17919 24472 1 60 . 1 1 40 40 GLN CB C 40 30.140 30.140 31.419 -1.278 17919 24473 1 60 . 1 1 40 40 GLN H H 40 7.820 7.820 7.591 0.229 17919 24474 1 60 . 1 1 41 41 GLN N N 41 117.720 117.720 120.412 -2.692 17919 24475 1 60 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.456 -0.212 17919 24476 1 60 . 1 1 41 41 GLN C C 41 176.300 176.300 175.314 0.986 17919 24477 1 60 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.263 0.207 17919 24478 1 60 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.834 1.816 17919 24479 1 60 . 1 1 41 41 GLN H H 41 7.480 7.480 7.413 0.067 17919 24480 1 60 . 1 1 42 42 ARG N N 42 122.680 122.680 123.265 -0.585 17919 24481 1 60 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.791 -0.291 17919 24482 1 60 . 1 1 42 42 ARG C C 42 174.050 174.050 174.528 -0.478 17919 24483 1 60 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.299 0.751 17919 24484 1 60 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.091 -0.341 17919 24485 1 60 . 1 1 42 42 ARG H H 42 8.530 8.530 8.330 0.200 17919 24486 1 60 . 1 1 43 43 LEU N N 43 124.040 124.040 126.319 -2.279 17919 24487 1 60 . 1 1 43 43 LEU C C 43 175.290 175.290 176.054 -0.764 17919 24488 1 60 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.144 -1.164 17919 24489 1 60 . 1 1 43 43 LEU CB C 43 45.790 45.790 42.928 2.862 17919 24490 1 60 . 1 1 43 43 LEU H H 43 8.820 8.820 8.926 -0.106 17919 24491 1 60 . 1 1 44 44 ILE N N 44 121.920 121.920 121.164 0.756 17919 24492 1 60 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.353 -0.361 17919 24493 1 60 . 1 1 44 44 ILE C C 44 176.060 176.060 173.705 2.355 17919 24494 1 60 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.265 -0.285 17919 24495 1 60 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.914 -0.494 17919 24496 1 60 . 1 1 44 44 ILE H H 44 9.030 9.030 8.923 0.107 17919 24497 1 60 . 1 1 45 45 PHE N N 45 125.390 125.390 128.275 -2.885 17919 24498 1 60 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.025 0.020 17919 24499 1 60 . 1 1 45 45 PHE C C 45 174.470 174.470 174.387 0.083 17919 24500 1 60 . 1 1 45 45 PHE CA C 45 57.020 57.020 57.431 -0.411 17919 24501 1 60 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.783 0.977 17919 24502 1 60 . 1 1 45 45 PHE H H 45 8.830 8.830 8.772 0.058 17919 24503 1 60 . 1 1 46 46 ALA N N 46 132.200 132.200 129.849 2.351 17919 24504 1 60 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.653 0.037 17919 24505 1 60 . 1 1 46 46 ALA C C 46 177.290 177.290 177.604 -0.314 17919 24506 1 60 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.853 -0.313 17919 24507 1 60 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.660 -0.090 17919 24508 1 60 . 1 1 46 46 ALA H H 46 8.810 8.810 8.699 0.111 17919 24509 1 60 . 1 1 47 47 GLY N N 47 102.340 102.340 104.228 -1.888 17919 24510 1 60 . 1 1 47 47 GLY C C 47 173.810 173.810 174.283 -0.473 17919 24511 1 60 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.633 -0.283 17919 24512 1 60 . 1 1 47 47 GLY H H 47 8.130 8.130 8.480 -0.350 17919 24513 1 60 . 1 1 48 48 LYS N N 48 121.570 121.570 120.632 0.938 17919 24514 1 60 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.602 0.020 17919 24515 1 60 . 1 1 48 48 LYS C C 48 174.700 174.700 175.130 -0.430 17919 24516 1 60 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.892 -0.342 17919 24517 1 60 . 1 1 48 48 LYS CB C 48 34.530 34.530 35.014 -0.484 17919 24518 1 60 . 1 1 48 48 LYS H H 48 7.980 7.980 7.612 0.368 17919 24519 1 60 . 1 1 49 49 GLN N N 49 122.410 122.410 125.017 -2.607 17919 24520 1 60 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.546 0.014 17919 24521 1 60 . 1 1 49 49 GLN C C 49 175.670 175.670 175.433 0.237 17919 24522 1 60 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.284 -0.544 17919 24523 1 60 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.618 -0.618 17919 24524 1 60 . 1 1 49 49 GLN H H 49 8.600 8.600 8.589 0.011 17919 24525 1 60 . 1 1 50 50 LEU N N 50 125.520 125.520 126.212 -0.692 17919 24526 1 60 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.147 -0.057 17919 24527 1 60 . 1 1 50 50 LEU C C 50 176.660 176.660 176.602 0.058 17919 24528 1 60 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.973 0.267 17919 24529 1 60 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.002 -0.432 17919 24530 1 60 . 1 1 50 50 LEU H H 50 8.530 8.530 8.558 -0.028 17919 24531 1 60 . 1 1 51 51 GLU N N 51 122.940 122.940 124.592 -1.652 17919 24532 1 60 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.359 0.129 17919 24533 1 60 . 1 1 51 51 GLU C C 51 175.870 175.870 177.065 -1.195 17919 24534 1 60 . 1 1 51 51 GLU CA C 51 55.960 55.960 56.400 -0.440 17919 24535 1 60 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.680 -0.110 17919 24536 1 60 . 1 1 51 51 GLU H H 51 8.400 8.400 8.655 -0.255 17919 24537 1 60 . 1 1 52 52 ASP N N 52 120.030 120.030 126.498 -6.468 17919 24538 1 60 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.508 -0.149 17919 24539 1 60 . 1 1 52 52 ASP C C 52 177.330 177.330 177.346 -0.016 17919 24540 1 60 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.301 -0.341 17919 24541 1 60 . 1 1 52 52 ASP CB C 52 40.850 40.850 41.012 -0.162 17919 24542 1 60 . 1 1 52 52 ASP H H 52 8.160 8.160 8.818 -0.658 17919 24543 1 60 . 1 1 53 53 GLY N N 53 106.660 106.660 106.619 0.041 17919 24544 1 60 . 1 1 53 53 GLY C C 53 174.870 174.870 174.761 0.109 17919 24545 1 60 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.115 0.055 17919 24546 1 60 . 1 1 53 53 GLY H H 53 9.390 9.390 8.261 1.129 17919 24547 1 60 . 1 1 54 54 ARG N N 54 119.050 119.050 121.520 -2.470 17919 24548 1 60 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.553 0.142 17919 24549 1 60 . 1 1 54 54 ARG C C 54 175.350 175.350 175.514 -0.164 17919 24550 1 60 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.772 -0.382 17919 24551 1 60 . 1 1 54 54 ARG CB C 54 32.650 32.650 31.676 0.974 17919 24552 1 60 . 1 1 54 54 ARG H H 54 7.460 7.460 7.513 -0.053 17919 24553 1 60 . 1 1 55 55 THR N N 55 108.400 108.400 110.703 -2.303 17919 24554 1 60 . 1 1 55 55 THR HA H 55 5.240 5.240 5.155 0.085 17919 24555 1 60 . 1 1 55 55 THR C C 55 176.560 176.560 175.684 0.876 17919 24556 1 60 . 1 1 55 55 THR CA C 55 59.690 59.690 59.867 -0.177 17919 24557 1 60 . 1 1 55 55 THR CB C 55 72.260 72.260 71.759 0.501 17919 24558 1 60 . 1 1 55 55 THR H H 55 8.730 8.730 8.602 0.128 17919 24559 1 60 . 1 1 56 56 LEU N N 56 117.920 117.920 121.495 -3.575 17919 24560 1 60 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.965 0.095 17919 24561 1 60 . 1 1 56 56 LEU C C 56 180.810 180.810 178.874 1.936 17919 24562 1 60 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.306 0.404 17919 24563 1 60 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.746 -1.376 17919 24564 1 60 . 1 1 56 56 LEU H H 56 8.140 8.140 8.565 -0.425 17919 24565 1 60 . 1 1 57 57 SER N N 57 113.330 113.330 115.461 -2.131 17919 24566 1 60 . 1 1 57 57 SER HA H 57 4.370 4.370 4.081 0.289 17919 24567 1 60 . 1 1 57 57 SER C C 57 178.310 178.310 176.569 1.741 17919 24568 1 60 . 1 1 57 57 SER CA C 57 61.080 61.080 62.565 -1.484 17919 24569 1 60 . 1 1 57 57 SER CB C 57 62.530 62.530 62.599 -0.069 17919 24570 1 60 . 1 1 57 57 SER H H 57 8.470 8.470 8.311 0.159 17919 24571 1 60 . 1 1 58 58 ASP N N 58 124.190 124.190 120.055 4.135 17919 24572 1 60 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.266 0.030 17919 24573 1 60 . 1 1 58 58 ASP C C 58 177.400 177.400 176.473 0.927 17919 24574 1 60 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.614 0.566 17919 24575 1 60 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.444 -0.344 17919 24576 1 60 . 1 1 58 58 ASP H H 58 7.930 7.930 7.877 0.053 17919 24577 1 60 . 1 1 59 59 TYR N N 59 115.510 115.510 115.169 0.341 17919 24578 1 60 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.611 0.059 17919 24579 1 60 . 1 1 59 59 TYR C C 59 174.700 174.700 174.863 -0.163 17919 24580 1 60 . 1 1 59 59 TYR CA C 59 58.250 58.250 56.879 1.371 17919 24581 1 60 . 1 1 59 59 TYR CB C 59 40.070 40.070 39.330 0.740 17919 24582 1 60 . 1 1 59 59 TYR H H 59 7.250 7.250 7.171 0.079 17919 24583 1 60 . 1 1 60 60 ASN N N 60 115.900 115.900 118.337 -2.437 17919 24584 1 60 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.374 -0.019 17919 24585 1 60 . 1 1 60 60 ASN C C 60 174.340 174.340 174.566 -0.226 17919 24586 1 60 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.397 -0.277 17919 24587 1 60 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.700 -0.290 17919 24588 1 60 . 1 1 60 60 ASN H H 60 8.150 8.150 8.301 -0.151 17919 24589 1 60 . 1 1 61 61 ILE N N 61 118.600 118.600 119.583 -0.983 17919 24590 1 60 . 1 1 61 61 ILE HA H 61 3.393 3.393 4.046 -0.653 17919 24591 1 60 . 1 1 61 61 ILE C C 61 174.610 174.610 175.170 -0.560 17919 24592 1 60 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.906 0.514 17919 24593 1 60 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.170 -0.430 17919 24594 1 60 . 1 1 61 61 ILE H H 61 7.250 7.250 8.194 -0.944 17919 24595 1 60 . 1 1 62 62 GLN N N 62 124.740 124.740 126.807 -2.067 17919 24596 1 60 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.678 -0.172 17919 24597 1 60 . 1 1 62 62 GLN C C 62 175.970 175.970 175.530 0.440 17919 24598 1 60 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.668 -0.008 17919 24599 1 60 . 1 1 62 62 GLN CB C 62 31.650 31.650 30.353 1.297 17919 24600 1 60 . 1 1 62 62 GLN H H 62 7.610 7.610 8.060 -0.450 17919 24601 1 60 . 1 1 63 63 LYS N N 63 120.300 120.300 119.426 0.874 17919 24602 1 60 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.040 -0.039 17919 24603 1 60 . 1 1 63 63 LYS C C 63 175.810 175.810 176.487 -0.677 17919 24604 1 60 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.015 -0.225 17919 24605 1 60 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.765 0.885 17919 24606 1 60 . 1 1 63 63 LYS H H 63 8.490 8.490 8.427 0.063 17919 24607 1 60 . 1 1 64 64 GLU N N 64 113.950 113.950 119.857 -5.907 17919 24608 1 60 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.657 -0.192 17919 24609 1 60 . 1 1 64 64 GLU C C 64 175.250 175.250 175.763 -0.513 17919 24610 1 60 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.719 0.171 17919 24611 1 60 . 1 1 64 64 GLU CB C 64 25.900 25.900 27.732 -1.832 17919 24612 1 60 . 1 1 64 64 GLU H H 64 9.280 9.280 8.867 0.413 17919 24613 1 60 . 1 1 65 65 SER N N 65 114.730 114.730 115.572 -0.842 17919 24614 1 60 . 1 1 65 65 SER HA H 65 4.640 4.640 4.471 0.169 17919 24615 1 60 . 1 1 65 65 SER C C 65 172.160 172.160 174.264 -2.104 17919 24616 1 60 . 1 1 65 65 SER CA C 65 60.890 60.890 60.086 0.804 17919 24617 1 60 . 1 1 65 65 SER CB C 65 64.910 64.910 63.610 1.300 17919 24618 1 60 . 1 1 65 65 SER H H 65 7.670 7.670 7.552 0.118 17919 24619 1 60 . 1 1 66 66 THR N N 66 117.110 117.110 122.618 -5.508 17919 24620 1 60 . 1 1 66 66 THR HA H 66 5.270 5.270 4.481 0.789 17919 24621 1 60 . 1 1 66 66 THR C C 66 173.950 173.950 173.912 0.038 17919 24622 1 60 . 1 1 66 66 THR CA C 66 62.340 62.340 63.115 -0.776 17919 24623 1 60 . 1 1 66 66 THR CB C 66 70.080 70.080 69.497 0.583 17919 24624 1 60 . 1 1 66 66 THR H H 66 8.730 8.730 8.553 0.177 17919 24625 1 60 . 1 1 67 67 LEU N N 67 127.110 127.110 127.726 -0.616 17919 24626 1 60 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.687 0.373 17919 24627 1 60 . 1 1 67 67 LEU C C 67 175.770 175.770 175.649 0.121 17919 24628 1 60 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.881 0.019 17919 24629 1 60 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.125 0.135 17919 24630 1 60 . 1 1 67 67 LEU H H 67 9.410 9.410 8.702 0.708 17919 24631 1 60 . 1 1 68 68 HIS N N 68 118.380 118.380 118.104 0.276 17919 24632 1 60 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.389 -0.149 17919 24633 1 60 . 1 1 68 68 HIS C C 68 173.150 173.150 174.346 -1.196 17919 24634 1 60 . 1 1 68 68 HIS CA C 68 55.000 55.000 55.085 -0.085 17919 24635 1 60 . 1 1 68 68 HIS CB C 68 30.530 30.530 33.272 -2.742 17919 24636 1 60 . 1 1 68 68 HIS H H 68 9.230 9.230 9.113 0.117 17919 24637 1 60 . 1 1 69 69 LEU N N 69 124.460 124.460 121.630 2.830 17919 24638 1 60 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.056 0.134 17919 24639 1 60 . 1 1 69 69 LEU C C 69 175.270 175.270 174.458 0.812 17919 24640 1 60 . 1 1 69 69 LEU CA C 69 53.890 53.890 55.246 -1.356 17919 24641 1 60 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.487 -0.107 17919 24642 1 60 . 1 1 69 69 LEU H H 69 8.340 8.340 8.062 0.278 17919 24643 1 60 . 1 1 70 70 VAL N N 70 126.940 126.940 125.715 1.225 17919 24644 1 60 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.543 -0.193 17919 24645 1 60 . 1 1 70 70 VAL C C 70 174.000 174.000 174.341 -0.341 17919 24646 1 60 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.389 0.411 17919 24647 1 60 . 1 1 70 70 VAL CB C 70 34.910 34.910 36.187 -1.277 17919 24648 1 60 . 1 1 70 70 VAL H H 70 9.200 9.200 7.986 1.214 17919 24649 1 60 . 1 1 71 71 LEU N N 71 123.130 123.130 123.288 -0.158 17919 24650 1 60 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.378 -0.318 17919 24651 1 60 . 1 1 71 71 LEU C C 71 177.830 177.830 176.892 0.938 17919 24652 1 60 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.510 0.430 17919 24653 1 60 . 1 1 71 71 LEU CB C 71 42.850 42.850 44.099 -1.249 17919 24654 1 60 . 1 1 71 71 LEU H H 71 8.120 8.120 8.268 -0.148 17919 24655 1 60 . 1 1 72 72 ARG N N 72 123.490 123.490 121.135 2.355 17919 24656 1 60 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.687 -0.386 17919 24657 1 60 . 1 1 72 72 ARG C C 72 175.350 175.350 176.291 -0.941 17919 24658 1 60 . 1 1 72 72 ARG CA C 72 55.610 55.610 54.025 1.585 17919 24659 1 60 . 1 1 72 72 ARG CB C 72 31.350 31.350 33.070 -1.720 17919 24660 1 60 . 1 1 72 72 ARG H H 72 8.580 8.580 8.617 -0.037 17919 24661 1 61 . 1 1 2 2 GLN N N 2 123.220 123.220 118.586 4.634 17919 24662 1 61 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.366 -0.117 17919 24663 1 61 . 1 1 2 2 GLN C C 2 175.920 175.920 175.235 0.685 17919 24664 1 61 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.228 0.852 17919 24665 1 61 . 1 1 2 2 GLN CB C 2 30.760 30.760 31.211 -0.451 17919 24666 1 61 . 1 1 2 2 GLN H H 2 8.900 8.900 8.241 0.659 17919 24667 1 61 . 1 1 3 3 ILE N N 3 115.340 115.340 116.463 -1.123 17919 24668 1 61 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.459 -0.246 17919 24669 1 61 . 1 1 3 3 ILE C C 3 172.450 172.450 173.909 -1.459 17919 24670 1 61 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.250 0.320 17919 24671 1 61 . 1 1 3 3 ILE CB C 3 42.210 42.210 40.801 1.409 17919 24672 1 61 . 1 1 3 3 ILE H H 3 8.320 8.320 8.731 -0.411 17919 24673 1 61 . 1 1 4 4 PHE N N 4 118.110 118.110 119.260 -1.150 17919 24674 1 61 . 1 1 4 4 PHE HA H 4 5.630 5.630 4.970 0.660 17919 24675 1 61 . 1 1 4 4 PHE C C 4 175.320 175.320 175.208 0.112 17919 24676 1 61 . 1 1 4 4 PHE CA C 4 55.210 55.210 56.401 -1.190 17919 24677 1 61 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.784 -0.304 17919 24678 1 61 . 1 1 4 4 PHE H H 4 8.610 8.610 8.674 -0.064 17919 24679 1 61 . 1 1 5 5 VAL N N 5 121.000 121.000 120.787 0.213 17919 24680 1 61 . 1 1 5 5 VAL HA H 5 4.725 4.725 5.125 -0.400 17919 24681 1 61 . 1 1 5 5 VAL C C 5 174.870 174.870 174.476 0.394 17919 24682 1 61 . 1 1 5 5 VAL CA C 5 60.620 60.620 60.984 -0.364 17919 24683 1 61 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.681 -0.451 17919 24684 1 61 . 1 1 5 5 VAL H H 5 9.300 9.300 8.412 0.888 17919 24685 1 61 . 1 1 6 6 LYS N N 6 127.520 127.520 129.121 -1.601 17919 24686 1 61 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.160 0.207 17919 24687 1 61 . 1 1 6 6 LYS C C 6 177.140 177.140 176.260 0.880 17919 24688 1 61 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.639 -0.119 17919 24689 1 61 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.149 -0.099 17919 24690 1 61 . 1 1 6 6 LYS H H 6 8.820 8.820 8.984 -0.164 17919 24691 1 61 . 1 1 7 7 THR N N 7 115.400 115.400 117.543 -2.143 17919 24692 1 61 . 1 1 7 7 THR HA H 7 4.970 4.970 4.531 0.439 17919 24693 1 61 . 1 1 7 7 THR C C 7 176.910 176.910 175.853 1.057 17919 24694 1 61 . 1 1 7 7 THR CA C 7 60.470 60.470 60.671 -0.201 17919 24695 1 61 . 1 1 7 7 THR CB C 7 70.630 70.630 70.496 0.134 17919 24696 1 61 . 1 1 7 7 THR H H 7 8.730 8.730 8.921 -0.191 17919 24697 1 61 . 1 1 8 8 LEU N N 8 121.330 121.330 121.653 -0.323 17919 24698 1 61 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.165 0.145 17919 24699 1 61 . 1 1 8 8 LEU C C 8 178.800 178.800 177.578 1.222 17919 24700 1 61 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.066 0.514 17919 24701 1 61 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.979 -0.009 17919 24702 1 61 . 1 1 8 8 LEU H H 8 9.100 9.100 8.842 0.258 17919 24703 1 61 . 1 1 9 9 THR N N 9 105.590 105.590 109.287 -3.697 17919 24704 1 61 . 1 1 9 9 THR HA H 9 4.428 4.428 4.318 0.110 17919 24705 1 61 . 1 1 9 9 THR C C 9 175.520 175.520 175.492 0.028 17919 24706 1 61 . 1 1 9 9 THR CA C 9 61.400 61.400 61.816 -0.416 17919 24707 1 61 . 1 1 9 9 THR CB C 9 69.140 69.140 69.302 -0.162 17919 24708 1 61 . 1 1 9 9 THR H H 9 7.630 7.630 7.553 0.077 17919 24709 1 61 . 1 1 10 10 GLY N N 10 108.890 108.890 111.559 -2.669 17919 24710 1 61 . 1 1 10 10 GLY C C 10 174.070 174.070 174.357 -0.287 17919 24711 1 61 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.075 0.385 17919 24712 1 61 . 1 1 10 10 GLY H H 10 7.810 7.810 7.576 0.234 17919 24713 1 61 . 1 1 11 11 LYS N N 11 121.600 121.600 121.632 -0.032 17919 24714 1 61 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.169 0.192 17919 24715 1 61 . 1 1 11 11 LYS C C 11 175.940 175.940 175.355 0.585 17919 24716 1 61 . 1 1 11 11 LYS CA C 11 56.280 56.280 57.216 -0.936 17919 24717 1 61 . 1 1 11 11 LYS CB C 11 33.200 33.200 32.963 0.237 17919 24718 1 61 . 1 1 11 11 LYS H H 11 7.280 7.280 7.561 -0.281 17919 24719 1 61 . 1 1 12 12 THR N N 12 120.440 120.440 114.242 6.198 17919 24720 1 61 . 1 1 12 12 THR HA H 12 5.046 5.046 5.425 -0.379 17919 24721 1 61 . 1 1 12 12 THR C C 12 174.320 174.320 174.038 0.282 17919 24722 1 61 . 1 1 12 12 THR CA C 12 62.390 62.390 61.255 1.135 17919 24723 1 61 . 1 1 12 12 THR CB C 12 69.910 69.910 71.419 -1.509 17919 24724 1 61 . 1 1 12 12 THR H H 12 8.650 8.650 8.111 0.539 17919 24725 1 61 . 1 1 13 13 ILE N N 13 127.110 127.110 121.513 5.597 17919 24726 1 61 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.813 -0.269 17919 24727 1 61 . 1 1 13 13 ILE C C 13 175.220 175.220 174.736 0.484 17919 24728 1 61 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.141 0.839 17919 24729 1 61 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.686 -0.736 17919 24730 1 61 . 1 1 13 13 ILE H H 13 9.450 9.450 8.788 0.662 17919 24731 1 61 . 1 1 14 14 THR N N 14 121.520 121.520 120.972 0.548 17919 24732 1 61 . 1 1 14 14 THR HA H 14 4.964 4.964 4.560 0.404 17919 24733 1 61 . 1 1 14 14 THR C C 14 173.790 173.790 173.561 0.229 17919 24734 1 61 . 1 1 14 14 THR CA C 14 61.940 61.940 62.459 -0.519 17919 24735 1 61 . 1 1 14 14 THR CB C 14 69.650 69.650 69.549 0.101 17919 24736 1 61 . 1 1 14 14 THR H H 14 8.710 8.710 8.338 0.372 17919 24737 1 61 . 1 1 15 15 LEU N N 15 124.800 124.800 125.999 -1.199 17919 24738 1 61 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.674 0.106 17919 24739 1 61 . 1 1 15 15 LEU C C 15 174.670 174.670 175.730 -1.060 17919 24740 1 61 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.121 -0.291 17919 24741 1 61 . 1 1 15 15 LEU CB C 15 47.070 47.070 42.802 4.268 17919 24742 1 61 . 1 1 15 15 LEU H H 15 8.710 8.710 8.118 0.592 17919 24743 1 61 . 1 1 16 16 GLU N N 16 122.160 122.160 123.957 -1.797 17919 24744 1 61 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.957 -0.040 17919 24745 1 61 . 1 1 16 16 GLU C C 16 175.860 175.860 176.056 -0.196 17919 24746 1 61 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.920 -1.101 17919 24747 1 61 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.586 -1.136 17919 24748 1 61 . 1 1 16 16 GLU H H 16 8.140 8.140 8.831 -0.691 17919 24749 1 61 . 1 1 17 17 VAL N N 17 117.210 117.210 120.191 -2.981 17919 24750 1 61 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.728 -0.014 17919 24751 1 61 . 1 1 17 17 VAL C C 17 174.160 174.160 175.057 -0.897 17919 24752 1 61 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.896 -0.466 17919 24753 1 61 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.568 0.832 17919 24754 1 61 . 1 1 17 17 VAL H H 17 8.900 8.900 8.944 -0.044 17919 24755 1 61 . 1 1 18 18 GLU N N 18 118.990 118.990 119.924 -0.934 17919 24756 1 61 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.880 0.199 17919 24757 1 61 . 1 1 18 18 GLU C C 18 176.160 176.160 174.822 1.338 17919 24758 1 61 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.616 0.104 17919 24759 1 61 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.768 -0.458 17919 24760 1 61 . 1 1 18 18 GLU H H 18 8.640 8.640 8.246 0.394 17919 24761 1 61 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.367 -0.226 17919 24762 1 61 . 1 1 19 19 PRO C C 19 175.310 175.310 177.155 -1.845 17919 24763 1 61 . 1 1 19 19 PRO CA C 19 65.470 65.470 64.882 0.588 17919 24764 1 61 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.810 0.140 17919 24765 1 61 . 1 1 20 20 SER N N 20 103.400 103.400 109.673 -6.273 17919 24766 1 61 . 1 1 20 20 SER HA H 20 4.370 4.370 4.340 0.030 17919 24767 1 61 . 1 1 20 20 SER C C 20 174.660 174.660 174.490 0.170 17919 24768 1 61 . 1 1 20 20 SER CA C 20 57.400 57.400 58.213 -0.813 17919 24769 1 61 . 1 1 20 20 SER CB C 20 63.370 63.370 63.075 0.295 17919 24770 1 61 . 1 1 20 20 SER H H 20 7.040 7.040 7.833 -0.793 17919 24771 1 61 . 1 1 21 21 ASP N N 21 123.480 123.480 123.824 -0.344 17919 24772 1 61 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.642 0.053 17919 24773 1 61 . 1 1 21 21 ASP C C 21 176.360 176.360 176.293 0.067 17919 24774 1 61 . 1 1 21 21 ASP CA C 21 55.700 55.700 56.118 -0.418 17919 24775 1 61 . 1 1 21 21 ASP CB C 21 40.800 40.800 42.318 -1.518 17919 24776 1 61 . 1 1 21 21 ASP H H 21 8.030 8.030 7.811 0.219 17919 24777 1 61 . 1 1 22 22 THR N N 22 108.800 108.800 113.258 -4.458 17919 24778 1 61 . 1 1 22 22 THR HA H 22 4.920 4.920 4.509 0.411 17919 24779 1 61 . 1 1 22 22 THR C C 22 176.750 176.750 175.509 1.241 17919 24780 1 61 . 1 1 22 22 THR CA C 22 59.690 59.690 60.813 -1.123 17919 24781 1 61 . 1 1 22 22 THR CB C 22 71.200 71.200 70.673 0.527 17919 24782 1 61 . 1 1 22 22 THR H H 22 7.900 7.900 8.276 -0.376 17919 24783 1 61 . 1 1 23 23 ILE N N 23 121.190 121.190 120.974 0.216 17919 24784 1 61 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.922 -0.265 17919 24785 1 61 . 1 1 23 23 ILE C C 23 179.040 179.040 177.668 1.372 17919 24786 1 61 . 1 1 23 23 ILE CA C 23 62.260 62.260 61.876 0.384 17919 24787 1 61 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.650 -2.300 17919 24788 1 61 . 1 1 23 23 ILE H H 23 8.560 8.560 8.520 0.040 17919 24789 1 61 . 1 1 24 24 GLU N N 24 120.830 120.830 121.389 -0.559 17919 24790 1 61 . 1 1 24 24 GLU HA H 24 3.917 3.917 4.025 -0.108 17919 24791 1 61 . 1 1 24 24 GLU C C 24 178.640 178.640 178.500 0.140 17919 24792 1 61 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.962 0.258 17919 24793 1 61 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.452 -1.172 17919 24794 1 61 . 1 1 24 24 GLU H H 24 9.760 9.760 8.030 1.730 17919 24795 1 61 . 1 1 25 25 ASN N N 25 120.570 120.570 117.193 3.377 17919 24796 1 61 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.530 -0.005 17919 24797 1 61 . 1 1 25 25 ASN C C 25 178.380 178.380 177.882 0.498 17919 24798 1 61 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.302 0.758 17919 24799 1 61 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.639 -0.189 17919 24800 1 61 . 1 1 25 25 ASN H H 25 7.920 7.920 7.704 0.216 17919 24801 1 61 . 1 1 26 26 VAL N N 26 121.710 121.710 121.165 0.545 17919 24802 1 61 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.557 -0.160 17919 24803 1 61 . 1 1 26 26 VAL C C 26 177.950 177.950 177.520 0.430 17919 24804 1 61 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.888 0.772 17919 24805 1 61 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.637 -0.797 17919 24806 1 61 . 1 1 26 26 VAL H H 26 8.070 8.070 8.013 0.057 17919 24807 1 61 . 1 1 27 27 LYS N N 27 118.860 118.860 119.622 -0.762 17919 24808 1 61 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.156 0.424 17919 24809 1 61 . 1 1 27 27 LYS C C 27 180.550 180.550 178.742 1.808 17919 24810 1 61 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.577 -0.327 17919 24811 1 61 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.189 1.541 17919 24812 1 61 . 1 1 27 27 LYS H H 27 8.560 8.560 7.770 0.790 17919 24813 1 61 . 1 1 28 28 ALA N N 28 123.440 123.440 120.541 2.899 17919 24814 1 61 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.146 0.014 17919 24815 1 61 . 1 1 28 28 ALA C C 28 180.300 180.300 178.956 1.344 17919 24816 1 61 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.337 1.032 17919 24817 1 61 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.305 -0.595 17919 24818 1 61 . 1 1 28 28 ALA H H 28 8.060 8.060 7.864 0.196 17919 24819 1 61 . 1 1 29 29 LYS N N 29 119.940 119.940 120.475 -0.535 17919 24820 1 61 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.050 0.157 17919 24821 1 61 . 1 1 29 29 LYS C C 29 180.320 180.320 178.795 1.525 17919 24822 1 61 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.405 0.245 17919 24823 1 61 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.419 0.871 17919 24824 1 61 . 1 1 29 29 LYS H H 29 7.850 7.850 7.907 -0.057 17919 24825 1 61 . 1 1 30 30 ILE N N 30 121.080 121.080 120.563 0.517 17919 24826 1 61 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.616 -0.109 17919 24827 1 61 . 1 1 30 30 ILE C C 30 178.310 178.310 177.569 0.741 17919 24828 1 61 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.498 0.652 17919 24829 1 61 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.479 -0.679 17919 24830 1 61 . 1 1 30 30 ILE H H 30 8.280 8.280 7.951 0.329 17919 24831 1 61 . 1 1 31 31 GLN N N 31 123.490 123.490 118.806 4.684 17919 24832 1 61 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.017 -0.188 17919 24833 1 61 . 1 1 31 31 GLN C C 31 178.890 178.890 177.962 0.928 17919 24834 1 61 . 1 1 31 31 GLN CA C 31 60.000 60.000 58.675 1.325 17919 24835 1 61 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.667 -0.947 17919 24836 1 61 . 1 1 31 31 GLN H H 31 8.580 8.580 8.276 0.304 17919 24837 1 61 . 1 1 32 32 ASP N N 32 119.360 119.360 120.326 -0.966 17919 24838 1 61 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.470 -0.116 17919 24839 1 61 . 1 1 32 32 ASP C C 32 177.250 177.250 178.050 -0.800 17919 24840 1 61 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.586 0.604 17919 24841 1 61 . 1 1 32 32 ASP CB C 32 40.580 40.580 41.040 -0.460 17919 24842 1 61 . 1 1 32 32 ASP H H 32 8.010 8.010 7.774 0.236 17919 24843 1 61 . 1 1 33 33 LYS N N 33 115.130 115.130 118.435 -3.305 17919 24844 1 61 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.216 0.121 17919 24845 1 61 . 1 1 33 33 LYS C C 33 177.870 177.870 178.206 -0.336 17919 24846 1 61 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.954 -0.904 17919 24847 1 61 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.489 0.681 17919 24848 1 61 . 1 1 33 33 LYS H H 33 7.430 7.430 8.054 -0.624 17919 24849 1 61 . 1 1 34 34 GLU N N 34 113.870 113.870 114.198 -0.328 17919 24850 1 61 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.544 0.081 17919 24851 1 61 . 1 1 34 34 GLU C C 34 177.840 177.840 176.845 0.995 17919 24852 1 61 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.705 -0.535 17919 24853 1 61 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.989 0.671 17919 24854 1 61 . 1 1 34 34 GLU H H 34 8.740 8.740 7.963 0.777 17919 24855 1 61 . 1 1 35 35 GLY N N 35 108.650 108.650 107.990 0.660 17919 24856 1 61 . 1 1 35 35 GLY C C 35 173.960 173.960 174.595 -0.635 17919 24857 1 61 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.682 0.398 17919 24858 1 61 . 1 1 35 35 GLY H H 35 8.530 8.530 7.971 0.559 17919 24859 1 61 . 1 1 36 36 ILE N N 36 119.880 119.880 122.703 -2.823 17919 24860 1 61 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.301 0.144 17919 24861 1 61 . 1 1 36 36 ILE C C 36 173.590 173.590 174.086 -0.496 17919 24862 1 61 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.384 -0.634 17919 24863 1 61 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.147 2.433 17919 24864 1 61 . 1 1 36 36 ILE H H 36 6.150 6.150 7.672 -1.522 17919 24865 1 61 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.549 0.085 17919 24866 1 61 . 1 1 37 37 PRO C C 37 176.940 176.940 176.033 0.907 17919 24867 1 61 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.741 -0.081 17919 24868 1 61 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.165 0.685 17919 24869 1 61 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.079 0.038 17919 24870 1 61 . 1 1 38 38 PRO C C 38 178.320 178.320 178.511 -0.191 17919 24871 1 61 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.957 0.303 17919 24872 1 61 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.874 1.016 17919 24873 1 61 . 1 1 39 39 ASP N N 39 113.380 113.380 115.614 -2.234 17919 24874 1 61 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.312 0.118 17919 24875 1 61 . 1 1 39 39 ASP C C 39 177.090 177.090 178.036 -0.946 17919 24876 1 61 . 1 1 39 39 ASP CA C 39 55.640 55.640 57.202 -1.562 17919 24877 1 61 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.373 -0.833 17919 24878 1 61 . 1 1 39 39 ASP H H 39 8.550 8.550 8.771 -0.221 17919 24879 1 61 . 1 1 40 40 GLN N N 40 116.780 116.780 117.107 -0.327 17919 24880 1 61 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.316 0.148 17919 24881 1 61 . 1 1 40 40 GLN C C 40 175.380 175.380 175.994 -0.614 17919 24882 1 61 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.437 -0.797 17919 24883 1 61 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.691 0.449 17919 24884 1 61 . 1 1 40 40 GLN H H 40 7.820 7.820 7.562 0.258 17919 24885 1 61 . 1 1 41 41 GLN N N 41 117.720 117.720 119.462 -1.742 17919 24886 1 61 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.440 -0.196 17919 24887 1 61 . 1 1 41 41 GLN C C 41 176.300 176.300 175.170 1.130 17919 24888 1 61 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.078 0.393 17919 24889 1 61 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.465 2.185 17919 24890 1 61 . 1 1 41 41 GLN H H 41 7.480 7.480 7.656 -0.176 17919 24891 1 61 . 1 1 42 42 ARG N N 42 122.680 122.680 123.476 -0.796 17919 24892 1 61 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.676 -0.176 17919 24893 1 61 . 1 1 42 42 ARG C C 42 174.050 174.050 174.575 -0.525 17919 24894 1 61 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.146 -0.096 17919 24895 1 61 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.961 -2.211 17919 24896 1 61 . 1 1 42 42 ARG H H 42 8.530 8.530 8.090 0.440 17919 24897 1 61 . 1 1 43 43 LEU N N 43 124.040 124.040 121.337 2.703 17919 24898 1 61 . 1 1 43 43 LEU C C 43 175.290 175.290 174.570 0.720 17919 24899 1 61 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.873 -0.893 17919 24900 1 61 . 1 1 43 43 LEU CB C 43 45.790 45.790 45.200 0.590 17919 24901 1 61 . 1 1 43 43 LEU H H 43 8.820 8.820 8.649 0.171 17919 24902 1 61 . 1 1 44 44 ILE N N 44 121.920 121.920 123.010 -1.090 17919 24903 1 61 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.068 -0.076 17919 24904 1 61 . 1 1 44 44 ILE C C 44 176.060 176.060 174.400 1.660 17919 24905 1 61 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.081 -1.101 17919 24906 1 61 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.231 0.189 17919 24907 1 61 . 1 1 44 44 ILE H H 44 9.030 9.030 7.998 1.032 17919 24908 1 61 . 1 1 45 45 PHE N N 45 125.390 125.390 128.646 -3.256 17919 24909 1 61 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.058 -0.013 17919 24910 1 61 . 1 1 45 45 PHE C C 45 174.470 174.470 174.284 0.186 17919 24911 1 61 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.010 1.010 17919 24912 1 61 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.942 0.818 17919 24913 1 61 . 1 1 45 45 PHE H H 45 8.830 8.830 8.937 -0.107 17919 24914 1 61 . 1 1 46 46 ALA N N 46 132.200 132.200 130.157 2.043 17919 24915 1 61 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.694 -0.004 17919 24916 1 61 . 1 1 46 46 ALA C C 46 177.290 177.290 177.780 -0.490 17919 24917 1 61 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.390 0.150 17919 24918 1 61 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.328 0.242 17919 24919 1 61 . 1 1 46 46 ALA H H 46 8.810 8.810 8.982 -0.172 17919 24920 1 61 . 1 1 47 47 GLY N N 47 102.340 102.340 105.286 -2.946 17919 24921 1 61 . 1 1 47 47 GLY C C 47 173.810 173.810 174.400 -0.590 17919 24922 1 61 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.288 0.062 17919 24923 1 61 . 1 1 47 47 GLY H H 47 8.130 8.130 8.614 -0.484 17919 24924 1 61 . 1 1 48 48 LYS N N 48 121.570 121.570 122.000 -0.430 17919 24925 1 61 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.409 0.213 17919 24926 1 61 . 1 1 48 48 LYS C C 48 174.700 174.700 175.380 -0.680 17919 24927 1 61 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.960 -0.410 17919 24928 1 61 . 1 1 48 48 LYS CB C 48 34.530 34.530 33.391 1.139 17919 24929 1 61 . 1 1 48 48 LYS H H 48 7.980 7.980 7.503 0.477 17919 24930 1 61 . 1 1 49 49 GLN N N 49 122.410 122.410 125.409 -2.999 17919 24931 1 61 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.141 0.419 17919 24932 1 61 . 1 1 49 49 GLN C C 49 175.670 175.670 175.135 0.535 17919 24933 1 61 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.261 -0.521 17919 24934 1 61 . 1 1 49 49 GLN CB C 49 29.000 29.000 28.946 0.054 17919 24935 1 61 . 1 1 49 49 GLN H H 49 8.600 8.600 8.684 -0.084 17919 24936 1 61 . 1 1 50 50 LEU N N 50 125.520 125.520 130.176 -4.656 17919 24937 1 61 . 1 1 50 50 LEU HA H 50 4.090 4.090 3.863 0.227 17919 24938 1 61 . 1 1 50 50 LEU C C 50 176.660 176.660 175.379 1.281 17919 24939 1 61 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.795 0.445 17919 24940 1 61 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.671 -0.101 17919 24941 1 61 . 1 1 50 50 LEU H H 50 8.530 8.530 8.965 -0.435 17919 24942 1 61 . 1 1 51 51 GLU N N 51 122.940 122.940 123.978 -1.038 17919 24943 1 61 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.526 -0.038 17919 24944 1 61 . 1 1 51 51 GLU C C 51 175.870 175.870 177.219 -1.349 17919 24945 1 61 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.132 0.828 17919 24946 1 61 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.433 -0.863 17919 24947 1 61 . 1 1 51 51 GLU H H 51 8.400 8.400 8.164 0.236 17919 24948 1 61 . 1 1 52 52 ASP N N 52 120.030 120.030 123.106 -3.076 17919 24949 1 61 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.582 -0.223 17919 24950 1 61 . 1 1 52 52 ASP C C 52 177.330 177.330 178.339 -1.009 17919 24951 1 61 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.434 -0.474 17919 24952 1 61 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.782 0.068 17919 24953 1 61 . 1 1 52 52 ASP H H 52 8.160 8.160 8.818 -0.658 17919 24954 1 61 . 1 1 53 53 GLY N N 53 106.660 106.660 107.810 -1.150 17919 24955 1 61 . 1 1 53 53 GLY C C 53 174.870 174.870 174.223 0.647 17919 24956 1 61 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.139 0.031 17919 24957 1 61 . 1 1 53 53 GLY H H 53 9.390 9.390 8.393 0.997 17919 24958 1 61 . 1 1 54 54 ARG N N 54 119.050 119.050 120.304 -1.254 17919 24959 1 61 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.528 0.167 17919 24960 1 61 . 1 1 54 54 ARG C C 54 175.350 175.350 176.052 -0.702 17919 24961 1 61 . 1 1 54 54 ARG CA C 54 54.390 54.390 53.528 0.862 17919 24962 1 61 . 1 1 54 54 ARG CB C 54 32.650 32.650 31.860 0.790 17919 24963 1 61 . 1 1 54 54 ARG H H 54 7.460 7.460 7.627 -0.167 17919 24964 1 61 . 1 1 55 55 THR N N 55 108.400 108.400 113.695 -5.295 17919 24965 1 61 . 1 1 55 55 THR HA H 55 5.240 5.240 4.857 0.383 17919 24966 1 61 . 1 1 55 55 THR C C 55 176.560 176.560 176.145 0.415 17919 24967 1 61 . 1 1 55 55 THR CA C 55 59.690 59.690 60.708 -1.018 17919 24968 1 61 . 1 1 55 55 THR CB C 55 72.260 72.260 70.608 1.652 17919 24969 1 61 . 1 1 55 55 THR H H 55 8.730 8.730 8.011 0.719 17919 24970 1 61 . 1 1 56 56 LEU N N 56 117.920 117.920 122.929 -5.009 17919 24971 1 61 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.882 0.178 17919 24972 1 61 . 1 1 56 56 LEU C C 56 180.810 180.810 179.061 1.749 17919 24973 1 61 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.643 0.067 17919 24974 1 61 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.197 -0.827 17919 24975 1 61 . 1 1 56 56 LEU H H 56 8.140 8.140 8.610 -0.470 17919 24976 1 61 . 1 1 57 57 SER N N 57 113.330 113.330 113.587 -0.257 17919 24977 1 61 . 1 1 57 57 SER HA H 57 4.370 4.370 4.182 0.188 17919 24978 1 61 . 1 1 57 57 SER C C 57 178.310 178.310 177.094 1.216 17919 24979 1 61 . 1 1 57 57 SER CA C 57 61.080 61.080 61.267 -0.188 17919 24980 1 61 . 1 1 57 57 SER CB C 57 62.530 62.530 62.280 0.250 17919 24981 1 61 . 1 1 57 57 SER H H 57 8.470 8.470 8.180 0.290 17919 24982 1 61 . 1 1 58 58 ASP N N 58 124.190 124.190 124.175 0.015 17919 24983 1 61 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.306 -0.010 17919 24984 1 61 . 1 1 58 58 ASP C C 58 177.400 177.400 177.736 -0.336 17919 24985 1 61 . 1 1 58 58 ASP CA C 58 57.180 57.180 57.037 0.143 17919 24986 1 61 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.537 -0.437 17919 24987 1 61 . 1 1 58 58 ASP H H 58 7.930 7.930 7.686 0.243 17919 24988 1 61 . 1 1 59 59 TYR N N 59 115.510 115.510 116.121 -0.611 17919 24989 1 61 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.543 0.127 17919 24990 1 61 . 1 1 59 59 TYR C C 59 174.700 174.700 175.363 -0.663 17919 24991 1 61 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.010 1.240 17919 24992 1 61 . 1 1 59 59 TYR CB C 59 40.070 40.070 37.711 2.359 17919 24993 1 61 . 1 1 59 59 TYR H H 59 7.250 7.250 7.580 -0.330 17919 24994 1 61 . 1 1 60 60 ASN N N 60 115.900 115.900 117.906 -2.006 17919 24995 1 61 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.446 -0.091 17919 24996 1 61 . 1 1 60 60 ASN C C 60 174.340 174.340 174.274 0.066 17919 24997 1 61 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.708 -0.588 17919 24998 1 61 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.247 0.163 17919 24999 1 61 . 1 1 60 60 ASN H H 60 8.150 8.150 7.794 0.356 17919 25000 1 61 . 1 1 61 61 ILE N N 61 118.600 118.600 120.119 -1.519 17919 25001 1 61 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.615 -0.222 17919 25002 1 61 . 1 1 61 61 ILE C C 61 174.610 174.610 174.708 -0.098 17919 25003 1 61 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.496 0.924 17919 25004 1 61 . 1 1 61 61 ILE CB C 61 36.740 36.740 38.019 -1.279 17919 25005 1 61 . 1 1 61 61 ILE H H 61 7.250 7.250 8.286 -1.036 17919 25006 1 61 . 1 1 62 62 GLN N N 62 124.740 124.740 125.144 -0.404 17919 25007 1 61 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.666 -0.160 17919 25008 1 61 . 1 1 62 62 GLN C C 62 175.970 175.970 176.342 -0.372 17919 25009 1 61 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.523 0.138 17919 25010 1 61 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.135 0.515 17919 25011 1 61 . 1 1 62 62 GLN H H 62 7.610 7.610 8.133 -0.523 17919 25012 1 61 . 1 1 63 63 LYS N N 63 120.300 120.300 120.600 -0.300 17919 25013 1 61 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.944 0.057 17919 25014 1 61 . 1 1 63 63 LYS C C 63 175.810 175.810 177.061 -1.251 17919 25015 1 61 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.693 0.097 17919 25016 1 61 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.622 1.028 17919 25017 1 61 . 1 1 63 63 LYS H H 63 8.490 8.490 8.583 -0.093 17919 25018 1 61 . 1 1 64 64 GLU N N 64 113.950 113.950 118.037 -4.087 17919 25019 1 61 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.829 -0.364 17919 25020 1 61 . 1 1 64 64 GLU C C 64 175.250 175.250 176.052 -0.802 17919 25021 1 61 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.791 0.099 17919 25022 1 61 . 1 1 64 64 GLU CB C 64 25.900 25.900 27.748 -1.849 17919 25023 1 61 . 1 1 64 64 GLU H H 64 9.280 9.280 8.509 0.771 17919 25024 1 61 . 1 1 65 65 SER N N 65 114.730 114.730 116.569 -1.839 17919 25025 1 61 . 1 1 65 65 SER HA H 65 4.640 4.640 4.543 0.097 17919 25026 1 61 . 1 1 65 65 SER C C 65 172.160 172.160 173.845 -1.685 17919 25027 1 61 . 1 1 65 65 SER CA C 65 60.890 60.890 60.251 0.639 17919 25028 1 61 . 1 1 65 65 SER CB C 65 64.910 64.910 64.138 0.772 17919 25029 1 61 . 1 1 65 65 SER H H 65 7.670 7.670 7.656 0.014 17919 25030 1 61 . 1 1 66 66 THR N N 66 117.110 117.110 120.559 -3.449 17919 25031 1 61 . 1 1 66 66 THR HA H 66 5.270 5.270 4.939 0.331 17919 25032 1 61 . 1 1 66 66 THR C C 66 173.950 173.950 174.089 -0.139 17919 25033 1 61 . 1 1 66 66 THR CA C 66 62.340 62.340 62.172 0.168 17919 25034 1 61 . 1 1 66 66 THR CB C 66 70.080 70.080 69.844 0.236 17919 25035 1 61 . 1 1 66 66 THR H H 66 8.730 8.730 8.290 0.440 17919 25036 1 61 . 1 1 67 67 LEU N N 67 127.110 127.110 127.238 -0.128 17919 25037 1 61 . 1 1 67 67 LEU HA H 67 5.060 5.060 5.132 -0.072 17919 25038 1 61 . 1 1 67 67 LEU C C 67 175.770 175.770 175.273 0.497 17919 25039 1 61 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.027 -0.127 17919 25040 1 61 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.019 0.241 17919 25041 1 61 . 1 1 67 67 LEU H H 67 9.410 9.410 9.249 0.161 17919 25042 1 61 . 1 1 68 68 HIS N N 68 118.380 118.380 123.244 -4.864 17919 25043 1 61 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.336 -0.096 17919 25044 1 61 . 1 1 68 68 HIS C C 68 173.150 173.150 175.010 -1.860 17919 25045 1 61 . 1 1 68 68 HIS CA C 68 55.000 55.000 53.953 1.047 17919 25046 1 61 . 1 1 68 68 HIS CB C 68 30.530 30.530 30.980 -0.450 17919 25047 1 61 . 1 1 68 68 HIS H H 68 9.230 9.230 8.881 0.349 17919 25048 1 61 . 1 1 69 69 LEU N N 69 124.460 124.460 128.079 -3.619 17919 25049 1 61 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.019 0.171 17919 25050 1 61 . 1 1 69 69 LEU C C 69 175.270 175.270 174.262 1.008 17919 25051 1 61 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.984 -0.094 17919 25052 1 61 . 1 1 69 69 LEU CB C 69 44.380 44.380 43.830 0.551 17919 25053 1 61 . 1 1 69 69 LEU H H 69 8.340 8.340 7.753 0.587 17919 25054 1 61 . 1 1 70 70 VAL N N 70 126.940 126.940 120.184 6.756 17919 25055 1 61 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.441 -0.091 17919 25056 1 61 . 1 1 70 70 VAL C C 70 174.000 174.000 173.784 0.216 17919 25057 1 61 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.276 0.524 17919 25058 1 61 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.850 -0.940 17919 25059 1 61 . 1 1 70 70 VAL H H 70 9.200 9.200 8.279 0.921 17919 25060 1 61 . 1 1 71 71 LEU N N 71 123.130 123.130 126.115 -2.985 17919 25061 1 61 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.109 -0.049 17919 25062 1 61 . 1 1 71 71 LEU C C 71 177.830 177.830 176.591 1.239 17919 25063 1 61 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.639 0.301 17919 25064 1 61 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.156 -0.306 17919 25065 1 61 . 1 1 71 71 LEU H H 71 8.120 8.120 8.341 -0.221 17919 25066 1 61 . 1 1 72 72 ARG N N 72 123.490 123.490 124.355 -0.865 17919 25067 1 61 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.536 -0.235 17919 25068 1 61 . 1 1 72 72 ARG C C 72 175.350 175.350 175.365 -0.015 17919 25069 1 61 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.875 -0.265 17919 25070 1 61 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.906 0.444 17919 25071 1 61 . 1 1 72 72 ARG H H 72 8.580 8.580 8.608 -0.028 17919 25072 1 62 . 1 1 2 2 GLN N N 2 123.220 123.220 121.208 2.012 17919 25073 1 62 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.301 -0.052 17919 25074 1 62 . 1 1 2 2 GLN C C 2 175.920 175.920 175.059 0.861 17919 25075 1 62 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.660 0.420 17919 25076 1 62 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.696 0.064 17919 25077 1 62 . 1 1 2 2 GLN H H 2 8.900 8.900 8.709 0.191 17919 25078 1 62 . 1 1 3 3 ILE N N 3 115.340 115.340 118.167 -2.827 17919 25079 1 62 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.119 0.094 17919 25080 1 62 . 1 1 3 3 ILE C C 3 172.450 172.450 173.705 -1.255 17919 25081 1 62 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.195 0.375 17919 25082 1 62 . 1 1 3 3 ILE CB C 3 42.210 42.210 40.451 1.759 17919 25083 1 62 . 1 1 3 3 ILE H H 3 8.320 8.320 7.819 0.501 17919 25084 1 62 . 1 1 4 4 PHE N N 4 118.110 118.110 122.266 -4.156 17919 25085 1 62 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.319 0.311 17919 25086 1 62 . 1 1 4 4 PHE C C 4 175.320 175.320 175.536 -0.216 17919 25087 1 62 . 1 1 4 4 PHE CA C 4 55.210 55.210 54.946 0.264 17919 25088 1 62 . 1 1 4 4 PHE CB C 4 41.480 41.480 40.296 1.184 17919 25089 1 62 . 1 1 4 4 PHE H H 4 8.610 8.610 8.108 0.502 17919 25090 1 62 . 1 1 5 5 VAL N N 5 121.000 121.000 116.373 4.627 17919 25091 1 62 . 1 1 5 5 VAL HA H 5 4.725 4.725 5.254 -0.529 17919 25092 1 62 . 1 1 5 5 VAL C C 5 174.870 174.870 174.175 0.695 17919 25093 1 62 . 1 1 5 5 VAL CA C 5 60.620 60.620 60.034 0.586 17919 25094 1 62 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.515 -0.285 17919 25095 1 62 . 1 1 5 5 VAL H H 5 9.300 9.300 9.307 -0.007 17919 25096 1 62 . 1 1 6 6 LYS N N 6 127.520 127.520 127.423 0.097 17919 25097 1 62 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.376 -0.009 17919 25098 1 62 . 1 1 6 6 LYS C C 6 177.140 177.140 175.672 1.468 17919 25099 1 62 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.086 0.435 17919 25100 1 62 . 1 1 6 6 LYS CB C 6 35.050 35.050 36.784 -1.734 17919 25101 1 62 . 1 1 6 6 LYS H H 6 8.820 8.820 9.338 -0.518 17919 25102 1 62 . 1 1 7 7 THR N N 7 115.400 115.400 114.542 0.858 17919 25103 1 62 . 1 1 7 7 THR HA H 7 4.970 4.970 4.873 0.097 17919 25104 1 62 . 1 1 7 7 THR C C 7 176.910 176.910 175.669 1.241 17919 25105 1 62 . 1 1 7 7 THR CA C 7 60.470 60.470 60.400 0.070 17919 25106 1 62 . 1 1 7 7 THR CB C 7 70.630 70.630 71.767 -1.137 17919 25107 1 62 . 1 1 7 7 THR H H 7 8.730 8.730 8.612 0.118 17919 25108 1 62 . 1 1 8 8 LEU N N 8 121.330 121.330 124.321 -2.991 17919 25109 1 62 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.148 0.162 17919 25110 1 62 . 1 1 8 8 LEU C C 8 178.800 178.800 177.081 1.719 17919 25111 1 62 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.665 -0.085 17919 25112 1 62 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.308 -0.338 17919 25113 1 62 . 1 1 8 8 LEU H H 8 9.100 9.100 9.258 -0.158 17919 25114 1 62 . 1 1 9 9 THR N N 9 105.590 105.590 107.396 -1.806 17919 25115 1 62 . 1 1 9 9 THR HA H 9 4.428 4.428 4.196 0.232 17919 25116 1 62 . 1 1 9 9 THR C C 9 175.520 175.520 175.429 0.091 17919 25117 1 62 . 1 1 9 9 THR CA C 9 61.400 61.400 62.871 -1.471 17919 25118 1 62 . 1 1 9 9 THR CB C 9 69.140 69.140 68.274 0.866 17919 25119 1 62 . 1 1 9 9 THR H H 9 7.630 7.630 7.873 -0.243 17919 25120 1 62 . 1 1 10 10 GLY N N 10 108.890 108.890 109.456 -0.566 17919 25121 1 62 . 1 1 10 10 GLY C C 10 174.070 174.070 173.472 0.598 17919 25122 1 62 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.603 0.857 17919 25123 1 62 . 1 1 10 10 GLY H H 10 7.810 7.810 7.580 0.230 17919 25124 1 62 . 1 1 11 11 LYS N N 11 121.600 121.600 122.871 -1.271 17919 25125 1 62 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.538 -0.177 17919 25126 1 62 . 1 1 11 11 LYS C C 11 175.940 175.940 175.347 0.593 17919 25127 1 62 . 1 1 11 11 LYS CA C 11 56.280 56.280 55.168 1.112 17919 25128 1 62 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.832 -0.632 17919 25129 1 62 . 1 1 11 11 LYS H H 11 7.280 7.280 8.130 -0.850 17919 25130 1 62 . 1 1 12 12 THR N N 12 120.440 120.440 121.633 -1.193 17919 25131 1 62 . 1 1 12 12 THR HA H 12 5.046 5.046 4.391 0.655 17919 25132 1 62 . 1 1 12 12 THR C C 12 174.320 174.320 173.925 0.395 17919 25133 1 62 . 1 1 12 12 THR CA C 12 62.390 62.390 62.532 -0.142 17919 25134 1 62 . 1 1 12 12 THR CB C 12 69.910 69.910 69.587 0.323 17919 25135 1 62 . 1 1 12 12 THR H H 12 8.650 8.650 8.461 0.189 17919 25136 1 62 . 1 1 13 13 ILE N N 13 127.110 127.110 126.783 0.327 17919 25137 1 62 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.415 0.129 17919 25138 1 62 . 1 1 13 13 ILE C C 13 175.220 175.220 174.628 0.592 17919 25139 1 62 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.504 -0.524 17919 25140 1 62 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.629 -0.679 17919 25141 1 62 . 1 1 13 13 ILE H H 13 9.450 9.450 8.602 0.848 17919 25142 1 62 . 1 1 14 14 THR N N 14 121.520 121.520 120.777 0.743 17919 25143 1 62 . 1 1 14 14 THR HA H 14 4.964 4.964 5.014 -0.050 17919 25144 1 62 . 1 1 14 14 THR C C 14 173.790 173.790 173.742 0.048 17919 25145 1 62 . 1 1 14 14 THR CA C 14 61.940 61.940 62.062 -0.122 17919 25146 1 62 . 1 1 14 14 THR CB C 14 69.650 69.650 70.293 -0.643 17919 25147 1 62 . 1 1 14 14 THR H H 14 8.710 8.710 8.362 0.348 17919 25148 1 62 . 1 1 15 15 LEU N N 15 124.800 124.800 125.969 -1.169 17919 25149 1 62 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.749 0.031 17919 25150 1 62 . 1 1 15 15 LEU C C 15 174.670 174.670 175.174 -0.504 17919 25151 1 62 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.570 -0.740 17919 25152 1 62 . 1 1 15 15 LEU CB C 15 47.070 47.070 46.030 1.040 17919 25153 1 62 . 1 1 15 15 LEU H H 15 8.710 8.710 8.915 -0.205 17919 25154 1 62 . 1 1 16 16 GLU N N 16 122.160 122.160 122.768 -0.608 17919 25155 1 62 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.553 0.364 17919 25156 1 62 . 1 1 16 16 GLU C C 16 175.860 175.860 175.914 -0.054 17919 25157 1 62 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.725 -0.905 17919 25158 1 62 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.411 -0.961 17919 25159 1 62 . 1 1 16 16 GLU H H 16 8.140 8.140 8.668 -0.528 17919 25160 1 62 . 1 1 17 17 VAL N N 17 117.210 117.210 121.145 -3.935 17919 25161 1 62 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.856 -0.142 17919 25162 1 62 . 1 1 17 17 VAL C C 17 174.160 174.160 174.622 -0.462 17919 25163 1 62 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.096 -0.666 17919 25164 1 62 . 1 1 17 17 VAL CB C 17 36.400 36.400 36.071 0.329 17919 25165 1 62 . 1 1 17 17 VAL H H 17 8.900 8.900 8.498 0.402 17919 25166 1 62 . 1 1 18 18 GLU N N 18 118.990 118.990 119.382 -0.392 17919 25167 1 62 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.875 0.204 17919 25168 1 62 . 1 1 18 18 GLU C C 18 176.160 176.160 175.173 0.987 17919 25169 1 62 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.110 -0.390 17919 25170 1 62 . 1 1 18 18 GLU CB C 18 30.310 30.310 32.576 -2.266 17919 25171 1 62 . 1 1 18 18 GLU H H 18 8.640 8.640 8.345 0.295 17919 25172 1 62 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.297 -0.156 17919 25173 1 62 . 1 1 19 19 PRO C C 19 175.310 175.310 177.687 -2.377 17919 25174 1 62 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.173 0.297 17919 25175 1 62 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.969 -0.019 17919 25176 1 62 . 1 1 20 20 SER N N 20 103.400 103.400 110.290 -6.890 17919 25177 1 62 . 1 1 20 20 SER HA H 20 4.370 4.370 4.354 0.016 17919 25178 1 62 . 1 1 20 20 SER C C 20 174.660 174.660 174.450 0.210 17919 25179 1 62 . 1 1 20 20 SER CA C 20 57.400 57.400 58.321 -0.921 17919 25180 1 62 . 1 1 20 20 SER CB C 20 63.370 63.370 62.968 0.402 17919 25181 1 62 . 1 1 20 20 SER H H 20 7.040 7.040 7.954 -0.914 17919 25182 1 62 . 1 1 21 21 ASP N N 21 123.480 123.480 125.260 -1.780 17919 25183 1 62 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.624 0.071 17919 25184 1 62 . 1 1 21 21 ASP C C 21 176.360 176.360 175.985 0.375 17919 25185 1 62 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.289 0.411 17919 25186 1 62 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.410 -0.610 17919 25187 1 62 . 1 1 21 21 ASP H H 21 8.030 8.030 7.966 0.064 17919 25188 1 62 . 1 1 22 22 THR N N 22 108.800 108.800 114.183 -5.383 17919 25189 1 62 . 1 1 22 22 THR HA H 22 4.920 4.920 4.487 0.433 17919 25190 1 62 . 1 1 22 22 THR C C 22 176.750 176.750 176.101 0.649 17919 25191 1 62 . 1 1 22 22 THR CA C 22 59.690 59.690 62.227 -2.537 17919 25192 1 62 . 1 1 22 22 THR CB C 22 71.200 71.200 69.617 1.583 17919 25193 1 62 . 1 1 22 22 THR H H 22 7.900 7.900 8.451 -0.551 17919 25194 1 62 . 1 1 23 23 ILE N N 23 121.190 121.190 123.116 -1.926 17919 25195 1 62 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.737 -0.080 17919 25196 1 62 . 1 1 23 23 ILE C C 23 179.040 179.040 177.687 1.353 17919 25197 1 62 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.411 -0.151 17919 25198 1 62 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.236 -1.886 17919 25199 1 62 . 1 1 23 23 ILE H H 23 8.560 8.560 8.938 -0.378 17919 25200 1 62 . 1 1 24 24 GLU N N 24 120.830 120.830 120.405 0.425 17919 25201 1 62 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.845 0.072 17919 25202 1 62 . 1 1 24 24 GLU C C 24 178.640 178.640 178.522 0.118 17919 25203 1 62 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.983 0.237 17919 25204 1 62 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.397 -1.117 17919 25205 1 62 . 1 1 24 24 GLU H H 24 9.760 9.760 7.942 1.818 17919 25206 1 62 . 1 1 25 25 ASN N N 25 120.570 120.570 118.047 2.523 17919 25207 1 62 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.478 0.047 17919 25208 1 62 . 1 1 25 25 ASN C C 25 178.380 178.380 178.094 0.286 17919 25209 1 62 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.110 -0.050 17919 25210 1 62 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.252 0.198 17919 25211 1 62 . 1 1 25 25 ASN H H 25 7.920 7.920 7.679 0.241 17919 25212 1 62 . 1 1 26 26 VAL N N 26 121.710 121.710 120.116 1.594 17919 25213 1 62 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.621 -0.224 17919 25214 1 62 . 1 1 26 26 VAL C C 26 177.950 177.950 177.919 0.031 17919 25215 1 62 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.756 0.904 17919 25216 1 62 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.517 -0.677 17919 25217 1 62 . 1 1 26 26 VAL H H 26 8.070 8.070 7.903 0.167 17919 25218 1 62 . 1 1 27 27 LYS N N 27 118.860 118.860 119.886 -1.026 17919 25219 1 62 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.276 0.304 17919 25220 1 62 . 1 1 27 27 LYS C C 27 180.550 180.550 178.970 1.580 17919 25221 1 62 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.321 -0.071 17919 25222 1 62 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.376 1.354 17919 25223 1 62 . 1 1 27 27 LYS H H 27 8.560 8.560 7.843 0.717 17919 25224 1 62 . 1 1 28 28 ALA N N 28 123.440 123.440 122.608 0.832 17919 25225 1 62 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.122 0.038 17919 25226 1 62 . 1 1 28 28 ALA C C 28 180.300 180.300 179.213 1.087 17919 25227 1 62 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.079 0.291 17919 25228 1 62 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.310 -0.600 17919 25229 1 62 . 1 1 28 28 ALA H H 28 8.060 8.060 8.585 -0.525 17919 25230 1 62 . 1 1 29 29 LYS N N 29 119.940 119.940 119.585 0.355 17919 25231 1 62 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.064 0.143 17919 25232 1 62 . 1 1 29 29 LYS C C 29 180.320 180.320 179.105 1.215 17919 25233 1 62 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.525 0.125 17919 25234 1 62 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.438 0.852 17919 25235 1 62 . 1 1 29 29 LYS H H 29 7.850 7.850 7.465 0.385 17919 25236 1 62 . 1 1 30 30 ILE N N 30 121.080 121.080 120.734 0.346 17919 25237 1 62 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.554 -0.047 17919 25238 1 62 . 1 1 30 30 ILE C C 30 178.310 178.310 177.384 0.926 17919 25239 1 62 . 1 1 30 30 ILE CA C 30 66.150 66.150 66.078 0.072 17919 25240 1 62 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.868 -1.068 17919 25241 1 62 . 1 1 30 30 ILE H H 30 8.280 8.280 8.397 -0.117 17919 25242 1 62 . 1 1 31 31 GLN N N 31 123.490 123.490 119.104 4.386 17919 25243 1 62 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.009 -0.180 17919 25244 1 62 . 1 1 31 31 GLN C C 31 178.890 178.890 178.545 0.345 17919 25245 1 62 . 1 1 31 31 GLN CA C 31 60.000 60.000 58.963 1.037 17919 25246 1 62 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.510 -0.790 17919 25247 1 62 . 1 1 31 31 GLN H H 31 8.580 8.580 8.196 0.384 17919 25248 1 62 . 1 1 32 32 ASP N N 32 119.360 119.360 120.308 -0.948 17919 25249 1 62 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.395 -0.041 17919 25250 1 62 . 1 1 32 32 ASP C C 32 177.250 177.250 177.749 -0.499 17919 25251 1 62 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.811 0.379 17919 25252 1 62 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.813 -0.233 17919 25253 1 62 . 1 1 32 32 ASP H H 32 8.010 8.010 8.281 -0.271 17919 25254 1 62 . 1 1 33 33 LYS N N 33 115.130 115.130 119.131 -4.001 17919 25255 1 62 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.156 0.181 17919 25256 1 62 . 1 1 33 33 LYS C C 33 177.870 177.870 178.374 -0.504 17919 25257 1 62 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.207 -0.157 17919 25258 1 62 . 1 1 33 33 LYS CB C 33 34.170 34.170 32.971 1.199 17919 25259 1 62 . 1 1 33 33 LYS H H 33 7.430 7.430 7.790 -0.360 17919 25260 1 62 . 1 1 34 34 GLU N N 34 113.870 113.870 113.932 -0.062 17919 25261 1 62 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.501 0.124 17919 25262 1 62 . 1 1 34 34 GLU C C 34 177.840 177.840 177.151 0.689 17919 25263 1 62 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.037 -0.867 17919 25264 1 62 . 1 1 34 34 GLU CB C 34 32.660 32.660 32.313 0.347 17919 25265 1 62 . 1 1 34 34 GLU H H 34 8.740 8.740 8.278 0.462 17919 25266 1 62 . 1 1 35 35 GLY N N 35 108.650 108.650 108.596 0.054 17919 25267 1 62 . 1 1 35 35 GLY C C 35 173.960 173.960 174.308 -0.348 17919 25268 1 62 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.525 0.555 17919 25269 1 62 . 1 1 35 35 GLY H H 35 8.530 8.530 7.968 0.562 17919 25270 1 62 . 1 1 36 36 ILE N N 36 119.880 119.880 120.543 -0.663 17919 25271 1 62 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.272 0.173 17919 25272 1 62 . 1 1 36 36 ILE C C 36 173.590 173.590 174.163 -0.573 17919 25273 1 62 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.291 0.459 17919 25274 1 62 . 1 1 36 36 ILE CB C 36 40.580 40.580 36.931 3.649 17919 25275 1 62 . 1 1 36 36 ILE H H 36 6.150 6.150 7.748 -1.598 17919 25276 1 62 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.867 -0.233 17919 25277 1 62 . 1 1 37 37 PRO C C 37 176.940 176.940 176.167 0.773 17919 25278 1 62 . 1 1 37 37 PRO CA C 37 61.660 61.660 60.985 0.675 17919 25279 1 62 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.294 0.556 17919 25280 1 62 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.087 0.030 17919 25281 1 62 . 1 1 38 38 PRO C C 38 178.320 178.320 178.706 -0.386 17919 25282 1 62 . 1 1 38 38 PRO CA C 38 66.260 66.260 66.470 -0.210 17919 25283 1 62 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.865 1.025 17919 25284 1 62 . 1 1 39 39 ASP N N 39 113.380 113.380 116.158 -2.778 17919 25285 1 62 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.358 0.072 17919 25286 1 62 . 1 1 39 39 ASP C C 39 177.090 177.090 177.979 -0.889 17919 25287 1 62 . 1 1 39 39 ASP CA C 39 55.640 55.640 57.553 -1.913 17919 25288 1 62 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.472 -0.932 17919 25289 1 62 . 1 1 39 39 ASP H H 39 8.550 8.550 8.820 -0.270 17919 25290 1 62 . 1 1 40 40 GLN N N 40 116.780 116.780 117.562 -0.782 17919 25291 1 62 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.287 0.177 17919 25292 1 62 . 1 1 40 40 GLN C C 40 175.380 175.380 175.884 -0.504 17919 25293 1 62 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.313 -0.673 17919 25294 1 62 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.599 0.541 17919 25295 1 62 . 1 1 40 40 GLN H H 40 7.820 7.820 7.839 -0.019 17919 25296 1 62 . 1 1 41 41 GLN N N 41 117.720 117.720 120.014 -2.294 17919 25297 1 62 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.773 -0.529 17919 25298 1 62 . 1 1 41 41 GLN C C 41 176.300 176.300 174.908 1.392 17919 25299 1 62 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.419 1.051 17919 25300 1 62 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.000 2.650 17919 25301 1 62 . 1 1 41 41 GLN H H 41 7.480 7.480 7.450 0.030 17919 25302 1 62 . 1 1 42 42 ARG N N 42 122.680 122.680 125.781 -3.101 17919 25303 1 62 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.521 -0.021 17919 25304 1 62 . 1 1 42 42 ARG C C 42 174.050 174.050 174.367 -0.317 17919 25305 1 62 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.258 -0.208 17919 25306 1 62 . 1 1 42 42 ARG CB C 42 31.750 31.750 31.827 -0.077 17919 25307 1 62 . 1 1 42 42 ARG H H 42 8.530 8.530 9.053 -0.523 17919 25308 1 62 . 1 1 43 43 LEU N N 43 124.040 124.040 126.861 -2.821 17919 25309 1 62 . 1 1 43 43 LEU C C 43 175.290 175.290 175.715 -0.425 17919 25310 1 62 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.835 -0.855 17919 25311 1 62 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.324 2.466 17919 25312 1 62 . 1 1 43 43 LEU H H 43 8.820 8.820 8.753 0.067 17919 25313 1 62 . 1 1 44 44 ILE N N 44 121.920 121.920 121.726 0.194 17919 25314 1 62 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.137 -0.145 17919 25315 1 62 . 1 1 44 44 ILE C C 44 176.060 176.060 174.667 1.393 17919 25316 1 62 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.955 -0.975 17919 25317 1 62 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.697 -0.277 17919 25318 1 62 . 1 1 44 44 ILE H H 44 9.030 9.030 9.193 -0.163 17919 25319 1 62 . 1 1 45 45 PHE N N 45 125.390 125.390 126.710 -1.320 17919 25320 1 62 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.009 0.036 17919 25321 1 62 . 1 1 45 45 PHE C C 45 174.470 174.470 174.474 -0.004 17919 25322 1 62 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.741 0.279 17919 25323 1 62 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.873 0.886 17919 25324 1 62 . 1 1 45 45 PHE H H 45 8.830 8.830 8.496 0.334 17919 25325 1 62 . 1 1 46 46 ALA N N 46 132.200 132.200 129.395 2.805 17919 25326 1 62 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.690 0.000 17919 25327 1 62 . 1 1 46 46 ALA C C 46 177.290 177.290 177.773 -0.483 17919 25328 1 62 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.635 -0.095 17919 25329 1 62 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.664 -0.094 17919 25330 1 62 . 1 1 46 46 ALA H H 46 8.810 8.810 8.917 -0.107 17919 25331 1 62 . 1 1 47 47 GLY N N 47 102.340 102.340 104.254 -1.914 17919 25332 1 62 . 1 1 47 47 GLY C C 47 173.810 173.810 174.264 -0.454 17919 25333 1 62 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.969 0.381 17919 25334 1 62 . 1 1 47 47 GLY H H 47 8.130 8.130 8.635 -0.505 17919 25335 1 62 . 1 1 48 48 LYS N N 48 121.570 121.570 121.473 0.097 17919 25336 1 62 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.587 0.035 17919 25337 1 62 . 1 1 48 48 LYS C C 48 174.700 174.700 175.325 -0.625 17919 25338 1 62 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.749 -0.199 17919 25339 1 62 . 1 1 48 48 LYS CB C 48 34.530 34.530 33.814 0.716 17919 25340 1 62 . 1 1 48 48 LYS H H 48 7.980 7.980 7.761 0.219 17919 25341 1 62 . 1 1 49 49 GLN N N 49 122.410 122.410 124.575 -2.165 17919 25342 1 62 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.310 0.250 17919 25343 1 62 . 1 1 49 49 GLN C C 49 175.670 175.670 175.126 0.544 17919 25344 1 62 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.448 -0.708 17919 25345 1 62 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.301 -0.301 17919 25346 1 62 . 1 1 49 49 GLN H H 49 8.600 8.600 8.486 0.114 17919 25347 1 62 . 1 1 50 50 LEU N N 50 125.520 125.520 128.045 -2.525 17919 25348 1 62 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.284 -0.194 17919 25349 1 62 . 1 1 50 50 LEU C C 50 176.660 176.660 175.187 1.473 17919 25350 1 62 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.903 0.337 17919 25351 1 62 . 1 1 50 50 LEU CB C 50 41.570 41.570 43.531 -1.961 17919 25352 1 62 . 1 1 50 50 LEU H H 50 8.530 8.530 8.729 -0.199 17919 25353 1 62 . 1 1 51 51 GLU N N 51 122.940 122.940 121.610 1.330 17919 25354 1 62 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.540 -0.052 17919 25355 1 62 . 1 1 51 51 GLU C C 51 175.870 175.870 176.400 -0.530 17919 25356 1 62 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.555 0.405 17919 25357 1 62 . 1 1 51 51 GLU CB C 51 31.570 31.570 33.511 -1.941 17919 25358 1 62 . 1 1 51 51 GLU H H 51 8.400 8.400 8.564 -0.164 17919 25359 1 62 . 1 1 52 52 ASP N N 52 120.030 120.030 125.206 -5.176 17919 25360 1 62 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.601 -0.242 17919 25361 1 62 . 1 1 52 52 ASP C C 52 177.330 177.330 177.204 0.126 17919 25362 1 62 . 1 1 52 52 ASP CA C 52 56.960 56.960 56.327 0.633 17919 25363 1 62 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.961 -0.111 17919 25364 1 62 . 1 1 52 52 ASP H H 52 8.160 8.160 8.757 -0.597 17919 25365 1 62 . 1 1 53 53 GLY N N 53 106.660 106.660 106.208 0.452 17919 25366 1 62 . 1 1 53 53 GLY C C 53 174.870 174.870 174.826 0.044 17919 25367 1 62 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.673 0.497 17919 25368 1 62 . 1 1 53 53 GLY H H 53 9.390 9.390 8.534 0.856 17919 25369 1 62 . 1 1 54 54 ARG N N 54 119.050 119.050 120.132 -1.082 17919 25370 1 62 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.383 0.312 17919 25371 1 62 . 1 1 54 54 ARG C C 54 175.350 175.350 175.654 -0.304 17919 25372 1 62 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.906 -0.516 17919 25373 1 62 . 1 1 54 54 ARG CB C 54 32.650 32.650 31.110 1.540 17919 25374 1 62 . 1 1 54 54 ARG H H 54 7.460 7.460 7.364 0.096 17919 25375 1 62 . 1 1 55 55 THR N N 55 108.400 108.400 111.300 -2.900 17919 25376 1 62 . 1 1 55 55 THR HA H 55 5.240 5.240 5.030 0.210 17919 25377 1 62 . 1 1 55 55 THR C C 55 176.560 176.560 176.196 0.364 17919 25378 1 62 . 1 1 55 55 THR CA C 55 59.690 59.690 59.941 -0.251 17919 25379 1 62 . 1 1 55 55 THR CB C 55 72.260 72.260 70.676 1.584 17919 25380 1 62 . 1 1 55 55 THR H H 55 8.730 8.730 8.310 0.420 17919 25381 1 62 . 1 1 56 56 LEU N N 56 117.920 117.920 120.720 -2.800 17919 25382 1 62 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.781 0.279 17919 25383 1 62 . 1 1 56 56 LEU C C 56 180.810 180.810 178.725 2.085 17919 25384 1 62 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.568 0.142 17919 25385 1 62 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.264 -0.894 17919 25386 1 62 . 1 1 56 56 LEU H H 56 8.140 8.140 8.284 -0.144 17919 25387 1 62 . 1 1 57 57 SER N N 57 113.330 113.330 115.066 -1.736 17919 25388 1 62 . 1 1 57 57 SER HA H 57 4.370 4.370 4.091 0.279 17919 25389 1 62 . 1 1 57 57 SER C C 57 178.310 178.310 176.825 1.485 17919 25390 1 62 . 1 1 57 57 SER CA C 57 61.080 61.080 62.326 -1.246 17919 25391 1 62 . 1 1 57 57 SER CB C 57 62.530 62.530 62.599 -0.069 17919 25392 1 62 . 1 1 57 57 SER H H 57 8.470 8.470 7.914 0.556 17919 25393 1 62 . 1 1 58 58 ASP N N 58 124.190 124.190 122.107 2.083 17919 25394 1 62 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.317 -0.021 17919 25395 1 62 . 1 1 58 58 ASP C C 58 177.400 177.400 177.780 -0.380 17919 25396 1 62 . 1 1 58 58 ASP CA C 58 57.180 57.180 57.030 0.150 17919 25397 1 62 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.518 -0.418 17919 25398 1 62 . 1 1 58 58 ASP H H 58 7.930 7.930 7.582 0.348 17919 25399 1 62 . 1 1 59 59 TYR N N 59 115.510 115.510 115.896 -0.386 17919 25400 1 62 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.706 -0.036 17919 25401 1 62 . 1 1 59 59 TYR C C 59 174.700 174.700 174.924 -0.224 17919 25402 1 62 . 1 1 59 59 TYR CA C 59 58.250 58.250 56.587 1.663 17919 25403 1 62 . 1 1 59 59 TYR CB C 59 40.070 40.070 37.355 2.715 17919 25404 1 62 . 1 1 59 59 TYR H H 59 7.250 7.250 7.235 0.015 17919 25405 1 62 . 1 1 60 60 ASN N N 60 115.900 115.900 115.745 0.155 17919 25406 1 62 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.411 -0.056 17919 25407 1 62 . 1 1 60 60 ASN C C 60 174.340 174.340 174.069 0.271 17919 25408 1 62 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.293 -0.173 17919 25409 1 62 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.286 0.124 17919 25410 1 62 . 1 1 60 60 ASN H H 60 8.150 8.150 8.029 0.121 17919 25411 1 62 . 1 1 61 61 ILE N N 61 118.600 118.600 120.842 -2.242 17919 25412 1 62 . 1 1 61 61 ILE HA H 61 3.393 3.393 4.048 -0.655 17919 25413 1 62 . 1 1 61 61 ILE C C 61 174.610 174.610 175.024 -0.414 17919 25414 1 62 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.258 1.162 17919 25415 1 62 . 1 1 61 61 ILE CB C 61 36.740 36.740 38.002 -1.262 17919 25416 1 62 . 1 1 61 61 ILE H H 61 7.250 7.250 7.993 -0.743 17919 25417 1 62 . 1 1 62 62 GLN N N 62 124.740 124.740 128.011 -3.271 17919 25418 1 62 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.565 -0.059 17919 25419 1 62 . 1 1 62 62 GLN C C 62 175.970 175.970 175.543 0.427 17919 25420 1 62 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.720 -0.060 17919 25421 1 62 . 1 1 62 62 GLN CB C 62 31.650 31.650 30.146 1.504 17919 25422 1 62 . 1 1 62 62 GLN H H 62 7.610 7.610 8.258 -0.648 17919 25423 1 62 . 1 1 63 63 LYS N N 63 120.300 120.300 121.463 -1.163 17919 25424 1 62 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.880 0.121 17919 25425 1 62 . 1 1 63 63 LYS C C 63 175.810 175.810 176.334 -0.524 17919 25426 1 62 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.794 -0.004 17919 25427 1 62 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.770 0.880 17919 25428 1 62 . 1 1 63 63 LYS H H 63 8.490 8.490 8.385 0.105 17919 25429 1 62 . 1 1 64 64 GLU N N 64 113.950 113.950 117.063 -3.113 17919 25430 1 62 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.541 -0.076 17919 25431 1 62 . 1 1 64 64 GLU C C 64 175.250 175.250 175.458 -0.208 17919 25432 1 62 . 1 1 64 64 GLU CA C 64 57.890 57.890 58.302 -0.412 17919 25433 1 62 . 1 1 64 64 GLU CB C 64 25.900 25.900 27.545 -1.645 17919 25434 1 62 . 1 1 64 64 GLU H H 64 9.280 9.280 8.620 0.660 17919 25435 1 62 . 1 1 65 65 SER N N 65 114.730 114.730 117.068 -2.338 17919 25436 1 62 . 1 1 65 65 SER HA H 65 4.640 4.640 4.455 0.185 17919 25437 1 62 . 1 1 65 65 SER C C 65 172.160 172.160 173.976 -1.816 17919 25438 1 62 . 1 1 65 65 SER CA C 65 60.890 60.890 59.383 1.507 17919 25439 1 62 . 1 1 65 65 SER CB C 65 64.910 64.910 63.344 1.566 17919 25440 1 62 . 1 1 65 65 SER H H 65 7.670 7.670 7.544 0.126 17919 25441 1 62 . 1 1 66 66 THR N N 66 117.110 117.110 121.557 -4.447 17919 25442 1 62 . 1 1 66 66 THR HA H 66 5.270 5.270 4.438 0.832 17919 25443 1 62 . 1 1 66 66 THR C C 66 173.950 173.950 174.666 -0.716 17919 25444 1 62 . 1 1 66 66 THR CA C 66 62.340 62.340 64.016 -1.676 17919 25445 1 62 . 1 1 66 66 THR CB C 66 70.080 70.080 69.505 0.575 17919 25446 1 62 . 1 1 66 66 THR H H 66 8.730 8.730 8.386 0.344 17919 25447 1 62 . 1 1 67 67 LEU N N 67 127.110 127.110 127.882 -0.772 17919 25448 1 62 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.604 0.456 17919 25449 1 62 . 1 1 67 67 LEU C C 67 175.770 175.770 175.725 0.045 17919 25450 1 62 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.734 0.166 17919 25451 1 62 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.029 0.231 17919 25452 1 62 . 1 1 67 67 LEU H H 67 9.410 9.410 9.171 0.239 17919 25453 1 62 . 1 1 68 68 HIS N N 68 118.380 118.380 122.986 -4.606 17919 25454 1 62 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.102 0.138 17919 25455 1 62 . 1 1 68 68 HIS C C 68 173.150 173.150 173.432 -0.282 17919 25456 1 62 . 1 1 68 68 HIS CA C 68 55.000 55.000 53.999 1.001 17919 25457 1 62 . 1 1 68 68 HIS CB C 68 30.530 30.530 31.410 -0.879 17919 25458 1 62 . 1 1 68 68 HIS H H 68 9.230 9.230 8.963 0.267 17919 25459 1 62 . 1 1 69 69 LEU N N 69 124.460 124.460 130.403 -5.943 17919 25460 1 62 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.046 0.144 17919 25461 1 62 . 1 1 69 69 LEU C C 69 175.270 175.270 174.499 0.771 17919 25462 1 62 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.127 -0.236 17919 25463 1 62 . 1 1 69 69 LEU CB C 69 44.380 44.380 43.750 0.630 17919 25464 1 62 . 1 1 69 69 LEU H H 69 8.340 8.340 8.652 -0.312 17919 25465 1 62 . 1 1 70 70 VAL N N 70 126.940 126.940 127.221 -0.281 17919 25466 1 62 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.330 0.020 17919 25467 1 62 . 1 1 70 70 VAL C C 70 174.000 174.000 174.385 -0.385 17919 25468 1 62 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.825 -0.025 17919 25469 1 62 . 1 1 70 70 VAL CB C 70 34.910 34.910 34.985 -0.075 17919 25470 1 62 . 1 1 70 70 VAL H H 70 9.200 9.200 9.083 0.117 17919 25471 1 62 . 1 1 71 71 LEU N N 71 123.130 123.130 125.940 -2.810 17919 25472 1 62 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.960 0.100 17919 25473 1 62 . 1 1 71 71 LEU C C 71 177.830 177.830 177.509 0.321 17919 25474 1 62 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.969 -0.029 17919 25475 1 62 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.663 0.187 17919 25476 1 62 . 1 1 71 71 LEU H H 71 8.120 8.120 8.693 -0.573 17919 25477 1 62 . 1 1 72 72 ARG N N 72 123.490 123.490 125.710 -2.220 17919 25478 1 62 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.254 0.047 17919 25479 1 62 . 1 1 72 72 ARG C C 72 175.350 175.350 175.933 -0.583 17919 25480 1 62 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.376 -0.766 17919 25481 1 62 . 1 1 72 72 ARG CB C 72 31.350 31.350 28.190 3.160 17919 25482 1 62 . 1 1 72 72 ARG H H 72 8.580 8.580 8.714 -0.134 17919 25483 1 63 . 1 1 2 2 GLN N N 2 123.220 123.220 123.145 0.075 17919 25484 1 63 . 1 1 2 2 GLN HA H 2 5.249 5.249 4.948 0.301 17919 25485 1 63 . 1 1 2 2 GLN C C 2 175.920 175.920 174.741 1.179 17919 25486 1 63 . 1 1 2 2 GLN CA C 2 55.080 55.080 55.050 0.030 17919 25487 1 63 . 1 1 2 2 GLN CB C 2 30.760 30.760 29.633 1.127 17919 25488 1 63 . 1 1 2 2 GLN H H 2 8.900 8.900 8.474 0.426 17919 25489 1 63 . 1 1 3 3 ILE N N 3 115.340 115.340 120.254 -4.914 17919 25490 1 63 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.563 -0.350 17919 25491 1 63 . 1 1 3 3 ILE C C 3 172.450 172.450 173.744 -1.294 17919 25492 1 63 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.697 -0.127 17919 25493 1 63 . 1 1 3 3 ILE CB C 3 42.210 42.210 40.300 1.910 17919 25494 1 63 . 1 1 3 3 ILE H H 3 8.320 8.320 8.533 -0.213 17919 25495 1 63 . 1 1 4 4 PHE N N 4 118.110 118.110 121.308 -3.198 17919 25496 1 63 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.345 0.285 17919 25497 1 63 . 1 1 4 4 PHE C C 4 175.320 175.320 175.197 0.123 17919 25498 1 63 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.829 -0.619 17919 25499 1 63 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.526 -1.046 17919 25500 1 63 . 1 1 4 4 PHE H H 4 8.610 8.610 9.080 -0.470 17919 25501 1 63 . 1 1 5 5 VAL N N 5 121.000 121.000 123.518 -2.518 17919 25502 1 63 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.966 -0.241 17919 25503 1 63 . 1 1 5 5 VAL C C 5 174.870 174.870 175.718 -0.848 17919 25504 1 63 . 1 1 5 5 VAL CA C 5 60.620 60.620 60.980 -0.360 17919 25505 1 63 . 1 1 5 5 VAL CB C 5 34.230 34.230 31.692 2.538 17919 25506 1 63 . 1 1 5 5 VAL H H 5 9.300 9.300 8.841 0.459 17919 25507 1 63 . 1 1 6 6 LYS N N 6 127.520 127.520 128.893 -1.373 17919 25508 1 63 . 1 1 6 6 LYS HA H 6 5.367 5.367 4.794 0.573 17919 25509 1 63 . 1 1 6 6 LYS C C 6 177.140 177.140 176.634 0.506 17919 25510 1 63 . 1 1 6 6 LYS CA C 6 54.520 54.520 56.089 -1.569 17919 25511 1 63 . 1 1 6 6 LYS CB C 6 35.050 35.050 32.905 2.145 17919 25512 1 63 . 1 1 6 6 LYS H H 6 8.820 8.820 8.095 0.725 17919 25513 1 63 . 1 1 7 7 THR N N 7 115.400 115.400 114.781 0.619 17919 25514 1 63 . 1 1 7 7 THR HA H 7 4.970 4.970 4.631 0.339 17919 25515 1 63 . 1 1 7 7 THR C C 7 176.910 176.910 175.978 0.932 17919 25516 1 63 . 1 1 7 7 THR CA C 7 60.470 60.470 59.422 1.048 17919 25517 1 63 . 1 1 7 7 THR CB C 7 70.630 70.630 71.398 -0.768 17919 25518 1 63 . 1 1 7 7 THR H H 7 8.730 8.730 7.838 0.892 17919 25519 1 63 . 1 1 8 8 LEU N N 8 121.330 121.330 118.688 2.642 17919 25520 1 63 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.336 -0.026 17919 25521 1 63 . 1 1 8 8 LEU C C 8 178.800 178.800 178.385 0.415 17919 25522 1 63 . 1 1 8 8 LEU CA C 8 57.580 57.580 56.747 0.833 17919 25523 1 63 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.949 0.021 17919 25524 1 63 . 1 1 8 8 LEU H H 8 9.100 9.100 8.346 0.754 17919 25525 1 63 . 1 1 9 9 THR N N 9 105.590 105.590 110.073 -4.483 17919 25526 1 63 . 1 1 9 9 THR HA H 9 4.428 4.428 4.489 -0.061 17919 25527 1 63 . 1 1 9 9 THR C C 9 175.520 175.520 174.827 0.693 17919 25528 1 63 . 1 1 9 9 THR CA C 9 61.400 61.400 61.316 0.083 17919 25529 1 63 . 1 1 9 9 THR CB C 9 69.140 69.140 69.118 0.022 17919 25530 1 63 . 1 1 9 9 THR H H 9 7.630 7.630 7.756 -0.126 17919 25531 1 63 . 1 1 10 10 GLY N N 10 108.890 108.890 109.432 -0.542 17919 25532 1 63 . 1 1 10 10 GLY C C 10 174.070 174.070 173.907 0.163 17919 25533 1 63 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.662 0.798 17919 25534 1 63 . 1 1 10 10 GLY H H 10 7.810 7.810 7.981 -0.171 17919 25535 1 63 . 1 1 11 11 LYS N N 11 121.600 121.600 120.740 0.860 17919 25536 1 63 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.724 -0.363 17919 25537 1 63 . 1 1 11 11 LYS C C 11 175.940 175.940 175.137 0.803 17919 25538 1 63 . 1 1 11 11 LYS CA C 11 56.280 56.280 54.964 1.317 17919 25539 1 63 . 1 1 11 11 LYS CB C 11 33.200 33.200 34.653 -1.453 17919 25540 1 63 . 1 1 11 11 LYS H H 11 7.280 7.280 7.808 -0.528 17919 25541 1 63 . 1 1 12 12 THR N N 12 120.440 120.440 117.958 2.482 17919 25542 1 63 . 1 1 12 12 THR HA H 12 5.046 5.046 4.921 0.125 17919 25543 1 63 . 1 1 12 12 THR C C 12 174.320 174.320 173.731 0.589 17919 25544 1 63 . 1 1 12 12 THR CA C 12 62.390 62.390 61.802 0.588 17919 25545 1 63 . 1 1 12 12 THR CB C 12 69.910 69.910 69.861 0.049 17919 25546 1 63 . 1 1 12 12 THR H H 12 8.650 8.650 8.349 0.301 17919 25547 1 63 . 1 1 13 13 ILE N N 13 127.110 127.110 123.666 3.444 17919 25548 1 63 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.867 -0.323 17919 25549 1 63 . 1 1 13 13 ILE C C 13 175.220 175.220 174.404 0.816 17919 25550 1 63 . 1 1 13 13 ILE CA C 13 59.980 59.980 58.886 1.094 17919 25551 1 63 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.626 -0.676 17919 25552 1 63 . 1 1 13 13 ILE H H 13 9.450 9.450 8.605 0.845 17919 25553 1 63 . 1 1 14 14 THR N N 14 121.520 121.520 119.069 2.451 17919 25554 1 63 . 1 1 14 14 THR HA H 14 4.964 4.964 4.661 0.303 17919 25555 1 63 . 1 1 14 14 THR C C 14 173.790 173.790 172.801 0.989 17919 25556 1 63 . 1 1 14 14 THR CA C 14 61.940 61.940 61.059 0.881 17919 25557 1 63 . 1 1 14 14 THR CB C 14 69.650 69.650 69.393 0.257 17919 25558 1 63 . 1 1 14 14 THR H H 14 8.710 8.710 8.363 0.347 17919 25559 1 63 . 1 1 15 15 LEU N N 15 124.800 124.800 127.648 -2.848 17919 25560 1 63 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.751 0.029 17919 25561 1 63 . 1 1 15 15 LEU C C 15 174.670 174.670 174.244 0.426 17919 25562 1 63 . 1 1 15 15 LEU CA C 15 52.830 52.830 54.157 -1.327 17919 25563 1 63 . 1 1 15 15 LEU CB C 15 47.070 47.070 46.528 0.542 17919 25564 1 63 . 1 1 15 15 LEU H H 15 8.710 8.710 8.342 0.368 17919 25565 1 63 . 1 1 16 16 GLU N N 16 122.160 122.160 123.917 -1.757 17919 25566 1 63 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.050 -0.133 17919 25567 1 63 . 1 1 16 16 GLU C C 16 175.860 175.860 176.013 -0.153 17919 25568 1 63 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.236 -0.416 17919 25569 1 63 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.472 -1.022 17919 25570 1 63 . 1 1 16 16 GLU H H 16 8.140 8.140 8.426 -0.286 17919 25571 1 63 . 1 1 17 17 VAL N N 17 117.210 117.210 121.648 -4.438 17919 25572 1 63 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.342 0.372 17919 25573 1 63 . 1 1 17 17 VAL C C 17 174.160 174.160 173.775 0.385 17919 25574 1 63 . 1 1 17 17 VAL CA C 17 58.430 58.430 60.046 -1.616 17919 25575 1 63 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.048 1.352 17919 25576 1 63 . 1 1 17 17 VAL H H 17 8.900 8.900 8.829 0.071 17919 25577 1 63 . 1 1 18 18 GLU N N 18 118.990 118.990 119.551 -0.561 17919 25578 1 63 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.769 0.310 17919 25579 1 63 . 1 1 18 18 GLU C C 18 176.160 176.160 175.978 0.182 17919 25580 1 63 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.150 -0.430 17919 25581 1 63 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.612 -0.302 17919 25582 1 63 . 1 1 18 18 GLU H H 18 8.640 8.640 8.839 -0.199 17919 25583 1 63 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.435 -0.294 17919 25584 1 63 . 1 1 19 19 PRO C C 19 175.310 175.310 178.201 -2.891 17919 25585 1 63 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.151 0.319 17919 25586 1 63 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.019 -0.069 17919 25587 1 63 . 1 1 20 20 SER N N 20 103.400 103.400 112.474 -9.074 17919 25588 1 63 . 1 1 20 20 SER HA H 20 4.370 4.370 4.264 0.106 17919 25589 1 63 . 1 1 20 20 SER C C 20 174.660 174.660 174.648 0.012 17919 25590 1 63 . 1 1 20 20 SER CA C 20 57.400 57.400 60.259 -2.859 17919 25591 1 63 . 1 1 20 20 SER CB C 20 63.370 63.370 63.016 0.354 17919 25592 1 63 . 1 1 20 20 SER H H 20 7.040 7.040 8.080 -1.040 17919 25593 1 63 . 1 1 21 21 ASP N N 21 123.480 123.480 121.885 1.595 17919 25594 1 63 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.678 0.017 17919 25595 1 63 . 1 1 21 21 ASP C C 21 176.360 176.360 175.508 0.852 17919 25596 1 63 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.529 0.171 17919 25597 1 63 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.506 -0.706 17919 25598 1 63 . 1 1 21 21 ASP H H 21 8.030 8.030 7.783 0.247 17919 25599 1 63 . 1 1 22 22 THR N N 22 108.800 108.800 111.262 -2.462 17919 25600 1 63 . 1 1 22 22 THR HA H 22 4.920 4.920 4.789 0.131 17919 25601 1 63 . 1 1 22 22 THR C C 22 176.750 176.750 176.013 0.737 17919 25602 1 63 . 1 1 22 22 THR CA C 22 59.690 59.690 60.943 -1.253 17919 25603 1 63 . 1 1 22 22 THR CB C 22 71.200 71.200 70.590 0.610 17919 25604 1 63 . 1 1 22 22 THR H H 22 7.900 7.900 8.227 -0.327 17919 25605 1 63 . 1 1 23 23 ILE N N 23 121.190 121.190 122.124 -0.934 17919 25606 1 63 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.737 -0.080 17919 25607 1 63 . 1 1 23 23 ILE C C 23 179.040 179.040 177.600 1.440 17919 25608 1 63 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.171 -0.911 17919 25609 1 63 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.507 -2.157 17919 25610 1 63 . 1 1 23 23 ILE H H 23 8.560 8.560 8.852 -0.292 17919 25611 1 63 . 1 1 24 24 GLU N N 24 120.830 120.830 120.212 0.618 17919 25612 1 63 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.924 -0.007 17919 25613 1 63 . 1 1 24 24 GLU C C 24 178.640 178.640 178.584 0.056 17919 25614 1 63 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.553 0.667 17919 25615 1 63 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.505 -1.225 17919 25616 1 63 . 1 1 24 24 GLU H H 24 9.760 9.760 8.047 1.713 17919 25617 1 63 . 1 1 25 25 ASN N N 25 120.570 120.570 118.254 2.316 17919 25618 1 63 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.473 0.052 17919 25619 1 63 . 1 1 25 25 ASN C C 25 178.380 178.380 177.856 0.524 17919 25620 1 63 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.363 -0.303 17919 25621 1 63 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.582 -0.132 17919 25622 1 63 . 1 1 25 25 ASN H H 25 7.920 7.920 7.507 0.413 17919 25623 1 63 . 1 1 26 26 VAL N N 26 121.710 121.710 118.909 2.801 17919 25624 1 63 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.616 -0.219 17919 25625 1 63 . 1 1 26 26 VAL C C 26 177.950 177.950 178.161 -0.211 17919 25626 1 63 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.268 1.392 17919 25627 1 63 . 1 1 26 26 VAL CB C 26 30.840 30.840 30.781 0.059 17919 25628 1 63 . 1 1 26 26 VAL H H 26 8.070 8.070 8.030 0.040 17919 25629 1 63 . 1 1 27 27 LYS N N 27 118.860 118.860 119.292 -0.432 17919 25630 1 63 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.317 0.263 17919 25631 1 63 . 1 1 27 27 LYS C C 27 180.550 180.550 179.174 1.376 17919 25632 1 63 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.215 0.035 17919 25633 1 63 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.263 1.467 17919 25634 1 63 . 1 1 27 27 LYS H H 27 8.560 8.560 7.600 0.960 17919 25635 1 63 . 1 1 28 28 ALA N N 28 123.440 123.440 123.043 0.397 17919 25636 1 63 . 1 1 28 28 ALA HA H 28 4.160 4.160 3.981 0.179 17919 25637 1 63 . 1 1 28 28 ALA C C 28 180.300 180.300 179.179 1.121 17919 25638 1 63 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.439 -0.069 17919 25639 1 63 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.285 -0.575 17919 25640 1 63 . 1 1 28 28 ALA H H 28 8.060 8.060 8.312 -0.252 17919 25641 1 63 . 1 1 29 29 LYS N N 29 119.940 119.940 118.906 1.034 17919 25642 1 63 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.070 0.137 17919 25643 1 63 . 1 1 29 29 LYS C C 29 180.320 180.320 179.272 1.048 17919 25644 1 63 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.236 0.415 17919 25645 1 63 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.369 0.921 17919 25646 1 63 . 1 1 29 29 LYS H H 29 7.850 7.850 7.401 0.449 17919 25647 1 63 . 1 1 30 30 ILE N N 30 121.080 121.080 120.639 0.441 17919 25648 1 63 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.551 -0.044 17919 25649 1 63 . 1 1 30 30 ILE C C 30 178.310 178.310 177.427 0.883 17919 25650 1 63 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.568 0.582 17919 25651 1 63 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.240 -0.440 17919 25652 1 63 . 1 1 30 30 ILE H H 30 8.280 8.280 7.797 0.483 17919 25653 1 63 . 1 1 31 31 GLN N N 31 123.490 123.490 120.195 3.295 17919 25654 1 63 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.172 -0.343 17919 25655 1 63 . 1 1 31 31 GLN C C 31 178.890 178.890 178.597 0.293 17919 25656 1 63 . 1 1 31 31 GLN CA C 31 60.000 60.000 58.911 1.089 17919 25657 1 63 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.516 -0.796 17919 25658 1 63 . 1 1 31 31 GLN H H 31 8.580 8.580 7.824 0.756 17919 25659 1 63 . 1 1 32 32 ASP N N 32 119.360 119.360 119.843 -0.483 17919 25660 1 63 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.369 -0.015 17919 25661 1 63 . 1 1 32 32 ASP C C 32 177.250 177.250 177.937 -0.687 17919 25662 1 63 . 1 1 32 32 ASP CA C 32 57.190 57.190 57.009 0.181 17919 25663 1 63 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.859 -0.279 17919 25664 1 63 . 1 1 32 32 ASP H H 32 8.010 8.010 8.119 -0.109 17919 25665 1 63 . 1 1 33 33 LYS N N 33 115.130 115.130 117.712 -2.582 17919 25666 1 63 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.196 0.141 17919 25667 1 63 . 1 1 33 33 LYS C C 33 177.870 177.870 177.787 0.083 17919 25668 1 63 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.121 -0.071 17919 25669 1 63 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.582 0.588 17919 25670 1 63 . 1 1 33 33 LYS H H 33 7.430 7.430 7.473 -0.043 17919 25671 1 63 . 1 1 34 34 GLU N N 34 113.870 113.870 114.701 -0.831 17919 25672 1 63 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.439 0.185 17919 25673 1 63 . 1 1 34 34 GLU C C 34 177.840 177.840 176.078 1.762 17919 25674 1 63 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.255 -1.085 17919 25675 1 63 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.861 0.799 17919 25676 1 63 . 1 1 34 34 GLU H H 34 8.740 8.740 7.902 0.838 17919 25677 1 63 . 1 1 35 35 GLY N N 35 108.650 108.650 108.924 -0.274 17919 25678 1 63 . 1 1 35 35 GLY C C 35 173.960 173.960 173.929 0.031 17919 25679 1 63 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.581 0.499 17919 25680 1 63 . 1 1 35 35 GLY H H 35 8.530 8.530 8.056 0.474 17919 25681 1 63 . 1 1 36 36 ILE N N 36 119.880 119.880 118.379 1.501 17919 25682 1 63 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.461 -0.016 17919 25683 1 63 . 1 1 36 36 ILE C C 36 173.590 173.590 173.819 -0.229 17919 25684 1 63 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.439 0.311 17919 25685 1 63 . 1 1 36 36 ILE CB C 36 40.580 40.580 39.096 1.484 17919 25686 1 63 . 1 1 36 36 ILE H H 36 6.150 6.150 7.549 -1.399 17919 25687 1 63 . 1 1 37 37 PRO HA H 37 4.634 4.634 5.140 -0.506 17919 25688 1 63 . 1 1 37 37 PRO C C 37 176.940 176.940 176.376 0.564 17919 25689 1 63 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.268 0.392 17919 25690 1 63 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.181 0.669 17919 25691 1 63 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.294 -0.177 17919 25692 1 63 . 1 1 38 38 PRO C C 38 178.320 178.320 177.744 0.576 17919 25693 1 63 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.319 0.941 17919 25694 1 63 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.794 1.096 17919 25695 1 63 . 1 1 39 39 ASP N N 39 113.380 113.380 117.009 -3.629 17919 25696 1 63 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.290 0.140 17919 25697 1 63 . 1 1 39 39 ASP C C 39 177.090 177.090 177.103 -0.013 17919 25698 1 63 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.811 -1.171 17919 25699 1 63 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.350 -0.810 17919 25700 1 63 . 1 1 39 39 ASP H H 39 8.550 8.550 8.659 -0.109 17919 25701 1 63 . 1 1 40 40 GLN N N 40 116.780 116.780 117.017 -0.237 17919 25702 1 63 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.081 0.383 17919 25703 1 63 . 1 1 40 40 GLN C C 40 175.380 175.380 176.176 -0.796 17919 25704 1 63 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.863 -1.223 17919 25705 1 63 . 1 1 40 40 GLN CB C 40 30.140 30.140 28.687 1.453 17919 25706 1 63 . 1 1 40 40 GLN H H 40 7.820 7.820 7.640 0.180 17919 25707 1 63 . 1 1 41 41 GLN N N 41 117.720 117.720 117.918 -0.198 17919 25708 1 63 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.424 -0.180 17919 25709 1 63 . 1 1 41 41 GLN C C 41 176.300 176.300 175.434 0.866 17919 25710 1 63 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.325 1.145 17919 25711 1 63 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.204 2.446 17919 25712 1 63 . 1 1 41 41 GLN H H 41 7.480 7.480 7.217 0.263 17919 25713 1 63 . 1 1 42 42 ARG N N 42 122.680 122.680 125.540 -2.860 17919 25714 1 63 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.537 -0.037 17919 25715 1 63 . 1 1 42 42 ARG C C 42 174.050 174.050 174.792 -0.742 17919 25716 1 63 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.179 -0.129 17919 25717 1 63 . 1 1 42 42 ARG CB C 42 31.750 31.750 31.675 0.075 17919 25718 1 63 . 1 1 42 42 ARG H H 42 8.530 8.530 8.110 0.420 17919 25719 1 63 . 1 1 43 43 LEU N N 43 124.040 124.040 123.725 0.315 17919 25720 1 63 . 1 1 43 43 LEU C C 43 175.290 175.290 175.939 -0.649 17919 25721 1 63 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.209 -0.229 17919 25722 1 63 . 1 1 43 43 LEU CB C 43 45.790 45.790 45.217 0.573 17919 25723 1 63 . 1 1 43 43 LEU H H 43 8.820 8.820 8.628 0.192 17919 25724 1 63 . 1 1 44 44 ILE N N 44 121.920 121.920 120.674 1.246 17919 25725 1 63 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.226 -0.234 17919 25726 1 63 . 1 1 44 44 ILE C C 44 176.060 176.060 174.652 1.408 17919 25727 1 63 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.191 -1.211 17919 25728 1 63 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.104 0.316 17919 25729 1 63 . 1 1 44 44 ILE H H 44 9.030 9.030 8.675 0.355 17919 25730 1 63 . 1 1 45 45 PHE N N 45 125.390 125.390 127.095 -1.705 17919 25731 1 63 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.057 -0.012 17919 25732 1 63 . 1 1 45 45 PHE C C 45 174.470 174.470 174.770 -0.300 17919 25733 1 63 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.604 0.416 17919 25734 1 63 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.321 0.439 17919 25735 1 63 . 1 1 45 45 PHE H H 45 8.830 8.830 8.640 0.190 17919 25736 1 63 . 1 1 46 46 ALA N N 46 132.200 132.200 128.135 4.065 17919 25737 1 63 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.613 0.077 17919 25738 1 63 . 1 1 46 46 ALA C C 46 177.290 177.290 177.764 -0.474 17919 25739 1 63 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.920 -0.380 17919 25740 1 63 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.296 0.274 17919 25741 1 63 . 1 1 46 46 ALA H H 46 8.810 8.810 8.976 -0.166 17919 25742 1 63 . 1 1 47 47 GLY N N 47 102.340 102.340 103.395 -1.055 17919 25743 1 63 . 1 1 47 47 GLY C C 47 173.810 173.810 174.097 -0.287 17919 25744 1 63 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.659 0.691 17919 25745 1 63 . 1 1 47 47 GLY H H 47 8.130 8.130 8.336 -0.206 17919 25746 1 63 . 1 1 48 48 LYS N N 48 121.570 121.570 122.481 -0.911 17919 25747 1 63 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.608 0.014 17919 25748 1 63 . 1 1 48 48 LYS C C 48 174.700 174.700 175.157 -0.457 17919 25749 1 63 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.864 -0.314 17919 25750 1 63 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.463 0.067 17919 25751 1 63 . 1 1 48 48 LYS H H 48 7.980 7.980 7.948 0.032 17919 25752 1 63 . 1 1 49 49 GLN N N 49 122.410 122.410 127.361 -4.951 17919 25753 1 63 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.684 -0.124 17919 25754 1 63 . 1 1 49 49 GLN C C 49 175.670 175.670 175.787 -0.117 17919 25755 1 63 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.757 -0.016 17919 25756 1 63 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.141 -0.141 17919 25757 1 63 . 1 1 49 49 GLN H H 49 8.600 8.600 8.740 -0.140 17919 25758 1 63 . 1 1 50 50 LEU N N 50 125.520 125.520 129.424 -3.904 17919 25759 1 63 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.397 -0.307 17919 25760 1 63 . 1 1 50 50 LEU C C 50 176.660 176.660 177.025 -0.365 17919 25761 1 63 . 1 1 50 50 LEU CA C 50 54.240 54.240 55.357 -1.117 17919 25762 1 63 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.716 -0.146 17919 25763 1 63 . 1 1 50 50 LEU H H 50 8.530 8.530 8.587 -0.057 17919 25764 1 63 . 1 1 51 51 GLU N N 51 122.940 122.940 124.051 -1.111 17919 25765 1 63 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.445 0.043 17919 25766 1 63 . 1 1 51 51 GLU C C 51 175.870 175.870 176.572 -0.702 17919 25767 1 63 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.796 0.164 17919 25768 1 63 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.055 0.515 17919 25769 1 63 . 1 1 51 51 GLU H H 51 8.400 8.400 8.438 -0.038 17919 25770 1 63 . 1 1 52 52 ASP N N 52 120.030 120.030 124.924 -4.894 17919 25771 1 63 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.483 -0.124 17919 25772 1 63 . 1 1 52 52 ASP C C 52 177.330 177.330 177.382 -0.052 17919 25773 1 63 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.362 -0.402 17919 25774 1 63 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.819 0.031 17919 25775 1 63 . 1 1 52 52 ASP H H 52 8.160 8.160 8.815 -0.655 17919 25776 1 63 . 1 1 53 53 GLY N N 53 106.660 106.660 104.312 2.348 17919 25777 1 63 . 1 1 53 53 GLY C C 53 174.870 174.870 174.285 0.585 17919 25778 1 63 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.526 0.644 17919 25779 1 63 . 1 1 53 53 GLY H H 53 9.390 9.390 8.052 1.338 17919 25780 1 63 . 1 1 54 54 ARG N N 54 119.050 119.050 121.928 -2.878 17919 25781 1 63 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.597 0.098 17919 25782 1 63 . 1 1 54 54 ARG C C 54 175.350 175.350 175.164 0.186 17919 25783 1 63 . 1 1 54 54 ARG CA C 54 54.390 54.390 55.120 -0.730 17919 25784 1 63 . 1 1 54 54 ARG CB C 54 32.650 32.650 31.411 1.239 17919 25785 1 63 . 1 1 54 54 ARG H H 54 7.460 7.460 7.859 -0.399 17919 25786 1 63 . 1 1 55 55 THR N N 55 108.400 108.400 114.881 -6.481 17919 25787 1 63 . 1 1 55 55 THR HA H 55 5.240 5.240 5.138 0.102 17919 25788 1 63 . 1 1 55 55 THR C C 55 176.560 176.560 175.842 0.718 17919 25789 1 63 . 1 1 55 55 THR CA C 55 59.690 59.690 60.617 -0.927 17919 25790 1 63 . 1 1 55 55 THR CB C 55 72.260 72.260 70.775 1.485 17919 25791 1 63 . 1 1 55 55 THR H H 55 8.730 8.730 8.173 0.557 17919 25792 1 63 . 1 1 56 56 LEU N N 56 117.920 117.920 123.568 -5.648 17919 25793 1 63 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.048 0.012 17919 25794 1 63 . 1 1 56 56 LEU C C 56 180.810 180.810 178.763 2.047 17919 25795 1 63 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.641 0.069 17919 25796 1 63 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.417 -1.047 17919 25797 1 63 . 1 1 56 56 LEU H H 56 8.140 8.140 8.810 -0.670 17919 25798 1 63 . 1 1 57 57 SER N N 57 113.330 113.330 113.507 -0.177 17919 25799 1 63 . 1 1 57 57 SER HA H 57 4.370 4.370 4.073 0.297 17919 25800 1 63 . 1 1 57 57 SER C C 57 178.310 178.310 176.795 1.515 17919 25801 1 63 . 1 1 57 57 SER CA C 57 61.080 61.080 61.300 -0.220 17919 25802 1 63 . 1 1 57 57 SER CB C 57 62.530 62.530 62.224 0.306 17919 25803 1 63 . 1 1 57 57 SER H H 57 8.470 8.470 7.871 0.599 17919 25804 1 63 . 1 1 58 58 ASP N N 58 124.190 124.190 122.451 1.739 17919 25805 1 63 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.422 -0.126 17919 25806 1 63 . 1 1 58 58 ASP C C 58 177.400 177.400 177.189 0.211 17919 25807 1 63 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.269 0.911 17919 25808 1 63 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.792 -0.693 17919 25809 1 63 . 1 1 58 58 ASP H H 58 7.930 7.930 7.899 0.031 17919 25810 1 63 . 1 1 59 59 TYR N N 59 115.510 115.510 116.104 -0.594 17919 25811 1 63 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.530 0.140 17919 25812 1 63 . 1 1 59 59 TYR C C 59 174.700 174.700 175.163 -0.463 17919 25813 1 63 . 1 1 59 59 TYR CA C 59 58.250 58.250 58.767 -0.517 17919 25814 1 63 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.795 1.275 17919 25815 1 63 . 1 1 59 59 TYR H H 59 7.250 7.250 7.474 -0.224 17919 25816 1 63 . 1 1 60 60 ASN N N 60 115.900 115.900 115.565 0.335 17919 25817 1 63 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.371 -0.016 17919 25818 1 63 . 1 1 60 60 ASN C C 60 174.340 174.340 174.033 0.307 17919 25819 1 63 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.339 -0.219 17919 25820 1 63 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.159 0.251 17919 25821 1 63 . 1 1 60 60 ASN H H 60 8.150 8.150 7.760 0.390 17919 25822 1 63 . 1 1 61 61 ILE N N 61 118.600 118.600 120.392 -1.792 17919 25823 1 63 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.618 -0.225 17919 25824 1 63 . 1 1 61 61 ILE C C 61 174.610 174.610 175.118 -0.508 17919 25825 1 63 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.126 0.294 17919 25826 1 63 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.582 -0.842 17919 25827 1 63 . 1 1 61 61 ILE H H 61 7.250 7.250 7.379 -0.129 17919 25828 1 63 . 1 1 62 62 GLN N N 62 124.740 124.740 125.927 -1.187 17919 25829 1 63 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.746 -0.240 17919 25830 1 63 . 1 1 62 62 GLN C C 62 175.970 175.970 175.513 0.457 17919 25831 1 63 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.779 -0.119 17919 25832 1 63 . 1 1 62 62 GLN CB C 62 31.650 31.650 32.735 -1.085 17919 25833 1 63 . 1 1 62 62 GLN H H 62 7.610 7.610 7.993 -0.383 17919 25834 1 63 . 1 1 63 63 LYS N N 63 120.300 120.300 121.705 -1.405 17919 25835 1 63 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.037 -0.036 17919 25836 1 63 . 1 1 63 63 LYS C C 63 175.810 175.810 176.697 -0.887 17919 25837 1 63 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.477 0.313 17919 25838 1 63 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.041 0.609 17919 25839 1 63 . 1 1 63 63 LYS H H 63 8.490 8.490 8.631 -0.141 17919 25840 1 63 . 1 1 64 64 GLU N N 64 113.950 113.950 118.651 -4.701 17919 25841 1 63 . 1 1 64 64 GLU HA H 64 3.465 3.465 4.099 -0.634 17919 25842 1 63 . 1 1 64 64 GLU C C 64 175.250 175.250 175.658 -0.408 17919 25843 1 63 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.465 0.425 17919 25844 1 63 . 1 1 64 64 GLU CB C 64 25.900 25.900 27.623 -1.723 17919 25845 1 63 . 1 1 64 64 GLU H H 64 9.280 9.280 8.684 0.596 17919 25846 1 63 . 1 1 65 65 SER N N 65 114.730 114.730 114.468 0.262 17919 25847 1 63 . 1 1 65 65 SER HA H 65 4.640 4.640 4.651 -0.011 17919 25848 1 63 . 1 1 65 65 SER C C 65 172.160 172.160 173.887 -1.727 17919 25849 1 63 . 1 1 65 65 SER CA C 65 60.890 60.890 59.648 1.242 17919 25850 1 63 . 1 1 65 65 SER CB C 65 64.910 64.910 64.496 0.414 17919 25851 1 63 . 1 1 65 65 SER H H 65 7.670 7.670 7.852 -0.182 17919 25852 1 63 . 1 1 66 66 THR N N 66 117.110 117.110 117.283 -0.173 17919 25853 1 63 . 1 1 66 66 THR HA H 66 5.270 5.270 5.256 0.014 17919 25854 1 63 . 1 1 66 66 THR C C 66 173.950 173.950 173.434 0.516 17919 25855 1 63 . 1 1 66 66 THR CA C 66 62.340 62.340 62.052 0.288 17919 25856 1 63 . 1 1 66 66 THR CB C 66 70.080 70.080 70.915 -0.835 17919 25857 1 63 . 1 1 66 66 THR H H 66 8.730 8.730 8.474 0.256 17919 25858 1 63 . 1 1 67 67 LEU N N 67 127.110 127.110 127.053 0.057 17919 25859 1 63 . 1 1 67 67 LEU HA H 67 5.060 5.060 5.179 -0.119 17919 25860 1 63 . 1 1 67 67 LEU C C 67 175.770 175.770 175.895 -0.125 17919 25861 1 63 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.673 0.227 17919 25862 1 63 . 1 1 67 67 LEU CB C 67 44.260 44.260 42.947 1.313 17919 25863 1 63 . 1 1 67 67 LEU H H 67 9.410 9.410 8.975 0.435 17919 25864 1 63 . 1 1 68 68 HIS N N 68 118.380 118.380 121.755 -3.375 17919 25865 1 63 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.384 -0.144 17919 25866 1 63 . 1 1 68 68 HIS C C 68 173.150 173.150 174.263 -1.113 17919 25867 1 63 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.988 0.012 17919 25868 1 63 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.881 -2.351 17919 25869 1 63 . 1 1 68 68 HIS H H 68 9.230 9.230 9.183 0.047 17919 25870 1 63 . 1 1 69 69 LEU N N 69 124.460 124.460 126.461 -2.001 17919 25871 1 63 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.058 0.132 17919 25872 1 63 . 1 1 69 69 LEU C C 69 175.270 175.270 174.335 0.935 17919 25873 1 63 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.947 -0.057 17919 25874 1 63 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.809 -0.429 17919 25875 1 63 . 1 1 69 69 LEU H H 69 8.340 8.340 7.536 0.804 17919 25876 1 63 . 1 1 70 70 VAL N N 70 126.940 126.940 127.099 -0.159 17919 25877 1 63 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.383 -0.033 17919 25878 1 63 . 1 1 70 70 VAL C C 70 174.000 174.000 174.738 -0.738 17919 25879 1 63 . 1 1 70 70 VAL CA C 70 60.800 60.800 61.404 -0.605 17919 25880 1 63 . 1 1 70 70 VAL CB C 70 34.910 34.910 33.291 1.619 17919 25881 1 63 . 1 1 70 70 VAL H H 70 9.200 9.200 7.896 1.304 17919 25882 1 63 . 1 1 71 71 LEU N N 71 123.130 123.130 125.663 -2.533 17919 25883 1 63 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.209 -0.149 17919 25884 1 63 . 1 1 71 71 LEU C C 71 177.830 177.830 177.187 0.643 17919 25885 1 63 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.319 0.621 17919 25886 1 63 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.860 -1.010 17919 25887 1 63 . 1 1 71 71 LEU H H 71 8.120 8.120 8.488 -0.368 17919 25888 1 63 . 1 1 72 72 ARG N N 72 123.490 123.490 120.164 3.326 17919 25889 1 63 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.723 -0.422 17919 25890 1 63 . 1 1 72 72 ARG C C 72 175.350 175.350 174.608 0.742 17919 25891 1 63 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.756 -0.146 17919 25892 1 63 . 1 1 72 72 ARG CB C 72 31.350 31.350 32.078 -0.728 17919 25893 1 63 . 1 1 72 72 ARG H H 72 8.580 8.580 8.379 0.201 17919 25894 1 64 . 1 1 2 2 GLN N N 2 123.220 123.220 122.698 0.522 17919 25895 1 64 . 1 1 2 2 GLN HA H 2 5.249 5.249 4.813 0.436 17919 25896 1 64 . 1 1 2 2 GLN C C 2 175.920 175.920 175.495 0.425 17919 25897 1 64 . 1 1 2 2 GLN CA C 2 55.080 55.080 56.247 -1.167 17919 25898 1 64 . 1 1 2 2 GLN CB C 2 30.760 30.760 29.518 1.242 17919 25899 1 64 . 1 1 2 2 GLN H H 2 8.900 8.900 8.507 0.393 17919 25900 1 64 . 1 1 3 3 ILE N N 3 115.340 115.340 116.720 -1.380 17919 25901 1 64 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.205 0.008 17919 25902 1 64 . 1 1 3 3 ILE C C 3 172.450 172.450 173.312 -0.862 17919 25903 1 64 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.528 0.042 17919 25904 1 64 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.398 0.812 17919 25905 1 64 . 1 1 3 3 ILE H H 3 8.320 8.320 8.248 0.072 17919 25906 1 64 . 1 1 4 4 PHE N N 4 118.110 118.110 120.426 -2.316 17919 25907 1 64 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.171 0.459 17919 25908 1 64 . 1 1 4 4 PHE C C 4 175.320 175.320 175.304 0.016 17919 25909 1 64 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.903 -0.693 17919 25910 1 64 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.441 0.039 17919 25911 1 64 . 1 1 4 4 PHE H H 4 8.610 8.610 8.375 0.235 17919 25912 1 64 . 1 1 5 5 VAL N N 5 121.000 121.000 123.032 -2.032 17919 25913 1 64 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.964 -0.239 17919 25914 1 64 . 1 1 5 5 VAL C C 5 174.870 174.870 175.013 -0.143 17919 25915 1 64 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.257 -0.637 17919 25916 1 64 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.094 1.136 17919 25917 1 64 . 1 1 5 5 VAL H H 5 9.300 9.300 8.958 0.342 17919 25918 1 64 . 1 1 6 6 LYS N N 6 127.520 127.520 128.981 -1.461 17919 25919 1 64 . 1 1 6 6 LYS HA H 6 5.367 5.367 4.768 0.599 17919 25920 1 64 . 1 1 6 6 LYS C C 6 177.140 177.140 175.557 1.583 17919 25921 1 64 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.795 -0.275 17919 25922 1 64 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.410 -0.360 17919 25923 1 64 . 1 1 6 6 LYS H H 6 8.820 8.820 8.841 -0.021 17919 25924 1 64 . 1 1 7 7 THR N N 7 115.400 115.400 116.158 -0.758 17919 25925 1 64 . 1 1 7 7 THR HA H 7 4.970 4.970 4.358 0.612 17919 25926 1 64 . 1 1 7 7 THR C C 7 176.910 176.910 175.743 1.167 17919 25927 1 64 . 1 1 7 7 THR CA C 7 60.470 60.470 60.635 -0.165 17919 25928 1 64 . 1 1 7 7 THR CB C 7 70.630 70.630 70.358 0.272 17919 25929 1 64 . 1 1 7 7 THR H H 7 8.730 8.730 8.088 0.642 17919 25930 1 64 . 1 1 8 8 LEU N N 8 121.330 121.330 122.729 -1.399 17919 25931 1 64 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.491 -0.181 17919 25932 1 64 . 1 1 8 8 LEU C C 8 178.800 178.800 177.062 1.738 17919 25933 1 64 . 1 1 8 8 LEU CA C 8 57.580 57.580 56.427 1.153 17919 25934 1 64 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.152 -0.182 17919 25935 1 64 . 1 1 8 8 LEU H H 8 9.100 9.100 8.372 0.728 17919 25936 1 64 . 1 1 9 9 THR N N 9 105.590 105.590 107.454 -1.864 17919 25937 1 64 . 1 1 9 9 THR HA H 9 4.428 4.428 4.428 -0.000 17919 25938 1 64 . 1 1 9 9 THR C C 9 175.520 175.520 175.419 0.101 17919 25939 1 64 . 1 1 9 9 THR CA C 9 61.400 61.400 60.669 0.731 17919 25940 1 64 . 1 1 9 9 THR CB C 9 69.140 69.140 68.431 0.709 17919 25941 1 64 . 1 1 9 9 THR H H 9 7.630 7.630 7.570 0.060 17919 25942 1 64 . 1 1 10 10 GLY N N 10 108.890 108.890 110.775 -1.885 17919 25943 1 64 . 1 1 10 10 GLY C C 10 174.070 174.070 173.659 0.411 17919 25944 1 64 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.037 0.423 17919 25945 1 64 . 1 1 10 10 GLY H H 10 7.810 7.810 7.726 0.084 17919 25946 1 64 . 1 1 11 11 LYS N N 11 121.600 121.600 124.073 -2.473 17919 25947 1 64 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.533 -0.172 17919 25948 1 64 . 1 1 11 11 LYS C C 11 175.940 175.940 175.503 0.437 17919 25949 1 64 . 1 1 11 11 LYS CA C 11 56.280 56.280 55.537 0.743 17919 25950 1 64 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.059 0.141 17919 25951 1 64 . 1 1 11 11 LYS H H 11 7.280 7.280 7.573 -0.293 17919 25952 1 64 . 1 1 12 12 THR N N 12 120.440 120.440 122.642 -2.202 17919 25953 1 64 . 1 1 12 12 THR HA H 12 5.046 5.046 4.888 0.158 17919 25954 1 64 . 1 1 12 12 THR C C 12 174.320 174.320 174.556 -0.236 17919 25955 1 64 . 1 1 12 12 THR CA C 12 62.390 62.390 62.379 0.011 17919 25956 1 64 . 1 1 12 12 THR CB C 12 69.910 69.910 69.680 0.230 17919 25957 1 64 . 1 1 12 12 THR H H 12 8.650 8.650 8.484 0.166 17919 25958 1 64 . 1 1 13 13 ILE N N 13 127.110 127.110 126.711 0.399 17919 25959 1 64 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.407 0.137 17919 25960 1 64 . 1 1 13 13 ILE C C 13 175.220 175.220 175.230 -0.010 17919 25961 1 64 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.382 -0.402 17919 25962 1 64 . 1 1 13 13 ILE CB C 13 40.950 40.950 42.017 -1.067 17919 25963 1 64 . 1 1 13 13 ILE H H 13 9.450 9.450 9.074 0.376 17919 25964 1 64 . 1 1 14 14 THR N N 14 121.520 121.520 123.240 -1.720 17919 25965 1 64 . 1 1 14 14 THR HA H 14 4.964 4.964 4.701 0.263 17919 25966 1 64 . 1 1 14 14 THR C C 14 173.790 173.790 173.800 -0.010 17919 25967 1 64 . 1 1 14 14 THR CA C 14 61.940 61.940 63.192 -1.252 17919 25968 1 64 . 1 1 14 14 THR CB C 14 69.650 69.650 69.161 0.489 17919 25969 1 64 . 1 1 14 14 THR H H 14 8.710 8.710 8.587 0.123 17919 25970 1 64 . 1 1 15 15 LEU N N 15 124.800 124.800 129.039 -4.239 17919 25971 1 64 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.607 0.173 17919 25972 1 64 . 1 1 15 15 LEU C C 15 174.670 174.670 174.978 -0.308 17919 25973 1 64 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.798 -0.968 17919 25974 1 64 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.245 1.825 17919 25975 1 64 . 1 1 15 15 LEU H H 15 8.710 8.710 8.522 0.188 17919 25976 1 64 . 1 1 16 16 GLU N N 16 122.160 122.160 124.475 -2.315 17919 25977 1 64 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.733 0.184 17919 25978 1 64 . 1 1 16 16 GLU C C 16 175.860 175.860 175.980 -0.120 17919 25979 1 64 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.494 -0.674 17919 25980 1 64 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.167 -0.717 17919 25981 1 64 . 1 1 16 16 GLU H H 16 8.140 8.140 8.659 -0.519 17919 25982 1 64 . 1 1 17 17 VAL N N 17 117.210 117.210 119.244 -2.034 17919 25983 1 64 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.470 0.244 17919 25984 1 64 . 1 1 17 17 VAL C C 17 174.160 174.160 174.506 -0.346 17919 25985 1 64 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.238 -0.808 17919 25986 1 64 . 1 1 17 17 VAL CB C 17 36.400 36.400 34.562 1.838 17919 25987 1 64 . 1 1 17 17 VAL H H 17 8.900 8.900 8.629 0.271 17919 25988 1 64 . 1 1 18 18 GLU N N 18 118.990 118.990 120.093 -1.103 17919 25989 1 64 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.886 0.193 17919 25990 1 64 . 1 1 18 18 GLU C C 18 176.160 176.160 175.213 0.947 17919 25991 1 64 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.101 -0.381 17919 25992 1 64 . 1 1 18 18 GLU CB C 18 30.310 30.310 32.546 -2.236 17919 25993 1 64 . 1 1 18 18 GLU H H 18 8.640 8.640 8.444 0.196 17919 25994 1 64 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.204 -0.063 17919 25995 1 64 . 1 1 19 19 PRO C C 19 175.310 175.310 177.719 -2.409 17919 25996 1 64 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.712 -0.242 17919 25997 1 64 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.981 -0.031 17919 25998 1 64 . 1 1 20 20 SER N N 20 103.400 103.400 108.336 -4.936 17919 25999 1 64 . 1 1 20 20 SER HA H 20 4.370 4.370 4.409 -0.039 17919 26000 1 64 . 1 1 20 20 SER C C 20 174.660 174.660 174.390 0.270 17919 26001 1 64 . 1 1 20 20 SER CA C 20 57.400 57.400 57.724 -0.324 17919 26002 1 64 . 1 1 20 20 SER CB C 20 63.370 63.370 62.596 0.774 17919 26003 1 64 . 1 1 20 20 SER H H 20 7.040 7.040 7.884 -0.844 17919 26004 1 64 . 1 1 21 21 ASP N N 21 123.480 123.480 124.923 -1.443 17919 26005 1 64 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.653 0.042 17919 26006 1 64 . 1 1 21 21 ASP C C 21 176.360 176.360 175.774 0.586 17919 26007 1 64 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.252 0.448 17919 26008 1 64 . 1 1 21 21 ASP CB C 21 40.800 40.800 42.229 -1.429 17919 26009 1 64 . 1 1 21 21 ASP H H 21 8.030 8.030 7.862 0.168 17919 26010 1 64 . 1 1 22 22 THR N N 22 108.800 108.800 115.381 -6.581 17919 26011 1 64 . 1 1 22 22 THR HA H 22 4.920 4.920 4.454 0.466 17919 26012 1 64 . 1 1 22 22 THR C C 22 176.750 176.750 175.842 0.908 17919 26013 1 64 . 1 1 22 22 THR CA C 22 59.690 59.690 62.335 -2.645 17919 26014 1 64 . 1 1 22 22 THR CB C 22 71.200 71.200 69.583 1.617 17919 26015 1 64 . 1 1 22 22 THR H H 22 7.900 7.900 8.246 -0.346 17919 26016 1 64 . 1 1 23 23 ILE N N 23 121.190 121.190 122.757 -1.567 17919 26017 1 64 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.881 -0.224 17919 26018 1 64 . 1 1 23 23 ILE C C 23 179.040 179.040 177.446 1.594 17919 26019 1 64 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.822 -0.562 17919 26020 1 64 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.910 -2.560 17919 26021 1 64 . 1 1 23 23 ILE H H 23 8.560 8.560 8.882 -0.322 17919 26022 1 64 . 1 1 24 24 GLU N N 24 120.830 120.830 120.309 0.521 17919 26023 1 64 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.957 -0.040 17919 26024 1 64 . 1 1 24 24 GLU C C 24 178.640 178.640 178.217 0.423 17919 26025 1 64 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.724 0.496 17919 26026 1 64 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.620 -1.340 17919 26027 1 64 . 1 1 24 24 GLU H H 24 9.760 9.760 8.263 1.497 17919 26028 1 64 . 1 1 25 25 ASN N N 25 120.570 120.570 118.842 1.728 17919 26029 1 64 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.516 0.009 17919 26030 1 64 . 1 1 25 25 ASN C C 25 178.380 178.380 177.877 0.503 17919 26031 1 64 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.009 0.051 17919 26032 1 64 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.220 0.230 17919 26033 1 64 . 1 1 25 25 ASN H H 25 7.920 7.920 7.480 0.440 17919 26034 1 64 . 1 1 26 26 VAL N N 26 121.710 121.710 120.566 1.144 17919 26035 1 64 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.532 -0.135 17919 26036 1 64 . 1 1 26 26 VAL C C 26 177.950 177.950 178.326 -0.376 17919 26037 1 64 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.910 0.750 17919 26038 1 64 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.547 -0.708 17919 26039 1 64 . 1 1 26 26 VAL H H 26 8.070 8.070 8.401 -0.331 17919 26040 1 64 . 1 1 27 27 LYS N N 27 118.860 118.860 118.241 0.619 17919 26041 1 64 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.105 0.475 17919 26042 1 64 . 1 1 27 27 LYS C C 27 180.550 180.550 178.948 1.602 17919 26043 1 64 . 1 1 27 27 LYS CA C 27 59.250 59.250 58.696 0.554 17919 26044 1 64 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.477 1.253 17919 26045 1 64 . 1 1 27 27 LYS H H 27 8.560 8.560 7.896 0.664 17919 26046 1 64 . 1 1 28 28 ALA N N 28 123.440 123.440 122.015 1.425 17919 26047 1 64 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.046 0.114 17919 26048 1 64 . 1 1 28 28 ALA C C 28 180.300 180.300 179.108 1.192 17919 26049 1 64 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.413 -0.042 17919 26050 1 64 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.234 -0.524 17919 26051 1 64 . 1 1 28 28 ALA H H 28 8.060 8.060 8.401 -0.341 17919 26052 1 64 . 1 1 29 29 LYS N N 29 119.940 119.940 118.483 1.457 17919 26053 1 64 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.097 0.110 17919 26054 1 64 . 1 1 29 29 LYS C C 29 180.320 180.320 179.154 1.166 17919 26055 1 64 . 1 1 29 29 LYS CA C 29 59.650 59.650 58.964 0.686 17919 26056 1 64 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.316 0.974 17919 26057 1 64 . 1 1 29 29 LYS H H 29 7.850 7.850 7.547 0.303 17919 26058 1 64 . 1 1 30 30 ILE N N 30 121.080 121.080 120.695 0.385 17919 26059 1 64 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.606 -0.099 17919 26060 1 64 . 1 1 30 30 ILE C C 30 178.310 178.310 177.435 0.875 17919 26061 1 64 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.689 0.461 17919 26062 1 64 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.620 -0.820 17919 26063 1 64 . 1 1 30 30 ILE H H 30 8.280 8.280 7.708 0.572 17919 26064 1 64 . 1 1 31 31 GLN N N 31 123.490 123.490 119.908 3.582 17919 26065 1 64 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.985 -0.156 17919 26066 1 64 . 1 1 31 31 GLN C C 31 178.890 178.890 178.228 0.662 17919 26067 1 64 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.203 0.797 17919 26068 1 64 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.394 -0.674 17919 26069 1 64 . 1 1 31 31 GLN H H 31 8.580 8.580 7.801 0.779 17919 26070 1 64 . 1 1 32 32 ASP N N 32 119.360 119.360 119.727 -0.367 17919 26071 1 64 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.384 -0.030 17919 26072 1 64 . 1 1 32 32 ASP C C 32 177.250 177.250 177.817 -0.567 17919 26073 1 64 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.909 0.281 17919 26074 1 64 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.721 -0.141 17919 26075 1 64 . 1 1 32 32 ASP H H 32 8.010 8.010 8.235 -0.225 17919 26076 1 64 . 1 1 33 33 LYS N N 33 115.130 115.130 117.031 -1.901 17919 26077 1 64 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.439 -0.102 17919 26078 1 64 . 1 1 33 33 LYS C C 33 177.870 177.870 177.334 0.536 17919 26079 1 64 . 1 1 33 33 LYS CA C 33 58.050 58.050 56.992 1.058 17919 26080 1 64 . 1 1 33 33 LYS CB C 33 34.170 34.170 34.071 0.099 17919 26081 1 64 . 1 1 33 33 LYS H H 33 7.430 7.430 7.503 -0.073 17919 26082 1 64 . 1 1 34 34 GLU N N 34 113.870 113.870 115.370 -1.500 17919 26083 1 64 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.510 0.115 17919 26084 1 64 . 1 1 34 34 GLU C C 34 177.840 177.840 176.467 1.373 17919 26085 1 64 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.780 -0.610 17919 26086 1 64 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.293 1.367 17919 26087 1 64 . 1 1 34 34 GLU H H 34 8.740 8.740 8.124 0.616 17919 26088 1 64 . 1 1 35 35 GLY N N 35 108.650 108.650 109.168 -0.518 17919 26089 1 64 . 1 1 35 35 GLY C C 35 173.960 173.960 174.726 -0.766 17919 26090 1 64 . 1 1 35 35 GLY CA C 35 46.080 46.080 46.286 -0.206 17919 26091 1 64 . 1 1 35 35 GLY H H 35 8.530 8.530 8.304 0.226 17919 26092 1 64 . 1 1 36 36 ILE N N 36 119.880 119.880 121.307 -1.427 17919 26093 1 64 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.425 0.020 17919 26094 1 64 . 1 1 36 36 ILE C C 36 173.590 173.590 174.090 -0.500 17919 26095 1 64 . 1 1 36 36 ILE CA C 36 57.750 57.750 56.721 1.029 17919 26096 1 64 . 1 1 36 36 ILE CB C 36 40.580 40.580 36.956 3.624 17919 26097 1 64 . 1 1 36 36 ILE H H 36 6.150 6.150 7.804 -1.654 17919 26098 1 64 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.693 -0.059 17919 26099 1 64 . 1 1 37 37 PRO C C 37 176.940 176.940 176.584 0.356 17919 26100 1 64 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.944 -0.284 17919 26101 1 64 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.630 0.220 17919 26102 1 64 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.204 -0.087 17919 26103 1 64 . 1 1 38 38 PRO C C 38 178.320 178.320 178.343 -0.023 17919 26104 1 64 . 1 1 38 38 PRO CA C 38 66.260 66.260 66.034 0.226 17919 26105 1 64 . 1 1 38 38 PRO CB C 38 32.890 32.890 32.089 0.801 17919 26106 1 64 . 1 1 39 39 ASP N N 39 113.380 113.380 117.195 -3.815 17919 26107 1 64 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.408 0.022 17919 26108 1 64 . 1 1 39 39 ASP C C 39 177.090 177.090 178.778 -1.688 17919 26109 1 64 . 1 1 39 39 ASP CA C 39 55.640 55.640 57.197 -1.556 17919 26110 1 64 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.602 -1.062 17919 26111 1 64 . 1 1 39 39 ASP H H 39 8.550 8.550 8.648 -0.098 17919 26112 1 64 . 1 1 40 40 GLN N N 40 116.780 116.780 118.854 -2.074 17919 26113 1 64 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.016 0.448 17919 26114 1 64 . 1 1 40 40 GLN C C 40 175.380 175.380 176.967 -1.587 17919 26115 1 64 . 1 1 40 40 GLN CA C 40 55.640 55.640 58.391 -2.751 17919 26116 1 64 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.231 0.909 17919 26117 1 64 . 1 1 40 40 GLN H H 40 7.820 7.820 7.717 0.103 17919 26118 1 64 . 1 1 41 41 GLN N N 41 117.720 117.720 117.797 -0.077 17919 26119 1 64 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.192 0.052 17919 26120 1 64 . 1 1 41 41 GLN C C 41 176.300 176.300 175.377 0.923 17919 26121 1 64 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.726 -0.256 17919 26122 1 64 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.320 2.330 17919 26123 1 64 . 1 1 41 41 GLN H H 41 7.480 7.480 7.528 -0.048 17919 26124 1 64 . 1 1 42 42 ARG N N 42 122.680 122.680 122.215 0.465 17919 26125 1 64 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.649 -0.149 17919 26126 1 64 . 1 1 42 42 ARG C C 42 174.050 174.050 174.998 -0.948 17919 26127 1 64 . 1 1 42 42 ARG CA C 42 55.050 55.050 53.662 1.388 17919 26128 1 64 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.037 -0.287 17919 26129 1 64 . 1 1 42 42 ARG H H 42 8.530 8.530 7.990 0.540 17919 26130 1 64 . 1 1 43 43 LEU N N 43 124.040 124.040 125.153 -1.113 17919 26131 1 64 . 1 1 43 43 LEU C C 43 175.290 175.290 176.283 -0.993 17919 26132 1 64 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.861 -0.881 17919 26133 1 64 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.179 2.611 17919 26134 1 64 . 1 1 43 43 LEU H H 43 8.820 8.820 8.774 0.046 17919 26135 1 64 . 1 1 44 44 ILE N N 44 121.920 121.920 123.034 -1.114 17919 26136 1 64 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.056 -0.064 17919 26137 1 64 . 1 1 44 44 ILE C C 44 176.060 176.060 174.734 1.326 17919 26138 1 64 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.400 -0.420 17919 26139 1 64 . 1 1 44 44 ILE CB C 44 41.420 41.420 40.556 0.864 17919 26140 1 64 . 1 1 44 44 ILE H H 44 9.030 9.030 8.108 0.922 17919 26141 1 64 . 1 1 45 45 PHE N N 45 125.390 125.390 126.741 -1.351 17919 26142 1 64 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.915 0.130 17919 26143 1 64 . 1 1 45 45 PHE C C 45 174.470 174.470 174.147 0.323 17919 26144 1 64 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.938 0.082 17919 26145 1 64 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.050 0.710 17919 26146 1 64 . 1 1 45 45 PHE H H 45 8.830 8.830 8.935 -0.105 17919 26147 1 64 . 1 1 46 46 ALA N N 46 132.200 132.200 128.699 3.501 17919 26148 1 64 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.527 0.163 17919 26149 1 64 . 1 1 46 46 ALA C C 46 177.290 177.290 177.199 0.091 17919 26150 1 64 . 1 1 46 46 ALA CA C 46 52.540 52.540 53.110 -0.570 17919 26151 1 64 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.391 0.179 17919 26152 1 64 . 1 1 46 46 ALA H H 46 8.810 8.810 8.481 0.329 17919 26153 1 64 . 1 1 47 47 GLY N N 47 102.340 102.340 102.417 -0.077 17919 26154 1 64 . 1 1 47 47 GLY C C 47 173.810 173.810 174.491 -0.681 17919 26155 1 64 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.794 0.556 17919 26156 1 64 . 1 1 47 47 GLY H H 47 8.130 8.130 8.156 -0.026 17919 26157 1 64 . 1 1 48 48 LYS N N 48 121.570 121.570 120.890 0.680 17919 26158 1 64 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.692 -0.070 17919 26159 1 64 . 1 1 48 48 LYS C C 48 174.700 174.700 174.898 -0.198 17919 26160 1 64 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.982 -0.432 17919 26161 1 64 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.743 -0.213 17919 26162 1 64 . 1 1 48 48 LYS H H 48 7.980 7.980 7.748 0.232 17919 26163 1 64 . 1 1 49 49 GLN N N 49 122.410 122.410 123.548 -1.138 17919 26164 1 64 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.629 -0.069 17919 26165 1 64 . 1 1 49 49 GLN C C 49 175.670 175.670 175.631 0.039 17919 26166 1 64 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.461 0.279 17919 26167 1 64 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.442 -0.442 17919 26168 1 64 . 1 1 49 49 GLN H H 49 8.600 8.600 8.474 0.126 17919 26169 1 64 . 1 1 50 50 LEU N N 50 125.520 125.520 125.592 -0.072 17919 26170 1 64 . 1 1 50 50 LEU HA H 50 4.090 4.090 3.836 0.254 17919 26171 1 64 . 1 1 50 50 LEU C C 50 176.660 176.660 176.476 0.184 17919 26172 1 64 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.508 -0.268 17919 26173 1 64 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.699 -0.129 17919 26174 1 64 . 1 1 50 50 LEU H H 50 8.530 8.530 8.247 0.283 17919 26175 1 64 . 1 1 51 51 GLU N N 51 122.940 122.940 124.654 -1.714 17919 26176 1 64 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.482 0.006 17919 26177 1 64 . 1 1 51 51 GLU C C 51 175.870 175.870 177.308 -1.438 17919 26178 1 64 . 1 1 51 51 GLU CA C 51 55.960 55.960 56.216 -0.256 17919 26179 1 64 . 1 1 51 51 GLU CB C 51 31.570 31.570 30.665 0.905 17919 26180 1 64 . 1 1 51 51 GLU H H 51 8.400 8.400 8.324 0.076 17919 26181 1 64 . 1 1 52 52 ASP N N 52 120.030 120.030 125.387 -5.357 17919 26182 1 64 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.426 -0.067 17919 26183 1 64 . 1 1 52 52 ASP C C 52 177.330 177.330 178.134 -0.804 17919 26184 1 64 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.713 -0.753 17919 26185 1 64 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.636 0.214 17919 26186 1 64 . 1 1 52 52 ASP H H 52 8.160 8.160 8.876 -0.716 17919 26187 1 64 . 1 1 53 53 GLY N N 53 106.660 106.660 104.664 1.996 17919 26188 1 64 . 1 1 53 53 GLY C C 53 174.870 174.870 174.809 0.061 17919 26189 1 64 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.923 0.247 17919 26190 1 64 . 1 1 53 53 GLY H H 53 9.390 9.390 8.282 1.108 17919 26191 1 64 . 1 1 54 54 ARG N N 54 119.050 119.050 121.134 -2.084 17919 26192 1 64 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.292 0.403 17919 26193 1 64 . 1 1 54 54 ARG C C 54 175.350 175.350 175.808 -0.458 17919 26194 1 64 . 1 1 54 54 ARG CA C 54 54.390 54.390 56.109 -1.719 17919 26195 1 64 . 1 1 54 54 ARG CB C 54 32.650 32.650 31.470 1.180 17919 26196 1 64 . 1 1 54 54 ARG H H 54 7.460 7.460 7.391 0.069 17919 26197 1 64 . 1 1 55 55 THR N N 55 108.400 108.400 112.476 -4.076 17919 26198 1 64 . 1 1 55 55 THR HA H 55 5.240 5.240 4.769 0.471 17919 26199 1 64 . 1 1 55 55 THR C C 55 176.560 176.560 175.758 0.802 17919 26200 1 64 . 1 1 55 55 THR CA C 55 59.690 59.690 60.726 -1.036 17919 26201 1 64 . 1 1 55 55 THR CB C 55 72.260 72.260 70.851 1.409 17919 26202 1 64 . 1 1 55 55 THR H H 55 8.730 8.730 8.518 0.212 17919 26203 1 64 . 1 1 56 56 LEU N N 56 117.920 117.920 123.371 -5.451 17919 26204 1 64 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.779 0.281 17919 26205 1 64 . 1 1 56 56 LEU C C 56 180.810 180.810 178.757 2.053 17919 26206 1 64 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.603 0.106 17919 26207 1 64 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.176 -0.806 17919 26208 1 64 . 1 1 56 56 LEU H H 56 8.140 8.140 8.423 -0.283 17919 26209 1 64 . 1 1 57 57 SER N N 57 113.330 113.330 113.652 -0.322 17919 26210 1 64 . 1 1 57 57 SER HA H 57 4.370 4.370 4.035 0.335 17919 26211 1 64 . 1 1 57 57 SER C C 57 178.310 178.310 176.873 1.437 17919 26212 1 64 . 1 1 57 57 SER CA C 57 61.080 61.080 61.629 -0.548 17919 26213 1 64 . 1 1 57 57 SER CB C 57 62.530 62.530 62.713 -0.183 17919 26214 1 64 . 1 1 57 57 SER H H 57 8.470 8.470 7.938 0.532 17919 26215 1 64 . 1 1 58 58 ASP N N 58 124.190 124.190 122.693 1.497 17919 26216 1 64 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.283 0.013 17919 26217 1 64 . 1 1 58 58 ASP C C 58 177.400 177.400 177.938 -0.538 17919 26218 1 64 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.949 0.231 17919 26219 1 64 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.418 -0.318 17919 26220 1 64 . 1 1 58 58 ASP H H 58 7.930 7.930 7.419 0.511 17919 26221 1 64 . 1 1 59 59 TYR N N 59 115.510 115.510 115.824 -0.314 17919 26222 1 64 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.681 -0.011 17919 26223 1 64 . 1 1 59 59 TYR C C 59 174.700 174.700 175.080 -0.380 17919 26224 1 64 . 1 1 59 59 TYR CA C 59 58.250 58.250 56.647 1.603 17919 26225 1 64 . 1 1 59 59 TYR CB C 59 40.070 40.070 36.954 3.116 17919 26226 1 64 . 1 1 59 59 TYR H H 59 7.250 7.250 7.256 -0.006 17919 26227 1 64 . 1 1 60 60 ASN N N 60 115.900 115.900 115.223 0.677 17919 26228 1 64 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.359 -0.004 17919 26229 1 64 . 1 1 60 60 ASN C C 60 174.340 174.340 174.366 -0.026 17919 26230 1 64 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.331 -0.211 17919 26231 1 64 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.919 -0.509 17919 26232 1 64 . 1 1 60 60 ASN H H 60 8.150 8.150 7.690 0.460 17919 26233 1 64 . 1 1 61 61 ILE N N 61 118.600 118.600 119.531 -0.931 17919 26234 1 64 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.734 -0.341 17919 26235 1 64 . 1 1 61 61 ILE C C 61 174.610 174.610 175.197 -0.587 17919 26236 1 64 . 1 1 61 61 ILE CA C 61 62.420 62.420 60.503 1.917 17919 26237 1 64 . 1 1 61 61 ILE CB C 61 36.740 36.740 34.916 1.823 17919 26238 1 64 . 1 1 61 61 ILE H H 61 7.250 7.250 7.377 -0.127 17919 26239 1 64 . 1 1 62 62 GLN N N 62 124.740 124.740 126.239 -1.499 17919 26240 1 64 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.464 0.042 17919 26241 1 64 . 1 1 62 62 GLN C C 62 175.970 175.970 176.144 -0.174 17919 26242 1 64 . 1 1 62 62 GLN CA C 62 53.660 53.660 54.711 -1.051 17919 26243 1 64 . 1 1 62 62 GLN CB C 62 31.650 31.650 30.801 0.849 17919 26244 1 64 . 1 1 62 62 GLN H H 62 7.610 7.610 7.897 -0.287 17919 26245 1 64 . 1 1 63 63 LYS N N 63 120.300 120.300 120.275 0.025 17919 26246 1 64 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.893 0.108 17919 26247 1 64 . 1 1 63 63 LYS C C 63 175.810 175.810 176.980 -1.170 17919 26248 1 64 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.676 0.114 17919 26249 1 64 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.578 1.072 17919 26250 1 64 . 1 1 63 63 LYS H H 63 8.490 8.490 8.491 -0.001 17919 26251 1 64 . 1 1 64 64 GLU N N 64 113.950 113.950 119.586 -5.636 17919 26252 1 64 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.606 -0.141 17919 26253 1 64 . 1 1 64 64 GLU C C 64 175.250 175.250 176.625 -1.375 17919 26254 1 64 . 1 1 64 64 GLU CA C 64 57.890 57.890 58.252 -0.362 17919 26255 1 64 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.246 -2.346 17919 26256 1 64 . 1 1 64 64 GLU H H 64 9.280 9.280 8.959 0.321 17919 26257 1 64 . 1 1 65 65 SER N N 65 114.730 114.730 116.449 -1.719 17919 26258 1 64 . 1 1 65 65 SER HA H 65 4.640 4.640 4.409 0.231 17919 26259 1 64 . 1 1 65 65 SER C C 65 172.160 172.160 174.037 -1.877 17919 26260 1 64 . 1 1 65 65 SER CA C 65 60.890 60.890 59.725 1.165 17919 26261 1 64 . 1 1 65 65 SER CB C 65 64.910 64.910 63.395 1.514 17919 26262 1 64 . 1 1 65 65 SER H H 65 7.670 7.670 7.592 0.078 17919 26263 1 64 . 1 1 66 66 THR N N 66 117.110 117.110 122.418 -5.308 17919 26264 1 64 . 1 1 66 66 THR HA H 66 5.270 5.270 4.569 0.701 17919 26265 1 64 . 1 1 66 66 THR C C 66 173.950 173.950 174.556 -0.606 17919 26266 1 64 . 1 1 66 66 THR CA C 66 62.340 62.340 62.798 -0.458 17919 26267 1 64 . 1 1 66 66 THR CB C 66 70.080 70.080 69.366 0.714 17919 26268 1 64 . 1 1 66 66 THR H H 66 8.730 8.730 8.443 0.287 17919 26269 1 64 . 1 1 67 67 LEU N N 67 127.110 127.110 128.763 -1.653 17919 26270 1 64 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.713 0.347 17919 26271 1 64 . 1 1 67 67 LEU C C 67 175.770 175.770 176.180 -0.410 17919 26272 1 64 . 1 1 67 67 LEU CA C 67 53.900 53.900 55.242 -1.342 17919 26273 1 64 . 1 1 67 67 LEU CB C 67 44.260 44.260 42.749 1.511 17919 26274 1 64 . 1 1 67 67 LEU H H 67 9.410 9.410 9.067 0.343 17919 26275 1 64 . 1 1 68 68 HIS N N 68 118.380 118.380 120.819 -2.439 17919 26276 1 64 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.642 -0.402 17919 26277 1 64 . 1 1 68 68 HIS C C 68 173.150 173.150 173.922 -0.772 17919 26278 1 64 . 1 1 68 68 HIS CA C 68 55.000 55.000 53.976 1.024 17919 26279 1 64 . 1 1 68 68 HIS CB C 68 30.530 30.530 33.822 -3.292 17919 26280 1 64 . 1 1 68 68 HIS H H 68 9.230 9.230 9.141 0.089 17919 26281 1 64 . 1 1 69 69 LEU N N 69 124.460 124.460 120.672 3.788 17919 26282 1 64 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.862 0.328 17919 26283 1 64 . 1 1 69 69 LEU C C 69 175.270 175.270 173.909 1.361 17919 26284 1 64 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.940 -1.050 17919 26285 1 64 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.733 -0.353 17919 26286 1 64 . 1 1 69 69 LEU H H 69 8.340 8.340 6.793 1.547 17919 26287 1 64 . 1 1 70 70 VAL N N 70 126.940 126.940 126.438 0.502 17919 26288 1 64 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.487 -0.137 17919 26289 1 64 . 1 1 70 70 VAL C C 70 174.000 174.000 174.589 -0.589 17919 26290 1 64 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.463 0.337 17919 26291 1 64 . 1 1 70 70 VAL CB C 70 34.910 34.910 33.836 1.074 17919 26292 1 64 . 1 1 70 70 VAL H H 70 9.200 9.200 7.939 1.261 17919 26293 1 64 . 1 1 71 71 LEU N N 71 123.130 123.130 126.846 -3.716 17919 26294 1 64 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.759 0.301 17919 26295 1 64 . 1 1 71 71 LEU C C 71 177.830 177.830 177.222 0.608 17919 26296 1 64 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.689 0.251 17919 26297 1 64 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.031 -0.181 17919 26298 1 64 . 1 1 71 71 LEU H H 71 8.120 8.120 8.427 -0.307 17919 26299 1 64 . 1 1 72 72 ARG N N 72 123.490 123.490 122.710 0.780 17919 26300 1 64 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.263 0.038 17919 26301 1 64 . 1 1 72 72 ARG C C 72 175.350 175.350 176.338 -0.988 17919 26302 1 64 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.245 -0.635 17919 26303 1 64 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.740 0.610 17919 26304 1 64 . 1 1 72 72 ARG H H 72 8.580 8.580 8.085 0.495 17919 26305 1 65 . 1 1 2 2 GLN N N 2 123.220 123.220 122.424 0.796 17919 26306 1 65 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.170 0.079 17919 26307 1 65 . 1 1 2 2 GLN C C 2 175.920 175.920 174.149 1.771 17919 26308 1 65 . 1 1 2 2 GLN CA C 2 55.080 55.080 53.851 1.229 17919 26309 1 65 . 1 1 2 2 GLN CB C 2 30.760 30.760 32.068 -1.308 17919 26310 1 65 . 1 1 2 2 GLN H H 2 8.900 8.900 8.515 0.385 17919 26311 1 65 . 1 1 3 3 ILE N N 3 115.340 115.340 117.409 -2.069 17919 26312 1 65 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.709 -0.496 17919 26313 1 65 . 1 1 3 3 ILE C C 3 172.450 172.450 173.457 -1.007 17919 26314 1 65 . 1 1 3 3 ILE CA C 3 59.570 59.570 58.949 0.621 17919 26315 1 65 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.482 0.728 17919 26316 1 65 . 1 1 3 3 ILE H H 3 8.320 8.320 7.533 0.787 17919 26317 1 65 . 1 1 4 4 PHE N N 4 118.110 118.110 120.580 -2.470 17919 26318 1 65 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.313 0.317 17919 26319 1 65 . 1 1 4 4 PHE C C 4 175.320 175.320 174.700 0.620 17919 26320 1 65 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.548 -0.338 17919 26321 1 65 . 1 1 4 4 PHE CB C 4 41.480 41.480 40.855 0.625 17919 26322 1 65 . 1 1 4 4 PHE H H 4 8.610 8.610 8.418 0.192 17919 26323 1 65 . 1 1 5 5 VAL N N 5 121.000 121.000 118.296 2.704 17919 26324 1 65 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.923 -0.198 17919 26325 1 65 . 1 1 5 5 VAL C C 5 174.870 174.870 174.429 0.441 17919 26326 1 65 . 1 1 5 5 VAL CA C 5 60.620 60.620 60.113 0.507 17919 26327 1 65 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.196 0.034 17919 26328 1 65 . 1 1 5 5 VAL H H 5 9.300 9.300 9.119 0.181 17919 26329 1 65 . 1 1 6 6 LYS N N 6 127.520 127.520 128.510 -0.990 17919 26330 1 65 . 1 1 6 6 LYS HA H 6 5.367 5.367 4.972 0.395 17919 26331 1 65 . 1 1 6 6 LYS C C 6 177.140 177.140 176.063 1.077 17919 26332 1 65 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.782 -0.263 17919 26333 1 65 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.656 -0.606 17919 26334 1 65 . 1 1 6 6 LYS H H 6 8.820 8.820 8.982 -0.162 17919 26335 1 65 . 1 1 7 7 THR N N 7 115.400 115.400 117.648 -2.248 17919 26336 1 65 . 1 1 7 7 THR HA H 7 4.970 4.970 4.653 0.317 17919 26337 1 65 . 1 1 7 7 THR C C 7 176.910 176.910 176.184 0.726 17919 26338 1 65 . 1 1 7 7 THR CA C 7 60.470 60.470 60.211 0.259 17919 26339 1 65 . 1 1 7 7 THR CB C 7 70.630 70.630 70.891 -0.261 17919 26340 1 65 . 1 1 7 7 THR H H 7 8.730 8.730 8.845 -0.115 17919 26341 1 65 . 1 1 8 8 LEU N N 8 121.330 121.330 120.910 0.420 17919 26342 1 65 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.380 -0.070 17919 26343 1 65 . 1 1 8 8 LEU C C 8 178.800 178.800 177.516 1.284 17919 26344 1 65 . 1 1 8 8 LEU CA C 8 57.580 57.580 56.524 1.056 17919 26345 1 65 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.283 -0.313 17919 26346 1 65 . 1 1 8 8 LEU H H 8 9.100 9.100 8.779 0.321 17919 26347 1 65 . 1 1 9 9 THR N N 9 105.590 105.590 110.100 -4.510 17919 26348 1 65 . 1 1 9 9 THR HA H 9 4.428 4.428 4.437 -0.009 17919 26349 1 65 . 1 1 9 9 THR C C 9 175.520 175.520 175.302 0.218 17919 26350 1 65 . 1 1 9 9 THR CA C 9 61.400 61.400 61.622 -0.222 17919 26351 1 65 . 1 1 9 9 THR CB C 9 69.140 69.140 70.036 -0.896 17919 26352 1 65 . 1 1 9 9 THR H H 9 7.630 7.630 7.517 0.113 17919 26353 1 65 . 1 1 10 10 GLY N N 10 108.890 108.890 111.276 -2.386 17919 26354 1 65 . 1 1 10 10 GLY C C 10 174.070 174.070 174.184 -0.114 17919 26355 1 65 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.957 0.503 17919 26356 1 65 . 1 1 10 10 GLY H H 10 7.810 7.810 7.775 0.035 17919 26357 1 65 . 1 1 11 11 LYS N N 11 121.600 121.600 121.954 -0.354 17919 26358 1 65 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.397 -0.036 17919 26359 1 65 . 1 1 11 11 LYS C C 11 175.940 175.940 175.186 0.754 17919 26360 1 65 . 1 1 11 11 LYS CA C 11 56.280 56.280 55.977 0.303 17919 26361 1 65 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.366 -0.166 17919 26362 1 65 . 1 1 11 11 LYS H H 11 7.280 7.280 7.638 -0.358 17919 26363 1 65 . 1 1 12 12 THR N N 12 120.440 120.440 118.440 2.000 17919 26364 1 65 . 1 1 12 12 THR HA H 12 5.046 5.046 4.684 0.362 17919 26365 1 65 . 1 1 12 12 THR C C 12 174.320 174.320 174.207 0.113 17919 26366 1 65 . 1 1 12 12 THR CA C 12 62.390 62.390 62.133 0.258 17919 26367 1 65 . 1 1 12 12 THR CB C 12 69.910 69.910 69.368 0.542 17919 26368 1 65 . 1 1 12 12 THR H H 12 8.650 8.650 8.307 0.343 17919 26369 1 65 . 1 1 13 13 ILE N N 13 127.110 127.110 129.540 -2.430 17919 26370 1 65 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.146 0.398 17919 26371 1 65 . 1 1 13 13 ILE C C 13 175.220 175.220 175.467 -0.247 17919 26372 1 65 . 1 1 13 13 ILE CA C 13 59.980 59.980 61.762 -1.782 17919 26373 1 65 . 1 1 13 13 ILE CB C 13 40.950 40.950 38.551 2.399 17919 26374 1 65 . 1 1 13 13 ILE H H 13 9.450 9.450 9.149 0.301 17919 26375 1 65 . 1 1 14 14 THR N N 14 121.520 121.520 123.288 -1.768 17919 26376 1 65 . 1 1 14 14 THR HA H 14 4.964 4.964 4.851 0.113 17919 26377 1 65 . 1 1 14 14 THR C C 14 173.790 173.790 173.941 -0.151 17919 26378 1 65 . 1 1 14 14 THR CA C 14 61.940 61.940 62.242 -0.302 17919 26379 1 65 . 1 1 14 14 THR CB C 14 69.650 69.650 69.594 0.057 17919 26380 1 65 . 1 1 14 14 THR H H 14 8.710 8.710 8.571 0.139 17919 26381 1 65 . 1 1 15 15 LEU N N 15 124.800 124.800 127.948 -3.148 17919 26382 1 65 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.646 0.134 17919 26383 1 65 . 1 1 15 15 LEU C C 15 174.670 174.670 175.460 -0.790 17919 26384 1 65 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.700 -0.870 17919 26385 1 65 . 1 1 15 15 LEU CB C 15 47.070 47.070 44.562 2.508 17919 26386 1 65 . 1 1 15 15 LEU H H 15 8.710 8.710 8.264 0.446 17919 26387 1 65 . 1 1 16 16 GLU N N 16 122.160 122.160 122.933 -0.773 17919 26388 1 65 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.172 -0.255 17919 26389 1 65 . 1 1 16 16 GLU C C 16 175.860 175.860 175.646 0.214 17919 26390 1 65 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.386 -0.566 17919 26391 1 65 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.922 -1.472 17919 26392 1 65 . 1 1 16 16 GLU H H 16 8.140 8.140 8.454 -0.314 17919 26393 1 65 . 1 1 17 17 VAL N N 17 117.210 117.210 120.811 -3.601 17919 26394 1 65 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.671 0.043 17919 26395 1 65 . 1 1 17 17 VAL C C 17 174.160 174.160 174.093 0.067 17919 26396 1 65 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.024 -0.594 17919 26397 1 65 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.267 1.133 17919 26398 1 65 . 1 1 17 17 VAL H H 17 8.900 8.900 8.473 0.427 17919 26399 1 65 . 1 1 18 18 GLU N N 18 118.990 118.990 119.578 -0.588 17919 26400 1 65 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.824 0.255 17919 26401 1 65 . 1 1 18 18 GLU C C 18 176.160 176.160 174.930 1.230 17919 26402 1 65 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.285 -0.565 17919 26403 1 65 . 1 1 18 18 GLU CB C 18 30.310 30.310 31.015 -0.705 17919 26404 1 65 . 1 1 18 18 GLU H H 18 8.640 8.640 7.826 0.814 17919 26405 1 65 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.170 -0.029 17919 26406 1 65 . 1 1 19 19 PRO C C 19 175.310 175.310 177.592 -2.282 17919 26407 1 65 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.838 -0.368 17919 26408 1 65 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.998 -0.048 17919 26409 1 65 . 1 1 20 20 SER N N 20 103.400 103.400 110.095 -6.695 17919 26410 1 65 . 1 1 20 20 SER HA H 20 4.370 4.370 4.398 -0.028 17919 26411 1 65 . 1 1 20 20 SER C C 20 174.660 174.660 173.292 1.368 17919 26412 1 65 . 1 1 20 20 SER CA C 20 57.400 57.400 58.299 -0.899 17919 26413 1 65 . 1 1 20 20 SER CB C 20 63.370 63.370 63.288 0.083 17919 26414 1 65 . 1 1 20 20 SER H H 20 7.040 7.040 7.833 -0.793 17919 26415 1 65 . 1 1 21 21 ASP N N 21 123.480 123.480 122.763 0.717 17919 26416 1 65 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.570 0.125 17919 26417 1 65 . 1 1 21 21 ASP C C 21 176.360 176.360 175.547 0.813 17919 26418 1 65 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.416 1.284 17919 26419 1 65 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.825 -1.025 17919 26420 1 65 . 1 1 21 21 ASP H H 21 8.030 8.030 7.569 0.461 17919 26421 1 65 . 1 1 22 22 THR N N 22 108.800 108.800 113.861 -5.061 17919 26422 1 65 . 1 1 22 22 THR HA H 22 4.920 4.920 4.717 0.203 17919 26423 1 65 . 1 1 22 22 THR C C 22 176.750 176.750 175.724 1.026 17919 26424 1 65 . 1 1 22 22 THR CA C 22 59.690 59.690 60.445 -0.755 17919 26425 1 65 . 1 1 22 22 THR CB C 22 71.200 71.200 70.945 0.255 17919 26426 1 65 . 1 1 22 22 THR H H 22 7.900 7.900 8.319 -0.419 17919 26427 1 65 . 1 1 23 23 ILE N N 23 121.190 121.190 122.447 -1.257 17919 26428 1 65 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.847 -0.190 17919 26429 1 65 . 1 1 23 23 ILE C C 23 179.040 179.040 177.746 1.294 17919 26430 1 65 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.355 -0.096 17919 26431 1 65 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.283 -1.933 17919 26432 1 65 . 1 1 23 23 ILE H H 23 8.560 8.560 8.894 -0.334 17919 26433 1 65 . 1 1 24 24 GLU N N 24 120.830 120.830 120.302 0.528 17919 26434 1 65 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.870 0.047 17919 26435 1 65 . 1 1 24 24 GLU C C 24 178.640 178.640 178.940 -0.300 17919 26436 1 65 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.210 0.010 17919 26437 1 65 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.380 -1.100 17919 26438 1 65 . 1 1 24 24 GLU H H 24 9.760 9.760 8.447 1.313 17919 26439 1 65 . 1 1 25 25 ASN N N 25 120.570 120.570 117.949 2.621 17919 26440 1 65 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.553 -0.028 17919 26441 1 65 . 1 1 25 25 ASN C C 25 178.380 178.380 177.645 0.735 17919 26442 1 65 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.672 0.388 17919 26443 1 65 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.313 0.137 17919 26444 1 65 . 1 1 25 25 ASN H H 25 7.920 7.920 7.640 0.280 17919 26445 1 65 . 1 1 26 26 VAL N N 26 121.710 121.710 120.200 1.510 17919 26446 1 65 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.812 -0.415 17919 26447 1 65 . 1 1 26 26 VAL C C 26 177.950 177.950 177.689 0.261 17919 26448 1 65 . 1 1 26 26 VAL CA C 26 67.660 67.660 64.537 3.123 17919 26449 1 65 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.198 -0.357 17919 26450 1 65 . 1 1 26 26 VAL H H 26 8.070 8.070 8.334 -0.264 17919 26451 1 65 . 1 1 27 27 LYS N N 27 118.860 118.860 120.271 -1.411 17919 26452 1 65 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.309 0.271 17919 26453 1 65 . 1 1 27 27 LYS C C 27 180.550 180.550 178.818 1.732 17919 26454 1 65 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.622 -0.372 17919 26455 1 65 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.366 1.364 17919 26456 1 65 . 1 1 27 27 LYS H H 27 8.560 8.560 8.520 0.040 17919 26457 1 65 . 1 1 28 28 ALA N N 28 123.440 123.440 123.150 0.290 17919 26458 1 65 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.051 0.109 17919 26459 1 65 . 1 1 28 28 ALA C C 28 180.300 180.300 179.198 1.102 17919 26460 1 65 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.995 0.375 17919 26461 1 65 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.367 -0.657 17919 26462 1 65 . 1 1 28 28 ALA H H 28 8.060 8.060 8.016 0.044 17919 26463 1 65 . 1 1 29 29 LYS N N 29 119.940 119.940 119.702 0.238 17919 26464 1 65 . 1 1 29 29 LYS HA H 29 4.207 4.207 3.887 0.320 17919 26465 1 65 . 1 1 29 29 LYS C C 29 180.320 180.320 179.186 1.134 17919 26466 1 65 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.660 -0.010 17919 26467 1 65 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.229 1.061 17919 26468 1 65 . 1 1 29 29 LYS H H 29 7.850 7.850 8.105 -0.255 17919 26469 1 65 . 1 1 30 30 ILE N N 30 121.080 121.080 119.061 2.019 17919 26470 1 65 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.657 -0.150 17919 26471 1 65 . 1 1 30 30 ILE C C 30 178.310 178.310 177.691 0.619 17919 26472 1 65 . 1 1 30 30 ILE CA C 30 66.150 66.150 64.650 1.500 17919 26473 1 65 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.568 -0.768 17919 26474 1 65 . 1 1 30 30 ILE H H 30 8.280 8.280 7.430 0.850 17919 26475 1 65 . 1 1 31 31 GLN N N 31 123.490 123.490 119.736 3.754 17919 26476 1 65 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.956 -0.127 17919 26477 1 65 . 1 1 31 31 GLN C C 31 178.890 178.890 178.567 0.323 17919 26478 1 65 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.138 0.862 17919 26479 1 65 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.469 -0.749 17919 26480 1 65 . 1 1 31 31 GLN H H 31 8.580 8.580 7.979 0.601 17919 26481 1 65 . 1 1 32 32 ASP N N 32 119.360 119.360 118.036 1.324 17919 26482 1 65 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.439 -0.085 17919 26483 1 65 . 1 1 32 32 ASP C C 32 177.250 177.250 177.156 0.094 17919 26484 1 65 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.317 0.873 17919 26485 1 65 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.747 -0.167 17919 26486 1 65 . 1 1 32 32 ASP H H 32 8.010 8.010 8.212 -0.202 17919 26487 1 65 . 1 1 33 33 LYS N N 33 115.130 115.130 118.580 -3.450 17919 26488 1 65 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.388 -0.051 17919 26489 1 65 . 1 1 33 33 LYS C C 33 177.870 177.870 178.273 -0.403 17919 26490 1 65 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.304 0.746 17919 26491 1 65 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.308 0.862 17919 26492 1 65 . 1 1 33 33 LYS H H 33 7.430 7.430 7.545 -0.115 17919 26493 1 65 . 1 1 34 34 GLU N N 34 113.870 113.870 118.009 -4.139 17919 26494 1 65 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.362 0.263 17919 26495 1 65 . 1 1 34 34 GLU C C 34 177.840 177.840 177.138 0.702 17919 26496 1 65 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.477 -1.307 17919 26497 1 65 . 1 1 34 34 GLU CB C 34 32.660 32.660 30.474 2.186 17919 26498 1 65 . 1 1 34 34 GLU H H 34 8.740 8.740 7.995 0.745 17919 26499 1 65 . 1 1 35 35 GLY N N 35 108.650 108.650 107.588 1.062 17919 26500 1 65 . 1 1 35 35 GLY C C 35 173.960 173.960 174.417 -0.457 17919 26501 1 65 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.412 0.668 17919 26502 1 65 . 1 1 35 35 GLY H H 35 8.530 8.530 7.801 0.729 17919 26503 1 65 . 1 1 36 36 ILE N N 36 119.880 119.880 120.332 -0.452 17919 26504 1 65 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.337 0.108 17919 26505 1 65 . 1 1 36 36 ILE C C 36 173.590 173.590 173.840 -0.250 17919 26506 1 65 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.058 -0.308 17919 26507 1 65 . 1 1 36 36 ILE CB C 36 40.580 40.580 37.965 2.615 17919 26508 1 65 . 1 1 36 36 ILE H H 36 6.150 6.150 7.627 -1.477 17919 26509 1 65 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.682 -0.048 17919 26510 1 65 . 1 1 37 37 PRO C C 37 176.940 176.940 176.141 0.799 17919 26511 1 65 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.686 -0.026 17919 26512 1 65 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.524 0.326 17919 26513 1 65 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.137 -0.020 17919 26514 1 65 . 1 1 38 38 PRO C C 38 178.320 178.320 178.505 -0.185 17919 26515 1 65 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.625 0.635 17919 26516 1 65 . 1 1 38 38 PRO CB C 38 32.890 32.890 32.009 0.881 17919 26517 1 65 . 1 1 39 39 ASP N N 39 113.380 113.380 117.342 -3.962 17919 26518 1 65 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.216 0.214 17919 26519 1 65 . 1 1 39 39 ASP C C 39 177.090 177.090 178.284 -1.194 17919 26520 1 65 . 1 1 39 39 ASP CA C 39 55.640 55.640 57.510 -1.870 17919 26521 1 65 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.468 -0.928 17919 26522 1 65 . 1 1 39 39 ASP H H 39 8.550 8.550 8.905 -0.355 17919 26523 1 65 . 1 1 40 40 GLN N N 40 116.780 116.780 116.610 0.170 17919 26524 1 65 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.311 0.153 17919 26525 1 65 . 1 1 40 40 GLN C C 40 175.380 175.380 175.786 -0.406 17919 26526 1 65 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.760 -0.119 17919 26527 1 65 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.201 0.939 17919 26528 1 65 . 1 1 40 40 GLN H H 40 7.820 7.820 7.726 0.094 17919 26529 1 65 . 1 1 41 41 GLN N N 41 117.720 117.720 120.043 -2.323 17919 26530 1 65 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.507 -0.263 17919 26531 1 65 . 1 1 41 41 GLN C C 41 176.300 176.300 175.142 1.158 17919 26532 1 65 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.473 -0.003 17919 26533 1 65 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.247 2.403 17919 26534 1 65 . 1 1 41 41 GLN H H 41 7.480 7.480 7.406 0.074 17919 26535 1 65 . 1 1 42 42 ARG N N 42 122.680 122.680 124.910 -2.230 17919 26536 1 65 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.607 -0.107 17919 26537 1 65 . 1 1 42 42 ARG C C 42 174.050 174.050 173.971 0.079 17919 26538 1 65 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.078 -0.028 17919 26539 1 65 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.806 -1.056 17919 26540 1 65 . 1 1 42 42 ARG H H 42 8.530 8.530 8.850 -0.320 17919 26541 1 65 . 1 1 43 43 LEU N N 43 124.040 124.040 127.899 -3.859 17919 26542 1 65 . 1 1 43 43 LEU C C 43 175.290 175.290 174.848 0.442 17919 26543 1 65 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.302 -1.322 17919 26544 1 65 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.538 2.252 17919 26545 1 65 . 1 1 43 43 LEU H H 43 8.820 8.820 8.847 -0.027 17919 26546 1 65 . 1 1 44 44 ILE N N 44 121.920 121.920 123.550 -1.630 17919 26547 1 65 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.748 0.244 17919 26548 1 65 . 1 1 44 44 ILE C C 44 176.060 176.060 174.629 1.431 17919 26549 1 65 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.426 -0.446 17919 26550 1 65 . 1 1 44 44 ILE CB C 44 41.420 41.420 40.119 1.301 17919 26551 1 65 . 1 1 44 44 ILE H H 44 9.030 9.030 8.104 0.926 17919 26552 1 65 . 1 1 45 45 PHE N N 45 125.390 125.390 127.803 -2.413 17919 26553 1 65 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.923 0.122 17919 26554 1 65 . 1 1 45 45 PHE C C 45 174.470 174.470 174.480 -0.010 17919 26555 1 65 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.382 0.638 17919 26556 1 65 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.581 1.179 17919 26557 1 65 . 1 1 45 45 PHE H H 45 8.830 8.830 8.699 0.131 17919 26558 1 65 . 1 1 46 46 ALA N N 46 132.200 132.200 129.706 2.494 17919 26559 1 65 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.648 0.042 17919 26560 1 65 . 1 1 46 46 ALA C C 46 177.290 177.290 177.337 -0.047 17919 26561 1 65 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.823 -0.283 17919 26562 1 65 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.599 -0.029 17919 26563 1 65 . 1 1 46 46 ALA H H 46 8.810 8.810 8.914 -0.104 17919 26564 1 65 . 1 1 47 47 GLY N N 47 102.340 102.340 104.184 -1.844 17919 26565 1 65 . 1 1 47 47 GLY C C 47 173.810 173.810 174.633 -0.823 17919 26566 1 65 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.350 0.000 17919 26567 1 65 . 1 1 47 47 GLY H H 47 8.130 8.130 8.430 -0.300 17919 26568 1 65 . 1 1 48 48 LYS N N 48 121.570 121.570 122.917 -1.347 17919 26569 1 65 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.521 0.101 17919 26570 1 65 . 1 1 48 48 LYS C C 48 174.700 174.700 175.131 -0.431 17919 26571 1 65 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.889 -0.339 17919 26572 1 65 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.022 0.508 17919 26573 1 65 . 1 1 48 48 LYS H H 48 7.980 7.980 7.688 0.292 17919 26574 1 65 . 1 1 49 49 GLN N N 49 122.410 122.410 125.967 -3.557 17919 26575 1 65 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.546 0.014 17919 26576 1 65 . 1 1 49 49 GLN C C 49 175.670 175.670 175.325 0.345 17919 26577 1 65 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.327 -0.587 17919 26578 1 65 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.380 -0.380 17919 26579 1 65 . 1 1 49 49 GLN H H 49 8.600 8.600 8.663 -0.063 17919 26580 1 65 . 1 1 50 50 LEU N N 50 125.520 125.520 128.636 -3.116 17919 26581 1 65 . 1 1 50 50 LEU HA H 50 4.090 4.090 3.987 0.103 17919 26582 1 65 . 1 1 50 50 LEU C C 50 176.660 176.660 175.982 0.678 17919 26583 1 65 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.057 0.183 17919 26584 1 65 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.918 -0.348 17919 26585 1 65 . 1 1 50 50 LEU H H 50 8.530 8.530 8.281 0.249 17919 26586 1 65 . 1 1 51 51 GLU N N 51 122.940 122.940 124.617 -1.677 17919 26587 1 65 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.581 -0.093 17919 26588 1 65 . 1 1 51 51 GLU C C 51 175.870 175.870 176.943 -1.073 17919 26589 1 65 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.393 0.567 17919 26590 1 65 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.558 0.012 17919 26591 1 65 . 1 1 51 51 GLU H H 51 8.400 8.400 8.737 -0.337 17919 26592 1 65 . 1 1 52 52 ASP N N 52 120.030 120.030 125.114 -5.084 17919 26593 1 65 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.440 -0.081 17919 26594 1 65 . 1 1 52 52 ASP C C 52 177.330 177.330 178.221 -0.891 17919 26595 1 65 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.509 -0.549 17919 26596 1 65 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.659 0.191 17919 26597 1 65 . 1 1 52 52 ASP H H 52 8.160 8.160 8.836 -0.676 17919 26598 1 65 . 1 1 53 53 GLY N N 53 106.660 106.660 106.398 0.262 17919 26599 1 65 . 1 1 53 53 GLY C C 53 174.870 174.870 174.196 0.674 17919 26600 1 65 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.203 -0.033 17919 26601 1 65 . 1 1 53 53 GLY H H 53 9.390 9.390 8.535 0.855 17919 26602 1 65 . 1 1 54 54 ARG N N 54 119.050 119.050 119.904 -0.854 17919 26603 1 65 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.550 0.145 17919 26604 1 65 . 1 1 54 54 ARG C C 54 175.350 175.350 175.061 0.289 17919 26605 1 65 . 1 1 54 54 ARG CA C 54 54.390 54.390 53.569 0.821 17919 26606 1 65 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.249 0.401 17919 26607 1 65 . 1 1 54 54 ARG H H 54 7.460 7.460 7.162 0.298 17919 26608 1 65 . 1 1 55 55 THR N N 55 108.400 108.400 110.805 -2.405 17919 26609 1 65 . 1 1 55 55 THR HA H 55 5.240 5.240 5.119 0.121 17919 26610 1 65 . 1 1 55 55 THR C C 55 176.560 176.560 176.116 0.444 17919 26611 1 65 . 1 1 55 55 THR CA C 55 59.690 59.690 59.698 -0.008 17919 26612 1 65 . 1 1 55 55 THR CB C 55 72.260 72.260 71.640 0.620 17919 26613 1 65 . 1 1 55 55 THR H H 55 8.730 8.730 8.817 -0.087 17919 26614 1 65 . 1 1 56 56 LEU N N 56 117.920 117.920 121.450 -3.530 17919 26615 1 65 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.018 0.042 17919 26616 1 65 . 1 1 56 56 LEU C C 56 180.810 180.810 178.856 1.954 17919 26617 1 65 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.295 0.415 17919 26618 1 65 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.425 -1.055 17919 26619 1 65 . 1 1 56 56 LEU H H 56 8.140 8.140 8.403 -0.263 17919 26620 1 65 . 1 1 57 57 SER N N 57 113.330 113.330 115.454 -2.124 17919 26621 1 65 . 1 1 57 57 SER HA H 57 4.370 4.370 4.055 0.315 17919 26622 1 65 . 1 1 57 57 SER C C 57 178.310 178.310 176.834 1.476 17919 26623 1 65 . 1 1 57 57 SER CA C 57 61.080 61.080 61.383 -0.303 17919 26624 1 65 . 1 1 57 57 SER CB C 57 62.530 62.530 62.721 -0.192 17919 26625 1 65 . 1 1 57 57 SER H H 57 8.470 8.470 7.867 0.603 17919 26626 1 65 . 1 1 58 58 ASP N N 58 124.190 124.190 123.122 1.068 17919 26627 1 65 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.320 -0.024 17919 26628 1 65 . 1 1 58 58 ASP C C 58 177.400 177.400 176.709 0.691 17919 26629 1 65 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.713 0.467 17919 26630 1 65 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.225 -0.125 17919 26631 1 65 . 1 1 58 58 ASP H H 58 7.930 7.930 8.014 -0.084 17919 26632 1 65 . 1 1 59 59 TYR N N 59 115.510 115.510 115.442 0.068 17919 26633 1 65 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.607 0.063 17919 26634 1 65 . 1 1 59 59 TYR C C 59 174.700 174.700 175.437 -0.737 17919 26635 1 65 . 1 1 59 59 TYR CA C 59 58.250 58.250 56.625 1.625 17919 26636 1 65 . 1 1 59 59 TYR CB C 59 40.070 40.070 37.486 2.584 17919 26637 1 65 . 1 1 59 59 TYR H H 59 7.250 7.250 7.042 0.208 17919 26638 1 65 . 1 1 60 60 ASN N N 60 115.900 115.900 114.742 1.158 17919 26639 1 65 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.367 -0.012 17919 26640 1 65 . 1 1 60 60 ASN C C 60 174.340 174.340 174.632 -0.292 17919 26641 1 65 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.641 -0.521 17919 26642 1 65 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.631 -0.221 17919 26643 1 65 . 1 1 60 60 ASN H H 60 8.150 8.150 8.218 -0.068 17919 26644 1 65 . 1 1 61 61 ILE N N 61 118.600 118.600 119.279 -0.679 17919 26645 1 65 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.610 -0.217 17919 26646 1 65 . 1 1 61 61 ILE C C 61 174.610 174.610 175.031 -0.421 17919 26647 1 65 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.451 -0.031 17919 26648 1 65 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.599 -0.859 17919 26649 1 65 . 1 1 61 61 ILE H H 61 7.250 7.250 7.609 -0.359 17919 26650 1 65 . 1 1 62 62 GLN N N 62 124.740 124.740 123.443 1.297 17919 26651 1 65 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.741 -0.235 17919 26652 1 65 . 1 1 62 62 GLN C C 62 175.970 175.970 175.278 0.692 17919 26653 1 65 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.618 0.042 17919 26654 1 65 . 1 1 62 62 GLN CB C 62 31.650 31.650 33.516 -1.866 17919 26655 1 65 . 1 1 62 62 GLN H H 62 7.610 7.610 7.854 -0.244 17919 26656 1 65 . 1 1 63 63 LYS N N 63 120.300 120.300 123.196 -2.896 17919 26657 1 65 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.004 -0.003 17919 26658 1 65 . 1 1 63 63 LYS C C 63 175.810 175.810 176.146 -0.336 17919 26659 1 65 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.320 -0.530 17919 26660 1 65 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.424 1.226 17919 26661 1 65 . 1 1 63 63 LYS H H 63 8.490 8.490 8.645 -0.155 17919 26662 1 65 . 1 1 64 64 GLU N N 64 113.950 113.950 117.581 -3.631 17919 26663 1 65 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.992 -0.527 17919 26664 1 65 . 1 1 64 64 GLU C C 64 175.250 175.250 175.396 -0.146 17919 26665 1 65 . 1 1 64 64 GLU CA C 64 57.890 57.890 56.972 0.917 17919 26666 1 65 . 1 1 64 64 GLU CB C 64 25.900 25.900 26.884 -0.984 17919 26667 1 65 . 1 1 64 64 GLU H H 64 9.280 9.280 8.538 0.742 17919 26668 1 65 . 1 1 65 65 SER N N 65 114.730 114.730 116.332 -1.602 17919 26669 1 65 . 1 1 65 65 SER HA H 65 4.640 4.640 4.535 0.105 17919 26670 1 65 . 1 1 65 65 SER C C 65 172.160 172.160 174.060 -1.900 17919 26671 1 65 . 1 1 65 65 SER CA C 65 60.890 60.890 59.977 0.913 17919 26672 1 65 . 1 1 65 65 SER CB C 65 64.910 64.910 64.097 0.813 17919 26673 1 65 . 1 1 65 65 SER H H 65 7.670 7.670 7.792 -0.122 17919 26674 1 65 . 1 1 66 66 THR N N 66 117.110 117.110 118.266 -1.156 17919 26675 1 65 . 1 1 66 66 THR HA H 66 5.270 5.270 5.067 0.203 17919 26676 1 65 . 1 1 66 66 THR C C 66 173.950 173.950 173.527 0.423 17919 26677 1 65 . 1 1 66 66 THR CA C 66 62.340 62.340 61.432 0.908 17919 26678 1 65 . 1 1 66 66 THR CB C 66 70.080 70.080 70.712 -0.632 17919 26679 1 65 . 1 1 66 66 THR H H 66 8.730 8.730 8.359 0.371 17919 26680 1 65 . 1 1 67 67 LEU N N 67 127.110 127.110 125.930 1.180 17919 26681 1 65 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.877 0.183 17919 26682 1 65 . 1 1 67 67 LEU C C 67 175.770 175.770 175.943 -0.173 17919 26683 1 65 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.465 0.435 17919 26684 1 65 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.911 0.348 17919 26685 1 65 . 1 1 67 67 LEU H H 67 9.410 9.410 8.022 1.388 17919 26686 1 65 . 1 1 68 68 HIS N N 68 118.380 118.380 120.833 -2.453 17919 26687 1 65 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.005 0.235 17919 26688 1 65 . 1 1 68 68 HIS C C 68 173.150 173.150 174.879 -1.729 17919 26689 1 65 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.862 0.138 17919 26690 1 65 . 1 1 68 68 HIS CB C 68 30.530 30.530 29.546 0.984 17919 26691 1 65 . 1 1 68 68 HIS H H 68 9.230 9.230 8.392 0.838 17919 26692 1 65 . 1 1 69 69 LEU N N 69 124.460 124.460 127.698 -3.238 17919 26693 1 65 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.285 0.905 17919 26694 1 65 . 1 1 69 69 LEU C C 69 175.270 175.270 175.433 -0.163 17919 26695 1 65 . 1 1 69 69 LEU CA C 69 53.890 53.890 55.741 -1.851 17919 26696 1 65 . 1 1 69 69 LEU CB C 69 44.380 44.380 41.863 2.517 17919 26697 1 65 . 1 1 69 69 LEU H H 69 8.340 8.340 8.610 -0.270 17919 26698 1 65 . 1 1 70 70 VAL N N 70 126.940 126.940 123.368 3.572 17919 26699 1 65 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.613 -0.263 17919 26700 1 65 . 1 1 70 70 VAL C C 70 174.000 174.000 174.131 -0.131 17919 26701 1 65 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.651 1.149 17919 26702 1 65 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.602 -0.692 17919 26703 1 65 . 1 1 70 70 VAL H H 70 9.200 9.200 8.984 0.216 17919 26704 1 65 . 1 1 71 71 LEU N N 71 123.130 123.130 123.175 -0.045 17919 26705 1 65 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.180 -0.120 17919 26706 1 65 . 1 1 71 71 LEU C C 71 177.830 177.830 177.856 -0.026 17919 26707 1 65 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.718 0.222 17919 26708 1 65 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.059 -0.209 17919 26709 1 65 . 1 1 71 71 LEU H H 71 8.120 8.120 8.435 -0.315 17919 26710 1 65 . 1 1 72 72 ARG N N 72 123.490 123.490 122.207 1.283 17919 26711 1 65 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.450 -0.149 17919 26712 1 65 . 1 1 72 72 ARG C C 72 175.350 175.350 178.460 -3.110 17919 26713 1 65 . 1 1 72 72 ARG CA C 72 55.610 55.610 57.444 -1.834 17919 26714 1 65 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.123 1.226 17919 26715 1 65 . 1 1 72 72 ARG H H 72 8.580 8.580 8.829 -0.249 17919 26716 1 66 . 1 1 2 2 GLN N N 2 123.220 123.220 120.442 2.778 17919 26717 1 66 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.398 -0.149 17919 26718 1 66 . 1 1 2 2 GLN C C 2 175.920 175.920 175.764 0.156 17919 26719 1 66 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.621 0.459 17919 26720 1 66 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.490 0.270 17919 26721 1 66 . 1 1 2 2 GLN H H 2 8.900 8.900 8.338 0.562 17919 26722 1 66 . 1 1 3 3 ILE N N 3 115.340 115.340 115.973 -0.633 17919 26723 1 66 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.346 -0.133 17919 26724 1 66 . 1 1 3 3 ILE C C 3 172.450 172.450 173.625 -1.175 17919 26725 1 66 . 1 1 3 3 ILE CA C 3 59.570 59.570 58.792 0.778 17919 26726 1 66 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.111 1.099 17919 26727 1 66 . 1 1 3 3 ILE H H 3 8.320 8.320 8.160 0.160 17919 26728 1 66 . 1 1 4 4 PHE N N 4 118.110 118.110 116.508 1.602 17919 26729 1 66 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.417 0.213 17919 26730 1 66 . 1 1 4 4 PHE C C 4 175.320 175.320 175.019 0.301 17919 26731 1 66 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.324 -0.114 17919 26732 1 66 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.203 -0.723 17919 26733 1 66 . 1 1 4 4 PHE H H 4 8.610 8.610 8.202 0.408 17919 26734 1 66 . 1 1 5 5 VAL N N 5 121.000 121.000 119.911 1.089 17919 26735 1 66 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.890 -0.165 17919 26736 1 66 . 1 1 5 5 VAL C C 5 174.870 174.870 175.113 -0.243 17919 26737 1 66 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.121 -0.501 17919 26738 1 66 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.605 0.625 17919 26739 1 66 . 1 1 5 5 VAL H H 5 9.300 9.300 9.089 0.211 17919 26740 1 66 . 1 1 6 6 LYS N N 6 127.520 127.520 128.234 -0.714 17919 26741 1 66 . 1 1 6 6 LYS HA H 6 5.367 5.367 4.970 0.397 17919 26742 1 66 . 1 1 6 6 LYS C C 6 177.140 177.140 176.558 0.582 17919 26743 1 66 . 1 1 6 6 LYS CA C 6 54.520 54.520 55.186 -0.666 17919 26744 1 66 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.436 -0.386 17919 26745 1 66 . 1 1 6 6 LYS H H 6 8.820 8.820 8.649 0.171 17919 26746 1 66 . 1 1 7 7 THR N N 7 115.400 115.400 117.168 -1.768 17919 26747 1 66 . 1 1 7 7 THR HA H 7 4.970 4.970 4.601 0.369 17919 26748 1 66 . 1 1 7 7 THR C C 7 176.910 176.910 175.925 0.985 17919 26749 1 66 . 1 1 7 7 THR CA C 7 60.470 60.470 60.575 -0.105 17919 26750 1 66 . 1 1 7 7 THR CB C 7 70.630 70.630 70.558 0.072 17919 26751 1 66 . 1 1 7 7 THR H H 7 8.730 8.730 8.378 0.352 17919 26752 1 66 . 1 1 8 8 LEU N N 8 121.330 121.330 121.167 0.163 17919 26753 1 66 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.329 -0.019 17919 26754 1 66 . 1 1 8 8 LEU C C 8 178.800 178.800 177.952 0.848 17919 26755 1 66 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.405 0.175 17919 26756 1 66 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.874 0.096 17919 26757 1 66 . 1 1 8 8 LEU H H 8 9.100 9.100 8.877 0.223 17919 26758 1 66 . 1 1 9 9 THR N N 9 105.590 105.590 108.219 -2.629 17919 26759 1 66 . 1 1 9 9 THR HA H 9 4.428 4.428 4.301 0.127 17919 26760 1 66 . 1 1 9 9 THR C C 9 175.520 175.520 175.045 0.475 17919 26761 1 66 . 1 1 9 9 THR CA C 9 61.400 61.400 62.492 -1.092 17919 26762 1 66 . 1 1 9 9 THR CB C 9 69.140 69.140 68.901 0.239 17919 26763 1 66 . 1 1 9 9 THR H H 9 7.630 7.630 7.940 -0.310 17919 26764 1 66 . 1 1 10 10 GLY N N 10 108.890 108.890 110.570 -1.680 17919 26765 1 66 . 1 1 10 10 GLY C C 10 174.070 174.070 173.734 0.336 17919 26766 1 66 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.767 0.693 17919 26767 1 66 . 1 1 10 10 GLY H H 10 7.810 7.810 7.447 0.363 17919 26768 1 66 . 1 1 11 11 LYS N N 11 121.600 121.600 122.022 -0.422 17919 26769 1 66 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.335 0.026 17919 26770 1 66 . 1 1 11 11 LYS C C 11 175.940 175.940 175.824 0.116 17919 26771 1 66 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.689 -0.409 17919 26772 1 66 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.594 -0.394 17919 26773 1 66 . 1 1 11 11 LYS H H 11 7.280 7.280 7.964 -0.684 17919 26774 1 66 . 1 1 12 12 THR N N 12 120.440 120.440 120.252 0.188 17919 26775 1 66 . 1 1 12 12 THR HA H 12 5.046 5.046 5.131 -0.085 17919 26776 1 66 . 1 1 12 12 THR C C 12 174.320 174.320 174.203 0.117 17919 26777 1 66 . 1 1 12 12 THR CA C 12 62.390 62.390 61.531 0.860 17919 26778 1 66 . 1 1 12 12 THR CB C 12 69.910 69.910 70.513 -0.603 17919 26779 1 66 . 1 1 12 12 THR H H 12 8.650 8.650 8.305 0.345 17919 26780 1 66 . 1 1 13 13 ILE N N 13 127.110 127.110 126.580 0.530 17919 26781 1 66 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.503 0.041 17919 26782 1 66 . 1 1 13 13 ILE C C 13 175.220 175.220 174.778 0.442 17919 26783 1 66 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.060 -0.080 17919 26784 1 66 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.971 -0.021 17919 26785 1 66 . 1 1 13 13 ILE H H 13 9.450 9.450 8.663 0.787 17919 26786 1 66 . 1 1 14 14 THR N N 14 121.520 121.520 123.871 -2.351 17919 26787 1 66 . 1 1 14 14 THR HA H 14 4.964 4.964 4.890 0.074 17919 26788 1 66 . 1 1 14 14 THR C C 14 173.790 173.790 173.915 -0.125 17919 26789 1 66 . 1 1 14 14 THR CA C 14 61.940 61.940 62.059 -0.119 17919 26790 1 66 . 1 1 14 14 THR CB C 14 69.650 69.650 69.533 0.117 17919 26791 1 66 . 1 1 14 14 THR H H 14 8.710 8.710 8.448 0.262 17919 26792 1 66 . 1 1 15 15 LEU N N 15 124.800 124.800 127.916 -3.116 17919 26793 1 66 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.708 0.072 17919 26794 1 66 . 1 1 15 15 LEU C C 15 174.670 174.670 174.557 0.113 17919 26795 1 66 . 1 1 15 15 LEU CA C 15 52.830 52.830 54.037 -1.207 17919 26796 1 66 . 1 1 15 15 LEU CB C 15 47.070 47.070 46.232 0.838 17919 26797 1 66 . 1 1 15 15 LEU H H 15 8.710 8.710 8.467 0.243 17919 26798 1 66 . 1 1 16 16 GLU N N 16 122.160 122.160 124.956 -2.796 17919 26799 1 66 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.812 0.105 17919 26800 1 66 . 1 1 16 16 GLU C C 16 175.860 175.860 175.997 -0.137 17919 26801 1 66 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.193 -0.373 17919 26802 1 66 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.381 -0.931 17919 26803 1 66 . 1 1 16 16 GLU H H 16 8.140 8.140 8.583 -0.443 17919 26804 1 66 . 1 1 17 17 VAL N N 17 117.210 117.210 121.479 -4.269 17919 26805 1 66 . 1 1 17 17 VAL HA H 17 4.714 4.714 5.124 -0.410 17919 26806 1 66 . 1 1 17 17 VAL C C 17 174.160 174.160 174.485 -0.325 17919 26807 1 66 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.105 -0.675 17919 26808 1 66 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.129 1.271 17919 26809 1 66 . 1 1 17 17 VAL H H 17 8.900 8.900 8.762 0.138 17919 26810 1 66 . 1 1 18 18 GLU N N 18 118.990 118.990 121.022 -2.032 17919 26811 1 66 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.925 0.154 17919 26812 1 66 . 1 1 18 18 GLU C C 18 176.160 176.160 175.159 1.001 17919 26813 1 66 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.847 -0.127 17919 26814 1 66 . 1 1 18 18 GLU CB C 18 30.310 30.310 32.952 -2.642 17919 26815 1 66 . 1 1 18 18 GLU H H 18 8.640 8.640 8.199 0.441 17919 26816 1 66 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.226 -0.085 17919 26817 1 66 . 1 1 19 19 PRO C C 19 175.310 175.310 177.495 -2.185 17919 26818 1 66 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.247 0.223 17919 26819 1 66 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.068 -0.118 17919 26820 1 66 . 1 1 20 20 SER N N 20 103.400 103.400 109.899 -6.499 17919 26821 1 66 . 1 1 20 20 SER HA H 20 4.370 4.370 4.389 -0.019 17919 26822 1 66 . 1 1 20 20 SER C C 20 174.660 174.660 174.127 0.533 17919 26823 1 66 . 1 1 20 20 SER CA C 20 57.400 57.400 58.450 -1.050 17919 26824 1 66 . 1 1 20 20 SER CB C 20 63.370 63.370 63.096 0.274 17919 26825 1 66 . 1 1 20 20 SER H H 20 7.040 7.040 7.965 -0.925 17919 26826 1 66 . 1 1 21 21 ASP N N 21 123.480 123.480 122.884 0.596 17919 26827 1 66 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.723 -0.028 17919 26828 1 66 . 1 1 21 21 ASP C C 21 176.360 176.360 175.486 0.874 17919 26829 1 66 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.108 0.592 17919 26830 1 66 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.736 -0.936 17919 26831 1 66 . 1 1 21 21 ASP H H 21 8.030 8.030 7.786 0.244 17919 26832 1 66 . 1 1 22 22 THR N N 22 108.800 108.800 112.458 -3.658 17919 26833 1 66 . 1 1 22 22 THR HA H 22 4.920 4.920 4.886 0.034 17919 26834 1 66 . 1 1 22 22 THR C C 22 176.750 176.750 176.102 0.648 17919 26835 1 66 . 1 1 22 22 THR CA C 22 59.690 59.690 60.422 -0.732 17919 26836 1 66 . 1 1 22 22 THR CB C 22 71.200 71.200 70.468 0.732 17919 26837 1 66 . 1 1 22 22 THR H H 22 7.900 7.900 8.367 -0.467 17919 26838 1 66 . 1 1 23 23 ILE N N 23 121.190 121.190 121.633 -0.443 17919 26839 1 66 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.787 -0.130 17919 26840 1 66 . 1 1 23 23 ILE C C 23 179.040 179.040 177.597 1.443 17919 26841 1 66 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.244 -0.984 17919 26842 1 66 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.271 -1.921 17919 26843 1 66 . 1 1 23 23 ILE H H 23 8.560 8.560 8.662 -0.102 17919 26844 1 66 . 1 1 24 24 GLU N N 24 120.830 120.830 119.441 1.389 17919 26845 1 66 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.971 -0.054 17919 26846 1 66 . 1 1 24 24 GLU C C 24 178.640 178.640 178.993 -0.353 17919 26847 1 66 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.432 0.788 17919 26848 1 66 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.091 -0.811 17919 26849 1 66 . 1 1 24 24 GLU H H 24 9.760 9.760 8.004 1.756 17919 26850 1 66 . 1 1 25 25 ASN N N 25 120.570 120.570 118.441 2.129 17919 26851 1 66 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.584 -0.059 17919 26852 1 66 . 1 1 25 25 ASN C C 25 178.380 178.380 177.822 0.558 17919 26853 1 66 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.853 0.207 17919 26854 1 66 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.130 0.320 17919 26855 1 66 . 1 1 25 25 ASN H H 25 7.920 7.920 7.895 0.025 17919 26856 1 66 . 1 1 26 26 VAL N N 26 121.710 121.710 120.299 1.411 17919 26857 1 66 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.546 -0.149 17919 26858 1 66 . 1 1 26 26 VAL C C 26 177.950 177.950 177.877 0.073 17919 26859 1 66 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.954 0.706 17919 26860 1 66 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.325 -0.485 17919 26861 1 66 . 1 1 26 26 VAL H H 26 8.070 8.070 8.131 -0.061 17919 26862 1 66 . 1 1 27 27 LYS N N 27 118.860 118.860 119.363 -0.503 17919 26863 1 66 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.232 0.348 17919 26864 1 66 . 1 1 27 27 LYS C C 27 180.550 180.550 178.673 1.877 17919 26865 1 66 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.330 -0.080 17919 26866 1 66 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.266 1.464 17919 26867 1 66 . 1 1 27 27 LYS H H 27 8.560 8.560 8.144 0.416 17919 26868 1 66 . 1 1 28 28 ALA N N 28 123.440 123.440 121.382 2.058 17919 26869 1 66 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.151 0.009 17919 26870 1 66 . 1 1 28 28 ALA C C 28 180.300 180.300 179.199 1.101 17919 26871 1 66 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.628 0.742 17919 26872 1 66 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.392 -0.683 17919 26873 1 66 . 1 1 28 28 ALA H H 28 8.060 8.060 8.242 -0.182 17919 26874 1 66 . 1 1 29 29 LYS N N 29 119.940 119.940 119.616 0.324 17919 26875 1 66 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.113 0.094 17919 26876 1 66 . 1 1 29 29 LYS C C 29 180.320 180.320 178.734 1.586 17919 26877 1 66 . 1 1 29 29 LYS CA C 29 59.650 59.650 58.987 0.663 17919 26878 1 66 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.466 0.824 17919 26879 1 66 . 1 1 29 29 LYS H H 29 7.850 7.850 7.491 0.359 17919 26880 1 66 . 1 1 30 30 ILE N N 30 121.080 121.080 120.728 0.352 17919 26881 1 66 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.695 -0.188 17919 26882 1 66 . 1 1 30 30 ILE C C 30 178.310 178.310 177.103 1.207 17919 26883 1 66 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.998 0.152 17919 26884 1 66 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.939 -1.139 17919 26885 1 66 . 1 1 30 30 ILE H H 30 8.280 8.280 8.122 0.158 17919 26886 1 66 . 1 1 31 31 GLN N N 31 123.490 123.490 119.406 4.084 17919 26887 1 66 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.053 -0.224 17919 26888 1 66 . 1 1 31 31 GLN C C 31 178.890 178.890 177.911 0.979 17919 26889 1 66 . 1 1 31 31 GLN CA C 31 60.000 60.000 58.555 1.445 17919 26890 1 66 . 1 1 31 31 GLN CB C 31 27.720 27.720 27.604 0.116 17919 26891 1 66 . 1 1 31 31 GLN H H 31 8.580 8.580 8.478 0.102 17919 26892 1 66 . 1 1 32 32 ASP N N 32 119.360 119.360 120.666 -1.306 17919 26893 1 66 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.347 0.007 17919 26894 1 66 . 1 1 32 32 ASP C C 32 177.250 177.250 178.072 -0.822 17919 26895 1 66 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.924 0.266 17919 26896 1 66 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.824 -0.244 17919 26897 1 66 . 1 1 32 32 ASP H H 32 8.010 8.010 7.821 0.189 17919 26898 1 66 . 1 1 33 33 LYS N N 33 115.130 115.130 115.878 -0.748 17919 26899 1 66 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.379 -0.042 17919 26900 1 66 . 1 1 33 33 LYS C C 33 177.870 177.870 177.863 0.007 17919 26901 1 66 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.643 0.407 17919 26902 1 66 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.873 0.297 17919 26903 1 66 . 1 1 33 33 LYS H H 33 7.430 7.430 7.542 -0.112 17919 26904 1 66 . 1 1 34 34 GLU N N 34 113.870 113.870 116.132 -2.262 17919 26905 1 66 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.434 0.191 17919 26906 1 66 . 1 1 34 34 GLU C C 34 177.840 177.840 177.638 0.202 17919 26907 1 66 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.115 -0.945 17919 26908 1 66 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.414 1.246 17919 26909 1 66 . 1 1 34 34 GLU H H 34 8.740 8.740 8.075 0.665 17919 26910 1 66 . 1 1 35 35 GLY N N 35 108.650 108.650 109.763 -1.113 17919 26911 1 66 . 1 1 35 35 GLY C C 35 173.960 173.960 174.441 -0.481 17919 26912 1 66 . 1 1 35 35 GLY CA C 35 46.080 46.080 46.254 -0.174 17919 26913 1 66 . 1 1 35 35 GLY H H 35 8.530 8.530 8.313 0.217 17919 26914 1 66 . 1 1 36 36 ILE N N 36 119.880 119.880 122.420 -2.540 17919 26915 1 66 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.223 0.222 17919 26916 1 66 . 1 1 36 36 ILE C C 36 173.590 173.590 174.528 -0.938 17919 26917 1 66 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.227 -0.477 17919 26918 1 66 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.094 2.486 17919 26919 1 66 . 1 1 36 36 ILE H H 36 6.150 6.150 7.627 -1.477 17919 26920 1 66 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.741 -0.107 17919 26921 1 66 . 1 1 37 37 PRO C C 37 176.940 176.940 176.149 0.791 17919 26922 1 66 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.279 0.381 17919 26923 1 66 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.414 0.436 17919 26924 1 66 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.114 0.003 17919 26925 1 66 . 1 1 38 38 PRO C C 38 178.320 178.320 178.721 -0.401 17919 26926 1 66 . 1 1 38 38 PRO CA C 38 66.260 66.260 66.059 0.201 17919 26927 1 66 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.804 1.086 17919 26928 1 66 . 1 1 39 39 ASP N N 39 113.380 113.380 116.209 -2.829 17919 26929 1 66 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.293 0.137 17919 26930 1 66 . 1 1 39 39 ASP C C 39 177.090 177.090 177.844 -0.754 17919 26931 1 66 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.927 -1.287 17919 26932 1 66 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.409 -0.869 17919 26933 1 66 . 1 1 39 39 ASP H H 39 8.550 8.550 8.533 0.017 17919 26934 1 66 . 1 1 40 40 GLN N N 40 116.780 116.780 116.125 0.655 17919 26935 1 66 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.387 0.077 17919 26936 1 66 . 1 1 40 40 GLN C C 40 175.380 175.380 175.809 -0.429 17919 26937 1 66 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.578 0.062 17919 26938 1 66 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.619 0.521 17919 26939 1 66 . 1 1 40 40 GLN H H 40 7.820 7.820 8.080 -0.260 17919 26940 1 66 . 1 1 41 41 GLN N N 41 117.720 117.720 119.340 -1.620 17919 26941 1 66 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.397 -0.153 17919 26942 1 66 . 1 1 41 41 GLN C C 41 176.300 176.300 174.911 1.389 17919 26943 1 66 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.110 0.360 17919 26944 1 66 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.597 2.053 17919 26945 1 66 . 1 1 41 41 GLN H H 41 7.480 7.480 7.358 0.122 17919 26946 1 66 . 1 1 42 42 ARG N N 42 122.680 122.680 124.590 -1.910 17919 26947 1 66 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.537 -0.037 17919 26948 1 66 . 1 1 42 42 ARG C C 42 174.050 174.050 174.055 -0.005 17919 26949 1 66 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.898 0.152 17919 26950 1 66 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.669 -0.919 17919 26951 1 66 . 1 1 42 42 ARG H H 42 8.530 8.530 8.347 0.183 17919 26952 1 66 . 1 1 43 43 LEU N N 43 124.040 124.040 126.767 -2.727 17919 26953 1 66 . 1 1 43 43 LEU C C 43 175.290 175.290 175.057 0.233 17919 26954 1 66 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.719 -0.739 17919 26955 1 66 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.568 1.222 17919 26956 1 66 . 1 1 43 43 LEU H H 43 8.820 8.820 8.733 0.087 17919 26957 1 66 . 1 1 44 44 ILE N N 44 121.920 121.920 119.176 2.744 17919 26958 1 66 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.108 -0.116 17919 26959 1 66 . 1 1 44 44 ILE C C 44 176.060 176.060 173.655 2.405 17919 26960 1 66 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.739 -0.759 17919 26961 1 66 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.007 0.413 17919 26962 1 66 . 1 1 44 44 ILE H H 44 9.030 9.030 8.719 0.311 17919 26963 1 66 . 1 1 45 45 PHE N N 45 125.390 125.390 128.556 -3.166 17919 26964 1 66 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.020 0.025 17919 26965 1 66 . 1 1 45 45 PHE C C 45 174.470 174.470 175.327 -0.857 17919 26966 1 66 . 1 1 45 45 PHE CA C 45 57.020 57.020 55.924 1.096 17919 26967 1 66 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.675 1.085 17919 26968 1 66 . 1 1 45 45 PHE H H 45 8.830 8.830 9.012 -0.182 17919 26969 1 66 . 1 1 46 46 ALA N N 46 132.200 132.200 130.600 1.600 17919 26970 1 66 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.855 -0.165 17919 26971 1 66 . 1 1 46 46 ALA C C 46 177.290 177.290 177.338 -0.048 17919 26972 1 66 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.001 0.539 17919 26973 1 66 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.471 0.099 17919 26974 1 66 . 1 1 46 46 ALA H H 46 8.810 8.810 8.952 -0.142 17919 26975 1 66 . 1 1 47 47 GLY N N 47 102.340 102.340 105.157 -2.817 17919 26976 1 66 . 1 1 47 47 GLY C C 47 173.810 173.810 174.114 -0.304 17919 26977 1 66 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.779 -0.429 17919 26978 1 66 . 1 1 47 47 GLY H H 47 8.130 8.130 8.466 -0.336 17919 26979 1 66 . 1 1 48 48 LYS N N 48 121.570 121.570 120.089 1.481 17919 26980 1 66 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.524 0.098 17919 26981 1 66 . 1 1 48 48 LYS C C 48 174.700 174.700 174.613 0.087 17919 26982 1 66 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.262 -0.712 17919 26983 1 66 . 1 1 48 48 LYS CB C 48 34.530 34.530 36.246 -1.716 17919 26984 1 66 . 1 1 48 48 LYS H H 48 7.980 7.980 7.852 0.128 17919 26985 1 66 . 1 1 49 49 GLN N N 49 122.410 122.410 121.982 0.428 17919 26986 1 66 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.282 0.278 17919 26987 1 66 . 1 1 49 49 GLN C C 49 175.670 175.670 175.344 0.326 17919 26988 1 66 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.040 -0.300 17919 26989 1 66 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.269 -0.269 17919 26990 1 66 . 1 1 49 49 GLN H H 49 8.600 8.600 8.514 0.086 17919 26991 1 66 . 1 1 50 50 LEU N N 50 125.520 125.520 128.567 -3.047 17919 26992 1 66 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.150 -0.060 17919 26993 1 66 . 1 1 50 50 LEU C C 50 176.660 176.660 176.422 0.238 17919 26994 1 66 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.844 0.396 17919 26995 1 66 . 1 1 50 50 LEU CB C 50 41.570 41.570 43.088 -1.518 17919 26996 1 66 . 1 1 50 50 LEU H H 50 8.530 8.530 8.113 0.417 17919 26997 1 66 . 1 1 51 51 GLU N N 51 122.940 122.940 122.812 0.128 17919 26998 1 66 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.603 -0.115 17919 26999 1 66 . 1 1 51 51 GLU C C 51 175.870 175.870 176.691 -0.821 17919 27000 1 66 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.128 0.832 17919 27001 1 66 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.695 -0.125 17919 27002 1 66 . 1 1 51 51 GLU H H 51 8.400 8.400 8.594 -0.194 17919 27003 1 66 . 1 1 52 52 ASP N N 52 120.030 120.030 122.626 -2.596 17919 27004 1 66 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.569 -0.210 17919 27005 1 66 . 1 1 52 52 ASP C C 52 177.330 177.330 177.661 -0.331 17919 27006 1 66 . 1 1 52 52 ASP CA C 52 56.960 56.960 56.712 0.248 17919 27007 1 66 . 1 1 52 52 ASP CB C 52 40.850 40.850 41.105 -0.255 17919 27008 1 66 . 1 1 52 52 ASP H H 52 8.160 8.160 8.846 -0.686 17919 27009 1 66 . 1 1 53 53 GLY N N 53 106.660 106.660 108.284 -1.624 17919 27010 1 66 . 1 1 53 53 GLY C C 53 174.870 174.870 174.092 0.778 17919 27011 1 66 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.761 0.409 17919 27012 1 66 . 1 1 53 53 GLY H H 53 9.390 9.390 8.307 1.083 17919 27013 1 66 . 1 1 54 54 ARG N N 54 119.050 119.050 119.364 -0.314 17919 27014 1 66 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.633 0.062 17919 27015 1 66 . 1 1 54 54 ARG C C 54 175.350 175.350 175.465 -0.115 17919 27016 1 66 . 1 1 54 54 ARG CA C 54 54.390 54.390 53.340 1.050 17919 27017 1 66 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.525 0.126 17919 27018 1 66 . 1 1 54 54 ARG H H 54 7.460 7.460 7.539 -0.079 17919 27019 1 66 . 1 1 55 55 THR N N 55 108.400 108.400 111.500 -3.100 17919 27020 1 66 . 1 1 55 55 THR HA H 55 5.240 5.240 5.085 0.155 17919 27021 1 66 . 1 1 55 55 THR C C 55 176.560 176.560 176.051 0.509 17919 27022 1 66 . 1 1 55 55 THR CA C 55 59.690 59.690 59.735 -0.045 17919 27023 1 66 . 1 1 55 55 THR CB C 55 72.260 72.260 71.914 0.346 17919 27024 1 66 . 1 1 55 55 THR H H 55 8.730 8.730 8.956 -0.226 17919 27025 1 66 . 1 1 56 56 LEU N N 56 117.920 117.920 121.623 -3.703 17919 27026 1 66 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.868 0.192 17919 27027 1 66 . 1 1 56 56 LEU C C 56 180.810 180.810 178.705 2.105 17919 27028 1 66 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.748 -0.038 17919 27029 1 66 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.348 -0.978 17919 27030 1 66 . 1 1 56 56 LEU H H 56 8.140 8.140 8.354 -0.214 17919 27031 1 66 . 1 1 57 57 SER N N 57 113.330 113.330 113.900 -0.570 17919 27032 1 66 . 1 1 57 57 SER HA H 57 4.370 4.370 4.031 0.339 17919 27033 1 66 . 1 1 57 57 SER C C 57 178.310 178.310 176.977 1.333 17919 27034 1 66 . 1 1 57 57 SER CA C 57 61.080 61.080 61.415 -0.335 17919 27035 1 66 . 1 1 57 57 SER CB C 57 62.530 62.530 62.727 -0.197 17919 27036 1 66 . 1 1 57 57 SER H H 57 8.470 8.470 7.785 0.685 17919 27037 1 66 . 1 1 58 58 ASP N N 58 124.190 124.190 122.265 1.925 17919 27038 1 66 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.365 -0.069 17919 27039 1 66 . 1 1 58 58 ASP C C 58 177.400 177.400 177.669 -0.269 17919 27040 1 66 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.768 0.412 17919 27041 1 66 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.717 -0.617 17919 27042 1 66 . 1 1 58 58 ASP H H 58 7.930 7.930 7.630 0.300 17919 27043 1 66 . 1 1 59 59 TYR N N 59 115.510 115.510 116.195 -0.685 17919 27044 1 66 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.662 0.008 17919 27045 1 66 . 1 1 59 59 TYR C C 59 174.700 174.700 175.135 -0.435 17919 27046 1 66 . 1 1 59 59 TYR CA C 59 58.250 58.250 56.830 1.420 17919 27047 1 66 . 1 1 59 59 TYR CB C 59 40.070 40.070 37.336 2.734 17919 27048 1 66 . 1 1 59 59 TYR H H 59 7.250 7.250 7.323 -0.073 17919 27049 1 66 . 1 1 60 60 ASN N N 60 115.900 115.900 116.502 -0.602 17919 27050 1 66 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.358 -0.003 17919 27051 1 66 . 1 1 60 60 ASN C C 60 174.340 174.340 174.422 -0.082 17919 27052 1 66 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.593 -0.472 17919 27053 1 66 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.802 -0.392 17919 27054 1 66 . 1 1 60 60 ASN H H 60 8.150 8.150 7.894 0.256 17919 27055 1 66 . 1 1 61 61 ILE N N 61 118.600 118.600 120.485 -1.885 17919 27056 1 66 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.965 -0.572 17919 27057 1 66 . 1 1 61 61 ILE C C 61 174.610 174.610 175.120 -0.510 17919 27058 1 66 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.640 0.780 17919 27059 1 66 . 1 1 61 61 ILE CB C 61 36.740 36.740 36.227 0.513 17919 27060 1 66 . 1 1 61 61 ILE H H 61 7.250 7.250 8.393 -1.143 17919 27061 1 66 . 1 1 62 62 GLN N N 62 124.740 124.740 126.526 -1.786 17919 27062 1 66 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.613 -0.107 17919 27063 1 66 . 1 1 62 62 GLN C C 62 175.970 175.970 176.194 -0.224 17919 27064 1 66 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.937 -0.277 17919 27065 1 66 . 1 1 62 62 GLN CB C 62 31.650 31.650 30.293 1.357 17919 27066 1 66 . 1 1 62 62 GLN H H 62 7.610 7.610 7.814 -0.204 17919 27067 1 66 . 1 1 63 63 LYS N N 63 120.300 120.300 119.448 0.852 17919 27068 1 66 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.879 0.122 17919 27069 1 66 . 1 1 63 63 LYS C C 63 175.810 175.810 176.605 -0.795 17919 27070 1 66 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.698 0.092 17919 27071 1 66 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.855 0.795 17919 27072 1 66 . 1 1 63 63 LYS H H 63 8.490 8.490 8.466 0.024 17919 27073 1 66 . 1 1 64 64 GLU N N 64 113.950 113.950 118.311 -4.361 17919 27074 1 66 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.754 -0.289 17919 27075 1 66 . 1 1 64 64 GLU C C 64 175.250 175.250 175.712 -0.462 17919 27076 1 66 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.742 0.148 17919 27077 1 66 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.008 -2.108 17919 27078 1 66 . 1 1 64 64 GLU H H 64 9.280 9.280 8.511 0.769 17919 27079 1 66 . 1 1 65 65 SER N N 65 114.730 114.730 113.489 1.241 17919 27080 1 66 . 1 1 65 65 SER HA H 65 4.640 4.640 4.619 0.021 17919 27081 1 66 . 1 1 65 65 SER C C 65 172.160 172.160 173.525 -1.365 17919 27082 1 66 . 1 1 65 65 SER CA C 65 60.890 60.890 58.738 2.152 17919 27083 1 66 . 1 1 65 65 SER CB C 65 64.910 64.910 64.492 0.419 17919 27084 1 66 . 1 1 65 65 SER H H 65 7.670 7.670 7.419 0.251 17919 27085 1 66 . 1 1 66 66 THR N N 66 117.110 117.110 117.934 -0.824 17919 27086 1 66 . 1 1 66 66 THR HA H 66 5.270 5.270 5.083 0.187 17919 27087 1 66 . 1 1 66 66 THR C C 66 173.950 173.950 173.850 0.100 17919 27088 1 66 . 1 1 66 66 THR CA C 66 62.340 62.340 61.979 0.361 17919 27089 1 66 . 1 1 66 66 THR CB C 66 70.080 70.080 69.868 0.212 17919 27090 1 66 . 1 1 66 66 THR H H 66 8.730 8.730 8.266 0.464 17919 27091 1 66 . 1 1 67 67 LEU N N 67 127.110 127.110 124.334 2.776 17919 27092 1 66 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.682 0.378 17919 27093 1 66 . 1 1 67 67 LEU C C 67 175.770 175.770 174.950 0.820 17919 27094 1 66 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.511 0.389 17919 27095 1 66 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.956 -0.696 17919 27096 1 66 . 1 1 67 67 LEU H H 67 9.410 9.410 8.942 0.468 17919 27097 1 66 . 1 1 68 68 HIS N N 68 118.380 118.380 121.660 -3.280 17919 27098 1 66 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.239 0.001 17919 27099 1 66 . 1 1 68 68 HIS C C 68 173.150 173.150 173.601 -0.451 17919 27100 1 66 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.059 0.941 17919 27101 1 66 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.667 -2.137 17919 27102 1 66 . 1 1 68 68 HIS H H 68 9.230 9.230 8.364 0.866 17919 27103 1 66 . 1 1 69 69 LEU N N 69 124.460 124.460 130.790 -6.330 17919 27104 1 66 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.075 0.115 17919 27105 1 66 . 1 1 69 69 LEU C C 69 175.270 175.270 174.163 1.107 17919 27106 1 66 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.907 -0.017 17919 27107 1 66 . 1 1 69 69 LEU CB C 69 44.380 44.380 43.051 1.329 17919 27108 1 66 . 1 1 69 69 LEU H H 69 8.340 8.340 7.626 0.714 17919 27109 1 66 . 1 1 70 70 VAL N N 70 126.940 126.940 125.926 1.014 17919 27110 1 66 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.289 0.061 17919 27111 1 66 . 1 1 70 70 VAL C C 70 174.000 174.000 174.662 -0.662 17919 27112 1 66 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.143 0.657 17919 27113 1 66 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.026 -0.116 17919 27114 1 66 . 1 1 70 70 VAL H H 70 9.200 9.200 8.173 1.027 17919 27115 1 66 . 1 1 71 71 LEU N N 71 123.130 123.130 122.162 0.968 17919 27116 1 66 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.010 0.050 17919 27117 1 66 . 1 1 71 71 LEU C C 71 177.830 177.830 177.426 0.404 17919 27118 1 66 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.077 0.863 17919 27119 1 66 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.106 -0.256 17919 27120 1 66 . 1 1 71 71 LEU H H 71 8.120 8.120 8.280 -0.160 17919 27121 1 66 . 1 1 72 72 ARG N N 72 123.490 123.490 124.718 -1.228 17919 27122 1 66 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.439 -0.138 17919 27123 1 66 . 1 1 72 72 ARG C C 72 175.350 175.350 174.890 0.460 17919 27124 1 66 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.235 -0.625 17919 27125 1 66 . 1 1 72 72 ARG CB C 72 31.350 31.350 31.266 0.084 17919 27126 1 66 . 1 1 72 72 ARG H H 72 8.580 8.580 8.241 0.339 17919 27127 1 67 . 1 1 2 2 GLN N N 2 123.220 123.220 122.364 0.856 17919 27128 1 67 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.404 -0.155 17919 27129 1 67 . 1 1 2 2 GLN C C 2 175.920 175.920 174.920 1.000 17919 27130 1 67 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.718 0.362 17919 27131 1 67 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.448 0.312 17919 27132 1 67 . 1 1 2 2 GLN H H 2 8.900 8.900 8.487 0.413 17919 27133 1 67 . 1 1 3 3 ILE N N 3 115.340 115.340 116.052 -0.712 17919 27134 1 67 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.145 0.068 17919 27135 1 67 . 1 1 3 3 ILE C C 3 172.450 172.450 173.397 -0.947 17919 27136 1 67 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.269 0.301 17919 27137 1 67 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.615 0.595 17919 27138 1 67 . 1 1 3 3 ILE H H 3 8.320 8.320 8.602 -0.282 17919 27139 1 67 . 1 1 4 4 PHE N N 4 118.110 118.110 121.048 -2.938 17919 27140 1 67 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.168 0.462 17919 27141 1 67 . 1 1 4 4 PHE C C 4 175.320 175.320 175.241 0.079 17919 27142 1 67 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.175 0.035 17919 27143 1 67 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.480 -0.000 17919 27144 1 67 . 1 1 4 4 PHE H H 4 8.610 8.610 8.909 -0.299 17919 27145 1 67 . 1 1 5 5 VAL N N 5 121.000 121.000 122.106 -1.106 17919 27146 1 67 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.625 0.100 17919 27147 1 67 . 1 1 5 5 VAL C C 5 174.870 174.870 174.837 0.033 17919 27148 1 67 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.360 -0.740 17919 27149 1 67 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.673 0.557 17919 27150 1 67 . 1 1 5 5 VAL H H 5 9.300 9.300 8.547 0.753 17919 27151 1 67 . 1 1 6 6 LYS N N 6 127.520 127.520 129.790 -2.270 17919 27152 1 67 . 1 1 6 6 LYS HA H 6 5.367 5.367 4.744 0.623 17919 27153 1 67 . 1 1 6 6 LYS C C 6 177.140 177.140 176.278 0.862 17919 27154 1 67 . 1 1 6 6 LYS CA C 6 54.520 54.520 55.492 -0.973 17919 27155 1 67 . 1 1 6 6 LYS CB C 6 35.050 35.050 33.706 1.344 17919 27156 1 67 . 1 1 6 6 LYS H H 6 8.820 8.820 8.273 0.547 17919 27157 1 67 . 1 1 7 7 THR N N 7 115.400 115.400 117.723 -2.323 17919 27158 1 67 . 1 1 7 7 THR HA H 7 4.970 4.970 4.614 0.356 17919 27159 1 67 . 1 1 7 7 THR C C 7 176.910 176.910 176.606 0.304 17919 27160 1 67 . 1 1 7 7 THR CA C 7 60.470 60.470 59.802 0.668 17919 27161 1 67 . 1 1 7 7 THR CB C 7 70.630 70.630 70.923 -0.293 17919 27162 1 67 . 1 1 7 7 THR H H 7 8.730 8.730 8.336 0.394 17919 27163 1 67 . 1 1 8 8 LEU N N 8 121.330 121.330 119.828 1.502 17919 27164 1 67 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.135 0.175 17919 27165 1 67 . 1 1 8 8 LEU C C 8 178.800 178.800 178.307 0.493 17919 27166 1 67 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.441 0.139 17919 27167 1 67 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.766 0.204 17919 27168 1 67 . 1 1 8 8 LEU H H 8 9.100 9.100 8.695 0.405 17919 27169 1 67 . 1 1 9 9 THR N N 9 105.590 105.590 106.495 -0.905 17919 27170 1 67 . 1 1 9 9 THR HA H 9 4.428 4.428 4.188 0.240 17919 27171 1 67 . 1 1 9 9 THR C C 9 175.520 175.520 175.794 -0.274 17919 27172 1 67 . 1 1 9 9 THR CA C 9 61.400 61.400 62.536 -1.137 17919 27173 1 67 . 1 1 9 9 THR CB C 9 69.140 69.140 69.081 0.059 17919 27174 1 67 . 1 1 9 9 THR H H 9 7.630 7.630 7.828 -0.198 17919 27175 1 67 . 1 1 10 10 GLY N N 10 108.890 108.890 110.836 -1.946 17919 27176 1 67 . 1 1 10 10 GLY C C 10 174.070 174.070 174.684 -0.614 17919 27177 1 67 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.046 0.414 17919 27178 1 67 . 1 1 10 10 GLY H H 10 7.810 7.810 8.054 -0.244 17919 27179 1 67 . 1 1 11 11 LYS N N 11 121.600 121.600 122.138 -0.538 17919 27180 1 67 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.382 -0.021 17919 27181 1 67 . 1 1 11 11 LYS C C 11 175.940 175.940 175.743 0.197 17919 27182 1 67 . 1 1 11 11 LYS CA C 11 56.280 56.280 55.981 0.299 17919 27183 1 67 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.315 -0.115 17919 27184 1 67 . 1 1 11 11 LYS H H 11 7.280 7.280 7.558 -0.278 17919 27185 1 67 . 1 1 12 12 THR N N 12 120.440 120.440 116.897 3.543 17919 27186 1 67 . 1 1 12 12 THR HA H 12 5.046 5.046 4.985 0.061 17919 27187 1 67 . 1 1 12 12 THR C C 12 174.320 174.320 174.111 0.209 17919 27188 1 67 . 1 1 12 12 THR CA C 12 62.390 62.390 61.519 0.871 17919 27189 1 67 . 1 1 12 12 THR CB C 12 69.910 69.910 70.472 -0.562 17919 27190 1 67 . 1 1 12 12 THR H H 12 8.650 8.650 8.298 0.352 17919 27191 1 67 . 1 1 13 13 ILE N N 13 127.110 127.110 126.910 0.200 17919 27192 1 67 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.568 -0.024 17919 27193 1 67 . 1 1 13 13 ILE C C 13 175.220 175.220 175.370 -0.150 17919 27194 1 67 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.321 -0.341 17919 27195 1 67 . 1 1 13 13 ILE CB C 13 40.950 40.950 39.843 1.107 17919 27196 1 67 . 1 1 13 13 ILE H H 13 9.450 9.450 8.362 1.088 17919 27197 1 67 . 1 1 14 14 THR N N 14 121.520 121.520 123.639 -2.119 17919 27198 1 67 . 1 1 14 14 THR HA H 14 4.964 4.964 4.503 0.461 17919 27199 1 67 . 1 1 14 14 THR C C 14 173.790 173.790 174.091 -0.301 17919 27200 1 67 . 1 1 14 14 THR CA C 14 61.940 61.940 63.611 -1.671 17919 27201 1 67 . 1 1 14 14 THR CB C 14 69.650 69.650 69.432 0.218 17919 27202 1 67 . 1 1 14 14 THR H H 14 8.710 8.710 8.308 0.402 17919 27203 1 67 . 1 1 15 15 LEU N N 15 124.800 124.800 128.605 -3.805 17919 27204 1 67 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.639 0.141 17919 27205 1 67 . 1 1 15 15 LEU C C 15 174.670 174.670 175.401 -0.731 17919 27206 1 67 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.852 -1.022 17919 27207 1 67 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.410 1.660 17919 27208 1 67 . 1 1 15 15 LEU H H 15 8.710 8.710 8.898 -0.188 17919 27209 1 67 . 1 1 16 16 GLU N N 16 122.160 122.160 123.590 -1.430 17919 27210 1 67 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.514 0.403 17919 27211 1 67 . 1 1 16 16 GLU C C 16 175.860 175.860 175.849 0.011 17919 27212 1 67 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.904 -1.085 17919 27213 1 67 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.049 -0.599 17919 27214 1 67 . 1 1 16 16 GLU H H 16 8.140 8.140 8.719 -0.579 17919 27215 1 67 . 1 1 17 17 VAL N N 17 117.210 117.210 120.470 -3.260 17919 27216 1 67 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.534 0.180 17919 27217 1 67 . 1 1 17 17 VAL C C 17 174.160 174.160 174.800 -0.640 17919 27218 1 67 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.208 -0.778 17919 27219 1 67 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.306 1.093 17919 27220 1 67 . 1 1 17 17 VAL H H 17 8.900 8.900 8.674 0.226 17919 27221 1 67 . 1 1 18 18 GLU N N 18 118.990 118.990 120.560 -1.570 17919 27222 1 67 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.735 0.344 17919 27223 1 67 . 1 1 18 18 GLU C C 18 176.160 176.160 175.036 1.124 17919 27224 1 67 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.899 -1.179 17919 27225 1 67 . 1 1 18 18 GLU CB C 18 30.310 30.310 31.281 -0.971 17919 27226 1 67 . 1 1 18 18 GLU H H 18 8.640 8.640 8.561 0.079 17919 27227 1 67 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.351 -0.210 17919 27228 1 67 . 1 1 19 19 PRO C C 19 175.310 175.310 177.326 -2.016 17919 27229 1 67 . 1 1 19 19 PRO CA C 19 65.470 65.470 64.989 0.481 17919 27230 1 67 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.888 0.062 17919 27231 1 67 . 1 1 20 20 SER N N 20 103.400 103.400 109.634 -6.234 17919 27232 1 67 . 1 1 20 20 SER HA H 20 4.370 4.370 4.377 -0.007 17919 27233 1 67 . 1 1 20 20 SER C C 20 174.660 174.660 174.523 0.137 17919 27234 1 67 . 1 1 20 20 SER CA C 20 57.400 57.400 58.360 -0.960 17919 27235 1 67 . 1 1 20 20 SER CB C 20 63.370 63.370 62.788 0.582 17919 27236 1 67 . 1 1 20 20 SER H H 20 7.040 7.040 7.971 -0.931 17919 27237 1 67 . 1 1 21 21 ASP N N 21 123.480 123.480 124.025 -0.545 17919 27238 1 67 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.671 0.024 17919 27239 1 67 . 1 1 21 21 ASP C C 21 176.360 176.360 176.216 0.144 17919 27240 1 67 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.285 0.415 17919 27241 1 67 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.826 -1.026 17919 27242 1 67 . 1 1 21 21 ASP H H 21 8.030 8.030 7.629 0.401 17919 27243 1 67 . 1 1 22 22 THR N N 22 108.800 108.800 114.630 -5.830 17919 27244 1 67 . 1 1 22 22 THR HA H 22 4.920 4.920 4.771 0.149 17919 27245 1 67 . 1 1 22 22 THR C C 22 176.750 176.750 176.363 0.387 17919 27246 1 67 . 1 1 22 22 THR CA C 22 59.690 59.690 60.946 -1.256 17919 27247 1 67 . 1 1 22 22 THR CB C 22 71.200 71.200 70.171 1.028 17919 27248 1 67 . 1 1 22 22 THR H H 22 7.900 7.900 7.894 0.006 17919 27249 1 67 . 1 1 23 23 ILE N N 23 121.190 121.190 121.733 -0.543 17919 27250 1 67 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.670 -0.013 17919 27251 1 67 . 1 1 23 23 ILE C C 23 179.040 179.040 177.675 1.365 17919 27252 1 67 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.000 -0.740 17919 27253 1 67 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.026 -1.676 17919 27254 1 67 . 1 1 23 23 ILE H H 23 8.560 8.560 8.745 -0.185 17919 27255 1 67 . 1 1 24 24 GLU N N 24 120.830 120.830 120.149 0.681 17919 27256 1 67 . 1 1 24 24 GLU HA H 24 3.917 3.917 4.016 -0.099 17919 27257 1 67 . 1 1 24 24 GLU C C 24 178.640 178.640 178.413 0.227 17919 27258 1 67 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.815 0.406 17919 27259 1 67 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.357 -1.077 17919 27260 1 67 . 1 1 24 24 GLU H H 24 9.760 9.760 8.168 1.592 17919 27261 1 67 . 1 1 25 25 ASN N N 25 120.570 120.570 118.646 1.924 17919 27262 1 67 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.550 -0.025 17919 27263 1 67 . 1 1 25 25 ASN C C 25 178.380 178.380 177.894 0.486 17919 27264 1 67 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.898 0.163 17919 27265 1 67 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.548 -0.098 17919 27266 1 67 . 1 1 25 25 ASN H H 25 7.920 7.920 7.577 0.343 17919 27267 1 67 . 1 1 26 26 VAL N N 26 121.710 121.710 120.520 1.190 17919 27268 1 67 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.491 -0.094 17919 27269 1 67 . 1 1 26 26 VAL C C 26 177.950 177.950 177.502 0.448 17919 27270 1 67 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.325 1.335 17919 27271 1 67 . 1 1 26 26 VAL CB C 26 30.840 30.840 30.388 0.452 17919 27272 1 67 . 1 1 26 26 VAL H H 26 8.070 8.070 8.366 -0.296 17919 27273 1 67 . 1 1 27 27 LYS N N 27 118.860 118.860 120.005 -1.145 17919 27274 1 67 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.056 0.524 17919 27275 1 67 . 1 1 27 27 LYS C C 27 180.550 180.550 179.243 1.307 17919 27276 1 67 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.640 -0.390 17919 27277 1 67 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.080 1.650 17919 27278 1 67 . 1 1 27 27 LYS H H 27 8.560 8.560 8.082 0.478 17919 27279 1 67 . 1 1 28 28 ALA N N 28 123.440 123.440 121.498 1.942 17919 27280 1 67 . 1 1 28 28 ALA HA H 28 4.160 4.160 3.998 0.162 17919 27281 1 67 . 1 1 28 28 ALA C C 28 180.300 180.300 179.128 1.172 17919 27282 1 67 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.190 0.180 17919 27283 1 67 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.473 -0.763 17919 27284 1 67 . 1 1 28 28 ALA H H 28 8.060 8.060 8.354 -0.294 17919 27285 1 67 . 1 1 29 29 LYS N N 29 119.940 119.940 119.374 0.566 17919 27286 1 67 . 1 1 29 29 LYS HA H 29 4.207 4.207 3.924 0.283 17919 27287 1 67 . 1 1 29 29 LYS C C 29 180.320 180.320 179.241 1.079 17919 27288 1 67 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.342 0.308 17919 27289 1 67 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.220 1.070 17919 27290 1 67 . 1 1 29 29 LYS H H 29 7.850 7.850 7.351 0.499 17919 27291 1 67 . 1 1 30 30 ILE N N 30 121.080 121.080 119.784 1.296 17919 27292 1 67 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.613 -0.106 17919 27293 1 67 . 1 1 30 30 ILE C C 30 178.310 178.310 177.336 0.974 17919 27294 1 67 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.351 0.799 17919 27295 1 67 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.360 -0.560 17919 27296 1 67 . 1 1 30 30 ILE H H 30 8.280 8.280 8.342 -0.062 17919 27297 1 67 . 1 1 31 31 GLN N N 31 123.490 123.490 118.330 5.160 17919 27298 1 67 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.960 -0.131 17919 27299 1 67 . 1 1 31 31 GLN C C 31 178.890 178.890 177.334 1.556 17919 27300 1 67 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.031 0.969 17919 27301 1 67 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.421 -0.701 17919 27302 1 67 . 1 1 31 31 GLN H H 31 8.580 8.580 7.945 0.635 17919 27303 1 67 . 1 1 32 32 ASP N N 32 119.360 119.360 118.359 1.001 17919 27304 1 67 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.488 -0.134 17919 27305 1 67 . 1 1 32 32 ASP C C 32 177.250 177.250 177.218 0.032 17919 27306 1 67 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.316 0.874 17919 27307 1 67 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.663 -0.082 17919 27308 1 67 . 1 1 32 32 ASP H H 32 8.010 8.010 7.650 0.360 17919 27309 1 67 . 1 1 33 33 LYS N N 33 115.130 115.130 119.519 -4.389 17919 27310 1 67 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.256 0.081 17919 27311 1 67 . 1 1 33 33 LYS C C 33 177.870 177.870 178.099 -0.229 17919 27312 1 67 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.703 0.347 17919 27313 1 67 . 1 1 33 33 LYS CB C 33 34.170 34.170 32.822 1.348 17919 27314 1 67 . 1 1 33 33 LYS H H 33 7.430 7.430 7.441 -0.011 17919 27315 1 67 . 1 1 34 34 GLU N N 34 113.870 113.870 115.093 -1.223 17919 27316 1 67 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.506 0.119 17919 27317 1 67 . 1 1 34 34 GLU C C 34 177.840 177.840 177.157 0.683 17919 27318 1 67 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.108 -0.938 17919 27319 1 67 . 1 1 34 34 GLU CB C 34 32.660 32.660 30.822 1.838 17919 27320 1 67 . 1 1 34 34 GLU H H 34 8.740 8.740 8.032 0.708 17919 27321 1 67 . 1 1 35 35 GLY N N 35 108.650 108.650 109.229 -0.579 17919 27322 1 67 . 1 1 35 35 GLY C C 35 173.960 173.960 174.234 -0.274 17919 27323 1 67 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.860 0.220 17919 27324 1 67 . 1 1 35 35 GLY H H 35 8.530 8.530 7.800 0.730 17919 27325 1 67 . 1 1 36 36 ILE N N 36 119.880 119.880 121.991 -2.111 17919 27326 1 67 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.293 0.152 17919 27327 1 67 . 1 1 36 36 ILE C C 36 173.590 173.590 174.000 -0.410 17919 27328 1 67 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.151 -0.401 17919 27329 1 67 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.833 1.747 17919 27330 1 67 . 1 1 36 36 ILE H H 36 6.150 6.150 7.807 -1.657 17919 27331 1 67 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.667 -0.033 17919 27332 1 67 . 1 1 37 37 PRO C C 37 176.940 176.940 176.150 0.790 17919 27333 1 67 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.686 -0.026 17919 27334 1 67 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.380 0.470 17919 27335 1 67 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.063 0.054 17919 27336 1 67 . 1 1 38 38 PRO C C 38 178.320 178.320 178.364 -0.044 17919 27337 1 67 . 1 1 38 38 PRO CA C 38 66.260 66.260 66.339 -0.079 17919 27338 1 67 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.845 1.045 17919 27339 1 67 . 1 1 39 39 ASP N N 39 113.380 113.380 114.472 -1.092 17919 27340 1 67 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.325 0.105 17919 27341 1 67 . 1 1 39 39 ASP C C 39 177.090 177.090 177.366 -0.276 17919 27342 1 67 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.489 -0.849 17919 27343 1 67 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.288 -0.748 17919 27344 1 67 . 1 1 39 39 ASP H H 39 8.550 8.550 8.761 -0.211 17919 27345 1 67 . 1 1 40 40 GLN N N 40 116.780 116.780 115.628 1.152 17919 27346 1 67 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.445 0.019 17919 27347 1 67 . 1 1 40 40 GLN C C 40 175.380 175.380 175.669 -0.289 17919 27348 1 67 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.388 0.252 17919 27349 1 67 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.931 0.209 17919 27350 1 67 . 1 1 40 40 GLN H H 40 7.820 7.820 8.083 -0.263 17919 27351 1 67 . 1 1 41 41 GLN N N 41 117.720 117.720 119.858 -2.138 17919 27352 1 67 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.256 -0.012 17919 27353 1 67 . 1 1 41 41 GLN C C 41 176.300 176.300 174.841 1.459 17919 27354 1 67 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.370 0.100 17919 27355 1 67 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.320 2.330 17919 27356 1 67 . 1 1 41 41 GLN H H 41 7.480 7.480 7.512 -0.032 17919 27357 1 67 . 1 1 42 42 ARG N N 42 122.680 122.680 122.962 -0.282 17919 27358 1 67 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.607 -0.107 17919 27359 1 67 . 1 1 42 42 ARG C C 42 174.050 174.050 174.399 -0.349 17919 27360 1 67 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.905 0.145 17919 27361 1 67 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.046 -1.296 17919 27362 1 67 . 1 1 42 42 ARG H H 42 8.530 8.530 8.102 0.428 17919 27363 1 67 . 1 1 43 43 LEU N N 43 124.040 124.040 123.721 0.319 17919 27364 1 67 . 1 1 43 43 LEU C C 43 175.290 175.290 175.301 -0.011 17919 27365 1 67 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.325 -0.345 17919 27366 1 67 . 1 1 43 43 LEU CB C 43 45.790 45.790 45.182 0.608 17919 27367 1 67 . 1 1 43 43 LEU H H 43 8.820 8.820 8.650 0.170 17919 27368 1 67 . 1 1 44 44 ILE N N 44 121.920 121.920 121.324 0.596 17919 27369 1 67 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.562 0.430 17919 27370 1 67 . 1 1 44 44 ILE C C 44 176.060 176.060 174.481 1.579 17919 27371 1 67 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.000 -1.020 17919 27372 1 67 . 1 1 44 44 ILE CB C 44 41.420 41.420 40.147 1.273 17919 27373 1 67 . 1 1 44 44 ILE H H 44 9.030 9.030 8.210 0.820 17919 27374 1 67 . 1 1 45 45 PHE N N 45 125.390 125.390 128.274 -2.884 17919 27375 1 67 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.970 0.075 17919 27376 1 67 . 1 1 45 45 PHE C C 45 174.470 174.470 174.509 -0.039 17919 27377 1 67 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.364 0.656 17919 27378 1 67 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.580 1.180 17919 27379 1 67 . 1 1 45 45 PHE H H 45 8.830 8.830 8.624 0.206 17919 27380 1 67 . 1 1 46 46 ALA N N 46 132.200 132.200 129.848 2.352 17919 27381 1 67 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.691 -0.001 17919 27382 1 67 . 1 1 46 46 ALA C C 46 177.290 177.290 177.684 -0.394 17919 27383 1 67 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.547 -0.007 17919 27384 1 67 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.623 -0.053 17919 27385 1 67 . 1 1 46 46 ALA H H 46 8.810 8.810 8.865 -0.055 17919 27386 1 67 . 1 1 47 47 GLY N N 47 102.340 102.340 103.954 -1.614 17919 27387 1 67 . 1 1 47 47 GLY C C 47 173.810 173.810 174.349 -0.539 17919 27388 1 67 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.069 0.281 17919 27389 1 67 . 1 1 47 47 GLY H H 47 8.130 8.130 8.349 -0.219 17919 27390 1 67 . 1 1 48 48 LYS N N 48 121.570 121.570 120.479 1.091 17919 27391 1 67 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.607 0.015 17919 27392 1 67 . 1 1 48 48 LYS C C 48 174.700 174.700 174.952 -0.252 17919 27393 1 67 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.932 -0.382 17919 27394 1 67 . 1 1 48 48 LYS CB C 48 34.530 34.530 35.119 -0.589 17919 27395 1 67 . 1 1 48 48 LYS H H 48 7.980 7.980 7.807 0.173 17919 27396 1 67 . 1 1 49 49 GLN N N 49 122.410 122.410 124.482 -2.072 17919 27397 1 67 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.837 -0.277 17919 27398 1 67 . 1 1 49 49 GLN C C 49 175.670 175.670 175.327 0.343 17919 27399 1 67 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.415 0.325 17919 27400 1 67 . 1 1 49 49 GLN CB C 49 29.000 29.000 30.627 -1.627 17919 27401 1 67 . 1 1 49 49 GLN H H 49 8.600 8.600 8.695 -0.095 17919 27402 1 67 . 1 1 50 50 LEU N N 50 125.520 125.520 126.490 -0.970 17919 27403 1 67 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.126 -0.036 17919 27404 1 67 . 1 1 50 50 LEU C C 50 176.660 176.660 176.433 0.227 17919 27405 1 67 . 1 1 50 50 LEU CA C 50 54.240 54.240 55.231 -0.991 17919 27406 1 67 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.861 -1.291 17919 27407 1 67 . 1 1 50 50 LEU H H 50 8.530 8.530 8.207 0.323 17919 27408 1 67 . 1 1 51 51 GLU N N 51 122.940 122.940 120.460 2.480 17919 27409 1 67 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.527 -0.039 17919 27410 1 67 . 1 1 51 51 GLU C C 51 175.870 175.870 175.583 0.287 17919 27411 1 67 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.423 0.537 17919 27412 1 67 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.661 -1.091 17919 27413 1 67 . 1 1 51 51 GLU H H 51 8.400 8.400 8.244 0.156 17919 27414 1 67 . 1 1 52 52 ASP N N 52 120.030 120.030 124.475 -4.445 17919 27415 1 67 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.588 -0.229 17919 27416 1 67 . 1 1 52 52 ASP C C 52 177.330 177.330 177.079 0.251 17919 27417 1 67 . 1 1 52 52 ASP CA C 52 56.960 56.960 55.888 1.072 17919 27418 1 67 . 1 1 52 52 ASP CB C 52 40.850 40.850 41.066 -0.216 17919 27419 1 67 . 1 1 52 52 ASP H H 52 8.160 8.160 8.901 -0.741 17919 27420 1 67 . 1 1 53 53 GLY N N 53 106.660 106.660 105.926 0.734 17919 27421 1 67 . 1 1 53 53 GLY C C 53 174.870 174.870 174.315 0.555 17919 27422 1 67 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.442 0.728 17919 27423 1 67 . 1 1 53 53 GLY H H 53 9.390 9.390 8.216 1.174 17919 27424 1 67 . 1 1 54 54 ARG N N 54 119.050 119.050 121.398 -2.348 17919 27425 1 67 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.296 0.399 17919 27426 1 67 . 1 1 54 54 ARG C C 54 175.350 175.350 175.246 0.104 17919 27427 1 67 . 1 1 54 54 ARG CA C 54 54.390 54.390 56.558 -2.168 17919 27428 1 67 . 1 1 54 54 ARG CB C 54 32.650 32.650 31.040 1.611 17919 27429 1 67 . 1 1 54 54 ARG H H 54 7.460 7.460 7.901 -0.441 17919 27430 1 67 . 1 1 55 55 THR N N 55 108.400 108.400 109.414 -1.014 17919 27431 1 67 . 1 1 55 55 THR HA H 55 5.240 5.240 4.997 0.243 17919 27432 1 67 . 1 1 55 55 THR C C 55 176.560 176.560 176.050 0.510 17919 27433 1 67 . 1 1 55 55 THR CA C 55 59.690 59.690 59.465 0.225 17919 27434 1 67 . 1 1 55 55 THR CB C 55 72.260 72.260 72.218 0.042 17919 27435 1 67 . 1 1 55 55 THR H H 55 8.730 8.730 8.364 0.366 17919 27436 1 67 . 1 1 56 56 LEU N N 56 117.920 117.920 120.520 -2.600 17919 27437 1 67 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.978 0.082 17919 27438 1 67 . 1 1 56 56 LEU C C 56 180.810 180.810 178.803 2.007 17919 27439 1 67 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.388 0.322 17919 27440 1 67 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.338 -0.968 17919 27441 1 67 . 1 1 56 56 LEU H H 56 8.140 8.140 8.237 -0.097 17919 27442 1 67 . 1 1 57 57 SER N N 57 113.330 113.330 115.055 -1.725 17919 27443 1 67 . 1 1 57 57 SER HA H 57 4.370 4.370 4.270 0.100 17919 27444 1 67 . 1 1 57 57 SER C C 57 178.310 178.310 176.744 1.566 17919 27445 1 67 . 1 1 57 57 SER CA C 57 61.080 61.080 61.849 -0.769 17919 27446 1 67 . 1 1 57 57 SER CB C 57 62.530 62.530 62.721 -0.191 17919 27447 1 67 . 1 1 57 57 SER H H 57 8.470 8.470 8.076 0.394 17919 27448 1 67 . 1 1 58 58 ASP N N 58 124.190 124.190 123.632 0.558 17919 27449 1 67 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.463 -0.167 17919 27450 1 67 . 1 1 58 58 ASP C C 58 177.400 177.400 177.597 -0.197 17919 27451 1 67 . 1 1 58 58 ASP CA C 58 57.180 57.180 57.098 0.082 17919 27452 1 67 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.611 -0.511 17919 27453 1 67 . 1 1 58 58 ASP H H 58 7.930 7.930 7.807 0.123 17919 27454 1 67 . 1 1 59 59 TYR N N 59 115.510 115.510 115.257 0.253 17919 27455 1 67 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.530 0.140 17919 27456 1 67 . 1 1 59 59 TYR C C 59 174.700 174.700 175.924 -1.224 17919 27457 1 67 . 1 1 59 59 TYR CA C 59 58.250 58.250 58.276 -0.027 17919 27458 1 67 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.388 1.682 17919 27459 1 67 . 1 1 59 59 TYR H H 59 7.250 7.250 7.506 -0.256 17919 27460 1 67 . 1 1 60 60 ASN N N 60 115.900 115.900 118.192 -2.292 17919 27461 1 67 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.391 -0.036 17919 27462 1 67 . 1 1 60 60 ASN C C 60 174.340 174.340 174.726 -0.386 17919 27463 1 67 . 1 1 60 60 ASN CA C 60 54.120 54.120 53.888 0.232 17919 27464 1 67 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.577 -0.167 17919 27465 1 67 . 1 1 60 60 ASN H H 60 8.150 8.150 7.756 0.394 17919 27466 1 67 . 1 1 61 61 ILE N N 61 118.600 118.600 120.501 -1.901 17919 27467 1 67 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.750 -0.357 17919 27468 1 67 . 1 1 61 61 ILE C C 61 174.610 174.610 175.385 -0.775 17919 27469 1 67 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.201 0.219 17919 27470 1 67 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.425 -0.685 17919 27471 1 67 . 1 1 61 61 ILE H H 61 7.250 7.250 8.354 -1.104 17919 27472 1 67 . 1 1 62 62 GLN N N 62 124.740 124.740 126.570 -1.830 17919 27473 1 67 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.653 -0.147 17919 27474 1 67 . 1 1 62 62 GLN C C 62 175.970 175.970 175.281 0.689 17919 27475 1 67 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.867 -0.207 17919 27476 1 67 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.063 0.587 17919 27477 1 67 . 1 1 62 62 GLN H H 62 7.610 7.610 8.233 -0.623 17919 27478 1 67 . 1 1 63 63 LYS N N 63 120.300 120.300 121.613 -1.313 17919 27479 1 67 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.754 0.247 17919 27480 1 67 . 1 1 63 63 LYS C C 63 175.810 175.810 176.498 -0.688 17919 27481 1 67 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.915 -0.125 17919 27482 1 67 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.584 1.066 17919 27483 1 67 . 1 1 63 63 LYS H H 63 8.490 8.490 8.621 -0.131 17919 27484 1 67 . 1 1 64 64 GLU N N 64 113.950 113.950 117.735 -3.785 17919 27485 1 67 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.287 0.178 17919 27486 1 67 . 1 1 64 64 GLU C C 64 175.250 175.250 175.598 -0.348 17919 27487 1 67 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.110 0.780 17919 27488 1 67 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.087 -2.187 17919 27489 1 67 . 1 1 64 64 GLU H H 64 9.280 9.280 8.730 0.550 17919 27490 1 67 . 1 1 65 65 SER N N 65 114.730 114.730 114.714 0.016 17919 27491 1 67 . 1 1 65 65 SER HA H 65 4.640 4.640 4.327 0.313 17919 27492 1 67 . 1 1 65 65 SER C C 65 172.160 172.160 174.104 -1.944 17919 27493 1 67 . 1 1 65 65 SER CA C 65 60.890 60.890 60.409 0.481 17919 27494 1 67 . 1 1 65 65 SER CB C 65 64.910 64.910 63.830 1.080 17919 27495 1 67 . 1 1 65 65 SER H H 65 7.670 7.670 7.414 0.256 17919 27496 1 67 . 1 1 66 66 THR N N 66 117.110 117.110 119.705 -2.595 17919 27497 1 67 . 1 1 66 66 THR HA H 66 5.270 5.270 4.810 0.460 17919 27498 1 67 . 1 1 66 66 THR C C 66 173.950 173.950 173.873 0.077 17919 27499 1 67 . 1 1 66 66 THR CA C 66 62.340 62.340 62.343 -0.003 17919 27500 1 67 . 1 1 66 66 THR CB C 66 70.080 70.080 70.222 -0.142 17919 27501 1 67 . 1 1 66 66 THR H H 66 8.730 8.730 8.492 0.238 17919 27502 1 67 . 1 1 67 67 LEU N N 67 127.110 127.110 125.618 1.492 17919 27503 1 67 . 1 1 67 67 LEU HA H 67 5.060 5.060 5.102 -0.042 17919 27504 1 67 . 1 1 67 67 LEU C C 67 175.770 175.770 175.292 0.478 17919 27505 1 67 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.730 0.170 17919 27506 1 67 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.772 -0.512 17919 27507 1 67 . 1 1 67 67 LEU H H 67 9.410 9.410 8.478 0.932 17919 27508 1 67 . 1 1 68 68 HIS N N 68 118.380 118.380 120.968 -2.588 17919 27509 1 67 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.144 0.096 17919 27510 1 67 . 1 1 68 68 HIS C C 68 173.150 173.150 174.919 -1.769 17919 27511 1 67 . 1 1 68 68 HIS CA C 68 55.000 55.000 53.643 1.357 17919 27512 1 67 . 1 1 68 68 HIS CB C 68 30.530 30.530 30.020 0.510 17919 27513 1 67 . 1 1 68 68 HIS H H 68 9.230 9.230 8.293 0.937 17919 27514 1 67 . 1 1 69 69 LEU N N 69 124.460 124.460 125.591 -1.131 17919 27515 1 67 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.223 0.967 17919 27516 1 67 . 1 1 69 69 LEU C C 69 175.270 175.270 175.469 -0.199 17919 27517 1 67 . 1 1 69 69 LEU CA C 69 53.890 53.890 56.020 -2.130 17919 27518 1 67 . 1 1 69 69 LEU CB C 69 44.380 44.380 42.233 2.147 17919 27519 1 67 . 1 1 69 69 LEU H H 69 8.340 8.340 8.249 0.091 17919 27520 1 67 . 1 1 70 70 VAL N N 70 126.940 126.940 127.395 -0.455 17919 27521 1 67 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.244 0.106 17919 27522 1 67 . 1 1 70 70 VAL C C 70 174.000 174.000 174.929 -0.929 17919 27523 1 67 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.376 1.424 17919 27524 1 67 . 1 1 70 70 VAL CB C 70 34.910 34.910 34.591 0.319 17919 27525 1 67 . 1 1 70 70 VAL H H 70 9.200 9.200 8.518 0.682 17919 27526 1 67 . 1 1 71 71 LEU N N 71 123.130 123.130 125.124 -1.994 17919 27527 1 67 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.198 0.862 17919 27528 1 67 . 1 1 71 71 LEU C C 71 177.830 177.830 176.721 1.109 17919 27529 1 67 . 1 1 71 71 LEU CA C 71 53.940 53.940 55.482 -1.542 17919 27530 1 67 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.084 -0.234 17919 27531 1 67 . 1 1 71 71 LEU H H 71 8.120 8.120 8.610 -0.490 17919 27532 1 67 . 1 1 72 72 ARG N N 72 123.490 123.490 122.853 0.637 17919 27533 1 67 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.298 0.003 17919 27534 1 67 . 1 1 72 72 ARG C C 72 175.350 175.350 175.195 0.155 17919 27535 1 67 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.533 -0.923 17919 27536 1 67 . 1 1 72 72 ARG CB C 72 31.350 31.350 31.121 0.229 17919 27537 1 67 . 1 1 72 72 ARG H H 72 8.580 8.580 8.067 0.513 17919 27538 1 68 . 1 1 2 2 GLN N N 2 123.220 123.220 121.725 1.495 17919 27539 1 68 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.166 0.083 17919 27540 1 68 . 1 1 2 2 GLN C C 2 175.920 175.920 175.099 0.821 17919 27541 1 68 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.758 0.322 17919 27542 1 68 . 1 1 2 2 GLN CB C 2 30.760 30.760 31.154 -0.394 17919 27543 1 68 . 1 1 2 2 GLN H H 2 8.900 8.900 8.724 0.176 17919 27544 1 68 . 1 1 3 3 ILE N N 3 115.340 115.340 118.311 -2.971 17919 27545 1 68 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.367 -0.154 17919 27546 1 68 . 1 1 3 3 ILE C C 3 172.450 172.450 173.957 -1.507 17919 27547 1 68 . 1 1 3 3 ILE CA C 3 59.570 59.570 58.993 0.577 17919 27548 1 68 . 1 1 3 3 ILE CB C 3 42.210 42.210 40.913 1.297 17919 27549 1 68 . 1 1 3 3 ILE H H 3 8.320 8.320 8.147 0.173 17919 27550 1 68 . 1 1 4 4 PHE N N 4 118.110 118.110 119.037 -0.927 17919 27551 1 68 . 1 1 4 4 PHE HA H 4 5.630 5.630 4.949 0.681 17919 27552 1 68 . 1 1 4 4 PHE C C 4 175.320 175.320 174.866 0.454 17919 27553 1 68 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.791 -0.581 17919 27554 1 68 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.976 -0.496 17919 27555 1 68 . 1 1 4 4 PHE H H 4 8.610 8.610 8.040 0.570 17919 27556 1 68 . 1 1 5 5 VAL N N 5 121.000 121.000 121.438 -0.438 17919 27557 1 68 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.785 -0.060 17919 27558 1 68 . 1 1 5 5 VAL C C 5 174.870 174.870 174.783 0.087 17919 27559 1 68 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.351 -0.731 17919 27560 1 68 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.601 0.629 17919 27561 1 68 . 1 1 5 5 VAL H H 5 9.300 9.300 8.734 0.566 17919 27562 1 68 . 1 1 6 6 LYS N N 6 127.520 127.520 127.931 -0.411 17919 27563 1 68 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.529 -0.162 17919 27564 1 68 . 1 1 6 6 LYS C C 6 177.140 177.140 176.772 0.368 17919 27565 1 68 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.169 0.351 17919 27566 1 68 . 1 1 6 6 LYS CB C 6 35.050 35.050 36.121 -1.071 17919 27567 1 68 . 1 1 6 6 LYS H H 6 8.820 8.820 8.944 -0.124 17919 27568 1 68 . 1 1 7 7 THR N N 7 115.400 115.400 117.718 -2.318 17919 27569 1 68 . 1 1 7 7 THR HA H 7 4.970 4.970 4.278 0.692 17919 27570 1 68 . 1 1 7 7 THR C C 7 176.910 176.910 176.534 0.376 17919 27571 1 68 . 1 1 7 7 THR CA C 7 60.470 60.470 61.513 -1.042 17919 27572 1 68 . 1 1 7 7 THR CB C 7 70.630 70.630 69.713 0.917 17919 27573 1 68 . 1 1 7 7 THR H H 7 8.730 8.730 8.942 -0.212 17919 27574 1 68 . 1 1 8 8 LEU N N 8 121.330 121.330 117.630 3.700 17919 27575 1 68 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.317 -0.007 17919 27576 1 68 . 1 1 8 8 LEU C C 8 178.800 178.800 177.661 1.139 17919 27577 1 68 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.738 -0.158 17919 27578 1 68 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.173 0.797 17919 27579 1 68 . 1 1 8 8 LEU H H 8 9.100 9.100 8.024 1.076 17919 27580 1 68 . 1 1 9 9 THR N N 9 105.590 105.590 107.468 -1.878 17919 27581 1 68 . 1 1 9 9 THR HA H 9 4.428 4.428 4.304 0.124 17919 27582 1 68 . 1 1 9 9 THR C C 9 175.520 175.520 175.594 -0.074 17919 27583 1 68 . 1 1 9 9 THR CA C 9 61.400 61.400 61.947 -0.547 17919 27584 1 68 . 1 1 9 9 THR CB C 9 69.140 69.140 68.743 0.397 17919 27585 1 68 . 1 1 9 9 THR H H 9 7.630 7.630 7.772 -0.142 17919 27586 1 68 . 1 1 10 10 GLY N N 10 108.890 108.890 110.100 -1.210 17919 27587 1 68 . 1 1 10 10 GLY C C 10 174.070 174.070 174.041 0.029 17919 27588 1 68 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.156 0.304 17919 27589 1 68 . 1 1 10 10 GLY H H 10 7.810 7.810 7.851 -0.041 17919 27590 1 68 . 1 1 11 11 LYS N N 11 121.600 121.600 120.669 0.931 17919 27591 1 68 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.502 -0.141 17919 27592 1 68 . 1 1 11 11 LYS C C 11 175.940 175.940 175.520 0.420 17919 27593 1 68 . 1 1 11 11 LYS CA C 11 56.280 56.280 55.394 0.886 17919 27594 1 68 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.358 -0.158 17919 27595 1 68 . 1 1 11 11 LYS H H 11 7.280 7.280 7.997 -0.717 17919 27596 1 68 . 1 1 12 12 THR N N 12 120.440 120.440 115.889 4.551 17919 27597 1 68 . 1 1 12 12 THR HA H 12 5.046 5.046 5.112 -0.066 17919 27598 1 68 . 1 1 12 12 THR C C 12 174.320 174.320 174.316 0.004 17919 27599 1 68 . 1 1 12 12 THR CA C 12 62.390 62.390 61.992 0.398 17919 27600 1 68 . 1 1 12 12 THR CB C 12 69.910 69.910 70.498 -0.588 17919 27601 1 68 . 1 1 12 12 THR H H 12 8.650 8.650 8.261 0.389 17919 27602 1 68 . 1 1 13 13 ILE N N 13 127.110 127.110 128.541 -1.431 17919 27603 1 68 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.406 0.138 17919 27604 1 68 . 1 1 13 13 ILE C C 13 175.220 175.220 174.922 0.298 17919 27605 1 68 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.651 -0.671 17919 27606 1 68 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.142 0.808 17919 27607 1 68 . 1 1 13 13 ILE H H 13 9.450 9.450 9.309 0.141 17919 27608 1 68 . 1 1 14 14 THR N N 14 121.520 121.520 123.454 -1.934 17919 27609 1 68 . 1 1 14 14 THR HA H 14 4.964 4.964 4.798 0.166 17919 27610 1 68 . 1 1 14 14 THR C C 14 173.790 173.790 173.824 -0.034 17919 27611 1 68 . 1 1 14 14 THR CA C 14 61.940 61.940 62.595 -0.655 17919 27612 1 68 . 1 1 14 14 THR CB C 14 69.650 69.650 69.747 -0.097 17919 27613 1 68 . 1 1 14 14 THR H H 14 8.710 8.710 8.495 0.215 17919 27614 1 68 . 1 1 15 15 LEU N N 15 124.800 124.800 128.064 -3.264 17919 27615 1 68 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.655 0.125 17919 27616 1 68 . 1 1 15 15 LEU C C 15 174.670 174.670 174.556 0.114 17919 27617 1 68 . 1 1 15 15 LEU CA C 15 52.830 52.830 54.447 -1.617 17919 27618 1 68 . 1 1 15 15 LEU CB C 15 47.070 47.070 46.157 0.913 17919 27619 1 68 . 1 1 15 15 LEU H H 15 8.710 8.710 8.427 0.283 17919 27620 1 68 . 1 1 16 16 GLU N N 16 122.160 122.160 123.728 -1.568 17919 27621 1 68 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.645 0.272 17919 27622 1 68 . 1 1 16 16 GLU C C 16 175.860 175.860 175.678 0.182 17919 27623 1 68 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.162 -0.342 17919 27624 1 68 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.608 -1.158 17919 27625 1 68 . 1 1 16 16 GLU H H 16 8.140 8.140 8.634 -0.494 17919 27626 1 68 . 1 1 17 17 VAL N N 17 117.210 117.210 121.376 -4.166 17919 27627 1 68 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.826 -0.112 17919 27628 1 68 . 1 1 17 17 VAL C C 17 174.160 174.160 174.993 -0.833 17919 27629 1 68 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.566 -0.135 17919 27630 1 68 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.500 0.900 17919 27631 1 68 . 1 1 17 17 VAL H H 17 8.900 8.900 8.438 0.462 17919 27632 1 68 . 1 1 18 18 GLU N N 18 118.990 118.990 120.367 -1.377 17919 27633 1 68 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.894 0.185 17919 27634 1 68 . 1 1 18 18 GLU C C 18 176.160 176.160 175.842 0.318 17919 27635 1 68 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.590 0.130 17919 27636 1 68 . 1 1 18 18 GLU CB C 18 30.310 30.310 31.496 -1.186 17919 27637 1 68 . 1 1 18 18 GLU H H 18 8.640 8.640 8.823 -0.183 17919 27638 1 68 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.191 -0.050 17919 27639 1 68 . 1 1 19 19 PRO C C 19 175.310 175.310 178.115 -2.805 17919 27640 1 68 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.336 0.134 17919 27641 1 68 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.946 0.004 17919 27642 1 68 . 1 1 20 20 SER N N 20 103.400 103.400 111.971 -8.571 17919 27643 1 68 . 1 1 20 20 SER HA H 20 4.370 4.370 4.243 0.127 17919 27644 1 68 . 1 1 20 20 SER C C 20 174.660 174.660 174.523 0.137 17919 27645 1 68 . 1 1 20 20 SER CA C 20 57.400 57.400 59.249 -1.849 17919 27646 1 68 . 1 1 20 20 SER CB C 20 63.370 63.370 62.882 0.488 17919 27647 1 68 . 1 1 20 20 SER H H 20 7.040 7.040 8.230 -1.190 17919 27648 1 68 . 1 1 21 21 ASP N N 21 123.480 123.480 122.110 1.370 17919 27649 1 68 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.779 -0.084 17919 27650 1 68 . 1 1 21 21 ASP C C 21 176.360 176.360 175.799 0.561 17919 27651 1 68 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.370 1.330 17919 27652 1 68 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.691 -0.891 17919 27653 1 68 . 1 1 21 21 ASP H H 21 8.030 8.030 7.679 0.351 17919 27654 1 68 . 1 1 22 22 THR N N 22 108.800 108.800 112.756 -3.956 17919 27655 1 68 . 1 1 22 22 THR HA H 22 4.920 4.920 4.511 0.409 17919 27656 1 68 . 1 1 22 22 THR C C 22 176.750 176.750 175.848 0.902 17919 27657 1 68 . 1 1 22 22 THR CA C 22 59.690 59.690 62.267 -2.577 17919 27658 1 68 . 1 1 22 22 THR CB C 22 71.200 71.200 69.993 1.208 17919 27659 1 68 . 1 1 22 22 THR H H 22 7.900 7.900 8.375 -0.475 17919 27660 1 68 . 1 1 23 23 ILE N N 23 121.190 121.190 122.772 -1.582 17919 27661 1 68 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.846 -0.189 17919 27662 1 68 . 1 1 23 23 ILE C C 23 179.040 179.040 177.909 1.131 17919 27663 1 68 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.933 -0.673 17919 27664 1 68 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.433 -2.083 17919 27665 1 68 . 1 1 23 23 ILE H H 23 8.560 8.560 8.934 -0.374 17919 27666 1 68 . 1 1 24 24 GLU N N 24 120.830 120.830 120.108 0.722 17919 27667 1 68 . 1 1 24 24 GLU HA H 24 3.917 3.917 4.039 -0.122 17919 27668 1 68 . 1 1 24 24 GLU C C 24 178.640 178.640 178.168 0.472 17919 27669 1 68 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.237 0.983 17919 27670 1 68 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.271 -0.991 17919 27671 1 68 . 1 1 24 24 GLU H H 24 9.760 9.760 8.008 1.752 17919 27672 1 68 . 1 1 25 25 ASN N N 25 120.570 120.570 118.376 2.194 17919 27673 1 68 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.618 -0.093 17919 27674 1 68 . 1 1 25 25 ASN C C 25 178.380 178.380 177.779 0.601 17919 27675 1 68 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.605 0.455 17919 27676 1 68 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.005 0.445 17919 27677 1 68 . 1 1 25 25 ASN H H 25 7.920 7.920 7.766 0.154 17919 27678 1 68 . 1 1 26 26 VAL N N 26 121.710 121.710 119.632 2.078 17919 27679 1 68 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.587 -0.190 17919 27680 1 68 . 1 1 26 26 VAL C C 26 177.950 177.950 177.842 0.108 17919 27681 1 68 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.213 1.447 17919 27682 1 68 . 1 1 26 26 VAL CB C 26 30.840 30.840 30.367 0.473 17919 27683 1 68 . 1 1 26 26 VAL H H 26 8.070 8.070 7.950 0.120 17919 27684 1 68 . 1 1 27 27 LYS N N 27 118.860 118.860 120.150 -1.290 17919 27685 1 68 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.155 0.425 17919 27686 1 68 . 1 1 27 27 LYS C C 27 180.550 180.550 179.202 1.348 17919 27687 1 68 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.592 -0.342 17919 27688 1 68 . 1 1 27 27 LYS CB C 27 33.730 33.730 31.976 1.754 17919 27689 1 68 . 1 1 27 27 LYS H H 27 8.560 8.560 7.948 0.612 17919 27690 1 68 . 1 1 28 28 ALA N N 28 123.440 123.440 120.642 2.798 17919 27691 1 68 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.083 0.077 17919 27692 1 68 . 1 1 28 28 ALA C C 28 180.300 180.300 178.892 1.408 17919 27693 1 68 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.102 0.268 17919 27694 1 68 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.489 -0.779 17919 27695 1 68 . 1 1 28 28 ALA H H 28 8.060 8.060 8.617 -0.557 17919 27696 1 68 . 1 1 29 29 LYS N N 29 119.940 119.940 119.955 -0.015 17919 27697 1 68 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.048 0.159 17919 27698 1 68 . 1 1 29 29 LYS C C 29 180.320 180.320 179.132 1.188 17919 27699 1 68 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.196 0.455 17919 27700 1 68 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.327 0.963 17919 27701 1 68 . 1 1 29 29 LYS H H 29 7.850 7.850 7.517 0.333 17919 27702 1 68 . 1 1 30 30 ILE N N 30 121.080 121.080 121.374 -0.294 17919 27703 1 68 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.567 -0.060 17919 27704 1 68 . 1 1 30 30 ILE C C 30 178.310 178.310 177.445 0.865 17919 27705 1 68 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.411 0.739 17919 27706 1 68 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.680 -0.880 17919 27707 1 68 . 1 1 30 30 ILE H H 30 8.280 8.280 8.416 -0.136 17919 27708 1 68 . 1 1 31 31 GLN N N 31 123.490 123.490 120.197 3.293 17919 27709 1 68 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.018 -0.189 17919 27710 1 68 . 1 1 31 31 GLN C C 31 178.890 178.890 178.118 0.772 17919 27711 1 68 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.083 0.917 17919 27712 1 68 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.495 -0.775 17919 27713 1 68 . 1 1 31 31 GLN H H 31 8.580 8.580 8.089 0.491 17919 27714 1 68 . 1 1 32 32 ASP N N 32 119.360 119.360 118.554 0.806 17919 27715 1 68 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.427 -0.073 17919 27716 1 68 . 1 1 32 32 ASP C C 32 177.250 177.250 178.139 -0.889 17919 27717 1 68 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.581 0.609 17919 27718 1 68 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.962 -0.382 17919 27719 1 68 . 1 1 32 32 ASP H H 32 8.010 8.010 7.972 0.038 17919 27720 1 68 . 1 1 33 33 LYS N N 33 115.130 115.130 118.894 -3.764 17919 27721 1 68 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.196 0.141 17919 27722 1 68 . 1 1 33 33 LYS C C 33 177.870 177.870 177.974 -0.104 17919 27723 1 68 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.909 0.141 17919 27724 1 68 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.196 0.974 17919 27725 1 68 . 1 1 33 33 LYS H H 33 7.430 7.430 7.599 -0.169 17919 27726 1 68 . 1 1 34 34 GLU N N 34 113.870 113.870 114.111 -0.241 17919 27727 1 68 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.484 0.141 17919 27728 1 68 . 1 1 34 34 GLU C C 34 177.840 177.840 176.500 1.340 17919 27729 1 68 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.308 -1.138 17919 27730 1 68 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.748 0.912 17919 27731 1 68 . 1 1 34 34 GLU H H 34 8.740 8.740 8.158 0.582 17919 27732 1 68 . 1 1 35 35 GLY N N 35 108.650 108.650 109.348 -0.698 17919 27733 1 68 . 1 1 35 35 GLY C C 35 173.960 173.960 174.346 -0.386 17919 27734 1 68 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.928 0.152 17919 27735 1 68 . 1 1 35 35 GLY H H 35 8.530 8.530 8.023 0.507 17919 27736 1 68 . 1 1 36 36 ILE N N 36 119.880 119.880 121.124 -1.244 17919 27737 1 68 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.314 0.131 17919 27738 1 68 . 1 1 36 36 ILE C C 36 173.590 173.590 174.097 -0.507 17919 27739 1 68 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.983 -0.233 17919 27740 1 68 . 1 1 36 36 ILE CB C 36 40.580 40.580 37.864 2.716 17919 27741 1 68 . 1 1 36 36 ILE H H 36 6.150 6.150 7.633 -1.483 17919 27742 1 68 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.579 0.055 17919 27743 1 68 . 1 1 37 37 PRO C C 37 176.940 176.940 176.372 0.568 17919 27744 1 68 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.861 -0.201 17919 27745 1 68 . 1 1 37 37 PRO CB C 37 31.850 31.850 30.914 0.936 17919 27746 1 68 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.239 -0.122 17919 27747 1 68 . 1 1 38 38 PRO C C 38 178.320 178.320 178.054 0.266 17919 27748 1 68 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.840 0.420 17919 27749 1 68 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.880 1.010 17919 27750 1 68 . 1 1 39 39 ASP N N 39 113.380 113.380 116.269 -2.889 17919 27751 1 68 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.326 0.104 17919 27752 1 68 . 1 1 39 39 ASP C C 39 177.090 177.090 177.994 -0.904 17919 27753 1 68 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.737 -1.097 17919 27754 1 68 . 1 1 39 39 ASP CB C 39 39.540 39.540 39.680 -0.140 17919 27755 1 68 . 1 1 39 39 ASP H H 39 8.550 8.550 8.772 -0.222 17919 27756 1 68 . 1 1 40 40 GLN N N 40 116.780 116.780 118.552 -1.772 17919 27757 1 68 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.717 -0.253 17919 27758 1 68 . 1 1 40 40 GLN C C 40 175.380 175.380 175.868 -0.488 17919 27759 1 68 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.110 -0.470 17919 27760 1 68 . 1 1 40 40 GLN CB C 40 30.140 30.140 31.096 -0.956 17919 27761 1 68 . 1 1 40 40 GLN H H 40 7.820 7.820 7.986 -0.166 17919 27762 1 68 . 1 1 41 41 GLN N N 41 117.720 117.720 118.997 -1.277 17919 27763 1 68 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.273 -0.029 17919 27764 1 68 . 1 1 41 41 GLN C C 41 176.300 176.300 175.406 0.894 17919 27765 1 68 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.767 -0.297 17919 27766 1 68 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.671 1.979 17919 27767 1 68 . 1 1 41 41 GLN H H 41 7.480 7.480 7.346 0.134 17919 27768 1 68 . 1 1 42 42 ARG N N 42 122.680 122.680 122.171 0.509 17919 27769 1 68 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.590 -0.090 17919 27770 1 68 . 1 1 42 42 ARG C C 42 174.050 174.050 174.191 -0.141 17919 27771 1 68 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.809 0.241 17919 27772 1 68 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.910 -2.160 17919 27773 1 68 . 1 1 42 42 ARG H H 42 8.530 8.530 8.115 0.415 17919 27774 1 68 . 1 1 43 43 LEU N N 43 124.040 124.040 122.858 1.182 17919 27775 1 68 . 1 1 43 43 LEU C C 43 175.290 175.290 175.498 -0.208 17919 27776 1 68 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.479 -0.499 17919 27777 1 68 . 1 1 43 43 LEU CB C 43 45.790 45.790 45.135 0.655 17919 27778 1 68 . 1 1 43 43 LEU H H 43 8.820 8.820 8.614 0.206 17919 27779 1 68 . 1 1 44 44 ILE N N 44 121.920 121.920 119.932 1.988 17919 27780 1 68 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.790 0.202 17919 27781 1 68 . 1 1 44 44 ILE C C 44 176.060 176.060 174.657 1.403 17919 27782 1 68 . 1 1 44 44 ILE CA C 44 58.980 58.980 61.047 -2.067 17919 27783 1 68 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.772 -0.352 17919 27784 1 68 . 1 1 44 44 ILE H H 44 9.030 9.030 8.598 0.432 17919 27785 1 68 . 1 1 45 45 PHE N N 45 125.390 125.390 127.566 -2.176 17919 27786 1 68 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.990 0.055 17919 27787 1 68 . 1 1 45 45 PHE C C 45 174.470 174.470 175.178 -0.708 17919 27788 1 68 . 1 1 45 45 PHE CA C 45 57.020 57.020 57.456 -0.436 17919 27789 1 68 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.703 1.057 17919 27790 1 68 . 1 1 45 45 PHE H H 45 8.830 8.830 8.315 0.515 17919 27791 1 68 . 1 1 46 46 ALA N N 46 132.200 132.200 122.499 9.701 17919 27792 1 68 . 1 1 46 46 ALA HA H 46 3.690 3.690 4.502 -0.812 17919 27793 1 68 . 1 1 46 46 ALA C C 46 177.290 177.290 177.136 0.154 17919 27794 1 68 . 1 1 46 46 ALA CA C 46 52.540 52.540 50.456 2.084 17919 27795 1 68 . 1 1 46 46 ALA CB C 46 16.570 16.570 17.278 -0.708 17919 27796 1 68 . 1 1 46 46 ALA H H 46 8.810 8.810 8.232 0.578 17919 27797 1 68 . 1 1 47 47 GLY N N 47 102.340 102.340 106.670 -4.330 17919 27798 1 68 . 1 1 47 47 GLY C C 47 173.810 173.810 173.880 -0.070 17919 27799 1 68 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.953 -0.603 17919 27800 1 68 . 1 1 47 47 GLY H H 47 8.130 8.130 7.867 0.263 17919 27801 1 68 . 1 1 48 48 LYS N N 48 121.570 121.570 119.669 1.901 17919 27802 1 68 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.580 0.042 17919 27803 1 68 . 1 1 48 48 LYS C C 48 174.700 174.700 175.297 -0.597 17919 27804 1 68 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.894 -0.344 17919 27805 1 68 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.737 -0.207 17919 27806 1 68 . 1 1 48 48 LYS H H 48 7.980 7.980 7.822 0.158 17919 27807 1 68 . 1 1 49 49 GLN N N 49 122.410 122.410 122.681 -0.271 17919 27808 1 68 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.467 0.093 17919 27809 1 68 . 1 1 49 49 GLN C C 49 175.670 175.670 175.834 -0.164 17919 27810 1 68 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.286 -0.546 17919 27811 1 68 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.096 -0.096 17919 27812 1 68 . 1 1 49 49 GLN H H 49 8.600 8.600 8.596 0.004 17919 27813 1 68 . 1 1 50 50 LEU N N 50 125.520 125.520 125.477 0.043 17919 27814 1 68 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.128 -0.038 17919 27815 1 68 . 1 1 50 50 LEU C C 50 176.660 176.660 175.841 0.819 17919 27816 1 68 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.696 0.544 17919 27817 1 68 . 1 1 50 50 LEU CB C 50 41.570 41.570 40.847 0.723 17919 27818 1 68 . 1 1 50 50 LEU H H 50 8.530 8.530 8.705 -0.175 17919 27819 1 68 . 1 1 51 51 GLU N N 51 122.940 122.940 123.802 -0.862 17919 27820 1 68 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.497 -0.009 17919 27821 1 68 . 1 1 51 51 GLU C C 51 175.870 175.870 177.061 -1.191 17919 27822 1 68 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.532 0.428 17919 27823 1 68 . 1 1 51 51 GLU CB C 51 31.570 31.570 30.782 0.788 17919 27824 1 68 . 1 1 51 51 GLU H H 51 8.400 8.400 8.252 0.148 17919 27825 1 68 . 1 1 52 52 ASP N N 52 120.030 120.030 122.670 -2.640 17919 27826 1 68 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.545 -0.186 17919 27827 1 68 . 1 1 52 52 ASP C C 52 177.330 177.330 177.451 -0.121 17919 27828 1 68 . 1 1 52 52 ASP CA C 52 56.960 56.960 56.594 0.366 17919 27829 1 68 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.924 -0.074 17919 27830 1 68 . 1 1 52 52 ASP H H 52 8.160 8.160 8.798 -0.638 17919 27831 1 68 . 1 1 53 53 GLY N N 53 106.660 106.660 106.361 0.299 17919 27832 1 68 . 1 1 53 53 GLY C C 53 174.870 174.870 174.718 0.152 17919 27833 1 68 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.781 0.390 17919 27834 1 68 . 1 1 53 53 GLY H H 53 9.390 9.390 8.358 1.032 17919 27835 1 68 . 1 1 54 54 ARG N N 54 119.050 119.050 120.683 -1.633 17919 27836 1 68 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.660 0.035 17919 27837 1 68 . 1 1 54 54 ARG C C 54 175.350 175.350 175.530 -0.180 17919 27838 1 68 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.860 -0.470 17919 27839 1 68 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.608 0.042 17919 27840 1 68 . 1 1 54 54 ARG H H 54 7.460 7.460 7.386 0.074 17919 27841 1 68 . 1 1 55 55 THR N N 55 108.400 108.400 112.716 -4.316 17919 27842 1 68 . 1 1 55 55 THR HA H 55 5.240 5.240 4.655 0.585 17919 27843 1 68 . 1 1 55 55 THR C C 55 176.560 176.560 176.199 0.361 17919 27844 1 68 . 1 1 55 55 THR CA C 55 59.690 59.690 61.201 -1.511 17919 27845 1 68 . 1 1 55 55 THR CB C 55 72.260 72.260 70.073 2.187 17919 27846 1 68 . 1 1 55 55 THR H H 55 8.730 8.730 8.551 0.179 17919 27847 1 68 . 1 1 56 56 LEU N N 56 117.920 117.920 121.365 -3.445 17919 27848 1 68 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.967 0.093 17919 27849 1 68 . 1 1 56 56 LEU C C 56 180.810 180.810 179.011 1.799 17919 27850 1 68 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.733 -0.023 17919 27851 1 68 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.411 -1.041 17919 27852 1 68 . 1 1 56 56 LEU H H 56 8.140 8.140 8.080 0.060 17919 27853 1 68 . 1 1 57 57 SER N N 57 113.330 113.330 113.990 -0.660 17919 27854 1 68 . 1 1 57 57 SER HA H 57 4.370 4.370 4.114 0.256 17919 27855 1 68 . 1 1 57 57 SER C C 57 178.310 178.310 176.765 1.545 17919 27856 1 68 . 1 1 57 57 SER CA C 57 61.080 61.080 61.796 -0.716 17919 27857 1 68 . 1 1 57 57 SER CB C 57 62.530 62.530 62.586 -0.056 17919 27858 1 68 . 1 1 57 57 SER H H 57 8.470 8.470 7.959 0.511 17919 27859 1 68 . 1 1 58 58 ASP N N 58 124.190 124.190 120.626 3.564 17919 27860 1 68 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.391 -0.095 17919 27861 1 68 . 1 1 58 58 ASP C C 58 177.400 177.400 176.780 0.620 17919 27862 1 68 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.062 1.118 17919 27863 1 68 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.424 -0.324 17919 27864 1 68 . 1 1 58 58 ASP H H 58 7.930 7.930 7.642 0.288 17919 27865 1 68 . 1 1 59 59 TYR N N 59 115.510 115.510 116.223 -0.713 17919 27866 1 68 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.576 0.094 17919 27867 1 68 . 1 1 59 59 TYR C C 59 174.700 174.700 175.188 -0.488 17919 27868 1 68 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.769 0.481 17919 27869 1 68 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.516 1.554 17919 27870 1 68 . 1 1 59 59 TYR H H 59 7.250 7.250 7.273 -0.023 17919 27871 1 68 . 1 1 60 60 ASN N N 60 115.900 115.900 114.534 1.366 17919 27872 1 68 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.357 -0.002 17919 27873 1 68 . 1 1 60 60 ASN C C 60 174.340 174.340 174.467 -0.127 17919 27874 1 68 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.143 -0.023 17919 27875 1 68 . 1 1 60 60 ASN CB C 60 37.410 37.410 36.671 0.739 17919 27876 1 68 . 1 1 60 60 ASN H H 60 8.150 8.150 7.850 0.300 17919 27877 1 68 . 1 1 61 61 ILE N N 61 118.600 118.600 120.163 -1.563 17919 27878 1 68 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.901 -0.508 17919 27879 1 68 . 1 1 61 61 ILE C C 61 174.610 174.610 175.918 -1.308 17919 27880 1 68 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.091 0.329 17919 27881 1 68 . 1 1 61 61 ILE CB C 61 36.740 36.740 36.987 -0.247 17919 27882 1 68 . 1 1 61 61 ILE H H 61 7.250 7.250 7.701 -0.451 17919 27883 1 68 . 1 1 62 62 GLN N N 62 124.740 124.740 126.996 -2.256 17919 27884 1 68 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.582 -0.076 17919 27885 1 68 . 1 1 62 62 GLN C C 62 175.970 175.970 176.158 -0.188 17919 27886 1 68 . 1 1 62 62 GLN CA C 62 53.660 53.660 54.232 -0.572 17919 27887 1 68 . 1 1 62 62 GLN CB C 62 31.650 31.650 30.524 1.126 17919 27888 1 68 . 1 1 62 62 GLN H H 62 7.610 7.610 8.034 -0.424 17919 27889 1 68 . 1 1 63 63 LYS N N 63 120.300 120.300 120.408 -0.108 17919 27890 1 68 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.879 0.122 17919 27891 1 68 . 1 1 63 63 LYS C C 63 175.810 175.810 176.548 -0.738 17919 27892 1 68 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.955 -0.165 17919 27893 1 68 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.943 0.707 17919 27894 1 68 . 1 1 63 63 LYS H H 63 8.490 8.490 8.604 -0.114 17919 27895 1 68 . 1 1 64 64 GLU N N 64 113.950 113.950 117.567 -3.617 17919 27896 1 68 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.618 -0.153 17919 27897 1 68 . 1 1 64 64 GLU C C 64 175.250 175.250 175.394 -0.144 17919 27898 1 68 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.965 -0.076 17919 27899 1 68 . 1 1 64 64 GLU CB C 64 25.900 25.900 27.369 -1.469 17919 27900 1 68 . 1 1 64 64 GLU H H 64 9.280 9.280 8.745 0.535 17919 27901 1 68 . 1 1 65 65 SER N N 65 114.730 114.730 115.315 -0.585 17919 27902 1 68 . 1 1 65 65 SER HA H 65 4.640 4.640 4.495 0.145 17919 27903 1 68 . 1 1 65 65 SER C C 65 172.160 172.160 174.109 -1.949 17919 27904 1 68 . 1 1 65 65 SER CA C 65 60.890 60.890 59.771 1.119 17919 27905 1 68 . 1 1 65 65 SER CB C 65 64.910 64.910 63.972 0.938 17919 27906 1 68 . 1 1 65 65 SER H H 65 7.670 7.670 7.497 0.173 17919 27907 1 68 . 1 1 66 66 THR N N 66 117.110 117.110 121.855 -4.745 17919 27908 1 68 . 1 1 66 66 THR HA H 66 5.270 5.270 4.753 0.517 17919 27909 1 68 . 1 1 66 66 THR C C 66 173.950 173.950 174.462 -0.512 17919 27910 1 68 . 1 1 66 66 THR CA C 66 62.340 62.340 62.679 -0.339 17919 27911 1 68 . 1 1 66 66 THR CB C 66 70.080 70.080 69.362 0.718 17919 27912 1 68 . 1 1 66 66 THR H H 66 8.730 8.730 8.487 0.243 17919 27913 1 68 . 1 1 67 67 LEU N N 67 127.110 127.110 128.618 -1.508 17919 27914 1 68 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.808 0.252 17919 27915 1 68 . 1 1 67 67 LEU C C 67 175.770 175.770 175.571 0.199 17919 27916 1 68 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.207 -0.307 17919 27917 1 68 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.547 0.713 17919 27918 1 68 . 1 1 67 67 LEU H H 67 9.410 9.410 9.027 0.383 17919 27919 1 68 . 1 1 68 68 HIS N N 68 118.380 118.380 120.872 -2.492 17919 27920 1 68 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.674 -0.434 17919 27921 1 68 . 1 1 68 68 HIS C C 68 173.150 173.150 173.889 -0.739 17919 27922 1 68 . 1 1 68 68 HIS CA C 68 55.000 55.000 53.843 1.157 17919 27923 1 68 . 1 1 68 68 HIS CB C 68 30.530 30.530 33.417 -2.887 17919 27924 1 68 . 1 1 68 68 HIS H H 68 9.230 9.230 8.658 0.572 17919 27925 1 68 . 1 1 69 69 LEU N N 69 124.460 124.460 125.868 -1.408 17919 27926 1 68 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.077 0.113 17919 27927 1 68 . 1 1 69 69 LEU C C 69 175.270 175.270 173.924 1.346 17919 27928 1 68 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.477 0.413 17919 27929 1 68 . 1 1 69 69 LEU CB C 69 44.380 44.380 45.772 -1.392 17919 27930 1 68 . 1 1 69 69 LEU H H 69 8.340 8.340 8.021 0.319 17919 27931 1 68 . 1 1 70 70 VAL N N 70 126.940 126.940 122.135 4.805 17919 27932 1 68 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.454 -0.104 17919 27933 1 68 . 1 1 70 70 VAL C C 70 174.000 174.000 173.755 0.245 17919 27934 1 68 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.809 0.991 17919 27935 1 68 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.833 -0.923 17919 27936 1 68 . 1 1 70 70 VAL H H 70 9.200 9.200 7.911 1.289 17919 27937 1 68 . 1 1 71 71 LEU N N 71 123.130 123.130 122.035 1.095 17919 27938 1 68 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.800 0.260 17919 27939 1 68 . 1 1 71 71 LEU C C 71 177.830 177.830 177.011 0.819 17919 27940 1 68 . 1 1 71 71 LEU CA C 71 53.940 53.940 54.474 -0.534 17919 27941 1 68 . 1 1 71 71 LEU CB C 71 42.850 42.850 41.982 0.868 17919 27942 1 68 . 1 1 71 71 LEU H H 71 8.120 8.120 8.136 -0.016 17919 27943 1 68 . 1 1 72 72 ARG N N 72 123.490 123.490 123.580 -0.090 17919 27944 1 68 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.716 -0.415 17919 27945 1 68 . 1 1 72 72 ARG C C 72 175.350 175.350 174.267 1.083 17919 27946 1 68 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.660 -0.050 17919 27947 1 68 . 1 1 72 72 ARG CB C 72 31.350 31.350 31.856 -0.506 17919 27948 1 68 . 1 1 72 72 ARG H H 72 8.580 8.580 8.738 -0.158 17919 27949 1 69 . 1 1 2 2 GLN N N 2 123.220 123.220 125.784 -2.564 17919 27950 1 69 . 1 1 2 2 GLN HA H 2 5.249 5.249 4.867 0.382 17919 27951 1 69 . 1 1 2 2 GLN C C 2 175.920 175.920 174.975 0.945 17919 27952 1 69 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.901 0.179 17919 27953 1 69 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.432 0.328 17919 27954 1 69 . 1 1 2 2 GLN H H 2 8.900 8.900 8.373 0.527 17919 27955 1 69 . 1 1 3 3 ILE N N 3 115.340 115.340 115.635 -0.295 17919 27956 1 69 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.564 -0.351 17919 27957 1 69 . 1 1 3 3 ILE C C 3 172.450 172.450 173.829 -1.379 17919 27958 1 69 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.225 0.345 17919 27959 1 69 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.133 1.077 17919 27960 1 69 . 1 1 3 3 ILE H H 3 8.320 8.320 8.215 0.105 17919 27961 1 69 . 1 1 4 4 PHE N N 4 118.110 118.110 121.610 -3.500 17919 27962 1 69 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.129 0.501 17919 27963 1 69 . 1 1 4 4 PHE C C 4 175.320 175.320 174.915 0.405 17919 27964 1 69 . 1 1 4 4 PHE CA C 4 55.210 55.210 56.186 -0.976 17919 27965 1 69 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.478 0.002 17919 27966 1 69 . 1 1 4 4 PHE H H 4 8.610 8.610 8.368 0.242 17919 27967 1 69 . 1 1 5 5 VAL N N 5 121.000 121.000 123.423 -2.423 17919 27968 1 69 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.958 -0.233 17919 27969 1 69 . 1 1 5 5 VAL C C 5 174.870 174.870 175.127 -0.257 17919 27970 1 69 . 1 1 5 5 VAL CA C 5 60.620 60.620 60.848 -0.228 17919 27971 1 69 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.382 0.848 17919 27972 1 69 . 1 1 5 5 VAL H H 5 9.300 9.300 9.250 0.050 17919 27973 1 69 . 1 1 6 6 LYS N N 6 127.520 127.520 127.099 0.421 17919 27974 1 69 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.124 0.243 17919 27975 1 69 . 1 1 6 6 LYS C C 6 177.140 177.140 175.893 1.247 17919 27976 1 69 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.779 -0.259 17919 27977 1 69 . 1 1 6 6 LYS CB C 6 35.050 35.050 36.028 -0.978 17919 27978 1 69 . 1 1 6 6 LYS H H 6 8.820 8.820 8.889 -0.069 17919 27979 1 69 . 1 1 7 7 THR N N 7 115.400 115.400 116.313 -0.913 17919 27980 1 69 . 1 1 7 7 THR HA H 7 4.970 4.970 5.064 -0.094 17919 27981 1 69 . 1 1 7 7 THR C C 7 176.910 176.910 176.632 0.278 17919 27982 1 69 . 1 1 7 7 THR CA C 7 60.470 60.470 60.402 0.068 17919 27983 1 69 . 1 1 7 7 THR CB C 7 70.630 70.630 71.056 -0.426 17919 27984 1 69 . 1 1 7 7 THR H H 7 8.730 8.730 8.225 0.505 17919 27985 1 69 . 1 1 8 8 LEU N N 8 121.330 121.330 127.510 -6.180 17919 27986 1 69 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.037 0.273 17919 27987 1 69 . 1 1 8 8 LEU C C 8 178.800 178.800 177.500 1.300 17919 27988 1 69 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.847 -0.267 17919 27989 1 69 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.097 -0.127 17919 27990 1 69 . 1 1 8 8 LEU H H 8 9.100 9.100 9.274 -0.174 17919 27991 1 69 . 1 1 9 9 THR N N 9 105.590 105.590 107.362 -1.772 17919 27992 1 69 . 1 1 9 9 THR HA H 9 4.428 4.428 4.368 0.060 17919 27993 1 69 . 1 1 9 9 THR C C 9 175.520 175.520 175.477 0.043 17919 27994 1 69 . 1 1 9 9 THR CA C 9 61.400 61.400 61.392 0.008 17919 27995 1 69 . 1 1 9 9 THR CB C 9 69.140 69.140 68.742 0.398 17919 27996 1 69 . 1 1 9 9 THR H H 9 7.630 7.630 7.706 -0.076 17919 27997 1 69 . 1 1 10 10 GLY N N 10 108.890 108.890 110.608 -1.718 17919 27998 1 69 . 1 1 10 10 GLY C C 10 174.070 174.070 173.811 0.259 17919 27999 1 69 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.734 0.726 17919 28000 1 69 . 1 1 10 10 GLY H H 10 7.810 7.810 7.890 -0.080 17919 28001 1 69 . 1 1 11 11 LYS N N 11 121.600 121.600 123.078 -1.478 17919 28002 1 69 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.496 -0.135 17919 28003 1 69 . 1 1 11 11 LYS C C 11 175.940 175.940 175.539 0.401 17919 28004 1 69 . 1 1 11 11 LYS CA C 11 56.280 56.280 55.465 0.815 17919 28005 1 69 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.452 -0.252 17919 28006 1 69 . 1 1 11 11 LYS H H 11 7.280 7.280 7.656 -0.376 17919 28007 1 69 . 1 1 12 12 THR N N 12 120.440 120.440 121.476 -1.036 17919 28008 1 69 . 1 1 12 12 THR HA H 12 5.046 5.046 4.635 0.411 17919 28009 1 69 . 1 1 12 12 THR C C 12 174.320 174.320 174.509 -0.189 17919 28010 1 69 . 1 1 12 12 THR CA C 12 62.390 62.390 63.638 -1.248 17919 28011 1 69 . 1 1 12 12 THR CB C 12 69.910 69.910 69.431 0.478 17919 28012 1 69 . 1 1 12 12 THR H H 12 8.650 8.650 8.551 0.099 17919 28013 1 69 . 1 1 13 13 ILE N N 13 127.110 127.110 128.170 -1.060 17919 28014 1 69 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.364 0.180 17919 28015 1 69 . 1 1 13 13 ILE C C 13 175.220 175.220 174.539 0.681 17919 28016 1 69 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.794 -0.814 17919 28017 1 69 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.108 0.842 17919 28018 1 69 . 1 1 13 13 ILE H H 13 9.450 9.450 8.985 0.465 17919 28019 1 69 . 1 1 14 14 THR N N 14 121.520 121.520 123.943 -2.423 17919 28020 1 69 . 1 1 14 14 THR HA H 14 4.964 4.964 4.679 0.285 17919 28021 1 69 . 1 1 14 14 THR C C 14 173.790 173.790 173.809 -0.019 17919 28022 1 69 . 1 1 14 14 THR CA C 14 61.940 61.940 62.183 -0.243 17919 28023 1 69 . 1 1 14 14 THR CB C 14 69.650 69.650 69.900 -0.250 17919 28024 1 69 . 1 1 14 14 THR H H 14 8.710 8.710 8.393 0.317 17919 28025 1 69 . 1 1 15 15 LEU N N 15 124.800 124.800 125.234 -0.434 17919 28026 1 69 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.688 0.092 17919 28027 1 69 . 1 1 15 15 LEU C C 15 174.670 174.670 175.182 -0.512 17919 28028 1 69 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.558 -0.728 17919 28029 1 69 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.404 1.666 17919 28030 1 69 . 1 1 15 15 LEU H H 15 8.710 8.710 8.726 -0.016 17919 28031 1 69 . 1 1 16 16 GLU N N 16 122.160 122.160 123.221 -1.061 17919 28032 1 69 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.427 0.490 17919 28033 1 69 . 1 1 16 16 GLU C C 16 175.860 175.860 175.222 0.638 17919 28034 1 69 . 1 1 16 16 GLU CA C 16 54.820 54.820 54.981 -0.161 17919 28035 1 69 . 1 1 16 16 GLU CB C 16 29.450 29.450 29.225 0.225 17919 28036 1 69 . 1 1 16 16 GLU H H 16 8.140 8.140 8.531 -0.391 17919 28037 1 69 . 1 1 17 17 VAL N N 17 117.210 117.210 121.973 -4.763 17919 28038 1 69 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.839 -0.125 17919 28039 1 69 . 1 1 17 17 VAL C C 17 174.160 174.160 174.991 -0.831 17919 28040 1 69 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.272 -0.842 17919 28041 1 69 . 1 1 17 17 VAL CB C 17 36.400 36.400 34.883 1.517 17919 28042 1 69 . 1 1 17 17 VAL H H 17 8.900 8.900 7.872 1.028 17919 28043 1 69 . 1 1 18 18 GLU N N 18 118.990 118.990 121.451 -2.461 17919 28044 1 69 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.748 0.331 17919 28045 1 69 . 1 1 18 18 GLU C C 18 176.160 176.160 176.207 -0.047 17919 28046 1 69 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.353 -0.633 17919 28047 1 69 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.388 -0.078 17919 28048 1 69 . 1 1 18 18 GLU H H 18 8.640 8.640 9.453 -0.813 17919 28049 1 69 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.300 -0.159 17919 28050 1 69 . 1 1 19 19 PRO C C 19 175.310 175.310 177.761 -2.451 17919 28051 1 69 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.513 -0.043 17919 28052 1 69 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.100 -0.150 17919 28053 1 69 . 1 1 20 20 SER N N 20 103.400 103.400 109.966 -6.566 17919 28054 1 69 . 1 1 20 20 SER HA H 20 4.370 4.370 4.165 0.205 17919 28055 1 69 . 1 1 20 20 SER C C 20 174.660 174.660 174.235 0.425 17919 28056 1 69 . 1 1 20 20 SER CA C 20 57.400 57.400 59.354 -1.954 17919 28057 1 69 . 1 1 20 20 SER CB C 20 63.370 63.370 62.718 0.652 17919 28058 1 69 . 1 1 20 20 SER H H 20 7.040 7.040 8.099 -1.059 17919 28059 1 69 . 1 1 21 21 ASP N N 21 123.480 123.480 123.402 0.078 17919 28060 1 69 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.679 0.016 17919 28061 1 69 . 1 1 21 21 ASP C C 21 176.360 176.360 175.679 0.681 17919 28062 1 69 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.863 0.837 17919 28063 1 69 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.610 -0.810 17919 28064 1 69 . 1 1 21 21 ASP H H 21 8.030 8.030 7.396 0.634 17919 28065 1 69 . 1 1 22 22 THR N N 22 108.800 108.800 114.254 -5.454 17919 28066 1 69 . 1 1 22 22 THR HA H 22 4.920 4.920 4.740 0.180 17919 28067 1 69 . 1 1 22 22 THR C C 22 176.750 176.750 175.874 0.876 17919 28068 1 69 . 1 1 22 22 THR CA C 22 59.690 59.690 61.326 -1.636 17919 28069 1 69 . 1 1 22 22 THR CB C 22 71.200 71.200 70.458 0.742 17919 28070 1 69 . 1 1 22 22 THR H H 22 7.900 7.900 8.338 -0.438 17919 28071 1 69 . 1 1 23 23 ILE N N 23 121.190 121.190 123.368 -2.178 17919 28072 1 69 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.724 -0.067 17919 28073 1 69 . 1 1 23 23 ILE C C 23 179.040 179.040 177.765 1.275 17919 28074 1 69 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.254 0.006 17919 28075 1 69 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.398 -2.048 17919 28076 1 69 . 1 1 23 23 ILE H H 23 8.560 8.560 8.815 -0.255 17919 28077 1 69 . 1 1 24 24 GLU N N 24 120.830 120.830 118.915 1.915 17919 28078 1 69 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.919 -0.002 17919 28079 1 69 . 1 1 24 24 GLU C C 24 178.640 178.640 178.951 -0.311 17919 28080 1 69 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.265 0.955 17919 28081 1 69 . 1 1 24 24 GLU CB C 24 28.280 28.280 28.741 -0.462 17919 28082 1 69 . 1 1 24 24 GLU H H 24 9.760 9.760 8.580 1.180 17919 28083 1 69 . 1 1 25 25 ASN N N 25 120.570 120.570 117.788 2.782 17919 28084 1 69 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.577 -0.052 17919 28085 1 69 . 1 1 25 25 ASN C C 25 178.380 178.380 177.523 0.857 17919 28086 1 69 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.553 0.507 17919 28087 1 69 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.213 0.237 17919 28088 1 69 . 1 1 25 25 ASN H H 25 7.920 7.920 7.765 0.155 17919 28089 1 69 . 1 1 26 26 VAL N N 26 121.710 121.710 119.096 2.614 17919 28090 1 69 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.628 -0.231 17919 28091 1 69 . 1 1 26 26 VAL C C 26 177.950 177.950 177.810 0.140 17919 28092 1 69 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.120 1.540 17919 28093 1 69 . 1 1 26 26 VAL CB C 26 30.840 30.840 30.551 0.289 17919 28094 1 69 . 1 1 26 26 VAL H H 26 8.070 8.070 7.680 0.390 17919 28095 1 69 . 1 1 27 27 LYS N N 27 118.860 118.860 119.250 -0.390 17919 28096 1 69 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.322 0.258 17919 28097 1 69 . 1 1 27 27 LYS C C 27 180.550 180.550 179.282 1.268 17919 28098 1 69 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.105 0.145 17919 28099 1 69 . 1 1 27 27 LYS CB C 27 33.730 33.730 31.976 1.754 17919 28100 1 69 . 1 1 27 27 LYS H H 27 8.560 8.560 7.810 0.750 17919 28101 1 69 . 1 1 28 28 ALA N N 28 123.440 123.440 123.470 -0.030 17919 28102 1 69 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.074 0.086 17919 28103 1 69 . 1 1 28 28 ALA C C 28 180.300 180.300 178.969 1.331 17919 28104 1 69 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.009 0.361 17919 28105 1 69 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.353 -0.643 17919 28106 1 69 . 1 1 28 28 ALA H H 28 8.060 8.060 8.170 -0.110 17919 28107 1 69 . 1 1 29 29 LYS N N 29 119.940 119.940 120.216 -0.276 17919 28108 1 69 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.164 0.043 17919 28109 1 69 . 1 1 29 29 LYS C C 29 180.320 180.320 178.972 1.348 17919 28110 1 69 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.534 0.116 17919 28111 1 69 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.340 0.950 17919 28112 1 69 . 1 1 29 29 LYS H H 29 7.850 7.850 7.671 0.179 17919 28113 1 69 . 1 1 30 30 ILE N N 30 121.080 121.080 119.053 2.027 17919 28114 1 69 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.589 -0.082 17919 28115 1 69 . 1 1 30 30 ILE C C 30 178.310 178.310 177.515 0.795 17919 28116 1 69 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.706 0.444 17919 28117 1 69 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.225 -0.425 17919 28118 1 69 . 1 1 30 30 ILE H H 30 8.280 8.280 8.526 -0.246 17919 28119 1 69 . 1 1 31 31 GLN N N 31 123.490 123.490 118.689 4.801 17919 28120 1 69 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.050 -0.221 17919 28121 1 69 . 1 1 31 31 GLN C C 31 178.890 178.890 178.429 0.461 17919 28122 1 69 . 1 1 31 31 GLN CA C 31 60.000 60.000 58.880 1.120 17919 28123 1 69 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.331 -0.611 17919 28124 1 69 . 1 1 31 31 GLN H H 31 8.580 8.580 7.749 0.831 17919 28125 1 69 . 1 1 32 32 ASP N N 32 119.360 119.360 119.180 0.180 17919 28126 1 69 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.520 -0.166 17919 28127 1 69 . 1 1 32 32 ASP C C 32 177.250 177.250 177.630 -0.380 17919 28128 1 69 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.200 0.990 17919 28129 1 69 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.726 -0.146 17919 28130 1 69 . 1 1 32 32 ASP H H 32 8.010 8.010 8.204 -0.194 17919 28131 1 69 . 1 1 33 33 LYS N N 33 115.130 115.130 118.483 -3.353 17919 28132 1 69 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.432 -0.095 17919 28133 1 69 . 1 1 33 33 LYS C C 33 177.870 177.870 177.753 0.117 17919 28134 1 69 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.538 0.512 17919 28135 1 69 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.958 0.212 17919 28136 1 69 . 1 1 33 33 LYS H H 33 7.430 7.430 7.422 0.008 17919 28137 1 69 . 1 1 34 34 GLU N N 34 113.870 113.870 115.921 -2.051 17919 28138 1 69 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.468 0.157 17919 28139 1 69 . 1 1 34 34 GLU C C 34 177.840 177.840 177.153 0.687 17919 28140 1 69 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.115 -0.945 17919 28141 1 69 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.438 1.222 17919 28142 1 69 . 1 1 34 34 GLU H H 34 8.740 8.740 8.090 0.650 17919 28143 1 69 . 1 1 35 35 GLY N N 35 108.650 108.650 109.420 -0.770 17919 28144 1 69 . 1 1 35 35 GLY C C 35 173.960 173.960 174.611 -0.651 17919 28145 1 69 . 1 1 35 35 GLY CA C 35 46.080 46.080 46.023 0.057 17919 28146 1 69 . 1 1 35 35 GLY H H 35 8.530 8.530 7.759 0.771 17919 28147 1 69 . 1 1 36 36 ILE N N 36 119.880 119.880 121.084 -1.204 17919 28148 1 69 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.104 0.341 17919 28149 1 69 . 1 1 36 36 ILE C C 36 173.590 173.590 174.311 -0.721 17919 28150 1 69 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.135 -0.385 17919 28151 1 69 . 1 1 36 36 ILE CB C 36 40.580 40.580 36.612 3.968 17919 28152 1 69 . 1 1 36 36 ILE H H 36 6.150 6.150 7.888 -1.738 17919 28153 1 69 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.722 -0.088 17919 28154 1 69 . 1 1 37 37 PRO C C 37 176.940 176.940 176.512 0.428 17919 28155 1 69 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.519 0.141 17919 28156 1 69 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.700 0.150 17919 28157 1 69 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.209 -0.092 17919 28158 1 69 . 1 1 38 38 PRO C C 38 178.320 178.320 177.847 0.473 17919 28159 1 69 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.507 0.753 17919 28160 1 69 . 1 1 38 38 PRO CB C 38 32.890 32.890 32.136 0.754 17919 28161 1 69 . 1 1 39 39 ASP N N 39 113.380 113.380 116.882 -3.502 17919 28162 1 69 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.402 0.028 17919 28163 1 69 . 1 1 39 39 ASP C C 39 177.090 177.090 177.954 -0.864 17919 28164 1 69 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.758 -1.118 17919 28165 1 69 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.362 -0.822 17919 28166 1 69 . 1 1 39 39 ASP H H 39 8.550 8.550 8.736 -0.186 17919 28167 1 69 . 1 1 40 40 GLN N N 40 116.780 116.780 117.542 -0.762 17919 28168 1 69 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.571 -0.107 17919 28169 1 69 . 1 1 40 40 GLN C C 40 175.380 175.380 175.571 -0.191 17919 28170 1 69 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.413 -0.773 17919 28171 1 69 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.419 0.721 17919 28172 1 69 . 1 1 40 40 GLN H H 40 7.820 7.820 7.640 0.180 17919 28173 1 69 . 1 1 41 41 GLN N N 41 117.720 117.720 118.786 -1.066 17919 28174 1 69 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.596 -0.352 17919 28175 1 69 . 1 1 41 41 GLN C C 41 176.300 176.300 174.824 1.476 17919 28176 1 69 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.233 1.237 17919 28177 1 69 . 1 1 41 41 GLN CB C 41 31.650 31.650 31.176 0.474 17919 28178 1 69 . 1 1 41 41 GLN H H 41 7.480 7.480 7.274 0.206 17919 28179 1 69 . 1 1 42 42 ARG N N 42 122.680 122.680 124.550 -1.870 17919 28180 1 69 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.691 -0.191 17919 28181 1 69 . 1 1 42 42 ARG C C 42 174.050 174.050 174.743 -0.693 17919 28182 1 69 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.828 0.222 17919 28183 1 69 . 1 1 42 42 ARG CB C 42 31.750 31.750 31.602 0.148 17919 28184 1 69 . 1 1 42 42 ARG H H 42 8.530 8.530 8.242 0.288 17919 28185 1 69 . 1 1 43 43 LEU N N 43 124.040 124.040 126.681 -2.641 17919 28186 1 69 . 1 1 43 43 LEU C C 43 175.290 175.290 176.154 -0.864 17919 28187 1 69 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.269 -1.289 17919 28188 1 69 . 1 1 43 43 LEU CB C 43 45.790 45.790 42.831 2.959 17919 28189 1 69 . 1 1 43 43 LEU H H 43 8.820 8.820 8.759 0.061 17919 28190 1 69 . 1 1 44 44 ILE N N 44 121.920 121.920 123.910 -1.990 17919 28191 1 69 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.953 0.039 17919 28192 1 69 . 1 1 44 44 ILE C C 44 176.060 176.060 174.994 1.066 17919 28193 1 69 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.261 -0.281 17919 28194 1 69 . 1 1 44 44 ILE CB C 44 41.420 41.420 39.169 2.252 17919 28195 1 69 . 1 1 44 44 ILE H H 44 9.030 9.030 8.733 0.297 17919 28196 1 69 . 1 1 45 45 PHE N N 45 125.390 125.390 127.425 -2.035 17919 28197 1 69 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.975 0.070 17919 28198 1 69 . 1 1 45 45 PHE C C 45 174.470 174.470 174.175 0.295 17919 28199 1 69 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.292 0.728 17919 28200 1 69 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.468 0.292 17919 28201 1 69 . 1 1 45 45 PHE H H 45 8.830 8.830 9.389 -0.559 17919 28202 1 69 . 1 1 46 46 ALA N N 46 132.200 132.200 128.822 3.378 17919 28203 1 69 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.642 0.048 17919 28204 1 69 . 1 1 46 46 ALA C C 46 177.290 177.290 177.745 -0.455 17919 28205 1 69 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.406 0.134 17919 28206 1 69 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.234 0.336 17919 28207 1 69 . 1 1 46 46 ALA H H 46 8.810 8.810 8.456 0.354 17919 28208 1 69 . 1 1 47 47 GLY N N 47 102.340 102.340 104.228 -1.888 17919 28209 1 69 . 1 1 47 47 GLY C C 47 173.810 173.810 174.134 -0.324 17919 28210 1 69 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.848 0.502 17919 28211 1 69 . 1 1 47 47 GLY H H 47 8.130 8.130 8.458 -0.328 17919 28212 1 69 . 1 1 48 48 LYS N N 48 121.570 121.570 120.983 0.587 17919 28213 1 69 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.623 -0.001 17919 28214 1 69 . 1 1 48 48 LYS C C 48 174.700 174.700 175.121 -0.421 17919 28215 1 69 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.725 -0.175 17919 28216 1 69 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.876 -0.346 17919 28217 1 69 . 1 1 48 48 LYS H H 48 7.980 7.980 7.973 0.007 17919 28218 1 69 . 1 1 49 49 GLN N N 49 122.410 122.410 124.568 -2.158 17919 28219 1 69 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.655 -0.095 17919 28220 1 69 . 1 1 49 49 GLN C C 49 175.670 175.670 175.889 -0.219 17919 28221 1 69 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.406 -0.666 17919 28222 1 69 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.433 -0.433 17919 28223 1 69 . 1 1 49 49 GLN H H 49 8.600 8.600 8.675 -0.075 17919 28224 1 69 . 1 1 50 50 LEU N N 50 125.520 125.520 126.524 -1.004 17919 28225 1 69 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.245 -0.155 17919 28226 1 69 . 1 1 50 50 LEU C C 50 176.660 176.660 176.365 0.295 17919 28227 1 69 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.543 -0.303 17919 28228 1 69 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.880 -1.310 17919 28229 1 69 . 1 1 50 50 LEU H H 50 8.530 8.530 8.218 0.312 17919 28230 1 69 . 1 1 51 51 GLU N N 51 122.940 122.940 120.119 2.821 17919 28231 1 69 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.526 -0.038 17919 28232 1 69 . 1 1 51 51 GLU C C 51 175.870 175.870 176.217 -0.347 17919 28233 1 69 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.536 0.423 17919 28234 1 69 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.024 -0.454 17919 28235 1 69 . 1 1 51 51 GLU H H 51 8.400 8.400 8.178 0.222 17919 28236 1 69 . 1 1 52 52 ASP N N 52 120.030 120.030 126.935 -6.905 17919 28237 1 69 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.459 -0.100 17919 28238 1 69 . 1 1 52 52 ASP C C 52 177.330 177.330 176.918 0.412 17919 28239 1 69 . 1 1 52 52 ASP CA C 52 56.960 56.960 56.339 0.621 17919 28240 1 69 . 1 1 52 52 ASP CB C 52 40.850 40.850 41.254 -0.404 17919 28241 1 69 . 1 1 52 52 ASP H H 52 8.160 8.160 8.804 -0.644 17919 28242 1 69 . 1 1 53 53 GLY N N 53 106.660 106.660 104.753 1.907 17919 28243 1 69 . 1 1 53 53 GLY C C 53 174.870 174.870 174.154 0.716 17919 28244 1 69 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.503 0.667 17919 28245 1 69 . 1 1 53 53 GLY H H 53 9.390 9.390 8.377 1.013 17919 28246 1 69 . 1 1 54 54 ARG N N 54 119.050 119.050 120.695 -1.645 17919 28247 1 69 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.722 -0.027 17919 28248 1 69 . 1 1 54 54 ARG C C 54 175.350 175.350 175.585 -0.235 17919 28249 1 69 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.566 -0.175 17919 28250 1 69 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.255 -0.605 17919 28251 1 69 . 1 1 54 54 ARG H H 54 7.460 7.460 7.480 -0.020 17919 28252 1 69 . 1 1 55 55 THR N N 55 108.400 108.400 113.330 -4.930 17919 28253 1 69 . 1 1 55 55 THR HA H 55 5.240 5.240 5.017 0.223 17919 28254 1 69 . 1 1 55 55 THR C C 55 176.560 176.560 176.765 -0.205 17919 28255 1 69 . 1 1 55 55 THR CA C 55 59.690 59.690 60.286 -0.596 17919 28256 1 69 . 1 1 55 55 THR CB C 55 72.260 72.260 70.479 1.781 17919 28257 1 69 . 1 1 55 55 THR H H 55 8.730 8.730 8.461 0.269 17919 28258 1 69 . 1 1 56 56 LEU N N 56 117.920 117.920 122.281 -4.361 17919 28259 1 69 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.880 0.180 17919 28260 1 69 . 1 1 56 56 LEU C C 56 180.810 180.810 178.333 2.477 17919 28261 1 69 . 1 1 56 56 LEU CA C 56 58.710 58.710 57.997 0.713 17919 28262 1 69 . 1 1 56 56 LEU CB C 56 40.370 40.370 40.979 -0.609 17919 28263 1 69 . 1 1 56 56 LEU H H 56 8.140 8.140 8.641 -0.501 17919 28264 1 69 . 1 1 57 57 SER N N 57 113.330 113.330 113.351 -0.021 17919 28265 1 69 . 1 1 57 57 SER HA H 57 4.370 4.370 4.188 0.182 17919 28266 1 69 . 1 1 57 57 SER C C 57 178.310 178.310 176.633 1.677 17919 28267 1 69 . 1 1 57 57 SER CA C 57 61.080 61.080 60.946 0.134 17919 28268 1 69 . 1 1 57 57 SER CB C 57 62.530 62.530 62.401 0.129 17919 28269 1 69 . 1 1 57 57 SER H H 57 8.470 8.470 8.077 0.393 17919 28270 1 69 . 1 1 58 58 ASP N N 58 124.190 124.190 123.166 1.024 17919 28271 1 69 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.220 0.076 17919 28272 1 69 . 1 1 58 58 ASP C C 58 177.400 177.400 176.890 0.510 17919 28273 1 69 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.315 0.865 17919 28274 1 69 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.396 -0.296 17919 28275 1 69 . 1 1 58 58 ASP H H 58 7.930 7.930 7.904 0.026 17919 28276 1 69 . 1 1 59 59 TYR N N 59 115.510 115.510 115.084 0.426 17919 28277 1 69 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.704 -0.034 17919 28278 1 69 . 1 1 59 59 TYR C C 59 174.700 174.700 175.260 -0.560 17919 28279 1 69 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.546 0.704 17919 28280 1 69 . 1 1 59 59 TYR CB C 59 40.070 40.070 39.097 0.973 17919 28281 1 69 . 1 1 59 59 TYR H H 59 7.250 7.250 7.225 0.025 17919 28282 1 69 . 1 1 60 60 ASN N N 60 115.900 115.900 117.109 -1.209 17919 28283 1 69 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.348 0.007 17919 28284 1 69 . 1 1 60 60 ASN C C 60 174.340 174.340 174.517 -0.177 17919 28285 1 69 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.555 -0.435 17919 28286 1 69 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.909 -0.499 17919 28287 1 69 . 1 1 60 60 ASN H H 60 8.150 8.150 7.710 0.440 17919 28288 1 69 . 1 1 61 61 ILE N N 61 118.600 118.600 120.662 -2.062 17919 28289 1 69 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.783 -0.390 17919 28290 1 69 . 1 1 61 61 ILE C C 61 174.610 174.610 175.020 -0.410 17919 28291 1 69 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.038 0.381 17919 28292 1 69 . 1 1 61 61 ILE CB C 61 36.740 36.740 36.520 0.221 17919 28293 1 69 . 1 1 61 61 ILE H H 61 7.250 7.250 7.792 -0.542 17919 28294 1 69 . 1 1 62 62 GLN N N 62 124.740 124.740 126.325 -1.585 17919 28295 1 69 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.730 -0.224 17919 28296 1 69 . 1 1 62 62 GLN C C 62 175.970 175.970 175.633 0.337 17919 28297 1 69 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.421 0.239 17919 28298 1 69 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.455 0.195 17919 28299 1 69 . 1 1 62 62 GLN H H 62 7.610 7.610 7.814 -0.204 17919 28300 1 69 . 1 1 63 63 LYS N N 63 120.300 120.300 119.687 0.613 17919 28301 1 69 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.008 -0.007 17919 28302 1 69 . 1 1 63 63 LYS C C 63 175.810 175.810 176.470 -0.660 17919 28303 1 69 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.870 -0.080 17919 28304 1 69 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.874 0.776 17919 28305 1 69 . 1 1 63 63 LYS H H 63 8.490 8.490 8.529 -0.039 17919 28306 1 69 . 1 1 64 64 GLU N N 64 113.950 113.950 117.184 -3.234 17919 28307 1 69 . 1 1 64 64 GLU HA H 64 3.465 3.465 4.093 -0.628 17919 28308 1 69 . 1 1 64 64 GLU C C 64 175.250 175.250 175.389 -0.139 17919 28309 1 69 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.526 0.364 17919 28310 1 69 . 1 1 64 64 GLU CB C 64 25.900 25.900 27.509 -1.609 17919 28311 1 69 . 1 1 64 64 GLU H H 64 9.280 9.280 8.514 0.766 17919 28312 1 69 . 1 1 65 65 SER N N 65 114.730 114.730 114.846 -0.116 17919 28313 1 69 . 1 1 65 65 SER HA H 65 4.640 4.640 4.627 0.013 17919 28314 1 69 . 1 1 65 65 SER C C 65 172.160 172.160 174.513 -2.353 17919 28315 1 69 . 1 1 65 65 SER CA C 65 60.890 60.890 59.418 1.472 17919 28316 1 69 . 1 1 65 65 SER CB C 65 64.910 64.910 64.275 0.635 17919 28317 1 69 . 1 1 65 65 SER H H 65 7.670 7.670 7.643 0.027 17919 28318 1 69 . 1 1 66 66 THR N N 66 117.110 117.110 120.352 -3.242 17919 28319 1 69 . 1 1 66 66 THR HA H 66 5.270 5.270 5.141 0.129 17919 28320 1 69 . 1 1 66 66 THR C C 66 173.950 173.950 174.764 -0.814 17919 28321 1 69 . 1 1 66 66 THR CA C 66 62.340 62.340 62.601 -0.261 17919 28322 1 69 . 1 1 66 66 THR CB C 66 70.080 70.080 69.624 0.456 17919 28323 1 69 . 1 1 66 66 THR H H 66 8.730 8.730 8.538 0.192 17919 28324 1 69 . 1 1 67 67 LEU N N 67 127.110 127.110 126.136 0.974 17919 28325 1 69 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.835 0.225 17919 28326 1 69 . 1 1 67 67 LEU C C 67 175.770 175.770 175.744 0.026 17919 28327 1 69 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.876 0.025 17919 28328 1 69 . 1 1 67 67 LEU CB C 67 44.260 44.260 45.430 -1.170 17919 28329 1 69 . 1 1 67 67 LEU H H 67 9.410 9.410 8.859 0.551 17919 28330 1 69 . 1 1 68 68 HIS N N 68 118.380 118.380 117.471 0.909 17919 28331 1 69 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.257 -0.017 17919 28332 1 69 . 1 1 68 68 HIS C C 68 173.150 173.150 174.516 -1.366 17919 28333 1 69 . 1 1 68 68 HIS CA C 68 55.000 55.000 55.279 -0.279 17919 28334 1 69 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.375 -1.845 17919 28335 1 69 . 1 1 68 68 HIS H H 68 9.230 9.230 8.629 0.601 17919 28336 1 69 . 1 1 69 69 LEU N N 69 124.460 124.460 124.662 -0.202 17919 28337 1 69 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.195 -0.005 17919 28338 1 69 . 1 1 69 69 LEU C C 69 175.270 175.270 174.775 0.495 17919 28339 1 69 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.121 -0.231 17919 28340 1 69 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.076 0.304 17919 28341 1 69 . 1 1 69 69 LEU H H 69 8.340 8.340 8.072 0.268 17919 28342 1 69 . 1 1 70 70 VAL N N 70 126.940 126.940 127.212 -0.272 17919 28343 1 69 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.435 -0.085 17919 28344 1 69 . 1 1 70 70 VAL C C 70 174.000 174.000 174.474 -0.474 17919 28345 1 69 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.819 -0.019 17919 28346 1 69 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.068 -0.158 17919 28347 1 69 . 1 1 70 70 VAL H H 70 9.200 9.200 8.200 1.000 17919 28348 1 69 . 1 1 71 71 LEU N N 71 123.130 123.130 122.992 0.138 17919 28349 1 69 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.382 -0.322 17919 28350 1 69 . 1 1 71 71 LEU C C 71 177.830 177.830 176.855 0.975 17919 28351 1 69 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.300 0.640 17919 28352 1 69 . 1 1 71 71 LEU CB C 71 42.850 42.850 44.062 -1.212 17919 28353 1 69 . 1 1 71 71 LEU H H 71 8.120 8.120 8.272 -0.152 17919 28354 1 69 . 1 1 72 72 ARG N N 72 123.490 123.490 121.492 1.998 17919 28355 1 69 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.616 -0.315 17919 28356 1 69 . 1 1 72 72 ARG C C 72 175.350 175.350 175.085 0.265 17919 28357 1 69 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.718 -0.108 17919 28358 1 69 . 1 1 72 72 ARG CB C 72 31.350 31.350 32.130 -0.780 17919 28359 1 69 . 1 1 72 72 ARG H H 72 8.580 8.580 8.431 0.149 17919 28360 1 70 . 1 1 2 2 GLN N N 2 123.220 123.220 122.605 0.615 17919 28361 1 70 . 1 1 2 2 GLN HA H 2 5.249 5.249 4.889 0.360 17919 28362 1 70 . 1 1 2 2 GLN C C 2 175.920 175.920 174.964 0.956 17919 28363 1 70 . 1 1 2 2 GLN CA C 2 55.080 55.080 55.258 -0.178 17919 28364 1 70 . 1 1 2 2 GLN CB C 2 30.760 30.760 29.482 1.278 17919 28365 1 70 . 1 1 2 2 GLN H H 2 8.900 8.900 8.225 0.675 17919 28366 1 70 . 1 1 3 3 ILE N N 3 115.340 115.340 117.038 -1.698 17919 28367 1 70 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.241 -0.028 17919 28368 1 70 . 1 1 3 3 ILE C C 3 172.450 172.450 173.360 -0.910 17919 28369 1 70 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.659 -0.089 17919 28370 1 70 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.840 0.370 17919 28371 1 70 . 1 1 3 3 ILE H H 3 8.320 8.320 7.975 0.345 17919 28372 1 70 . 1 1 4 4 PHE N N 4 118.110 118.110 118.970 -0.860 17919 28373 1 70 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.354 0.276 17919 28374 1 70 . 1 1 4 4 PHE C C 4 175.320 175.320 175.374 -0.054 17919 28375 1 70 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.276 -0.066 17919 28376 1 70 . 1 1 4 4 PHE CB C 4 41.480 41.480 40.965 0.515 17919 28377 1 70 . 1 1 4 4 PHE H H 4 8.610 8.610 8.320 0.290 17919 28378 1 70 . 1 1 5 5 VAL N N 5 121.000 121.000 122.363 -1.363 17919 28379 1 70 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.454 0.271 17919 28380 1 70 . 1 1 5 5 VAL C C 5 174.870 174.870 175.235 -0.365 17919 28381 1 70 . 1 1 5 5 VAL CA C 5 60.620 60.620 62.210 -1.590 17919 28382 1 70 . 1 1 5 5 VAL CB C 5 34.230 34.230 32.666 1.564 17919 28383 1 70 . 1 1 5 5 VAL H H 5 9.300 9.300 8.771 0.529 17919 28384 1 70 . 1 1 6 6 LYS N N 6 127.520 127.520 127.329 0.191 17919 28385 1 70 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.211 0.156 17919 28386 1 70 . 1 1 6 6 LYS C C 6 177.140 177.140 176.541 0.599 17919 28387 1 70 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.669 -0.149 17919 28388 1 70 . 1 1 6 6 LYS CB C 6 35.050 35.050 36.098 -1.048 17919 28389 1 70 . 1 1 6 6 LYS H H 6 8.820 8.820 8.911 -0.091 17919 28390 1 70 . 1 1 7 7 THR N N 7 115.400 115.400 117.642 -2.242 17919 28391 1 70 . 1 1 7 7 THR HA H 7 4.970 4.970 4.702 0.268 17919 28392 1 70 . 1 1 7 7 THR C C 7 176.910 176.910 176.174 0.736 17919 28393 1 70 . 1 1 7 7 THR CA C 7 60.470 60.470 60.514 -0.044 17919 28394 1 70 . 1 1 7 7 THR CB C 7 70.630 70.630 70.471 0.159 17919 28395 1 70 . 1 1 7 7 THR H H 7 8.730 8.730 8.276 0.454 17919 28396 1 70 . 1 1 8 8 LEU N N 8 121.330 121.330 122.160 -0.830 17919 28397 1 70 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.304 0.006 17919 28398 1 70 . 1 1 8 8 LEU C C 8 178.800 178.800 177.962 0.838 17919 28399 1 70 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.585 -0.005 17919 28400 1 70 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.819 0.151 17919 28401 1 70 . 1 1 8 8 LEU H H 8 9.100 9.100 8.989 0.111 17919 28402 1 70 . 1 1 9 9 THR N N 9 105.590 105.590 107.305 -1.715 17919 28403 1 70 . 1 1 9 9 THR HA H 9 4.428 4.428 4.289 0.139 17919 28404 1 70 . 1 1 9 9 THR C C 9 175.520 175.520 175.412 0.108 17919 28405 1 70 . 1 1 9 9 THR CA C 9 61.400 61.400 62.054 -0.654 17919 28406 1 70 . 1 1 9 9 THR CB C 9 69.140 69.140 68.966 0.173 17919 28407 1 70 . 1 1 9 9 THR H H 9 7.630 7.630 7.809 -0.179 17919 28408 1 70 . 1 1 10 10 GLY N N 10 108.890 108.890 110.842 -1.952 17919 28409 1 70 . 1 1 10 10 GLY C C 10 174.070 174.070 173.945 0.125 17919 28410 1 70 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.708 0.752 17919 28411 1 70 . 1 1 10 10 GLY H H 10 7.810 7.810 7.608 0.202 17919 28412 1 70 . 1 1 11 11 LYS N N 11 121.600 121.600 121.127 0.473 17919 28413 1 70 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.417 -0.056 17919 28414 1 70 . 1 1 11 11 LYS C C 11 175.940 175.940 175.328 0.612 17919 28415 1 70 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.780 -0.500 17919 28416 1 70 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.425 -0.225 17919 28417 1 70 . 1 1 11 11 LYS H H 11 7.280 7.280 7.691 -0.411 17919 28418 1 70 . 1 1 12 12 THR N N 12 120.440 120.440 117.489 2.951 17919 28419 1 70 . 1 1 12 12 THR HA H 12 5.046 5.046 5.143 -0.097 17919 28420 1 70 . 1 1 12 12 THR C C 12 174.320 174.320 174.145 0.175 17919 28421 1 70 . 1 1 12 12 THR CA C 12 62.390 62.390 61.299 1.091 17919 28422 1 70 . 1 1 12 12 THR CB C 12 69.910 69.910 70.670 -0.760 17919 28423 1 70 . 1 1 12 12 THR H H 12 8.650 8.650 8.243 0.407 17919 28424 1 70 . 1 1 13 13 ILE N N 13 127.110 127.110 124.075 3.035 17919 28425 1 70 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.510 0.034 17919 28426 1 70 . 1 1 13 13 ILE C C 13 175.220 175.220 174.011 1.209 17919 28427 1 70 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.770 -0.790 17919 28428 1 70 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.943 -0.993 17919 28429 1 70 . 1 1 13 13 ILE H H 13 9.450 9.450 8.618 0.832 17919 28430 1 70 . 1 1 14 14 THR N N 14 121.520 121.520 123.491 -1.971 17919 28431 1 70 . 1 1 14 14 THR HA H 14 4.964 4.964 4.835 0.129 17919 28432 1 70 . 1 1 14 14 THR C C 14 173.790 173.790 174.243 -0.453 17919 28433 1 70 . 1 1 14 14 THR CA C 14 61.940 61.940 61.984 -0.044 17919 28434 1 70 . 1 1 14 14 THR CB C 14 69.650 69.650 69.221 0.429 17919 28435 1 70 . 1 1 14 14 THR H H 14 8.710 8.710 8.406 0.304 17919 28436 1 70 . 1 1 15 15 LEU N N 15 124.800 124.800 127.993 -3.193 17919 28437 1 70 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.712 0.068 17919 28438 1 70 . 1 1 15 15 LEU C C 15 174.670 174.670 175.396 -0.726 17919 28439 1 70 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.747 -0.917 17919 28440 1 70 . 1 1 15 15 LEU CB C 15 47.070 47.070 44.278 2.792 17919 28441 1 70 . 1 1 15 15 LEU H H 15 8.710 8.710 8.591 0.119 17919 28442 1 70 . 1 1 16 16 GLU N N 16 122.160 122.160 123.123 -0.963 17919 28443 1 70 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.450 0.467 17919 28444 1 70 . 1 1 16 16 GLU C C 16 175.860 175.860 175.791 0.069 17919 28445 1 70 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.634 -0.814 17919 28446 1 70 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.100 -0.650 17919 28447 1 70 . 1 1 16 16 GLU H H 16 8.140 8.140 8.703 -0.563 17919 28448 1 70 . 1 1 17 17 VAL N N 17 117.210 117.210 121.288 -4.078 17919 28449 1 70 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.900 -0.186 17919 28450 1 70 . 1 1 17 17 VAL C C 17 174.160 174.160 174.946 -0.786 17919 28451 1 70 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.309 -0.879 17919 28452 1 70 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.723 0.677 17919 28453 1 70 . 1 1 17 17 VAL H H 17 8.900 8.900 8.058 0.842 17919 28454 1 70 . 1 1 18 18 GLU N N 18 118.990 118.990 119.254 -0.264 17919 28455 1 70 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.913 0.166 17919 28456 1 70 . 1 1 18 18 GLU C C 18 176.160 176.160 175.071 1.089 17919 28457 1 70 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.073 -0.353 17919 28458 1 70 . 1 1 18 18 GLU CB C 18 30.310 30.310 32.725 -2.415 17919 28459 1 70 . 1 1 18 18 GLU H H 18 8.640 8.640 9.335 -0.695 17919 28460 1 70 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.155 -0.014 17919 28461 1 70 . 1 1 19 19 PRO C C 19 175.310 175.310 178.393 -3.083 17919 28462 1 70 . 1 1 19 19 PRO CA C 19 65.470 65.470 66.009 -0.539 17919 28463 1 70 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.956 -0.006 17919 28464 1 70 . 1 1 20 20 SER N N 20 103.400 103.400 110.416 -7.016 17919 28465 1 70 . 1 1 20 20 SER HA H 20 4.370 4.370 4.219 0.151 17919 28466 1 70 . 1 1 20 20 SER C C 20 174.660 174.660 174.704 -0.044 17919 28467 1 70 . 1 1 20 20 SER CA C 20 57.400 57.400 59.506 -2.106 17919 28468 1 70 . 1 1 20 20 SER CB C 20 63.370 63.370 63.039 0.331 17919 28469 1 70 . 1 1 20 20 SER H H 20 7.040 7.040 8.446 -1.406 17919 28470 1 70 . 1 1 21 21 ASP N N 21 123.480 123.480 124.320 -0.840 17919 28471 1 70 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.497 0.198 17919 28472 1 70 . 1 1 21 21 ASP C C 21 176.360 176.360 176.491 -0.131 17919 28473 1 70 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.816 -0.116 17919 28474 1 70 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.505 -0.705 17919 28475 1 70 . 1 1 21 21 ASP H H 21 8.030 8.030 7.837 0.193 17919 28476 1 70 . 1 1 22 22 THR N N 22 108.800 108.800 112.803 -4.003 17919 28477 1 70 . 1 1 22 22 THR HA H 22 4.920 4.920 4.417 0.503 17919 28478 1 70 . 1 1 22 22 THR C C 22 176.750 176.750 176.180 0.570 17919 28479 1 70 . 1 1 22 22 THR CA C 22 59.690 59.690 62.169 -2.479 17919 28480 1 70 . 1 1 22 22 THR CB C 22 71.200 71.200 70.217 0.983 17919 28481 1 70 . 1 1 22 22 THR H H 22 7.900 7.900 8.290 -0.390 17919 28482 1 70 . 1 1 23 23 ILE N N 23 121.190 121.190 122.615 -1.425 17919 28483 1 70 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.775 -0.118 17919 28484 1 70 . 1 1 23 23 ILE C C 23 179.040 179.040 177.994 1.046 17919 28485 1 70 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.140 -0.880 17919 28486 1 70 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.612 -2.262 17919 28487 1 70 . 1 1 23 23 ILE H H 23 8.560 8.560 9.095 -0.535 17919 28488 1 70 . 1 1 24 24 GLU N N 24 120.830 120.830 120.013 0.817 17919 28489 1 70 . 1 1 24 24 GLU HA H 24 3.917 3.917 4.012 -0.095 17919 28490 1 70 . 1 1 24 24 GLU C C 24 178.640 178.640 178.686 -0.046 17919 28491 1 70 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.234 0.986 17919 28492 1 70 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.077 -0.797 17919 28493 1 70 . 1 1 24 24 GLU H H 24 9.760 9.760 8.346 1.414 17919 28494 1 70 . 1 1 25 25 ASN N N 25 120.570 120.570 117.546 3.024 17919 28495 1 70 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.499 0.026 17919 28496 1 70 . 1 1 25 25 ASN C C 25 178.380 178.380 177.841 0.539 17919 28497 1 70 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.432 -0.372 17919 28498 1 70 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.522 -0.072 17919 28499 1 70 . 1 1 25 25 ASN H H 25 7.920 7.920 7.949 -0.029 17919 28500 1 70 . 1 1 26 26 VAL N N 26 121.710 121.710 118.645 3.065 17919 28501 1 70 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.663 -0.266 17919 28502 1 70 . 1 1 26 26 VAL C C 26 177.950 177.950 177.467 0.483 17919 28503 1 70 . 1 1 26 26 VAL CA C 26 67.660 67.660 65.753 1.907 17919 28504 1 70 . 1 1 26 26 VAL CB C 26 30.840 30.840 30.709 0.131 17919 28505 1 70 . 1 1 26 26 VAL H H 26 8.070 8.070 7.612 0.458 17919 28506 1 70 . 1 1 27 27 LYS N N 27 118.860 118.860 121.225 -2.365 17919 28507 1 70 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.218 0.362 17919 28508 1 70 . 1 1 27 27 LYS C C 27 180.550 180.550 179.220 1.330 17919 28509 1 70 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.719 -0.469 17919 28510 1 70 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.091 1.639 17919 28511 1 70 . 1 1 27 27 LYS H H 27 8.560 8.560 7.793 0.767 17919 28512 1 70 . 1 1 28 28 ALA N N 28 123.440 123.440 120.827 2.613 17919 28513 1 70 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.274 -0.114 17919 28514 1 70 . 1 1 28 28 ALA C C 28 180.300 180.300 179.691 0.609 17919 28515 1 70 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.022 0.348 17919 28516 1 70 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.409 -0.699 17919 28517 1 70 . 1 1 28 28 ALA H H 28 8.060 8.060 8.461 -0.401 17919 28518 1 70 . 1 1 29 29 LYS N N 29 119.940 119.940 119.439 0.501 17919 28519 1 70 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.089 0.118 17919 28520 1 70 . 1 1 29 29 LYS C C 29 180.320 180.320 179.147 1.173 17919 28521 1 70 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.024 0.626 17919 28522 1 70 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.396 0.894 17919 28523 1 70 . 1 1 29 29 LYS H H 29 7.850 7.850 7.301 0.549 17919 28524 1 70 . 1 1 30 30 ILE N N 30 121.080 121.080 121.512 -0.432 17919 28525 1 70 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.552 -0.045 17919 28526 1 70 . 1 1 30 30 ILE C C 30 178.310 178.310 177.361 0.949 17919 28527 1 70 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.754 0.396 17919 28528 1 70 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.677 -0.877 17919 28529 1 70 . 1 1 30 30 ILE H H 30 8.280 8.280 8.664 -0.384 17919 28530 1 70 . 1 1 31 31 GLN N N 31 123.490 123.490 119.350 4.140 17919 28531 1 70 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.042 -0.213 17919 28532 1 70 . 1 1 31 31 GLN C C 31 178.890 178.890 177.929 0.961 17919 28533 1 70 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.180 0.820 17919 28534 1 70 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.598 -0.878 17919 28535 1 70 . 1 1 31 31 GLN H H 31 8.580 8.580 8.581 -0.001 17919 28536 1 70 . 1 1 32 32 ASP N N 32 119.360 119.360 119.339 0.021 17919 28537 1 70 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.421 -0.067 17919 28538 1 70 . 1 1 32 32 ASP C C 32 177.250 177.250 177.876 -0.626 17919 28539 1 70 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.651 0.539 17919 28540 1 70 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.898 -0.318 17919 28541 1 70 . 1 1 32 32 ASP H H 32 8.010 8.010 7.627 0.383 17919 28542 1 70 . 1 1 33 33 LYS N N 33 115.130 115.130 119.327 -4.197 17919 28543 1 70 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.240 0.097 17919 28544 1 70 . 1 1 33 33 LYS C C 33 177.870 177.870 177.850 0.020 17919 28545 1 70 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.710 0.340 17919 28546 1 70 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.425 0.745 17919 28547 1 70 . 1 1 33 33 LYS H H 33 7.430 7.430 7.715 -0.285 17919 28548 1 70 . 1 1 34 34 GLU N N 34 113.870 113.870 115.682 -1.812 17919 28549 1 70 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.455 0.170 17919 28550 1 70 . 1 1 34 34 GLU C C 34 177.840 177.840 176.921 0.919 17919 28551 1 70 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.998 -0.828 17919 28552 1 70 . 1 1 34 34 GLU CB C 34 32.660 32.660 32.534 0.126 17919 28553 1 70 . 1 1 34 34 GLU H H 34 8.740 8.740 8.043 0.697 17919 28554 1 70 . 1 1 35 35 GLY N N 35 108.650 108.650 108.390 0.260 17919 28555 1 70 . 1 1 35 35 GLY C C 35 173.960 173.960 174.488 -0.528 17919 28556 1 70 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.134 0.946 17919 28557 1 70 . 1 1 35 35 GLY H H 35 8.530 8.530 7.872 0.658 17919 28558 1 70 . 1 1 36 36 ILE N N 36 119.880 119.880 120.330 -0.450 17919 28559 1 70 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.392 0.053 17919 28560 1 70 . 1 1 36 36 ILE C C 36 173.590 173.590 174.292 -0.702 17919 28561 1 70 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.850 -0.100 17919 28562 1 70 . 1 1 36 36 ILE CB C 36 40.580 40.580 36.963 3.617 17919 28563 1 70 . 1 1 36 36 ILE H H 36 6.150 6.150 7.791 -1.641 17919 28564 1 70 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.628 0.006 17919 28565 1 70 . 1 1 37 37 PRO C C 37 176.940 176.940 176.496 0.444 17919 28566 1 70 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.794 -0.134 17919 28567 1 70 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.014 0.836 17919 28568 1 70 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.142 -0.025 17919 28569 1 70 . 1 1 38 38 PRO C C 38 178.320 178.320 177.926 0.394 17919 28570 1 70 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.478 0.782 17919 28571 1 70 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.728 1.162 17919 28572 1 70 . 1 1 39 39 ASP N N 39 113.380 113.380 116.612 -3.232 17919 28573 1 70 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.360 0.070 17919 28574 1 70 . 1 1 39 39 ASP C C 39 177.090 177.090 178.523 -1.433 17919 28575 1 70 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.894 -1.254 17919 28576 1 70 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.086 -0.546 17919 28577 1 70 . 1 1 39 39 ASP H H 39 8.550 8.550 8.791 -0.241 17919 28578 1 70 . 1 1 40 40 GLN N N 40 116.780 116.780 116.456 0.324 17919 28579 1 70 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.612 -0.148 17919 28580 1 70 . 1 1 40 40 GLN C C 40 175.380 175.380 175.380 0.000 17919 28581 1 70 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.742 -0.103 17919 28582 1 70 . 1 1 40 40 GLN CB C 40 30.140 30.140 30.351 -0.211 17919 28583 1 70 . 1 1 40 40 GLN H H 40 7.820 7.820 8.096 -0.276 17919 28584 1 70 . 1 1 41 41 GLN N N 41 117.720 117.720 119.935 -2.215 17919 28585 1 70 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.546 -0.302 17919 28586 1 70 . 1 1 41 41 GLN C C 41 176.300 176.300 174.863 1.437 17919 28587 1 70 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.988 0.482 17919 28588 1 70 . 1 1 41 41 GLN CB C 41 31.650 31.650 30.025 1.625 17919 28589 1 70 . 1 1 41 41 GLN H H 41 7.480 7.480 7.688 -0.208 17919 28590 1 70 . 1 1 42 42 ARG N N 42 122.680 122.680 124.180 -1.500 17919 28591 1 70 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.678 -0.178 17919 28592 1 70 . 1 1 42 42 ARG C C 42 174.050 174.050 173.895 0.155 17919 28593 1 70 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.749 0.301 17919 28594 1 70 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.504 -1.754 17919 28595 1 70 . 1 1 42 42 ARG H H 42 8.530 8.530 8.605 -0.075 17919 28596 1 70 . 1 1 43 43 LEU N N 43 124.040 124.040 125.313 -1.273 17919 28597 1 70 . 1 1 43 43 LEU C C 43 175.290 175.290 174.570 0.720 17919 28598 1 70 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.255 -1.275 17919 28599 1 70 . 1 1 43 43 LEU CB C 43 45.790 45.790 45.753 0.037 17919 28600 1 70 . 1 1 43 43 LEU H H 43 8.820 8.820 8.665 0.155 17919 28601 1 70 . 1 1 44 44 ILE N N 44 121.920 121.920 124.464 -2.544 17919 28602 1 70 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.249 -0.257 17919 28603 1 70 . 1 1 44 44 ILE C C 44 176.060 176.060 174.081 1.979 17919 28604 1 70 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.726 -0.746 17919 28605 1 70 . 1 1 44 44 ILE CB C 44 41.420 41.420 42.225 -0.805 17919 28606 1 70 . 1 1 44 44 ILE H H 44 9.030 9.030 8.819 0.211 17919 28607 1 70 . 1 1 45 45 PHE N N 45 125.390 125.390 126.864 -1.474 17919 28608 1 70 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.998 0.047 17919 28609 1 70 . 1 1 45 45 PHE C C 45 174.470 174.470 174.781 -0.311 17919 28610 1 70 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.281 0.739 17919 28611 1 70 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.630 1.129 17919 28612 1 70 . 1 1 45 45 PHE H H 45 8.830 8.830 8.837 -0.007 17919 28613 1 70 . 1 1 46 46 ALA N N 46 132.200 132.200 128.815 3.385 17919 28614 1 70 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.610 0.080 17919 28615 1 70 . 1 1 46 46 ALA C C 46 177.290 177.290 177.744 -0.454 17919 28616 1 70 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.649 -0.109 17919 28617 1 70 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.652 -0.082 17919 28618 1 70 . 1 1 46 46 ALA H H 46 8.810 8.810 8.575 0.235 17919 28619 1 70 . 1 1 47 47 GLY N N 47 102.340 102.340 103.882 -1.542 17919 28620 1 70 . 1 1 47 47 GLY C C 47 173.810 173.810 174.264 -0.454 17919 28621 1 70 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.750 0.600 17919 28622 1 70 . 1 1 47 47 GLY H H 47 8.130 8.130 8.362 -0.232 17919 28623 1 70 . 1 1 48 48 LYS N N 48 121.570 121.570 122.714 -1.144 17919 28624 1 70 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.496 0.126 17919 28625 1 70 . 1 1 48 48 LYS C C 48 174.700 174.700 175.053 -0.353 17919 28626 1 70 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.842 -0.292 17919 28627 1 70 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.127 0.403 17919 28628 1 70 . 1 1 48 48 LYS H H 48 7.980 7.980 7.770 0.210 17919 28629 1 70 . 1 1 49 49 GLN N N 49 122.410 122.410 127.303 -4.893 17919 28630 1 70 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.451 0.109 17919 28631 1 70 . 1 1 49 49 GLN C C 49 175.670 175.670 175.762 -0.092 17919 28632 1 70 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.980 -0.240 17919 28633 1 70 . 1 1 49 49 GLN CB C 49 29.000 29.000 28.674 0.326 17919 28634 1 70 . 1 1 49 49 GLN H H 49 8.600 8.600 8.714 -0.114 17919 28635 1 70 . 1 1 50 50 LEU N N 50 125.520 125.520 129.056 -3.536 17919 28636 1 70 . 1 1 50 50 LEU HA H 50 4.090 4.090 3.927 0.163 17919 28637 1 70 . 1 1 50 50 LEU C C 50 176.660 176.660 176.427 0.233 17919 28638 1 70 . 1 1 50 50 LEU CA C 50 54.240 54.240 56.175 -1.935 17919 28639 1 70 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.081 -0.511 17919 28640 1 70 . 1 1 50 50 LEU H H 50 8.530 8.530 8.387 0.143 17919 28641 1 70 . 1 1 51 51 GLU N N 51 122.940 122.940 122.049 0.891 17919 28642 1 70 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.567 -0.079 17919 28643 1 70 . 1 1 51 51 GLU C C 51 175.870 175.870 176.526 -0.656 17919 28644 1 70 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.338 0.622 17919 28645 1 70 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.706 -0.136 17919 28646 1 70 . 1 1 51 51 GLU H H 51 8.400 8.400 8.024 0.376 17919 28647 1 70 . 1 1 52 52 ASP N N 52 120.030 120.030 123.224 -3.194 17919 28648 1 70 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.570 -0.211 17919 28649 1 70 . 1 1 52 52 ASP C C 52 177.330 177.330 177.697 -0.367 17919 28650 1 70 . 1 1 52 52 ASP CA C 52 56.960 56.960 56.603 0.357 17919 28651 1 70 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.981 -0.131 17919 28652 1 70 . 1 1 52 52 ASP H H 52 8.160 8.160 8.691 -0.531 17919 28653 1 70 . 1 1 53 53 GLY N N 53 106.660 106.660 106.442 0.218 17919 28654 1 70 . 1 1 53 53 GLY C C 53 174.870 174.870 174.528 0.342 17919 28655 1 70 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.153 0.017 17919 28656 1 70 . 1 1 53 53 GLY H H 53 9.390 9.390 8.480 0.910 17919 28657 1 70 . 1 1 54 54 ARG N N 54 119.050 119.050 120.097 -1.047 17919 28658 1 70 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.680 0.015 17919 28659 1 70 . 1 1 54 54 ARG C C 54 175.350 175.350 175.109 0.241 17919 28660 1 70 . 1 1 54 54 ARG CA C 54 54.390 54.390 52.060 2.330 17919 28661 1 70 . 1 1 54 54 ARG CB C 54 32.650 32.650 31.143 1.507 17919 28662 1 70 . 1 1 54 54 ARG H H 54 7.460 7.460 7.435 0.025 17919 28663 1 70 . 1 1 55 55 THR N N 55 108.400 108.400 112.576 -4.176 17919 28664 1 70 . 1 1 55 55 THR HA H 55 5.240 5.240 4.896 0.344 17919 28665 1 70 . 1 1 55 55 THR C C 55 176.560 176.560 175.891 0.669 17919 28666 1 70 . 1 1 55 55 THR CA C 55 59.690 59.690 60.078 -0.388 17919 28667 1 70 . 1 1 55 55 THR CB C 55 72.260 72.260 71.162 1.098 17919 28668 1 70 . 1 1 55 55 THR H H 55 8.730 8.730 7.998 0.732 17919 28669 1 70 . 1 1 56 56 LEU N N 56 117.920 117.920 120.511 -2.591 17919 28670 1 70 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.021 0.039 17919 28671 1 70 . 1 1 56 56 LEU C C 56 180.810 180.810 179.041 1.769 17919 28672 1 70 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.487 0.223 17919 28673 1 70 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.420 -1.050 17919 28674 1 70 . 1 1 56 56 LEU H H 56 8.140 8.140 8.638 -0.498 17919 28675 1 70 . 1 1 57 57 SER N N 57 113.330 113.330 115.880 -2.550 17919 28676 1 70 . 1 1 57 57 SER HA H 57 4.370 4.370 4.168 0.202 17919 28677 1 70 . 1 1 57 57 SER C C 57 178.310 178.310 176.903 1.407 17919 28678 1 70 . 1 1 57 57 SER CA C 57 61.080 61.080 62.370 -1.290 17919 28679 1 70 . 1 1 57 57 SER CB C 57 62.530 62.530 62.716 -0.186 17919 28680 1 70 . 1 1 57 57 SER H H 57 8.470 8.470 7.870 0.600 17919 28681 1 70 . 1 1 58 58 ASP N N 58 124.190 124.190 122.895 1.295 17919 28682 1 70 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.313 -0.017 17919 28683 1 70 . 1 1 58 58 ASP C C 58 177.400 177.400 177.933 -0.533 17919 28684 1 70 . 1 1 58 58 ASP CA C 58 57.180 57.180 57.321 -0.141 17919 28685 1 70 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.626 -0.526 17919 28686 1 70 . 1 1 58 58 ASP H H 58 7.930 7.930 7.871 0.059 17919 28687 1 70 . 1 1 59 59 TYR N N 59 115.510 115.510 115.369 0.141 17919 28688 1 70 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.673 -0.003 17919 28689 1 70 . 1 1 59 59 TYR C C 59 174.700 174.700 175.155 -0.455 17919 28690 1 70 . 1 1 59 59 TYR CA C 59 58.250 58.250 56.816 1.435 17919 28691 1 70 . 1 1 59 59 TYR CB C 59 40.070 40.070 37.580 2.490 17919 28692 1 70 . 1 1 59 59 TYR H H 59 7.250 7.250 7.415 -0.165 17919 28693 1 70 . 1 1 60 60 ASN N N 60 115.900 115.900 116.428 -0.528 17919 28694 1 70 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.409 -0.054 17919 28695 1 70 . 1 1 60 60 ASN C C 60 174.340 174.340 174.424 -0.084 17919 28696 1 70 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.254 -0.134 17919 28697 1 70 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.550 -0.140 17919 28698 1 70 . 1 1 60 60 ASN H H 60 8.150 8.150 7.880 0.270 17919 28699 1 70 . 1 1 61 61 ILE N N 61 118.600 118.600 120.010 -1.410 17919 28700 1 70 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.711 -0.318 17919 28701 1 70 . 1 1 61 61 ILE C C 61 174.610 174.610 175.569 -0.959 17919 28702 1 70 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.422 0.998 17919 28703 1 70 . 1 1 61 61 ILE CB C 61 36.740 36.740 35.380 1.360 17919 28704 1 70 . 1 1 61 61 ILE H H 61 7.250 7.250 8.001 -0.751 17919 28705 1 70 . 1 1 62 62 GLN N N 62 124.740 124.740 126.637 -1.897 17919 28706 1 70 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.471 0.035 17919 28707 1 70 . 1 1 62 62 GLN C C 62 175.970 175.970 175.811 0.159 17919 28708 1 70 . 1 1 62 62 GLN CA C 62 53.660 53.660 54.550 -0.890 17919 28709 1 70 . 1 1 62 62 GLN CB C 62 31.650 31.650 30.176 1.474 17919 28710 1 70 . 1 1 62 62 GLN H H 62 7.610 7.610 7.855 -0.245 17919 28711 1 70 . 1 1 63 63 LYS N N 63 120.300 120.300 120.130 0.170 17919 28712 1 70 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.838 0.163 17919 28713 1 70 . 1 1 63 63 LYS C C 63 175.810 175.810 176.497 -0.687 17919 28714 1 70 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.781 0.009 17919 28715 1 70 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.733 0.917 17919 28716 1 70 . 1 1 63 63 LYS H H 63 8.490 8.490 8.451 0.039 17919 28717 1 70 . 1 1 64 64 GLU N N 64 113.950 113.950 117.853 -3.903 17919 28718 1 70 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.476 -0.011 17919 28719 1 70 . 1 1 64 64 GLU C C 64 175.250 175.250 175.411 -0.161 17919 28720 1 70 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.728 0.162 17919 28721 1 70 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.291 -2.390 17919 28722 1 70 . 1 1 64 64 GLU H H 64 9.280 9.280 8.898 0.382 17919 28723 1 70 . 1 1 65 65 SER N N 65 114.730 114.730 116.035 -1.305 17919 28724 1 70 . 1 1 65 65 SER HA H 65 4.640 4.640 4.535 0.105 17919 28725 1 70 . 1 1 65 65 SER C C 65 172.160 172.160 174.018 -1.858 17919 28726 1 70 . 1 1 65 65 SER CA C 65 60.890 60.890 59.521 1.369 17919 28727 1 70 . 1 1 65 65 SER CB C 65 64.910 64.910 63.301 1.609 17919 28728 1 70 . 1 1 65 65 SER H H 65 7.670 7.670 7.627 0.043 17919 28729 1 70 . 1 1 66 66 THR N N 66 117.110 117.110 120.466 -3.356 17919 28730 1 70 . 1 1 66 66 THR HA H 66 5.270 5.270 4.508 0.762 17919 28731 1 70 . 1 1 66 66 THR C C 66 173.950 173.950 174.867 -0.917 17919 28732 1 70 . 1 1 66 66 THR CA C 66 62.340 62.340 64.250 -1.910 17919 28733 1 70 . 1 1 66 66 THR CB C 66 70.080 70.080 69.627 0.453 17919 28734 1 70 . 1 1 66 66 THR H H 66 8.730 8.730 8.328 0.402 17919 28735 1 70 . 1 1 67 67 LEU N N 67 127.110 127.110 127.284 -0.174 17919 28736 1 70 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.943 0.117 17919 28737 1 70 . 1 1 67 67 LEU C C 67 175.770 175.770 175.307 0.463 17919 28738 1 70 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.520 0.380 17919 28739 1 70 . 1 1 67 67 LEU CB C 67 44.260 44.260 45.816 -1.556 17919 28740 1 70 . 1 1 67 67 LEU H H 67 9.410 9.410 8.105 1.305 17919 28741 1 70 . 1 1 68 68 HIS N N 68 118.380 118.380 121.725 -3.345 17919 28742 1 70 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.429 -0.189 17919 28743 1 70 . 1 1 68 68 HIS C C 68 173.150 173.150 174.122 -0.972 17919 28744 1 70 . 1 1 68 68 HIS CA C 68 55.000 55.000 53.956 1.044 17919 28745 1 70 . 1 1 68 68 HIS CB C 68 30.530 30.530 31.390 -0.860 17919 28746 1 70 . 1 1 68 68 HIS H H 68 9.230 9.230 8.746 0.484 17919 28747 1 70 . 1 1 69 69 LEU N N 69 124.460 124.460 130.763 -6.303 17919 28748 1 70 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.795 0.395 17919 28749 1 70 . 1 1 69 69 LEU C C 69 175.270 175.270 174.857 0.413 17919 28750 1 70 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.575 -0.685 17919 28751 1 70 . 1 1 69 69 LEU CB C 69 44.380 44.380 43.301 1.079 17919 28752 1 70 . 1 1 69 69 LEU H H 69 8.340 8.340 7.989 0.351 17919 28753 1 70 . 1 1 70 70 VAL N N 70 126.940 126.940 123.634 3.306 17919 28754 1 70 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.501 -0.151 17919 28755 1 70 . 1 1 70 70 VAL C C 70 174.000 174.000 173.770 0.230 17919 28756 1 70 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.252 1.548 17919 28757 1 70 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.059 -0.149 17919 28758 1 70 . 1 1 70 70 VAL H H 70 9.200 9.200 8.880 0.320 17919 28759 1 70 . 1 1 71 71 LEU N N 71 123.130 123.130 123.154 -0.024 17919 28760 1 70 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.910 0.150 17919 28761 1 70 . 1 1 71 71 LEU C C 71 177.830 177.830 177.665 0.165 17919 28762 1 70 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.593 0.347 17919 28763 1 70 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.075 0.775 17919 28764 1 70 . 1 1 71 71 LEU H H 71 8.120 8.120 8.439 -0.319 17919 28765 1 70 . 1 1 72 72 ARG N N 72 123.490 123.490 125.633 -2.143 17919 28766 1 70 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.355 -0.054 17919 28767 1 70 . 1 1 72 72 ARG C C 72 175.350 175.350 175.504 -0.154 17919 28768 1 70 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.946 -0.336 17919 28769 1 70 . 1 1 72 72 ARG CB C 72 31.350 31.350 29.137 2.213 17919 28770 1 70 . 1 1 72 72 ARG H H 72 8.580 8.580 8.648 -0.068 17919 28771 1 71 . 1 1 2 2 GLN N N 2 123.220 123.220 119.656 3.564 17919 28772 1 71 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.372 -0.123 17919 28773 1 71 . 1 1 2 2 GLN C C 2 175.920 175.920 175.173 0.747 17919 28774 1 71 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.354 0.726 17919 28775 1 71 . 1 1 2 2 GLN CB C 2 30.760 30.760 31.067 -0.307 17919 28776 1 71 . 1 1 2 2 GLN H H 2 8.900 8.900 8.267 0.633 17919 28777 1 71 . 1 1 3 3 ILE N N 3 115.340 115.340 115.843 -0.503 17919 28778 1 71 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.435 -0.222 17919 28779 1 71 . 1 1 3 3 ILE C C 3 172.450 172.450 173.768 -1.318 17919 28780 1 71 . 1 1 3 3 ILE CA C 3 59.570 59.570 58.924 0.646 17919 28781 1 71 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.393 0.817 17919 28782 1 71 . 1 1 3 3 ILE H H 3 8.320 8.320 8.444 -0.124 17919 28783 1 71 . 1 1 4 4 PHE N N 4 118.110 118.110 117.893 0.217 17919 28784 1 71 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.434 0.196 17919 28785 1 71 . 1 1 4 4 PHE C C 4 175.320 175.320 175.744 -0.424 17919 28786 1 71 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.388 -0.178 17919 28787 1 71 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.202 -0.722 17919 28788 1 71 . 1 1 4 4 PHE H H 4 8.610 8.610 8.167 0.443 17919 28789 1 71 . 1 1 5 5 VAL N N 5 121.000 121.000 119.596 1.404 17919 28790 1 71 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.950 -0.225 17919 28791 1 71 . 1 1 5 5 VAL C C 5 174.870 174.870 174.470 0.400 17919 28792 1 71 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.236 -0.616 17919 28793 1 71 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.913 -0.683 17919 28794 1 71 . 1 1 5 5 VAL H H 5 9.300 9.300 9.159 0.141 17919 28795 1 71 . 1 1 6 6 LYS N N 6 127.520 127.520 128.761 -1.241 17919 28796 1 71 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.306 0.061 17919 28797 1 71 . 1 1 6 6 LYS C C 6 177.140 177.140 175.759 1.381 17919 28798 1 71 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.236 0.284 17919 28799 1 71 . 1 1 6 6 LYS CB C 6 35.050 35.050 36.148 -1.098 17919 28800 1 71 . 1 1 6 6 LYS H H 6 8.820 8.820 9.005 -0.185 17919 28801 1 71 . 1 1 7 7 THR N N 7 115.400 115.400 116.836 -1.436 17919 28802 1 71 . 1 1 7 7 THR HA H 7 4.970 4.970 4.435 0.535 17919 28803 1 71 . 1 1 7 7 THR C C 7 176.910 176.910 175.858 1.052 17919 28804 1 71 . 1 1 7 7 THR CA C 7 60.470 60.470 60.763 -0.293 17919 28805 1 71 . 1 1 7 7 THR CB C 7 70.630 70.630 70.480 0.150 17919 28806 1 71 . 1 1 7 7 THR H H 7 8.730 8.730 8.647 0.083 17919 28807 1 71 . 1 1 8 8 LEU N N 8 121.330 121.330 123.172 -1.842 17919 28808 1 71 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.373 -0.063 17919 28809 1 71 . 1 1 8 8 LEU C C 8 178.800 178.800 177.479 1.321 17919 28810 1 71 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.245 0.335 17919 28811 1 71 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.802 0.168 17919 28812 1 71 . 1 1 8 8 LEU H H 8 9.100 9.100 8.752 0.348 17919 28813 1 71 . 1 1 9 9 THR N N 9 105.590 105.590 109.093 -3.503 17919 28814 1 71 . 1 1 9 9 THR HA H 9 4.428 4.428 4.334 0.094 17919 28815 1 71 . 1 1 9 9 THR C C 9 175.520 175.520 175.737 -0.217 17919 28816 1 71 . 1 1 9 9 THR CA C 9 61.400 61.400 62.177 -0.777 17919 28817 1 71 . 1 1 9 9 THR CB C 9 69.140 69.140 70.200 -1.060 17919 28818 1 71 . 1 1 9 9 THR H H 9 7.630 7.630 7.633 -0.003 17919 28819 1 71 . 1 1 10 10 GLY N N 10 108.890 108.890 111.222 -2.332 17919 28820 1 71 . 1 1 10 10 GLY C C 10 174.070 174.070 173.284 0.786 17919 28821 1 71 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.711 0.749 17919 28822 1 71 . 1 1 10 10 GLY H H 10 7.810 7.810 7.757 0.053 17919 28823 1 71 . 1 1 11 11 LYS N N 11 121.600 121.600 122.935 -1.335 17919 28824 1 71 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.384 -0.023 17919 28825 1 71 . 1 1 11 11 LYS C C 11 175.940 175.940 175.195 0.745 17919 28826 1 71 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.404 -0.124 17919 28827 1 71 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.543 -0.343 17919 28828 1 71 . 1 1 11 11 LYS H H 11 7.280 7.280 7.897 -0.617 17919 28829 1 71 . 1 1 12 12 THR N N 12 120.440 120.440 119.656 0.784 17919 28830 1 71 . 1 1 12 12 THR HA H 12 5.046 5.046 5.471 -0.425 17919 28831 1 71 . 1 1 12 12 THR C C 12 174.320 174.320 174.486 -0.166 17919 28832 1 71 . 1 1 12 12 THR CA C 12 62.390 62.390 61.298 1.092 17919 28833 1 71 . 1 1 12 12 THR CB C 12 69.910 69.910 70.471 -0.561 17919 28834 1 71 . 1 1 12 12 THR H H 12 8.650 8.650 8.220 0.430 17919 28835 1 71 . 1 1 13 13 ILE N N 13 127.110 127.110 121.964 5.146 17919 28836 1 71 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.586 -0.042 17919 28837 1 71 . 1 1 13 13 ILE C C 13 175.220 175.220 174.082 1.138 17919 28838 1 71 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.395 -0.415 17919 28839 1 71 . 1 1 13 13 ILE CB C 13 40.950 40.950 42.565 -1.615 17919 28840 1 71 . 1 1 13 13 ILE H H 13 9.450 9.450 8.656 0.794 17919 28841 1 71 . 1 1 14 14 THR N N 14 121.520 121.520 118.973 2.547 17919 28842 1 71 . 1 1 14 14 THR HA H 14 4.964 4.964 5.051 -0.086 17919 28843 1 71 . 1 1 14 14 THR C C 14 173.790 173.790 173.289 0.501 17919 28844 1 71 . 1 1 14 14 THR CA C 14 61.940 61.940 60.718 1.222 17919 28845 1 71 . 1 1 14 14 THR CB C 14 69.650 69.650 70.142 -0.492 17919 28846 1 71 . 1 1 14 14 THR H H 14 8.710 8.710 8.409 0.301 17919 28847 1 71 . 1 1 15 15 LEU N N 15 124.800 124.800 125.846 -1.046 17919 28848 1 71 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.708 0.072 17919 28849 1 71 . 1 1 15 15 LEU C C 15 174.670 174.670 175.688 -1.018 17919 28850 1 71 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.440 -0.610 17919 28851 1 71 . 1 1 15 15 LEU CB C 15 47.070 47.070 44.951 2.119 17919 28852 1 71 . 1 1 15 15 LEU H H 15 8.710 8.710 8.457 0.253 17919 28853 1 71 . 1 1 16 16 GLU N N 16 122.160 122.160 125.181 -3.021 17919 28854 1 71 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.931 -0.014 17919 28855 1 71 . 1 1 16 16 GLU C C 16 175.860 175.860 175.889 -0.029 17919 28856 1 71 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.219 -0.399 17919 28857 1 71 . 1 1 16 16 GLU CB C 16 29.450 29.450 29.090 0.360 17919 28858 1 71 . 1 1 16 16 GLU H H 16 8.140 8.140 8.804 -0.664 17919 28859 1 71 . 1 1 17 17 VAL N N 17 117.210 117.210 121.109 -3.899 17919 28860 1 71 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.734 -0.020 17919 28861 1 71 . 1 1 17 17 VAL C C 17 174.160 174.160 174.800 -0.640 17919 28862 1 71 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.324 -0.894 17919 28863 1 71 . 1 1 17 17 VAL CB C 17 36.400 36.400 34.494 1.906 17919 28864 1 71 . 1 1 17 17 VAL H H 17 8.900 8.900 8.538 0.362 17919 28865 1 71 . 1 1 18 18 GLU N N 18 118.990 118.990 121.781 -2.791 17919 28866 1 71 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.865 0.214 17919 28867 1 71 . 1 1 18 18 GLU C C 18 176.160 176.160 175.863 0.297 17919 28868 1 71 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.141 -0.420 17919 28869 1 71 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.253 0.057 17919 28870 1 71 . 1 1 18 18 GLU H H 18 8.640 8.640 9.475 -0.835 17919 28871 1 71 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.337 -0.196 17919 28872 1 71 . 1 1 19 19 PRO C C 19 175.310 175.310 177.405 -2.095 17919 28873 1 71 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.242 0.228 17919 28874 1 71 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.080 -0.130 17919 28875 1 71 . 1 1 20 20 SER N N 20 103.400 103.400 110.193 -6.793 17919 28876 1 71 . 1 1 20 20 SER HA H 20 4.370 4.370 4.528 -0.158 17919 28877 1 71 . 1 1 20 20 SER C C 20 174.660 174.660 173.554 1.106 17919 28878 1 71 . 1 1 20 20 SER CA C 20 57.400 57.400 58.534 -1.134 17919 28879 1 71 . 1 1 20 20 SER CB C 20 63.370 63.370 63.252 0.118 17919 28880 1 71 . 1 1 20 20 SER H H 20 7.040 7.040 8.057 -1.017 17919 28881 1 71 . 1 1 21 21 ASP N N 21 123.480 123.480 123.838 -0.358 17919 28882 1 71 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.593 0.102 17919 28883 1 71 . 1 1 21 21 ASP C C 21 176.360 176.360 175.943 0.417 17919 28884 1 71 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.225 0.475 17919 28885 1 71 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.410 -0.610 17919 28886 1 71 . 1 1 21 21 ASP H H 21 8.030 8.030 7.711 0.319 17919 28887 1 71 . 1 1 22 22 THR N N 22 108.800 108.800 112.354 -3.554 17919 28888 1 71 . 1 1 22 22 THR HA H 22 4.920 4.920 4.570 0.350 17919 28889 1 71 . 1 1 22 22 THR C C 22 176.750 176.750 176.236 0.514 17919 28890 1 71 . 1 1 22 22 THR CA C 22 59.690 59.690 61.826 -2.136 17919 28891 1 71 . 1 1 22 22 THR CB C 22 71.200 71.200 70.181 1.019 17919 28892 1 71 . 1 1 22 22 THR H H 22 7.900 7.900 8.479 -0.579 17919 28893 1 71 . 1 1 23 23 ILE N N 23 121.190 121.190 123.712 -2.522 17919 28894 1 71 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.652 0.005 17919 28895 1 71 . 1 1 23 23 ILE C C 23 179.040 179.040 177.774 1.266 17919 28896 1 71 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.306 -1.046 17919 28897 1 71 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.450 -2.100 17919 28898 1 71 . 1 1 23 23 ILE H H 23 8.560 8.560 9.161 -0.601 17919 28899 1 71 . 1 1 24 24 GLU N N 24 120.830 120.830 119.791 1.039 17919 28900 1 71 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.894 0.023 17919 28901 1 71 . 1 1 24 24 GLU C C 24 178.640 178.640 178.906 -0.266 17919 28902 1 71 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.597 0.623 17919 28903 1 71 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.505 -1.225 17919 28904 1 71 . 1 1 24 24 GLU H H 24 9.760 9.760 8.357 1.403 17919 28905 1 71 . 1 1 25 25 ASN N N 25 120.570 120.570 117.362 3.208 17919 28906 1 71 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.499 0.026 17919 28907 1 71 . 1 1 25 25 ASN C C 25 178.380 178.380 178.068 0.312 17919 28908 1 71 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.955 0.105 17919 28909 1 71 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.329 0.121 17919 28910 1 71 . 1 1 25 25 ASN H H 25 7.920 7.920 7.818 0.102 17919 28911 1 71 . 1 1 26 26 VAL N N 26 121.710 121.710 119.482 2.228 17919 28912 1 71 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.521 -0.124 17919 28913 1 71 . 1 1 26 26 VAL C C 26 177.950 177.950 177.674 0.276 17919 28914 1 71 . 1 1 26 26 VAL CA C 26 67.660 67.660 67.072 0.588 17919 28915 1 71 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.186 -0.346 17919 28916 1 71 . 1 1 26 26 VAL H H 26 8.070 8.070 7.763 0.306 17919 28917 1 71 . 1 1 27 27 LYS N N 27 118.860 118.860 119.846 -0.986 17919 28918 1 71 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.165 0.415 17919 28919 1 71 . 1 1 27 27 LYS C C 27 180.550 180.550 178.875 1.675 17919 28920 1 71 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.443 -0.193 17919 28921 1 71 . 1 1 27 27 LYS CB C 27 33.730 33.730 31.962 1.768 17919 28922 1 71 . 1 1 27 27 LYS H H 27 8.560 8.560 7.630 0.930 17919 28923 1 71 . 1 1 28 28 ALA N N 28 123.440 123.440 122.279 1.161 17919 28924 1 71 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.092 0.068 17919 28925 1 71 . 1 1 28 28 ALA C C 28 180.300 180.300 179.076 1.224 17919 28926 1 71 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.180 0.190 17919 28927 1 71 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.336 -0.626 17919 28928 1 71 . 1 1 28 28 ALA H H 28 8.060 8.060 7.682 0.378 17919 28929 1 71 . 1 1 29 29 LYS N N 29 119.940 119.940 119.751 0.189 17919 28930 1 71 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.387 -0.180 17919 28931 1 71 . 1 1 29 29 LYS C C 29 180.320 180.320 179.410 0.910 17919 28932 1 71 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.183 0.467 17919 28933 1 71 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.387 0.903 17919 28934 1 71 . 1 1 29 29 LYS H H 29 7.850 7.850 7.469 0.381 17919 28935 1 71 . 1 1 30 30 ILE N N 30 121.080 121.080 120.564 0.516 17919 28936 1 71 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.663 -0.156 17919 28937 1 71 . 1 1 30 30 ILE C C 30 178.310 178.310 177.200 1.110 17919 28938 1 71 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.131 1.019 17919 28939 1 71 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.786 -0.986 17919 28940 1 71 . 1 1 30 30 ILE H H 30 8.280 8.280 8.641 -0.361 17919 28941 1 71 . 1 1 31 31 GLN N N 31 123.490 123.490 121.352 2.138 17919 28942 1 71 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.963 -0.134 17919 28943 1 71 . 1 1 31 31 GLN C C 31 178.890 178.890 178.217 0.673 17919 28944 1 71 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.301 0.699 17919 28945 1 71 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.358 -0.638 17919 28946 1 71 . 1 1 31 31 GLN H H 31 8.580 8.580 7.913 0.667 17919 28947 1 71 . 1 1 32 32 ASP N N 32 119.360 119.360 119.259 0.101 17919 28948 1 71 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.450 -0.096 17919 28949 1 71 . 1 1 32 32 ASP C C 32 177.250 177.250 177.922 -0.672 17919 28950 1 71 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.629 0.561 17919 28951 1 71 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.373 0.207 17919 28952 1 71 . 1 1 32 32 ASP H H 32 8.010 8.010 8.463 -0.453 17919 28953 1 71 . 1 1 33 33 LYS N N 33 115.130 115.130 118.629 -3.499 17919 28954 1 71 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.347 -0.010 17919 28955 1 71 . 1 1 33 33 LYS C C 33 177.870 177.870 177.948 -0.078 17919 28956 1 71 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.725 0.325 17919 28957 1 71 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.191 0.979 17919 28958 1 71 . 1 1 33 33 LYS H H 33 7.430 7.430 7.393 0.037 17919 28959 1 71 . 1 1 34 34 GLU N N 34 113.870 113.870 114.975 -1.105 17919 28960 1 71 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.509 0.116 17919 28961 1 71 . 1 1 34 34 GLU C C 34 177.840 177.840 177.461 0.379 17919 28962 1 71 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.421 -0.251 17919 28963 1 71 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.499 1.161 17919 28964 1 71 . 1 1 34 34 GLU H H 34 8.740 8.740 8.283 0.457 17919 28965 1 71 . 1 1 35 35 GLY N N 35 108.650 108.650 109.167 -0.517 17919 28966 1 71 . 1 1 35 35 GLY C C 35 173.960 173.960 174.078 -0.118 17919 28967 1 71 . 1 1 35 35 GLY CA C 35 46.080 46.080 46.251 -0.171 17919 28968 1 71 . 1 1 35 35 GLY H H 35 8.530 8.530 8.450 0.080 17919 28969 1 71 . 1 1 36 36 ILE N N 36 119.880 119.880 116.348 3.532 17919 28970 1 71 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.700 -0.255 17919 28971 1 71 . 1 1 36 36 ILE C C 36 173.590 173.590 173.469 0.121 17919 28972 1 71 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.277 0.473 17919 28973 1 71 . 1 1 36 36 ILE CB C 36 40.580 40.580 40.145 0.435 17919 28974 1 71 . 1 1 36 36 ILE H H 36 6.150 6.150 7.430 -1.280 17919 28975 1 71 . 1 1 37 37 PRO HA H 37 4.634 4.634 5.027 -0.393 17919 28976 1 71 . 1 1 37 37 PRO C C 37 176.940 176.940 176.229 0.711 17919 28977 1 71 . 1 1 37 37 PRO CA C 37 61.660 61.660 60.795 0.865 17919 28978 1 71 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.336 0.514 17919 28979 1 71 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.154 -0.037 17919 28980 1 71 . 1 1 38 38 PRO C C 38 178.320 178.320 178.556 -0.236 17919 28981 1 71 . 1 1 38 38 PRO CA C 38 66.260 66.260 66.026 0.234 17919 28982 1 71 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.634 1.256 17919 28983 1 71 . 1 1 39 39 ASP N N 39 113.380 113.380 116.347 -2.967 17919 28984 1 71 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.397 0.033 17919 28985 1 71 . 1 1 39 39 ASP C C 39 177.090 177.090 178.088 -0.998 17919 28986 1 71 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.882 -1.242 17919 28987 1 71 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.320 -0.780 17919 28988 1 71 . 1 1 39 39 ASP H H 39 8.550 8.550 8.681 -0.131 17919 28989 1 71 . 1 1 40 40 GLN N N 40 116.780 116.780 118.570 -1.790 17919 28990 1 71 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.258 0.206 17919 28991 1 71 . 1 1 40 40 GLN C C 40 175.380 175.380 175.861 -0.481 17919 28992 1 71 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.421 -0.781 17919 28993 1 71 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.356 0.784 17919 28994 1 71 . 1 1 40 40 GLN H H 40 7.820 7.820 7.591 0.229 17919 28995 1 71 . 1 1 41 41 GLN N N 41 117.720 117.720 120.297 -2.577 17919 28996 1 71 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.338 -0.094 17919 28997 1 71 . 1 1 41 41 GLN C C 41 176.300 176.300 175.430 0.870 17919 28998 1 71 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.958 -0.488 17919 28999 1 71 . 1 1 41 41 GLN CB C 41 31.650 31.650 28.896 2.754 17919 29000 1 71 . 1 1 41 41 GLN H H 41 7.480 7.480 7.396 0.084 17919 29001 1 71 . 1 1 42 42 ARG N N 42 122.680 122.680 124.324 -1.644 17919 29002 1 71 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.564 -0.064 17919 29003 1 71 . 1 1 42 42 ARG C C 42 174.050 174.050 174.354 -0.304 17919 29004 1 71 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.095 -0.045 17919 29005 1 71 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.123 -0.373 17919 29006 1 71 . 1 1 42 42 ARG H H 42 8.530 8.530 8.435 0.095 17919 29007 1 71 . 1 1 43 43 LEU N N 43 124.040 124.040 126.333 -2.293 17919 29008 1 71 . 1 1 43 43 LEU C C 43 175.290 175.290 175.321 -0.031 17919 29009 1 71 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.310 -0.330 17919 29010 1 71 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.303 1.488 17919 29011 1 71 . 1 1 43 43 LEU H H 43 8.820 8.820 8.803 0.017 17919 29012 1 71 . 1 1 44 44 ILE N N 44 121.920 121.920 125.719 -3.799 17919 29013 1 71 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.990 0.002 17919 29014 1 71 . 1 1 44 44 ILE C C 44 176.060 176.060 174.122 1.938 17919 29015 1 71 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.542 -1.562 17919 29016 1 71 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.487 -0.067 17919 29017 1 71 . 1 1 44 44 ILE H H 44 9.030 9.030 8.601 0.429 17919 29018 1 71 . 1 1 45 45 PHE N N 45 125.390 125.390 127.160 -1.770 17919 29019 1 71 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.987 0.058 17919 29020 1 71 . 1 1 45 45 PHE C C 45 174.470 174.470 174.290 0.180 17919 29021 1 71 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.503 0.517 17919 29022 1 71 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.033 0.727 17919 29023 1 71 . 1 1 45 45 PHE H H 45 8.830 8.830 9.131 -0.301 17919 29024 1 71 . 1 1 46 46 ALA N N 46 132.200 132.200 129.740 2.460 17919 29025 1 71 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.622 0.068 17919 29026 1 71 . 1 1 46 46 ALA C C 46 177.290 177.290 177.578 -0.288 17919 29027 1 71 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.517 0.022 17919 29028 1 71 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.269 0.301 17919 29029 1 71 . 1 1 46 46 ALA H H 46 8.810 8.810 8.944 -0.134 17919 29030 1 71 . 1 1 47 47 GLY N N 47 102.340 102.340 103.778 -1.438 17919 29031 1 71 . 1 1 47 47 GLY C C 47 173.810 173.810 174.406 -0.596 17919 29032 1 71 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.086 0.264 17919 29033 1 71 . 1 1 47 47 GLY H H 47 8.130 8.130 8.492 -0.362 17919 29034 1 71 . 1 1 48 48 LYS N N 48 121.570 121.570 121.663 -0.093 17919 29035 1 71 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.472 0.150 17919 29036 1 71 . 1 1 48 48 LYS C C 48 174.700 174.700 175.941 -1.241 17919 29037 1 71 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.265 -0.715 17919 29038 1 71 . 1 1 48 48 LYS CB C 48 34.530 34.530 33.367 1.163 17919 29039 1 71 . 1 1 48 48 LYS H H 48 7.980 7.980 7.709 0.271 17919 29040 1 71 . 1 1 49 49 GLN N N 49 122.410 122.410 121.775 0.635 17919 29041 1 71 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.828 -0.268 17919 29042 1 71 . 1 1 49 49 GLN C C 49 175.670 175.670 175.884 -0.214 17919 29043 1 71 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.684 0.056 17919 29044 1 71 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.988 -0.988 17919 29045 1 71 . 1 1 49 49 GLN H H 49 8.600 8.600 8.600 0.000 17919 29046 1 71 . 1 1 50 50 LEU N N 50 125.520 125.520 124.903 0.617 17919 29047 1 71 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.146 -0.056 17919 29048 1 71 . 1 1 50 50 LEU C C 50 176.660 176.660 175.858 0.802 17919 29049 1 71 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.375 0.865 17919 29050 1 71 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.729 -0.159 17919 29051 1 71 . 1 1 50 50 LEU H H 50 8.530 8.530 8.615 -0.085 17919 29052 1 71 . 1 1 51 51 GLU N N 51 122.940 122.940 125.079 -2.139 17919 29053 1 71 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.161 0.327 17919 29054 1 71 . 1 1 51 51 GLU C C 51 175.870 175.870 177.377 -1.507 17919 29055 1 71 . 1 1 51 51 GLU CA C 51 55.960 55.960 56.843 -0.883 17919 29056 1 71 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.097 0.473 17919 29057 1 71 . 1 1 51 51 GLU H H 51 8.400 8.400 8.220 0.180 17919 29058 1 71 . 1 1 52 52 ASP N N 52 120.030 120.030 125.371 -5.341 17919 29059 1 71 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.454 -0.095 17919 29060 1 71 . 1 1 52 52 ASP C C 52 177.330 177.330 177.904 -0.574 17919 29061 1 71 . 1 1 52 52 ASP CA C 52 56.960 56.960 58.078 -1.118 17919 29062 1 71 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.829 0.021 17919 29063 1 71 . 1 1 52 52 ASP H H 52 8.160 8.160 8.859 -0.699 17919 29064 1 71 . 1 1 53 53 GLY N N 53 106.660 106.660 104.832 1.828 17919 29065 1 71 . 1 1 53 53 GLY C C 53 174.870 174.870 174.390 0.480 17919 29066 1 71 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.826 0.344 17919 29067 1 71 . 1 1 53 53 GLY H H 53 9.390 9.390 8.377 1.013 17919 29068 1 71 . 1 1 54 54 ARG N N 54 119.050 119.050 121.958 -2.908 17919 29069 1 71 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.488 0.207 17919 29070 1 71 . 1 1 54 54 ARG C C 54 175.350 175.350 176.230 -0.880 17919 29071 1 71 . 1 1 54 54 ARG CA C 54 54.390 54.390 55.577 -1.187 17919 29072 1 71 . 1 1 54 54 ARG CB C 54 32.650 32.650 31.534 1.116 17919 29073 1 71 . 1 1 54 54 ARG H H 54 7.460 7.460 7.528 -0.068 17919 29074 1 71 . 1 1 55 55 THR N N 55 108.400 108.400 112.477 -4.077 17919 29075 1 71 . 1 1 55 55 THR HA H 55 5.240 5.240 4.628 0.612 17919 29076 1 71 . 1 1 55 55 THR C C 55 176.560 176.560 176.369 0.191 17919 29077 1 71 . 1 1 55 55 THR CA C 55 59.690 59.690 61.441 -1.751 17919 29078 1 71 . 1 1 55 55 THR CB C 55 72.260 72.260 70.361 1.899 17919 29079 1 71 . 1 1 55 55 THR H H 55 8.730 8.730 8.924 -0.194 17919 29080 1 71 . 1 1 56 56 LEU N N 56 117.920 117.920 121.010 -3.090 17919 29081 1 71 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.065 -0.005 17919 29082 1 71 . 1 1 56 56 LEU C C 56 180.810 180.810 179.046 1.764 17919 29083 1 71 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.383 0.327 17919 29084 1 71 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.619 -1.249 17919 29085 1 71 . 1 1 56 56 LEU H H 56 8.140 8.140 8.314 -0.174 17919 29086 1 71 . 1 1 57 57 SER N N 57 113.330 113.330 112.670 0.660 17919 29087 1 71 . 1 1 57 57 SER HA H 57 4.370 4.370 4.248 0.122 17919 29088 1 71 . 1 1 57 57 SER C C 57 178.310 178.310 175.729 2.581 17919 29089 1 71 . 1 1 57 57 SER CA C 57 61.080 61.080 60.544 0.536 17919 29090 1 71 . 1 1 57 57 SER CB C 57 62.530 62.530 62.631 -0.101 17919 29091 1 71 . 1 1 57 57 SER H H 57 8.470 8.470 8.197 0.273 17919 29092 1 71 . 1 1 58 58 ASP N N 58 124.190 124.190 123.174 1.016 17919 29093 1 71 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.331 -0.035 17919 29094 1 71 . 1 1 58 58 ASP C C 58 177.400 177.400 176.623 0.777 17919 29095 1 71 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.652 0.528 17919 29096 1 71 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.555 -0.455 17919 29097 1 71 . 1 1 58 58 ASP H H 58 7.930 7.930 7.881 0.049 17919 29098 1 71 . 1 1 59 59 TYR N N 59 115.510 115.510 115.046 0.464 17919 29099 1 71 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.673 -0.003 17919 29100 1 71 . 1 1 59 59 TYR C C 59 174.700 174.700 175.456 -0.756 17919 29101 1 71 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.375 0.875 17919 29102 1 71 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.533 1.537 17919 29103 1 71 . 1 1 59 59 TYR H H 59 7.250 7.250 7.454 -0.204 17919 29104 1 71 . 1 1 60 60 ASN N N 60 115.900 115.900 117.911 -2.011 17919 29105 1 71 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.398 -0.043 17919 29106 1 71 . 1 1 60 60 ASN C C 60 174.340 174.340 174.502 -0.162 17919 29107 1 71 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.236 -0.116 17919 29108 1 71 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.229 0.181 17919 29109 1 71 . 1 1 60 60 ASN H H 60 8.150 8.150 7.921 0.229 17919 29110 1 71 . 1 1 61 61 ILE N N 61 118.600 118.600 120.497 -1.897 17919 29111 1 71 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.720 -0.327 17919 29112 1 71 . 1 1 61 61 ILE C C 61 174.610 174.610 175.288 -0.678 17919 29113 1 71 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.270 0.150 17919 29114 1 71 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.667 -0.927 17919 29115 1 71 . 1 1 61 61 ILE H H 61 7.250 7.250 7.952 -0.702 17919 29116 1 71 . 1 1 62 62 GLN N N 62 124.740 124.740 126.463 -1.723 17919 29117 1 71 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.682 -0.176 17919 29118 1 71 . 1 1 62 62 GLN C C 62 175.970 175.970 175.291 0.679 17919 29119 1 71 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.655 0.005 17919 29120 1 71 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.888 -0.238 17919 29121 1 71 . 1 1 62 62 GLN H H 62 7.610 7.610 8.162 -0.552 17919 29122 1 71 . 1 1 63 63 LYS N N 63 120.300 120.300 120.524 -0.224 17919 29123 1 71 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.841 0.160 17919 29124 1 71 . 1 1 63 63 LYS C C 63 175.810 175.810 176.837 -1.027 17919 29125 1 71 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.915 -0.125 17919 29126 1 71 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.963 0.687 17919 29127 1 71 . 1 1 63 63 LYS H H 63 8.490 8.490 8.548 -0.058 17919 29128 1 71 . 1 1 64 64 GLU N N 64 113.950 113.950 119.799 -5.849 17919 29129 1 71 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.522 -0.057 17919 29130 1 71 . 1 1 64 64 GLU C C 64 175.250 175.250 175.129 0.121 17919 29131 1 71 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.276 0.614 17919 29132 1 71 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.046 -2.146 17919 29133 1 71 . 1 1 64 64 GLU H H 64 9.280 9.280 8.650 0.630 17919 29134 1 71 . 1 1 65 65 SER N N 65 114.730 114.730 115.386 -0.656 17919 29135 1 71 . 1 1 65 65 SER HA H 65 4.640 4.640 4.443 0.197 17919 29136 1 71 . 1 1 65 65 SER C C 65 172.160 172.160 174.097 -1.937 17919 29137 1 71 . 1 1 65 65 SER CA C 65 60.890 60.890 59.447 1.443 17919 29138 1 71 . 1 1 65 65 SER CB C 65 64.910 64.910 63.832 1.078 17919 29139 1 71 . 1 1 65 65 SER H H 65 7.670 7.670 7.543 0.127 17919 29140 1 71 . 1 1 66 66 THR N N 66 117.110 117.110 119.913 -2.803 17919 29141 1 71 . 1 1 66 66 THR HA H 66 5.270 5.270 4.602 0.668 17919 29142 1 71 . 1 1 66 66 THR C C 66 173.950 173.950 173.302 0.648 17919 29143 1 71 . 1 1 66 66 THR CA C 66 62.340 62.340 61.862 0.478 17919 29144 1 71 . 1 1 66 66 THR CB C 66 70.080 70.080 69.781 0.299 17919 29145 1 71 . 1 1 66 66 THR H H 66 8.730 8.730 8.458 0.272 17919 29146 1 71 . 1 1 67 67 LEU N N 67 127.110 127.110 127.978 -0.868 17919 29147 1 71 . 1 1 67 67 LEU HA H 67 5.060 5.060 5.000 0.060 17919 29148 1 71 . 1 1 67 67 LEU C C 67 175.770 175.770 175.869 -0.099 17919 29149 1 71 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.000 -0.100 17919 29150 1 71 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.302 0.958 17919 29151 1 71 . 1 1 67 67 LEU H H 67 9.410 9.410 8.145 1.266 17919 29152 1 71 . 1 1 68 68 HIS N N 68 118.380 118.380 123.209 -4.829 17919 29153 1 71 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.679 -0.439 17919 29154 1 71 . 1 1 68 68 HIS C C 68 173.150 173.150 174.165 -1.015 17919 29155 1 71 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.665 0.335 17919 29156 1 71 . 1 1 68 68 HIS CB C 68 30.530 30.530 33.119 -2.589 17919 29157 1 71 . 1 1 68 68 HIS H H 68 9.230 9.230 9.093 0.137 17919 29158 1 71 . 1 1 69 69 LEU N N 69 124.460 124.460 122.661 1.799 17919 29159 1 71 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.110 0.080 17919 29160 1 71 . 1 1 69 69 LEU C C 69 175.270 175.270 174.088 1.182 17919 29161 1 71 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.387 -0.497 17919 29162 1 71 . 1 1 69 69 LEU CB C 69 44.380 44.380 46.179 -1.799 17919 29163 1 71 . 1 1 69 69 LEU H H 69 8.340 8.340 7.226 1.114 17919 29164 1 71 . 1 1 70 70 VAL N N 70 126.940 126.940 119.523 7.417 17919 29165 1 71 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.661 -0.311 17919 29166 1 71 . 1 1 70 70 VAL C C 70 174.000 174.000 173.925 0.075 17919 29167 1 71 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.779 1.021 17919 29168 1 71 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.739 -0.829 17919 29169 1 71 . 1 1 70 70 VAL H H 70 9.200 9.200 8.755 0.445 17919 29170 1 71 . 1 1 71 71 LEU N N 71 123.130 123.130 122.116 1.014 17919 29171 1 71 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.990 0.070 17919 29172 1 71 . 1 1 71 71 LEU C C 71 177.830 177.830 177.089 0.741 17919 29173 1 71 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.714 0.226 17919 29174 1 71 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.689 -0.839 17919 29175 1 71 . 1 1 71 71 LEU H H 71 8.120 8.120 8.399 -0.279 17919 29176 1 71 . 1 1 72 72 ARG N N 72 123.490 123.490 124.810 -1.320 17919 29177 1 71 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.532 -0.231 17919 29178 1 71 . 1 1 72 72 ARG C C 72 175.350 175.350 175.549 -0.199 17919 29179 1 71 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.448 0.162 17919 29180 1 71 . 1 1 72 72 ARG CB C 72 31.350 31.350 28.835 2.515 17919 29181 1 71 . 1 1 72 72 ARG H H 72 8.580 8.580 8.547 0.033 17919 29182 1 72 . 1 1 2 2 GLN N N 2 123.220 123.220 121.459 1.761 17919 29183 1 72 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.259 -0.010 17919 29184 1 72 . 1 1 2 2 GLN C C 2 175.920 175.920 175.513 0.407 17919 29185 1 72 . 1 1 2 2 GLN CA C 2 55.080 55.080 55.008 0.072 17919 29186 1 72 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.620 0.140 17919 29187 1 72 . 1 1 2 2 GLN H H 2 8.900 8.900 8.406 0.494 17919 29188 1 72 . 1 1 3 3 ILE N N 3 115.340 115.340 117.865 -2.525 17919 29189 1 72 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.349 -0.136 17919 29190 1 72 . 1 1 3 3 ILE C C 3 172.450 172.450 173.568 -1.118 17919 29191 1 72 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.154 0.416 17919 29192 1 72 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.027 1.183 17919 29193 1 72 . 1 1 3 3 ILE H H 3 8.320 8.320 8.336 -0.016 17919 29194 1 72 . 1 1 4 4 PHE N N 4 118.110 118.110 121.958 -3.848 17919 29195 1 72 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.092 0.538 17919 29196 1 72 . 1 1 4 4 PHE C C 4 175.320 175.320 175.232 0.088 17919 29197 1 72 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.686 -0.476 17919 29198 1 72 . 1 1 4 4 PHE CB C 4 41.480 41.480 40.546 0.934 17919 29199 1 72 . 1 1 4 4 PHE H H 4 8.610 8.610 8.665 -0.055 17919 29200 1 72 . 1 1 5 5 VAL N N 5 121.000 121.000 118.284 2.716 17919 29201 1 72 . 1 1 5 5 VAL HA H 5 4.725 4.725 5.154 -0.429 17919 29202 1 72 . 1 1 5 5 VAL C C 5 174.870 174.870 174.705 0.165 17919 29203 1 72 . 1 1 5 5 VAL CA C 5 60.620 60.620 60.193 0.427 17919 29204 1 72 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.716 0.514 17919 29205 1 72 . 1 1 5 5 VAL H H 5 9.300 9.300 8.386 0.914 17919 29206 1 72 . 1 1 6 6 LYS N N 6 127.520 127.520 129.021 -1.501 17919 29207 1 72 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.155 0.212 17919 29208 1 72 . 1 1 6 6 LYS C C 6 177.140 177.140 176.731 0.409 17919 29209 1 72 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.631 -0.111 17919 29210 1 72 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.793 -0.743 17919 29211 1 72 . 1 1 6 6 LYS H H 6 8.820 8.820 9.318 -0.498 17919 29212 1 72 . 1 1 7 7 THR N N 7 115.400 115.400 117.053 -1.653 17919 29213 1 72 . 1 1 7 7 THR HA H 7 4.970 4.970 4.528 0.442 17919 29214 1 72 . 1 1 7 7 THR C C 7 176.910 176.910 176.175 0.735 17919 29215 1 72 . 1 1 7 7 THR CA C 7 60.470 60.470 61.814 -1.344 17919 29216 1 72 . 1 1 7 7 THR CB C 7 70.630 70.630 70.114 0.516 17919 29217 1 72 . 1 1 7 7 THR H H 7 8.730 8.730 8.453 0.277 17919 29218 1 72 . 1 1 8 8 LEU N N 8 121.330 121.330 121.243 0.087 17919 29219 1 72 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.557 -0.247 17919 29220 1 72 . 1 1 8 8 LEU C C 8 178.800 178.800 177.723 1.077 17919 29221 1 72 . 1 1 8 8 LEU CA C 8 57.580 57.580 56.799 0.781 17919 29222 1 72 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.287 -0.317 17919 29223 1 72 . 1 1 8 8 LEU H H 8 9.100 9.100 8.800 0.300 17919 29224 1 72 . 1 1 9 9 THR N N 9 105.590 105.590 110.006 -4.416 17919 29225 1 72 . 1 1 9 9 THR HA H 9 4.428 4.428 4.356 0.072 17919 29226 1 72 . 1 1 9 9 THR C C 9 175.520 175.520 175.650 -0.130 17919 29227 1 72 . 1 1 9 9 THR CA C 9 61.400 61.400 62.078 -0.678 17919 29228 1 72 . 1 1 9 9 THR CB C 9 69.140 69.140 70.043 -0.904 17919 29229 1 72 . 1 1 9 9 THR H H 9 7.630 7.630 7.641 -0.011 17919 29230 1 72 . 1 1 10 10 GLY N N 10 108.890 108.890 111.640 -2.750 17919 29231 1 72 . 1 1 10 10 GLY C C 10 174.070 174.070 173.896 0.174 17919 29232 1 72 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.865 0.595 17919 29233 1 72 . 1 1 10 10 GLY H H 10 7.810 7.810 7.676 0.134 17919 29234 1 72 . 1 1 11 11 LYS N N 11 121.600 121.600 122.892 -1.292 17919 29235 1 72 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.419 -0.058 17919 29236 1 72 . 1 1 11 11 LYS C C 11 175.940 175.940 175.470 0.470 17919 29237 1 72 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.142 0.138 17919 29238 1 72 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.183 0.017 17919 29239 1 72 . 1 1 11 11 LYS H H 11 7.280 7.280 7.942 -0.662 17919 29240 1 72 . 1 1 12 12 THR N N 12 120.440 120.440 121.751 -1.311 17919 29241 1 72 . 1 1 12 12 THR HA H 12 5.046 5.046 4.705 0.341 17919 29242 1 72 . 1 1 12 12 THR C C 12 174.320 174.320 174.350 -0.030 17919 29243 1 72 . 1 1 12 12 THR CA C 12 62.390 62.390 62.042 0.348 17919 29244 1 72 . 1 1 12 12 THR CB C 12 69.910 69.910 69.774 0.136 17919 29245 1 72 . 1 1 12 12 THR H H 12 8.650 8.650 8.369 0.281 17919 29246 1 72 . 1 1 13 13 ILE N N 13 127.110 127.110 126.409 0.701 17919 29247 1 72 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.478 0.066 17919 29248 1 72 . 1 1 13 13 ILE C C 13 175.220 175.220 175.151 0.069 17919 29249 1 72 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.407 -0.427 17919 29250 1 72 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.451 0.499 17919 29251 1 72 . 1 1 13 13 ILE H H 13 9.450 9.450 8.631 0.819 17919 29252 1 72 . 1 1 14 14 THR N N 14 121.520 121.520 120.133 1.387 17919 29253 1 72 . 1 1 14 14 THR HA H 14 4.964 4.964 4.693 0.271 17919 29254 1 72 . 1 1 14 14 THR C C 14 173.790 173.790 172.894 0.896 17919 29255 1 72 . 1 1 14 14 THR CA C 14 61.940 61.940 61.607 0.333 17919 29256 1 72 . 1 1 14 14 THR CB C 14 69.650 69.650 68.947 0.703 17919 29257 1 72 . 1 1 14 14 THR H H 14 8.710 8.710 8.519 0.191 17919 29258 1 72 . 1 1 15 15 LEU N N 15 124.800 124.800 128.503 -3.703 17919 29259 1 72 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.769 0.011 17919 29260 1 72 . 1 1 15 15 LEU C C 15 174.670 174.670 174.700 -0.030 17919 29261 1 72 . 1 1 15 15 LEU CA C 15 52.830 52.830 54.205 -1.375 17919 29262 1 72 . 1 1 15 15 LEU CB C 15 47.070 47.070 44.891 2.179 17919 29263 1 72 . 1 1 15 15 LEU H H 15 8.710 8.710 8.121 0.589 17919 29264 1 72 . 1 1 16 16 GLU N N 16 122.160 122.160 124.488 -2.328 17919 29265 1 72 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.052 -0.135 17919 29266 1 72 . 1 1 16 16 GLU C C 16 175.860 175.860 175.822 0.038 17919 29267 1 72 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.662 -0.842 17919 29268 1 72 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.170 -0.720 17919 29269 1 72 . 1 1 16 16 GLU H H 16 8.140 8.140 8.749 -0.609 17919 29270 1 72 . 1 1 17 17 VAL N N 17 117.210 117.210 120.967 -3.757 17919 29271 1 72 . 1 1 17 17 VAL HA H 17 4.714 4.714 5.020 -0.306 17919 29272 1 72 . 1 1 17 17 VAL C C 17 174.160 174.160 174.586 -0.426 17919 29273 1 72 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.010 -0.580 17919 29274 1 72 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.226 1.174 17919 29275 1 72 . 1 1 17 17 VAL H H 17 8.900 8.900 8.544 0.356 17919 29276 1 72 . 1 1 18 18 GLU N N 18 118.990 118.990 118.715 0.275 17919 29277 1 72 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.863 0.216 17919 29278 1 72 . 1 1 18 18 GLU C C 18 176.160 176.160 174.868 1.292 17919 29279 1 72 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.425 -0.705 17919 29280 1 72 . 1 1 18 18 GLU CB C 18 30.310 30.310 31.266 -0.956 17919 29281 1 72 . 1 1 18 18 GLU H H 18 8.640 8.640 9.021 -0.381 17919 29282 1 72 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.168 -0.027 17919 29283 1 72 . 1 1 19 19 PRO C C 19 175.310 175.310 177.593 -2.283 17919 29284 1 72 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.856 -0.386 17919 29285 1 72 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.013 -0.063 17919 29286 1 72 . 1 1 20 20 SER N N 20 103.400 103.400 107.172 -3.772 17919 29287 1 72 . 1 1 20 20 SER HA H 20 4.370 4.370 4.365 0.005 17919 29288 1 72 . 1 1 20 20 SER C C 20 174.660 174.660 174.077 0.583 17919 29289 1 72 . 1 1 20 20 SER CA C 20 57.400 57.400 58.047 -0.647 17919 29290 1 72 . 1 1 20 20 SER CB C 20 63.370 63.370 63.002 0.368 17919 29291 1 72 . 1 1 20 20 SER H H 20 7.040 7.040 7.897 -0.857 17919 29292 1 72 . 1 1 21 21 ASP N N 21 123.480 123.480 124.882 -1.402 17919 29293 1 72 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.706 -0.011 17919 29294 1 72 . 1 1 21 21 ASP C C 21 176.360 176.360 175.825 0.535 17919 29295 1 72 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.357 0.343 17919 29296 1 72 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.705 -0.905 17919 29297 1 72 . 1 1 21 21 ASP H H 21 8.030 8.030 8.149 -0.119 17919 29298 1 72 . 1 1 22 22 THR N N 22 108.800 108.800 112.174 -3.374 17919 29299 1 72 . 1 1 22 22 THR HA H 22 4.920 4.920 4.619 0.301 17919 29300 1 72 . 1 1 22 22 THR C C 22 176.750 176.750 176.117 0.633 17919 29301 1 72 . 1 1 22 22 THR CA C 22 59.690 59.690 60.905 -1.215 17919 29302 1 72 . 1 1 22 22 THR CB C 22 71.200 71.200 70.716 0.484 17919 29303 1 72 . 1 1 22 22 THR H H 22 7.900 7.900 8.327 -0.427 17919 29304 1 72 . 1 1 23 23 ILE N N 23 121.190 121.190 122.972 -1.782 17919 29305 1 72 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.709 -0.052 17919 29306 1 72 . 1 1 23 23 ILE C C 23 179.040 179.040 177.711 1.329 17919 29307 1 72 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.567 -0.307 17919 29308 1 72 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.108 -1.758 17919 29309 1 72 . 1 1 23 23 ILE H H 23 8.560 8.560 8.712 -0.152 17919 29310 1 72 . 1 1 24 24 GLU N N 24 120.830 120.830 120.911 -0.081 17919 29311 1 72 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.860 0.057 17919 29312 1 72 . 1 1 24 24 GLU C C 24 178.640 178.640 178.877 -0.237 17919 29313 1 72 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.910 0.310 17919 29314 1 72 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.445 -1.165 17919 29315 1 72 . 1 1 24 24 GLU H H 24 9.760 9.760 8.199 1.561 17919 29316 1 72 . 1 1 25 25 ASN N N 25 120.570 120.570 117.150 3.420 17919 29317 1 72 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.537 -0.012 17919 29318 1 72 . 1 1 25 25 ASN C C 25 178.380 178.380 177.322 1.058 17919 29319 1 72 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.500 0.560 17919 29320 1 72 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.887 -0.437 17919 29321 1 72 . 1 1 25 25 ASN H H 25 7.920 7.920 7.649 0.271 17919 29322 1 72 . 1 1 26 26 VAL N N 26 121.710 121.710 119.535 2.175 17919 29323 1 72 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.890 -0.493 17919 29324 1 72 . 1 1 26 26 VAL C C 26 177.950 177.950 177.147 0.803 17919 29325 1 72 . 1 1 26 26 VAL CA C 26 67.660 67.660 64.825 2.835 17919 29326 1 72 . 1 1 26 26 VAL CB C 26 30.840 30.840 32.620 -1.780 17919 29327 1 72 . 1 1 26 26 VAL H H 26 8.070 8.070 7.849 0.221 17919 29328 1 72 . 1 1 27 27 LYS N N 27 118.860 118.860 120.455 -1.595 17919 29329 1 72 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.104 0.476 17919 29330 1 72 . 1 1 27 27 LYS C C 27 180.550 180.550 178.833 1.717 17919 29331 1 72 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.856 -0.606 17919 29332 1 72 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.144 1.586 17919 29333 1 72 . 1 1 27 27 LYS H H 27 8.560 8.560 8.024 0.536 17919 29334 1 72 . 1 1 28 28 ALA N N 28 123.440 123.440 120.564 2.876 17919 29335 1 72 . 1 1 28 28 ALA HA H 28 4.160 4.160 3.983 0.177 17919 29336 1 72 . 1 1 28 28 ALA C C 28 180.300 180.300 179.108 1.192 17919 29337 1 72 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.351 0.019 17919 29338 1 72 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.347 -0.637 17919 29339 1 72 . 1 1 28 28 ALA H H 28 8.060 8.060 7.892 0.168 17919 29340 1 72 . 1 1 29 29 LYS N N 29 119.940 119.940 119.225 0.715 17919 29341 1 72 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.021 0.186 17919 29342 1 72 . 1 1 29 29 LYS C C 29 180.320 180.320 179.141 1.179 17919 29343 1 72 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.221 0.429 17919 29344 1 72 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.319 0.971 17919 29345 1 72 . 1 1 29 29 LYS H H 29 7.850 7.850 7.590 0.260 17919 29346 1 72 . 1 1 30 30 ILE N N 30 121.080 121.080 120.997 0.083 17919 29347 1 72 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.586 -0.079 17919 29348 1 72 . 1 1 30 30 ILE C C 30 178.310 178.310 177.326 0.984 17919 29349 1 72 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.654 0.496 17919 29350 1 72 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.715 -0.915 17919 29351 1 72 . 1 1 30 30 ILE H H 30 8.280 8.280 8.157 0.123 17919 29352 1 72 . 1 1 31 31 GLN N N 31 123.490 123.490 120.513 2.977 17919 29353 1 72 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.809 0.020 17919 29354 1 72 . 1 1 31 31 GLN C C 31 178.890 178.890 178.084 0.806 17919 29355 1 72 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.346 0.654 17919 29356 1 72 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.505 -0.785 17919 29357 1 72 . 1 1 31 31 GLN H H 31 8.580 8.580 8.227 0.353 17919 29358 1 72 . 1 1 32 32 ASP N N 32 119.360 119.360 117.898 1.462 17919 29359 1 72 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.450 -0.096 17919 29360 1 72 . 1 1 32 32 ASP C C 32 177.250 177.250 178.390 -1.140 17919 29361 1 72 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.551 0.639 17919 29362 1 72 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.951 -0.371 17919 29363 1 72 . 1 1 32 32 ASP H H 32 8.010 8.010 8.219 -0.209 17919 29364 1 72 . 1 1 33 33 LYS N N 33 115.130 115.130 116.609 -1.479 17919 29365 1 72 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.477 -0.140 17919 29366 1 72 . 1 1 33 33 LYS C C 33 177.870 177.870 177.178 0.692 17919 29367 1 72 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.325 0.725 17919 29368 1 72 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.735 0.435 17919 29369 1 72 . 1 1 33 33 LYS H H 33 7.430 7.430 7.510 -0.080 17919 29370 1 72 . 1 1 34 34 GLU N N 34 113.870 113.870 115.761 -1.891 17919 29371 1 72 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.487 0.138 17919 29372 1 72 . 1 1 34 34 GLU C C 34 177.840 177.840 176.564 1.276 17919 29373 1 72 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.761 -0.591 17919 29374 1 72 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.412 1.248 17919 29375 1 72 . 1 1 34 34 GLU H H 34 8.740 8.740 8.403 0.337 17919 29376 1 72 . 1 1 35 35 GLY N N 35 108.650 108.650 109.552 -0.902 17919 29377 1 72 . 1 1 35 35 GLY C C 35 173.960 173.960 174.380 -0.420 17919 29378 1 72 . 1 1 35 35 GLY CA C 35 46.080 46.080 46.272 -0.192 17919 29379 1 72 . 1 1 35 35 GLY H H 35 8.530 8.530 7.943 0.587 17919 29380 1 72 . 1 1 36 36 ILE N N 36 119.880 119.880 117.093 2.787 17919 29381 1 72 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.477 -0.032 17919 29382 1 72 . 1 1 36 36 ILE C C 36 173.590 173.590 173.736 -0.146 17919 29383 1 72 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.449 0.301 17919 29384 1 72 . 1 1 36 36 ILE CB C 36 40.580 40.580 39.229 1.351 17919 29385 1 72 . 1 1 36 36 ILE H H 36 6.150 6.150 7.449 -1.299 17919 29386 1 72 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.801 -0.167 17919 29387 1 72 . 1 1 37 37 PRO C C 37 176.940 176.940 175.925 1.015 17919 29388 1 72 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.123 0.537 17919 29389 1 72 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.317 0.533 17919 29390 1 72 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.265 -0.148 17919 29391 1 72 . 1 1 38 38 PRO C C 38 178.320 178.320 178.043 0.277 17919 29392 1 72 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.293 0.967 17919 29393 1 72 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.948 0.942 17919 29394 1 72 . 1 1 39 39 ASP N N 39 113.380 113.380 117.450 -4.070 17919 29395 1 72 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.398 0.032 17919 29396 1 72 . 1 1 39 39 ASP C C 39 177.090 177.090 177.962 -0.872 17919 29397 1 72 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.751 -1.111 17919 29398 1 72 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.598 -1.058 17919 29399 1 72 . 1 1 39 39 ASP H H 39 8.550 8.550 8.798 -0.248 17919 29400 1 72 . 1 1 40 40 GLN N N 40 116.780 116.780 118.003 -1.223 17919 29401 1 72 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.187 0.277 17919 29402 1 72 . 1 1 40 40 GLN C C 40 175.380 175.380 176.179 -0.799 17919 29403 1 72 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.845 -1.205 17919 29404 1 72 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.073 1.067 17919 29405 1 72 . 1 1 40 40 GLN H H 40 7.820 7.820 7.882 -0.062 17919 29406 1 72 . 1 1 41 41 GLN N N 41 117.720 117.720 118.589 -0.869 17919 29407 1 72 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.426 -0.182 17919 29408 1 72 . 1 1 41 41 GLN C C 41 176.300 176.300 174.904 1.396 17919 29409 1 72 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.424 1.046 17919 29410 1 72 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.503 2.147 17919 29411 1 72 . 1 1 41 41 GLN H H 41 7.480 7.480 7.363 0.117 17919 29412 1 72 . 1 1 42 42 ARG N N 42 122.680 122.680 126.696 -4.016 17919 29413 1 72 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.512 -0.012 17919 29414 1 72 . 1 1 42 42 ARG C C 42 174.050 174.050 174.183 -0.133 17919 29415 1 72 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.014 0.036 17919 29416 1 72 . 1 1 42 42 ARG CB C 42 31.750 31.750 31.678 0.072 17919 29417 1 72 . 1 1 42 42 ARG H H 42 8.530 8.530 8.346 0.184 17919 29418 1 72 . 1 1 43 43 LEU N N 43 124.040 124.040 128.004 -3.964 17919 29419 1 72 . 1 1 43 43 LEU C C 43 175.290 175.290 175.747 -0.457 17919 29420 1 72 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.505 -0.525 17919 29421 1 72 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.202 1.588 17919 29422 1 72 . 1 1 43 43 LEU H H 43 8.820 8.820 8.691 0.129 17919 29423 1 72 . 1 1 44 44 ILE N N 44 121.920 121.920 122.862 -0.942 17919 29424 1 72 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.118 -0.126 17919 29425 1 72 . 1 1 44 44 ILE C C 44 176.060 176.060 174.540 1.520 17919 29426 1 72 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.049 -1.069 17919 29427 1 72 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.402 0.018 17919 29428 1 72 . 1 1 44 44 ILE H H 44 9.030 9.030 8.471 0.559 17919 29429 1 72 . 1 1 45 45 PHE N N 45 125.390 125.390 127.313 -1.923 17919 29430 1 72 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.983 0.062 17919 29431 1 72 . 1 1 45 45 PHE C C 45 174.470 174.470 174.415 0.055 17919 29432 1 72 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.626 0.394 17919 29433 1 72 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.095 0.665 17919 29434 1 72 . 1 1 45 45 PHE H H 45 8.830 8.830 8.480 0.350 17919 29435 1 72 . 1 1 46 46 ALA N N 46 132.200 132.200 128.631 3.569 17919 29436 1 72 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.695 -0.005 17919 29437 1 72 . 1 1 46 46 ALA C C 46 177.290 177.290 177.753 -0.463 17919 29438 1 72 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.598 -0.058 17919 29439 1 72 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.816 -0.246 17919 29440 1 72 . 1 1 46 46 ALA H H 46 8.810 8.810 8.800 0.010 17919 29441 1 72 . 1 1 47 47 GLY N N 47 102.340 102.340 104.684 -2.344 17919 29442 1 72 . 1 1 47 47 GLY C C 47 173.810 173.810 174.247 -0.437 17919 29443 1 72 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.849 0.501 17919 29444 1 72 . 1 1 47 47 GLY H H 47 8.130 8.130 8.592 -0.462 17919 29445 1 72 . 1 1 48 48 LYS N N 48 121.570 121.570 121.075 0.495 17919 29446 1 72 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.745 -0.123 17919 29447 1 72 . 1 1 48 48 LYS C C 48 174.700 174.700 175.076 -0.376 17919 29448 1 72 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.820 -0.270 17919 29449 1 72 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.729 -0.199 17919 29450 1 72 . 1 1 48 48 LYS H H 48 7.980 7.980 7.774 0.205 17919 29451 1 72 . 1 1 49 49 GLN N N 49 122.410 122.410 120.821 1.589 17919 29452 1 72 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.670 -0.110 17919 29453 1 72 . 1 1 49 49 GLN C C 49 175.670 175.670 175.355 0.315 17919 29454 1 72 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.023 -0.283 17919 29455 1 72 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.457 -0.457 17919 29456 1 72 . 1 1 49 49 GLN H H 49 8.600 8.600 8.307 0.293 17919 29457 1 72 . 1 1 50 50 LEU N N 50 125.520 125.520 124.803 0.717 17919 29458 1 72 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.289 -0.199 17919 29459 1 72 . 1 1 50 50 LEU C C 50 176.660 176.660 176.671 -0.011 17919 29460 1 72 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.079 0.161 17919 29461 1 72 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.700 -1.130 17919 29462 1 72 . 1 1 50 50 LEU H H 50 8.530 8.530 8.552 -0.022 17919 29463 1 72 . 1 1 51 51 GLU N N 51 122.940 122.940 121.778 1.162 17919 29464 1 72 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.504 -0.016 17919 29465 1 72 . 1 1 51 51 GLU C C 51 175.870 175.870 176.399 -0.529 17919 29466 1 72 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.907 0.053 17919 29467 1 72 . 1 1 51 51 GLU CB C 51 31.570 31.570 30.911 0.659 17919 29468 1 72 . 1 1 51 51 GLU H H 51 8.400 8.400 8.382 0.018 17919 29469 1 72 . 1 1 52 52 ASP N N 52 120.030 120.030 125.164 -5.134 17919 29470 1 72 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.480 -0.121 17919 29471 1 72 . 1 1 52 52 ASP C C 52 177.330 177.330 178.031 -0.701 17919 29472 1 72 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.936 -0.976 17919 29473 1 72 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.898 -0.048 17919 29474 1 72 . 1 1 52 52 ASP H H 52 8.160 8.160 8.887 -0.727 17919 29475 1 72 . 1 1 53 53 GLY N N 53 106.660 106.660 105.442 1.218 17919 29476 1 72 . 1 1 53 53 GLY C C 53 174.870 174.870 174.422 0.448 17919 29477 1 72 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.984 0.186 17919 29478 1 72 . 1 1 53 53 GLY H H 53 9.390 9.390 8.359 1.031 17919 29479 1 72 . 1 1 54 54 ARG N N 54 119.050 119.050 121.615 -2.565 17919 29480 1 72 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.507 0.188 17919 29481 1 72 . 1 1 54 54 ARG C C 54 175.350 175.350 175.413 -0.063 17919 29482 1 72 . 1 1 54 54 ARG CA C 54 54.390 54.390 55.082 -0.692 17919 29483 1 72 . 1 1 54 54 ARG CB C 54 32.650 32.650 31.759 0.891 17919 29484 1 72 . 1 1 54 54 ARG H H 54 7.460 7.460 7.620 -0.160 17919 29485 1 72 . 1 1 55 55 THR N N 55 108.400 108.400 113.717 -5.317 17919 29486 1 72 . 1 1 55 55 THR HA H 55 5.240 5.240 4.798 0.442 17919 29487 1 72 . 1 1 55 55 THR C C 55 176.560 176.560 176.789 -0.229 17919 29488 1 72 . 1 1 55 55 THR CA C 55 59.690 59.690 60.278 -0.588 17919 29489 1 72 . 1 1 55 55 THR CB C 55 72.260 72.260 69.984 2.276 17919 29490 1 72 . 1 1 55 55 THR H H 55 8.730 8.730 8.607 0.123 17919 29491 1 72 . 1 1 56 56 LEU N N 56 117.920 117.920 122.367 -4.447 17919 29492 1 72 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.958 0.102 17919 29493 1 72 . 1 1 56 56 LEU C C 56 180.810 180.810 178.742 2.068 17919 29494 1 72 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.714 -0.004 17919 29495 1 72 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.083 -0.713 17919 29496 1 72 . 1 1 56 56 LEU H H 56 8.140 8.140 8.327 -0.187 17919 29497 1 72 . 1 1 57 57 SER N N 57 113.330 113.330 112.248 1.082 17919 29498 1 72 . 1 1 57 57 SER HA H 57 4.370 4.370 4.210 0.160 17919 29499 1 72 . 1 1 57 57 SER C C 57 178.310 178.310 176.232 2.078 17919 29500 1 72 . 1 1 57 57 SER CA C 57 61.080 61.080 60.673 0.407 17919 29501 1 72 . 1 1 57 57 SER CB C 57 62.530 62.530 62.465 0.065 17919 29502 1 72 . 1 1 57 57 SER H H 57 8.470 8.470 7.696 0.774 17919 29503 1 72 . 1 1 58 58 ASP N N 58 124.190 124.190 121.085 3.105 17919 29504 1 72 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.348 -0.052 17919 29505 1 72 . 1 1 58 58 ASP C C 58 177.400 177.400 176.826 0.574 17919 29506 1 72 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.489 0.691 17919 29507 1 72 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.753 -0.653 17919 29508 1 72 . 1 1 58 58 ASP H H 58 7.930 7.930 8.034 -0.104 17919 29509 1 72 . 1 1 59 59 TYR N N 59 115.510 115.510 115.687 -0.177 17919 29510 1 72 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.750 -0.080 17919 29511 1 72 . 1 1 59 59 TYR C C 59 174.700 174.700 174.663 0.037 17919 29512 1 72 . 1 1 59 59 TYR CA C 59 58.250 58.250 56.792 1.458 17919 29513 1 72 . 1 1 59 59 TYR CB C 59 40.070 40.070 39.389 0.680 17919 29514 1 72 . 1 1 59 59 TYR H H 59 7.250 7.250 7.164 0.086 17919 29515 1 72 . 1 1 60 60 ASN N N 60 115.900 115.900 116.239 -0.339 17919 29516 1 72 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.380 -0.025 17919 29517 1 72 . 1 1 60 60 ASN C C 60 174.340 174.340 174.574 -0.234 17919 29518 1 72 . 1 1 60 60 ASN CA C 60 54.120 54.120 53.996 0.124 17919 29519 1 72 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.096 0.314 17919 29520 1 72 . 1 1 60 60 ASN H H 60 8.150 8.150 7.978 0.172 17919 29521 1 72 . 1 1 61 61 ILE N N 61 118.600 118.600 120.082 -1.482 17919 29522 1 72 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.733 -0.340 17919 29523 1 72 . 1 1 61 61 ILE C C 61 174.610 174.610 175.115 -0.505 17919 29524 1 72 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.373 1.047 17919 29525 1 72 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.543 -0.803 17919 29526 1 72 . 1 1 61 61 ILE H H 61 7.250 7.250 7.527 -0.277 17919 29527 1 72 . 1 1 62 62 GLN N N 62 124.740 124.740 125.424 -0.684 17919 29528 1 72 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.746 -0.240 17919 29529 1 72 . 1 1 62 62 GLN C C 62 175.970 175.970 175.467 0.503 17919 29530 1 72 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.228 0.432 17919 29531 1 72 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.812 -0.162 17919 29532 1 72 . 1 1 62 62 GLN H H 62 7.610 7.610 7.815 -0.205 17919 29533 1 72 . 1 1 63 63 LYS N N 63 120.300 120.300 119.929 0.371 17919 29534 1 72 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.159 -0.158 17919 29535 1 72 . 1 1 63 63 LYS C C 63 175.810 175.810 177.030 -1.220 17919 29536 1 72 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.751 0.039 17919 29537 1 72 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.771 0.879 17919 29538 1 72 . 1 1 63 63 LYS H H 63 8.490 8.490 8.542 -0.052 17919 29539 1 72 . 1 1 64 64 GLU N N 64 113.950 113.950 120.970 -7.020 17919 29540 1 72 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.764 -0.299 17919 29541 1 72 . 1 1 64 64 GLU C C 64 175.250 175.250 175.769 -0.519 17919 29542 1 72 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.787 0.103 17919 29543 1 72 . 1 1 64 64 GLU CB C 64 25.900 25.900 27.733 -1.833 17919 29544 1 72 . 1 1 64 64 GLU H H 64 9.280 9.280 9.064 0.216 17919 29545 1 72 . 1 1 65 65 SER N N 65 114.730 114.730 113.733 0.997 17919 29546 1 72 . 1 1 65 65 SER HA H 65 4.640 4.640 4.743 -0.103 17919 29547 1 72 . 1 1 65 65 SER C C 65 172.160 172.160 174.190 -2.030 17919 29548 1 72 . 1 1 65 65 SER CA C 65 60.890 60.890 58.936 1.954 17919 29549 1 72 . 1 1 65 65 SER CB C 65 64.910 64.910 65.309 -0.399 17919 29550 1 72 . 1 1 65 65 SER H H 65 7.670 7.670 7.524 0.146 17919 29551 1 72 . 1 1 66 66 THR N N 66 117.110 117.110 118.833 -1.723 17919 29552 1 72 . 1 1 66 66 THR HA H 66 5.270 5.270 5.249 0.021 17919 29553 1 72 . 1 1 66 66 THR C C 66 173.950 173.950 173.995 -0.045 17919 29554 1 72 . 1 1 66 66 THR CA C 66 62.340 62.340 61.568 0.772 17919 29555 1 72 . 1 1 66 66 THR CB C 66 70.080 70.080 69.955 0.125 17919 29556 1 72 . 1 1 66 66 THR H H 66 8.730 8.730 8.487 0.243 17919 29557 1 72 . 1 1 67 67 LEU N N 67 127.110 127.110 128.314 -1.204 17919 29558 1 72 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.999 0.061 17919 29559 1 72 . 1 1 67 67 LEU C C 67 175.770 175.770 175.758 0.012 17919 29560 1 72 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.604 0.296 17919 29561 1 72 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.960 0.300 17919 29562 1 72 . 1 1 67 67 LEU H H 67 9.410 9.410 9.097 0.313 17919 29563 1 72 . 1 1 68 68 HIS N N 68 118.380 118.380 122.300 -3.920 17919 29564 1 72 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.245 -0.005 17919 29565 1 72 . 1 1 68 68 HIS C C 68 173.150 173.150 173.750 -0.600 17919 29566 1 72 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.793 0.207 17919 29567 1 72 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.513 -1.983 17919 29568 1 72 . 1 1 68 68 HIS H H 68 9.230 9.230 8.401 0.829 17919 29569 1 72 . 1 1 69 69 LEU N N 69 124.460 124.460 126.700 -2.240 17919 29570 1 72 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.102 0.088 17919 29571 1 72 . 1 1 69 69 LEU C C 69 175.270 175.270 174.049 1.221 17919 29572 1 72 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.769 0.121 17919 29573 1 72 . 1 1 69 69 LEU CB C 69 44.380 44.380 45.153 -0.773 17919 29574 1 72 . 1 1 69 69 LEU H H 69 8.340 8.340 8.658 -0.318 17919 29575 1 72 . 1 1 70 70 VAL N N 70 126.940 126.940 125.859 1.081 17919 29576 1 72 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.218 0.132 17919 29577 1 72 . 1 1 70 70 VAL C C 70 174.000 174.000 174.676 -0.676 17919 29578 1 72 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.790 0.010 17919 29579 1 72 . 1 1 70 70 VAL CB C 70 34.910 34.910 32.376 2.534 17919 29580 1 72 . 1 1 70 70 VAL H H 70 9.200 9.200 8.449 0.751 17919 29581 1 72 . 1 1 71 71 LEU N N 71 123.130 123.130 128.315 -5.185 17919 29582 1 72 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.851 0.209 17919 29583 1 72 . 1 1 71 71 LEU C C 71 177.830 177.830 176.796 1.034 17919 29584 1 72 . 1 1 71 71 LEU CA C 71 53.940 53.940 54.532 -0.592 17919 29585 1 72 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.184 -0.334 17919 29586 1 72 . 1 1 71 71 LEU H H 71 8.120 8.120 8.609 -0.489 17919 29587 1 72 . 1 1 72 72 ARG N N 72 123.490 123.490 126.153 -2.663 17919 29588 1 72 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.497 -0.196 17919 29589 1 72 . 1 1 72 72 ARG C C 72 175.350 175.350 175.588 -0.238 17919 29590 1 72 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.221 0.389 17919 29591 1 72 . 1 1 72 72 ARG CB C 72 31.350 31.350 29.510 1.840 17919 29592 1 72 . 1 1 72 72 ARG H H 72 8.580 8.580 8.353 0.227 17919 29593 1 73 . 1 1 2 2 GLN N N 2 123.220 123.220 122.464 0.756 17919 29594 1 73 . 1 1 2 2 GLN HA H 2 5.249 5.249 4.530 0.719 17919 29595 1 73 . 1 1 2 2 GLN C C 2 175.920 175.920 174.546 1.374 17919 29596 1 73 . 1 1 2 2 GLN CA C 2 55.080 55.080 55.972 -0.892 17919 29597 1 73 . 1 1 2 2 GLN CB C 2 30.760 30.760 29.643 1.117 17919 29598 1 73 . 1 1 2 2 GLN H H 2 8.900 8.900 8.486 0.414 17919 29599 1 73 . 1 1 3 3 ILE N N 3 115.340 115.340 116.605 -1.265 17919 29600 1 73 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.183 0.030 17919 29601 1 73 . 1 1 3 3 ILE C C 3 172.450 172.450 173.363 -0.913 17919 29602 1 73 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.627 -0.057 17919 29603 1 73 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.637 0.573 17919 29604 1 73 . 1 1 3 3 ILE H H 3 8.320 8.320 8.229 0.091 17919 29605 1 73 . 1 1 4 4 PHE N N 4 118.110 118.110 120.444 -2.334 17919 29606 1 73 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.413 0.217 17919 29607 1 73 . 1 1 4 4 PHE C C 4 175.320 175.320 174.967 0.353 17919 29608 1 73 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.565 -0.355 17919 29609 1 73 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.278 -0.798 17919 29610 1 73 . 1 1 4 4 PHE H H 4 8.610 8.610 8.354 0.256 17919 29611 1 73 . 1 1 5 5 VAL N N 5 121.000 121.000 122.621 -1.621 17919 29612 1 73 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.836 -0.111 17919 29613 1 73 . 1 1 5 5 VAL C C 5 174.870 174.870 175.372 -0.502 17919 29614 1 73 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.517 -0.897 17919 29615 1 73 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.214 1.016 17919 29616 1 73 . 1 1 5 5 VAL H H 5 9.300 9.300 8.825 0.475 17919 29617 1 73 . 1 1 6 6 LYS N N 6 127.520 127.520 127.670 -0.150 17919 29618 1 73 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.300 0.067 17919 29619 1 73 . 1 1 6 6 LYS C C 6 177.140 177.140 176.827 0.313 17919 29620 1 73 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.694 -0.174 17919 29621 1 73 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.178 -0.128 17919 29622 1 73 . 1 1 6 6 LYS H H 6 8.820 8.820 9.079 -0.259 17919 29623 1 73 . 1 1 7 7 THR N N 7 115.400 115.400 113.477 1.923 17919 29624 1 73 . 1 1 7 7 THR HA H 7 4.970 4.970 4.447 0.523 17919 29625 1 73 . 1 1 7 7 THR C C 7 176.910 176.910 176.654 0.256 17919 29626 1 73 . 1 1 7 7 THR CA C 7 60.470 60.470 61.580 -1.110 17919 29627 1 73 . 1 1 7 7 THR CB C 7 70.630 70.630 70.052 0.578 17919 29628 1 73 . 1 1 7 7 THR H H 7 8.730 8.730 8.139 0.591 17919 29629 1 73 . 1 1 8 8 LEU N N 8 121.330 121.330 121.967 -0.637 17919 29630 1 73 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.149 0.161 17919 29631 1 73 . 1 1 8 8 LEU C C 8 178.800 178.800 177.780 1.020 17919 29632 1 73 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.651 -0.071 17919 29633 1 73 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.958 0.012 17919 29634 1 73 . 1 1 8 8 LEU H H 8 9.100 9.100 8.710 0.390 17919 29635 1 73 . 1 1 9 9 THR N N 9 105.590 105.590 106.914 -1.324 17919 29636 1 73 . 1 1 9 9 THR HA H 9 4.428 4.428 4.323 0.105 17919 29637 1 73 . 1 1 9 9 THR C C 9 175.520 175.520 175.502 0.018 17919 29638 1 73 . 1 1 9 9 THR CA C 9 61.400 61.400 61.846 -0.446 17919 29639 1 73 . 1 1 9 9 THR CB C 9 69.140 69.140 69.011 0.129 17919 29640 1 73 . 1 1 9 9 THR H H 9 7.630 7.630 7.712 -0.082 17919 29641 1 73 . 1 1 10 10 GLY N N 10 108.890 108.890 111.413 -2.523 17919 29642 1 73 . 1 1 10 10 GLY C C 10 174.070 174.070 173.524 0.546 17919 29643 1 73 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.725 0.735 17919 29644 1 73 . 1 1 10 10 GLY H H 10 7.810 7.810 7.782 0.028 17919 29645 1 73 . 1 1 11 11 LYS N N 11 121.600 121.600 121.599 0.001 17919 29646 1 73 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.508 -0.147 17919 29647 1 73 . 1 1 11 11 LYS C C 11 175.940 175.940 175.478 0.462 17919 29648 1 73 . 1 1 11 11 LYS CA C 11 56.280 56.280 55.936 0.344 17919 29649 1 73 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.464 -0.264 17919 29650 1 73 . 1 1 11 11 LYS H H 11 7.280 7.280 7.702 -0.422 17919 29651 1 73 . 1 1 12 12 THR N N 12 120.440 120.440 117.896 2.544 17919 29652 1 73 . 1 1 12 12 THR HA H 12 5.046 5.046 4.562 0.484 17919 29653 1 73 . 1 1 12 12 THR C C 12 174.320 174.320 174.539 -0.219 17919 29654 1 73 . 1 1 12 12 THR CA C 12 62.390 62.390 62.157 0.233 17919 29655 1 73 . 1 1 12 12 THR CB C 12 69.910 69.910 69.468 0.442 17919 29656 1 73 . 1 1 12 12 THR H H 12 8.650 8.650 8.335 0.315 17919 29657 1 73 . 1 1 13 13 ILE N N 13 127.110 127.110 125.954 1.156 17919 29658 1 73 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.621 -0.077 17919 29659 1 73 . 1 1 13 13 ILE C C 13 175.220 175.220 174.650 0.570 17919 29660 1 73 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.491 -0.511 17919 29661 1 73 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.866 0.084 17919 29662 1 73 . 1 1 13 13 ILE H H 13 9.450 9.450 8.854 0.596 17919 29663 1 73 . 1 1 14 14 THR N N 14 121.520 121.520 123.347 -1.827 17919 29664 1 73 . 1 1 14 14 THR HA H 14 4.964 4.964 4.922 0.042 17919 29665 1 73 . 1 1 14 14 THR C C 14 173.790 173.790 173.690 0.100 17919 29666 1 73 . 1 1 14 14 THR CA C 14 61.940 61.940 61.816 0.124 17919 29667 1 73 . 1 1 14 14 THR CB C 14 69.650 69.650 69.768 -0.118 17919 29668 1 73 . 1 1 14 14 THR H H 14 8.710 8.710 8.430 0.281 17919 29669 1 73 . 1 1 15 15 LEU N N 15 124.800 124.800 127.821 -3.021 17919 29670 1 73 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.763 0.017 17919 29671 1 73 . 1 1 15 15 LEU C C 15 174.670 174.670 175.221 -0.551 17919 29672 1 73 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.606 -0.776 17919 29673 1 73 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.503 1.567 17919 29674 1 73 . 1 1 15 15 LEU H H 15 8.710 8.710 8.874 -0.164 17919 29675 1 73 . 1 1 16 16 GLU N N 16 122.160 122.160 123.763 -1.603 17919 29676 1 73 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.538 0.379 17919 29677 1 73 . 1 1 16 16 GLU C C 16 175.860 175.860 175.440 0.420 17919 29678 1 73 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.445 -0.625 17919 29679 1 73 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.271 -0.821 17919 29680 1 73 . 1 1 16 16 GLU H H 16 8.140 8.140 8.526 -0.386 17919 29681 1 73 . 1 1 17 17 VAL N N 17 117.210 117.210 121.379 -4.169 17919 29682 1 73 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.584 0.130 17919 29683 1 73 . 1 1 17 17 VAL C C 17 174.160 174.160 174.435 -0.275 17919 29684 1 73 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.193 -0.763 17919 29685 1 73 . 1 1 17 17 VAL CB C 17 36.400 36.400 36.020 0.380 17919 29686 1 73 . 1 1 17 17 VAL H H 17 8.900 8.900 8.001 0.899 17919 29687 1 73 . 1 1 18 18 GLU N N 18 118.990 118.990 117.398 1.592 17919 29688 1 73 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.751 0.328 17919 29689 1 73 . 1 1 18 18 GLU C C 18 176.160 176.160 174.707 1.453 17919 29690 1 73 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.840 -0.120 17919 29691 1 73 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.844 -0.534 17919 29692 1 73 . 1 1 18 18 GLU H H 18 8.640 8.640 7.939 0.701 17919 29693 1 73 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.281 -0.140 17919 29694 1 73 . 1 1 19 19 PRO C C 19 175.310 175.310 178.053 -2.743 17919 29695 1 73 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.102 0.368 17919 29696 1 73 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.728 0.222 17919 29697 1 73 . 1 1 20 20 SER N N 20 103.400 103.400 111.805 -8.405 17919 29698 1 73 . 1 1 20 20 SER HA H 20 4.370 4.370 4.272 0.098 17919 29699 1 73 . 1 1 20 20 SER C C 20 174.660 174.660 174.175 0.485 17919 29700 1 73 . 1 1 20 20 SER CA C 20 57.400 57.400 59.458 -2.058 17919 29701 1 73 . 1 1 20 20 SER CB C 20 63.370 63.370 63.014 0.356 17919 29702 1 73 . 1 1 20 20 SER H H 20 7.040 7.040 8.229 -1.189 17919 29703 1 73 . 1 1 21 21 ASP N N 21 123.480 123.480 123.078 0.402 17919 29704 1 73 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.534 0.161 17919 29705 1 73 . 1 1 21 21 ASP C C 21 176.360 176.360 175.501 0.859 17919 29706 1 73 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.298 0.402 17919 29707 1 73 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.630 -0.830 17919 29708 1 73 . 1 1 21 21 ASP H H 21 8.030 8.030 7.649 0.381 17919 29709 1 73 . 1 1 22 22 THR N N 22 108.800 108.800 114.424 -5.624 17919 29710 1 73 . 1 1 22 22 THR HA H 22 4.920 4.920 4.393 0.527 17919 29711 1 73 . 1 1 22 22 THR C C 22 176.750 176.750 175.745 1.005 17919 29712 1 73 . 1 1 22 22 THR CA C 22 59.690 59.690 60.930 -1.240 17919 29713 1 73 . 1 1 22 22 THR CB C 22 71.200 71.200 70.356 0.844 17919 29714 1 73 . 1 1 22 22 THR H H 22 7.900 7.900 8.164 -0.264 17919 29715 1 73 . 1 1 23 23 ILE N N 23 121.190 121.190 122.501 -1.311 17919 29716 1 73 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.859 -0.202 17919 29717 1 73 . 1 1 23 23 ILE C C 23 179.040 179.040 177.552 1.488 17919 29718 1 73 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.931 -0.671 17919 29719 1 73 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.549 -2.199 17919 29720 1 73 . 1 1 23 23 ILE H H 23 8.560 8.560 8.798 -0.238 17919 29721 1 73 . 1 1 24 24 GLU N N 24 120.830 120.830 120.502 0.328 17919 29722 1 73 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.906 0.011 17919 29723 1 73 . 1 1 24 24 GLU C C 24 178.640 178.640 178.559 0.081 17919 29724 1 73 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.820 0.400 17919 29725 1 73 . 1 1 24 24 GLU CB C 24 28.280 28.280 28.786 -0.506 17919 29726 1 73 . 1 1 24 24 GLU H H 24 9.760 9.760 8.626 1.134 17919 29727 1 73 . 1 1 25 25 ASN N N 25 120.570 120.570 118.748 1.822 17919 29728 1 73 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.561 -0.036 17919 29729 1 73 . 1 1 25 25 ASN C C 25 178.380 178.380 177.451 0.929 17919 29730 1 73 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.426 0.634 17919 29731 1 73 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.136 0.314 17919 29732 1 73 . 1 1 25 25 ASN H H 25 7.920 7.920 8.163 -0.243 17919 29733 1 73 . 1 1 26 26 VAL N N 26 121.710 121.710 120.878 0.832 17919 29734 1 73 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.718 -0.321 17919 29735 1 73 . 1 1 26 26 VAL C C 26 177.950 177.950 177.363 0.587 17919 29736 1 73 . 1 1 26 26 VAL CA C 26 67.660 67.660 65.665 1.996 17919 29737 1 73 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.897 -1.057 17919 29738 1 73 . 1 1 26 26 VAL H H 26 8.070 8.070 8.034 0.036 17919 29739 1 73 . 1 1 27 27 LYS N N 27 118.860 118.860 120.230 -1.370 17919 29740 1 73 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.237 0.343 17919 29741 1 73 . 1 1 27 27 LYS C C 27 180.550 180.550 178.705 1.845 17919 29742 1 73 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.446 -0.196 17919 29743 1 73 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.484 1.246 17919 29744 1 73 . 1 1 27 27 LYS H H 27 8.560 8.560 8.430 0.130 17919 29745 1 73 . 1 1 28 28 ALA N N 28 123.440 123.440 123.034 0.406 17919 29746 1 73 . 1 1 28 28 ALA HA H 28 4.160 4.160 3.884 0.276 17919 29747 1 73 . 1 1 28 28 ALA C C 28 180.300 180.300 179.311 0.989 17919 29748 1 73 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.430 -0.060 17919 29749 1 73 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.167 -0.457 17919 29750 1 73 . 1 1 28 28 ALA H H 28 8.060 8.060 7.992 0.068 17919 29751 1 73 . 1 1 29 29 LYS N N 29 119.940 119.940 118.055 1.885 17919 29752 1 73 . 1 1 29 29 LYS HA H 29 4.207 4.207 3.969 0.238 17919 29753 1 73 . 1 1 29 29 LYS C C 29 180.320 180.320 179.157 1.163 17919 29754 1 73 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.459 0.191 17919 29755 1 73 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.220 1.070 17919 29756 1 73 . 1 1 29 29 LYS H H 29 7.850 7.850 8.000 -0.150 17919 29757 1 73 . 1 1 30 30 ILE N N 30 121.080 121.080 119.506 1.574 17919 29758 1 73 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.774 -0.267 17919 29759 1 73 . 1 1 30 30 ILE C C 30 178.310 178.310 177.791 0.519 17919 29760 1 73 . 1 1 30 30 ILE CA C 30 66.150 66.150 63.585 2.565 17919 29761 1 73 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.115 -0.315 17919 29762 1 73 . 1 1 30 30 ILE H H 30 8.280 8.280 7.739 0.541 17919 29763 1 73 . 1 1 31 31 GLN N N 31 123.490 123.490 120.736 2.754 17919 29764 1 73 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.913 -0.085 17919 29765 1 73 . 1 1 31 31 GLN C C 31 178.890 178.890 178.434 0.456 17919 29766 1 73 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.489 0.511 17919 29767 1 73 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.450 -0.730 17919 29768 1 73 . 1 1 31 31 GLN H H 31 8.580 8.580 8.320 0.260 17919 29769 1 73 . 1 1 32 32 ASP N N 32 119.360 119.360 119.358 0.002 17919 29770 1 73 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.369 -0.015 17919 29771 1 73 . 1 1 32 32 ASP C C 32 177.250 177.250 177.845 -0.595 17919 29772 1 73 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.931 0.258 17919 29773 1 73 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.773 -0.193 17919 29774 1 73 . 1 1 32 32 ASP H H 32 8.010 8.010 8.063 -0.053 17919 29775 1 73 . 1 1 33 33 LYS N N 33 115.130 115.130 116.537 -1.407 17919 29776 1 73 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.425 -0.088 17919 29777 1 73 . 1 1 33 33 LYS C C 33 177.870 177.870 178.035 -0.165 17919 29778 1 73 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.013 1.037 17919 29779 1 73 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.566 0.604 17919 29780 1 73 . 1 1 33 33 LYS H H 33 7.430 7.430 7.654 -0.224 17919 29781 1 73 . 1 1 34 34 GLU N N 34 113.870 113.870 116.169 -2.299 17919 29782 1 73 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.465 0.161 17919 29783 1 73 . 1 1 34 34 GLU C C 34 177.840 177.840 177.664 0.176 17919 29784 1 73 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.930 -0.760 17919 29785 1 73 . 1 1 34 34 GLU CB C 34 32.660 32.660 30.956 1.704 17919 29786 1 73 . 1 1 34 34 GLU H H 34 8.740 8.740 7.988 0.752 17919 29787 1 73 . 1 1 35 35 GLY N N 35 108.650 108.650 109.193 -0.543 17919 29788 1 73 . 1 1 35 35 GLY C C 35 173.960 173.960 174.491 -0.531 17919 29789 1 73 . 1 1 35 35 GLY CA C 35 46.080 46.080 46.016 0.064 17919 29790 1 73 . 1 1 35 35 GLY H H 35 8.530 8.530 8.130 0.400 17919 29791 1 73 . 1 1 36 36 ILE N N 36 119.880 119.880 121.331 -1.451 17919 29792 1 73 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.448 -0.003 17919 29793 1 73 . 1 1 36 36 ILE C C 36 173.590 173.590 173.946 -0.356 17919 29794 1 73 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.010 0.740 17919 29795 1 73 . 1 1 36 36 ILE CB C 36 40.580 40.580 37.996 2.584 17919 29796 1 73 . 1 1 36 36 ILE H H 36 6.150 6.150 7.869 -1.719 17919 29797 1 73 . 1 1 37 37 PRO HA H 37 4.634 4.634 5.234 -0.600 17919 29798 1 73 . 1 1 37 37 PRO C C 37 176.940 176.940 175.593 1.347 17919 29799 1 73 . 1 1 37 37 PRO CA C 37 61.660 61.660 60.171 1.489 17919 29800 1 73 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.880 -0.030 17919 29801 1 73 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.070 0.047 17919 29802 1 73 . 1 1 38 38 PRO C C 38 178.320 178.320 178.263 0.057 17919 29803 1 73 . 1 1 38 38 PRO CA C 38 66.260 66.260 66.257 0.003 17919 29804 1 73 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.802 1.088 17919 29805 1 73 . 1 1 39 39 ASP N N 39 113.380 113.380 115.513 -2.133 17919 29806 1 73 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.338 0.092 17919 29807 1 73 . 1 1 39 39 ASP C C 39 177.090 177.090 177.520 -0.430 17919 29808 1 73 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.565 -0.925 17919 29809 1 73 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.539 -0.999 17919 29810 1 73 . 1 1 39 39 ASP H H 39 8.550 8.550 8.747 -0.197 17919 29811 1 73 . 1 1 40 40 GLN N N 40 116.780 116.780 115.257 1.523 17919 29812 1 73 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.459 0.005 17919 29813 1 73 . 1 1 40 40 GLN C C 40 175.380 175.380 175.622 -0.242 17919 29814 1 73 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.523 0.117 17919 29815 1 73 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.884 0.256 17919 29816 1 73 . 1 1 40 40 GLN H H 40 7.820 7.820 7.942 -0.122 17919 29817 1 73 . 1 1 41 41 GLN N N 41 117.720 117.720 119.320 -1.600 17919 29818 1 73 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.588 -0.344 17919 29819 1 73 . 1 1 41 41 GLN C C 41 176.300 176.300 174.943 1.357 17919 29820 1 73 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.401 1.069 17919 29821 1 73 . 1 1 41 41 GLN CB C 41 31.650 31.650 30.499 1.151 17919 29822 1 73 . 1 1 41 41 GLN H H 41 7.480 7.480 7.415 0.065 17919 29823 1 73 . 1 1 42 42 ARG N N 42 122.680 122.680 124.134 -1.454 17919 29824 1 73 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.690 -0.190 17919 29825 1 73 . 1 1 42 42 ARG C C 42 174.050 174.050 174.834 -0.784 17919 29826 1 73 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.710 0.340 17919 29827 1 73 . 1 1 42 42 ARG CB C 42 31.750 31.750 31.997 -0.247 17919 29828 1 73 . 1 1 42 42 ARG H H 42 8.530 8.530 8.237 0.293 17919 29829 1 73 . 1 1 43 43 LEU N N 43 124.040 124.040 126.742 -2.702 17919 29830 1 73 . 1 1 43 43 LEU C C 43 175.290 175.290 176.185 -0.895 17919 29831 1 73 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.676 -1.696 17919 29832 1 73 . 1 1 43 43 LEU CB C 43 45.790 45.790 42.461 3.329 17919 29833 1 73 . 1 1 43 43 LEU H H 43 8.820 8.820 8.751 0.069 17919 29834 1 73 . 1 1 44 44 ILE N N 44 121.920 121.920 124.268 -2.348 17919 29835 1 73 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.140 -0.148 17919 29836 1 73 . 1 1 44 44 ILE C C 44 176.060 176.060 175.049 1.011 17919 29837 1 73 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.036 -0.056 17919 29838 1 73 . 1 1 44 44 ILE CB C 44 41.420 41.420 39.960 1.460 17919 29839 1 73 . 1 1 44 44 ILE H H 44 9.030 9.030 8.179 0.851 17919 29840 1 73 . 1 1 45 45 PHE N N 45 125.390 125.390 126.190 -0.800 17919 29841 1 73 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.824 0.221 17919 29842 1 73 . 1 1 45 45 PHE C C 45 174.470 174.470 173.996 0.474 17919 29843 1 73 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.744 0.276 17919 29844 1 73 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.107 0.653 17919 29845 1 73 . 1 1 45 45 PHE H H 45 8.830 8.830 8.899 -0.069 17919 29846 1 73 . 1 1 46 46 ALA N N 46 132.200 132.200 129.277 2.923 17919 29847 1 73 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.616 0.074 17919 29848 1 73 . 1 1 46 46 ALA C C 46 177.290 177.290 177.454 -0.164 17919 29849 1 73 . 1 1 46 46 ALA CA C 46 52.540 52.540 53.052 -0.512 17919 29850 1 73 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.385 0.185 17919 29851 1 73 . 1 1 46 46 ALA H H 46 8.810 8.810 8.845 -0.035 17919 29852 1 73 . 1 1 47 47 GLY N N 47 102.340 102.340 103.969 -1.629 17919 29853 1 73 . 1 1 47 47 GLY C C 47 173.810 173.810 174.438 -0.628 17919 29854 1 73 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.511 -0.161 17919 29855 1 73 . 1 1 47 47 GLY H H 47 8.130 8.130 8.551 -0.421 17919 29856 1 73 . 1 1 48 48 LYS N N 48 121.570 121.570 121.454 0.116 17919 29857 1 73 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.538 0.084 17919 29858 1 73 . 1 1 48 48 LYS C C 48 174.700 174.700 175.537 -0.837 17919 29859 1 73 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.611 -0.062 17919 29860 1 73 . 1 1 48 48 LYS CB C 48 34.530 34.530 33.951 0.579 17919 29861 1 73 . 1 1 48 48 LYS H H 48 7.980 7.980 8.003 -0.023 17919 29862 1 73 . 1 1 49 49 GLN N N 49 122.410 122.410 125.062 -2.652 17919 29863 1 73 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.494 0.066 17919 29864 1 73 . 1 1 49 49 GLN C C 49 175.670 175.670 175.811 -0.141 17919 29865 1 73 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.291 -0.550 17919 29866 1 73 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.303 -0.303 17919 29867 1 73 . 1 1 49 49 GLN H H 49 8.600 8.600 8.676 -0.076 17919 29868 1 73 . 1 1 50 50 LEU N N 50 125.520 125.520 129.183 -3.663 17919 29869 1 73 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.146 -0.056 17919 29870 1 73 . 1 1 50 50 LEU C C 50 176.660 176.660 176.638 0.022 17919 29871 1 73 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.207 0.033 17919 29872 1 73 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.907 -0.338 17919 29873 1 73 . 1 1 50 50 LEU H H 50 8.530 8.530 8.498 0.032 17919 29874 1 73 . 1 1 51 51 GLU N N 51 122.940 122.940 123.362 -0.422 17919 29875 1 73 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.405 0.083 17919 29876 1 73 . 1 1 51 51 GLU C C 51 175.870 175.870 177.022 -1.152 17919 29877 1 73 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.832 0.128 17919 29878 1 73 . 1 1 51 51 GLU CB C 51 31.570 31.570 30.813 0.757 17919 29879 1 73 . 1 1 51 51 GLU H H 51 8.400 8.400 8.586 -0.186 17919 29880 1 73 . 1 1 52 52 ASP N N 52 120.030 120.030 122.563 -2.533 17919 29881 1 73 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.612 -0.253 17919 29882 1 73 . 1 1 52 52 ASP C C 52 177.330 177.330 177.051 0.279 17919 29883 1 73 . 1 1 52 52 ASP CA C 52 56.960 56.960 56.033 0.927 17919 29884 1 73 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.866 -0.016 17919 29885 1 73 . 1 1 52 52 ASP H H 52 8.160 8.160 8.890 -0.730 17919 29886 1 73 . 1 1 53 53 GLY N N 53 106.660 106.660 105.813 0.847 17919 29887 1 73 . 1 1 53 53 GLY C C 53 174.870 174.870 174.493 0.377 17919 29888 1 73 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.406 0.764 17919 29889 1 73 . 1 1 53 53 GLY H H 53 9.390 9.390 8.442 0.948 17919 29890 1 73 . 1 1 54 54 ARG N N 54 119.050 119.050 119.857 -0.807 17919 29891 1 73 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.514 0.181 17919 29892 1 73 . 1 1 54 54 ARG C C 54 175.350 175.350 175.507 -0.157 17919 29893 1 73 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.012 0.378 17919 29894 1 73 . 1 1 54 54 ARG CB C 54 32.650 32.650 31.871 0.779 17919 29895 1 73 . 1 1 54 54 ARG H H 54 7.460 7.460 7.412 0.048 17919 29896 1 73 . 1 1 55 55 THR N N 55 108.400 108.400 110.234 -1.834 17919 29897 1 73 . 1 1 55 55 THR HA H 55 5.240 5.240 5.072 0.168 17919 29898 1 73 . 1 1 55 55 THR C C 55 176.560 176.560 176.492 0.068 17919 29899 1 73 . 1 1 55 55 THR CA C 55 59.690 59.690 59.392 0.298 17919 29900 1 73 . 1 1 55 55 THR CB C 55 72.260 72.260 71.875 0.385 17919 29901 1 73 . 1 1 55 55 THR H H 55 8.730 8.730 8.723 0.007 17919 29902 1 73 . 1 1 56 56 LEU N N 56 117.920 117.920 120.054 -2.134 17919 29903 1 73 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.938 0.122 17919 29904 1 73 . 1 1 56 56 LEU C C 56 180.810 180.810 179.249 1.561 17919 29905 1 73 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.521 0.189 17919 29906 1 73 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.171 -0.801 17919 29907 1 73 . 1 1 56 56 LEU H H 56 8.140 8.140 8.352 -0.212 17919 29908 1 73 . 1 1 57 57 SER N N 57 113.330 113.330 114.816 -1.486 17919 29909 1 73 . 1 1 57 57 SER HA H 57 4.370 4.370 4.265 0.105 17919 29910 1 73 . 1 1 57 57 SER C C 57 178.310 178.310 176.708 1.602 17919 29911 1 73 . 1 1 57 57 SER CA C 57 61.080 61.080 61.779 -0.699 17919 29912 1 73 . 1 1 57 57 SER CB C 57 62.530 62.530 62.666 -0.136 17919 29913 1 73 . 1 1 57 57 SER H H 57 8.470 8.470 7.956 0.514 17919 29914 1 73 . 1 1 58 58 ASP N N 58 124.190 124.190 122.789 1.401 17919 29915 1 73 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.261 0.035 17919 29916 1 73 . 1 1 58 58 ASP C C 58 177.400 177.400 177.205 0.195 17919 29917 1 73 . 1 1 58 58 ASP CA C 58 57.180 57.180 57.118 0.062 17919 29918 1 73 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.346 -0.246 17919 29919 1 73 . 1 1 58 58 ASP H H 58 7.930 7.930 7.952 -0.022 17919 29920 1 73 . 1 1 59 59 TYR N N 59 115.510 115.510 113.789 1.721 17919 29921 1 73 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.713 -0.043 17919 29922 1 73 . 1 1 59 59 TYR C C 59 174.700 174.700 174.978 -0.278 17919 29923 1 73 . 1 1 59 59 TYR CA C 59 58.250 58.250 56.608 1.642 17919 29924 1 73 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.727 1.343 17919 29925 1 73 . 1 1 59 59 TYR H H 59 7.250 7.250 7.166 0.084 17919 29926 1 73 . 1 1 60 60 ASN N N 60 115.900 115.900 118.584 -2.684 17919 29927 1 73 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.420 -0.065 17919 29928 1 73 . 1 1 60 60 ASN C C 60 174.340 174.340 175.001 -0.661 17919 29929 1 73 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.234 -0.114 17919 29930 1 73 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.298 0.112 17919 29931 1 73 . 1 1 60 60 ASN H H 60 8.150 8.150 7.751 0.399 17919 29932 1 73 . 1 1 61 61 ILE N N 61 118.600 118.600 120.244 -1.644 17919 29933 1 73 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.858 -0.465 17919 29934 1 73 . 1 1 61 61 ILE C C 61 174.610 174.610 174.917 -0.307 17919 29935 1 73 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.723 0.697 17919 29936 1 73 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.065 -0.324 17919 29937 1 73 . 1 1 61 61 ILE H H 61 7.250 7.250 8.197 -0.947 17919 29938 1 73 . 1 1 62 62 GLN N N 62 124.740 124.740 125.861 -1.121 17919 29939 1 73 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.768 -0.262 17919 29940 1 73 . 1 1 62 62 GLN C C 62 175.970 175.970 175.619 0.351 17919 29941 1 73 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.283 0.377 17919 29942 1 73 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.291 0.359 17919 29943 1 73 . 1 1 62 62 GLN H H 62 7.610 7.610 7.843 -0.233 17919 29944 1 73 . 1 1 63 63 LYS N N 63 120.300 120.300 120.315 -0.015 17919 29945 1 73 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.960 0.041 17919 29946 1 73 . 1 1 63 63 LYS C C 63 175.810 175.810 176.651 -0.841 17919 29947 1 73 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.497 0.293 17919 29948 1 73 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.001 0.649 17919 29949 1 73 . 1 1 63 63 LYS H H 63 8.490 8.490 8.593 -0.103 17919 29950 1 73 . 1 1 64 64 GLU N N 64 113.950 113.950 118.391 -4.441 17919 29951 1 73 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.484 -0.019 17919 29952 1 73 . 1 1 64 64 GLU C C 64 175.250 175.250 175.816 -0.566 17919 29953 1 73 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.534 0.356 17919 29954 1 73 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.071 -2.171 17919 29955 1 73 . 1 1 64 64 GLU H H 64 9.280 9.280 8.775 0.505 17919 29956 1 73 . 1 1 65 65 SER N N 65 114.730 114.730 114.258 0.472 17919 29957 1 73 . 1 1 65 65 SER HA H 65 4.640 4.640 4.462 0.178 17919 29958 1 73 . 1 1 65 65 SER C C 65 172.160 172.160 174.012 -1.852 17919 29959 1 73 . 1 1 65 65 SER CA C 65 60.890 60.890 60.060 0.830 17919 29960 1 73 . 1 1 65 65 SER CB C 65 64.910 64.910 64.275 0.636 17919 29961 1 73 . 1 1 65 65 SER H H 65 7.670 7.670 7.271 0.399 17919 29962 1 73 . 1 1 66 66 THR N N 66 117.110 117.110 119.081 -1.971 17919 29963 1 73 . 1 1 66 66 THR HA H 66 5.270 5.270 5.320 -0.050 17919 29964 1 73 . 1 1 66 66 THR C C 66 173.950 173.950 174.210 -0.260 17919 29965 1 73 . 1 1 66 66 THR CA C 66 62.340 62.340 61.657 0.683 17919 29966 1 73 . 1 1 66 66 THR CB C 66 70.080 70.080 70.016 0.064 17919 29967 1 73 . 1 1 66 66 THR H H 66 8.730 8.730 8.359 0.371 17919 29968 1 73 . 1 1 67 67 LEU N N 67 127.110 127.110 127.766 -0.656 17919 29969 1 73 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.704 0.356 17919 29970 1 73 . 1 1 67 67 LEU C C 67 175.770 175.770 176.027 -0.257 17919 29971 1 73 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.758 0.142 17919 29972 1 73 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.320 0.940 17919 29973 1 73 . 1 1 67 67 LEU H H 67 9.410 9.410 8.670 0.740 17919 29974 1 73 . 1 1 68 68 HIS N N 68 118.380 118.380 117.251 1.129 17919 29975 1 73 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.625 -0.385 17919 29976 1 73 . 1 1 68 68 HIS C C 68 173.150 173.150 174.823 -1.673 17919 29977 1 73 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.596 0.404 17919 29978 1 73 . 1 1 68 68 HIS CB C 68 30.530 30.530 31.974 -1.444 17919 29979 1 73 . 1 1 68 68 HIS H H 68 9.230 9.230 8.416 0.814 17919 29980 1 73 . 1 1 69 69 LEU N N 69 124.460 124.460 122.266 2.194 17919 29981 1 73 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.090 0.100 17919 29982 1 73 . 1 1 69 69 LEU C C 69 175.270 175.270 174.354 0.916 17919 29983 1 73 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.232 -0.342 17919 29984 1 73 . 1 1 69 69 LEU CB C 69 44.380 44.380 45.038 -0.658 17919 29985 1 73 . 1 1 69 69 LEU H H 69 8.340 8.340 8.288 0.052 17919 29986 1 73 . 1 1 70 70 VAL N N 70 126.940 126.940 125.084 1.856 17919 29987 1 73 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.705 -0.355 17919 29988 1 73 . 1 1 70 70 VAL C C 70 174.000 174.000 173.553 0.447 17919 29989 1 73 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.871 0.929 17919 29990 1 73 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.429 -0.519 17919 29991 1 73 . 1 1 70 70 VAL H H 70 9.200 9.200 8.074 1.126 17919 29992 1 73 . 1 1 71 71 LEU N N 71 123.130 123.130 121.123 2.007 17919 29993 1 73 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.290 -0.230 17919 29994 1 73 . 1 1 71 71 LEU C C 71 177.830 177.830 175.460 2.370 17919 29995 1 73 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.252 0.688 17919 29996 1 73 . 1 1 71 71 LEU CB C 71 42.850 42.850 45.828 -2.978 17919 29997 1 73 . 1 1 71 71 LEU H H 71 8.120 8.120 8.091 0.029 17919 29998 1 73 . 1 1 72 72 ARG N N 72 123.490 123.490 122.841 0.649 17919 29999 1 73 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.659 -0.358 17919 30000 1 73 . 1 1 72 72 ARG C C 72 175.350 175.350 174.899 0.451 17919 30001 1 73 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.791 -0.181 17919 30002 1 73 . 1 1 72 72 ARG CB C 72 31.350 31.350 31.806 -0.456 17919 30003 1 73 . 1 1 72 72 ARG H H 72 8.580 8.580 8.162 0.418 17919 30004 1 74 . 1 1 2 2 GLN N N 2 123.220 123.220 124.676 -1.456 17919 30005 1 74 . 1 1 2 2 GLN HA H 2 5.249 5.249 4.673 0.576 17919 30006 1 74 . 1 1 2 2 GLN C C 2 175.920 175.920 174.383 1.537 17919 30007 1 74 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.463 0.617 17919 30008 1 74 . 1 1 2 2 GLN CB C 2 30.760 30.760 29.254 1.506 17919 30009 1 74 . 1 1 2 2 GLN H H 2 8.900 8.900 8.528 0.372 17919 30010 1 74 . 1 1 3 3 ILE N N 3 115.340 115.340 117.896 -2.556 17919 30011 1 74 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.202 0.011 17919 30012 1 74 . 1 1 3 3 ILE C C 3 172.450 172.450 173.296 -0.846 17919 30013 1 74 . 1 1 3 3 ILE CA C 3 59.570 59.570 60.352 -0.782 17919 30014 1 74 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.751 0.459 17919 30015 1 74 . 1 1 3 3 ILE H H 3 8.320 8.320 7.857 0.463 17919 30016 1 74 . 1 1 4 4 PHE N N 4 118.110 118.110 121.214 -3.104 17919 30017 1 74 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.138 0.492 17919 30018 1 74 . 1 1 4 4 PHE C C 4 175.320 175.320 175.524 -0.204 17919 30019 1 74 . 1 1 4 4 PHE CA C 4 55.210 55.210 54.967 0.243 17919 30020 1 74 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.559 -0.079 17919 30021 1 74 . 1 1 4 4 PHE H H 4 8.610 8.610 7.779 0.831 17919 30022 1 74 . 1 1 5 5 VAL N N 5 121.000 121.000 121.586 -0.586 17919 30023 1 74 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.736 -0.011 17919 30024 1 74 . 1 1 5 5 VAL C C 5 174.870 174.870 175.226 -0.356 17919 30025 1 74 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.346 -0.726 17919 30026 1 74 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.354 0.876 17919 30027 1 74 . 1 1 5 5 VAL H H 5 9.300 9.300 8.578 0.722 17919 30028 1 74 . 1 1 6 6 LYS N N 6 127.520 127.520 128.133 -0.613 17919 30029 1 74 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.335 0.032 17919 30030 1 74 . 1 1 6 6 LYS C C 6 177.140 177.140 176.809 0.331 17919 30031 1 74 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.740 -0.220 17919 30032 1 74 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.590 0.460 17919 30033 1 74 . 1 1 6 6 LYS H H 6 8.820 8.820 9.023 -0.203 17919 30034 1 74 . 1 1 7 7 THR N N 7 115.400 115.400 117.239 -1.839 17919 30035 1 74 . 1 1 7 7 THR HA H 7 4.970 4.970 4.255 0.715 17919 30036 1 74 . 1 1 7 7 THR C C 7 176.910 176.910 175.907 1.003 17919 30037 1 74 . 1 1 7 7 THR CA C 7 60.470 60.470 61.053 -0.583 17919 30038 1 74 . 1 1 7 7 THR CB C 7 70.630 70.630 69.614 1.016 17919 30039 1 74 . 1 1 7 7 THR H H 7 8.730 8.730 8.057 0.673 17919 30040 1 74 . 1 1 8 8 LEU N N 8 121.330 121.330 119.257 2.073 17919 30041 1 74 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.288 0.022 17919 30042 1 74 . 1 1 8 8 LEU C C 8 178.800 178.800 178.239 0.561 17919 30043 1 74 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.473 0.107 17919 30044 1 74 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.869 0.101 17919 30045 1 74 . 1 1 8 8 LEU H H 8 9.100 9.100 8.469 0.631 17919 30046 1 74 . 1 1 9 9 THR N N 9 105.590 105.590 106.869 -1.279 17919 30047 1 74 . 1 1 9 9 THR HA H 9 4.428 4.428 4.327 0.101 17919 30048 1 74 . 1 1 9 9 THR C C 9 175.520 175.520 175.661 -0.141 17919 30049 1 74 . 1 1 9 9 THR CA C 9 61.400 61.400 62.158 -0.758 17919 30050 1 74 . 1 1 9 9 THR CB C 9 69.140 69.140 68.840 0.300 17919 30051 1 74 . 1 1 9 9 THR H H 9 7.630 7.630 7.630 0.000 17919 30052 1 74 . 1 1 10 10 GLY N N 10 108.890 108.890 111.442 -2.552 17919 30053 1 74 . 1 1 10 10 GLY C C 10 174.070 174.070 173.535 0.535 17919 30054 1 74 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.940 0.520 17919 30055 1 74 . 1 1 10 10 GLY H H 10 7.810 7.810 7.818 -0.008 17919 30056 1 74 . 1 1 11 11 LYS N N 11 121.600 121.600 120.378 1.222 17919 30057 1 74 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.340 0.021 17919 30058 1 74 . 1 1 11 11 LYS C C 11 175.940 175.940 175.501 0.439 17919 30059 1 74 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.282 -0.002 17919 30060 1 74 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.248 -0.049 17919 30061 1 74 . 1 1 11 11 LYS H H 11 7.280 7.280 7.704 -0.424 17919 30062 1 74 . 1 1 12 12 THR N N 12 120.440 120.440 117.600 2.840 17919 30063 1 74 . 1 1 12 12 THR HA H 12 5.046 5.046 5.052 -0.006 17919 30064 1 74 . 1 1 12 12 THR C C 12 174.320 174.320 174.460 -0.140 17919 30065 1 74 . 1 1 12 12 THR CA C 12 62.390 62.390 61.885 0.505 17919 30066 1 74 . 1 1 12 12 THR CB C 12 69.910 69.910 69.991 -0.081 17919 30067 1 74 . 1 1 12 12 THR H H 12 8.650 8.650 8.079 0.571 17919 30068 1 74 . 1 1 13 13 ILE N N 13 127.110 127.110 125.234 1.876 17919 30069 1 74 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.413 0.131 17919 30070 1 74 . 1 1 13 13 ILE C C 13 175.220 175.220 174.612 0.608 17919 30071 1 74 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.507 -0.527 17919 30072 1 74 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.551 -0.601 17919 30073 1 74 . 1 1 13 13 ILE H H 13 9.450 9.450 9.044 0.406 17919 30074 1 74 . 1 1 14 14 THR N N 14 121.520 121.520 122.526 -1.006 17919 30075 1 74 . 1 1 14 14 THR HA H 14 4.964 4.964 4.769 0.195 17919 30076 1 74 . 1 1 14 14 THR C C 14 173.790 173.790 173.678 0.112 17919 30077 1 74 . 1 1 14 14 THR CA C 14 61.940 61.940 61.984 -0.044 17919 30078 1 74 . 1 1 14 14 THR CB C 14 69.650 69.650 70.042 -0.392 17919 30079 1 74 . 1 1 14 14 THR H H 14 8.710 8.710 8.387 0.323 17919 30080 1 74 . 1 1 15 15 LEU N N 15 124.800 124.800 126.234 -1.434 17919 30081 1 74 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.787 -0.007 17919 30082 1 74 . 1 1 15 15 LEU C C 15 174.670 174.670 174.755 -0.085 17919 30083 1 74 . 1 1 15 15 LEU CA C 15 52.830 52.830 54.170 -1.340 17919 30084 1 74 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.858 1.212 17919 30085 1 74 . 1 1 15 15 LEU H H 15 8.710 8.710 8.066 0.644 17919 30086 1 74 . 1 1 16 16 GLU N N 16 122.160 122.160 123.752 -1.592 17919 30087 1 74 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.864 0.052 17919 30088 1 74 . 1 1 16 16 GLU C C 16 175.860 175.860 175.857 0.003 17919 30089 1 74 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.343 -0.523 17919 30090 1 74 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.464 -1.014 17919 30091 1 74 . 1 1 16 16 GLU H H 16 8.140 8.140 8.583 -0.443 17919 30092 1 74 . 1 1 17 17 VAL N N 17 117.210 117.210 121.498 -4.288 17919 30093 1 74 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.743 -0.029 17919 30094 1 74 . 1 1 17 17 VAL C C 17 174.160 174.160 174.512 -0.352 17919 30095 1 74 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.728 -0.298 17919 30096 1 74 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.125 1.275 17919 30097 1 74 . 1 1 17 17 VAL H H 17 8.900 8.900 9.027 -0.127 17919 30098 1 74 . 1 1 18 18 GLU N N 18 118.990 118.990 121.939 -2.949 17919 30099 1 74 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.907 0.172 17919 30100 1 74 . 1 1 18 18 GLU C C 18 176.160 176.160 175.553 0.607 17919 30101 1 74 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.958 -0.238 17919 30102 1 74 . 1 1 18 18 GLU CB C 18 30.310 30.310 32.320 -2.010 17919 30103 1 74 . 1 1 18 18 GLU H H 18 8.640 8.640 8.275 0.365 17919 30104 1 74 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.360 -0.219 17919 30105 1 74 . 1 1 19 19 PRO C C 19 175.310 175.310 177.107 -1.797 17919 30106 1 74 . 1 1 19 19 PRO CA C 19 65.470 65.470 64.702 0.768 17919 30107 1 74 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.853 0.097 17919 30108 1 74 . 1 1 20 20 SER N N 20 103.400 103.400 111.858 -8.458 17919 30109 1 74 . 1 1 20 20 SER HA H 20 4.370 4.370 4.365 0.005 17919 30110 1 74 . 1 1 20 20 SER C C 20 174.660 174.660 174.676 -0.016 17919 30111 1 74 . 1 1 20 20 SER CA C 20 57.400 57.400 57.866 -0.466 17919 30112 1 74 . 1 1 20 20 SER CB C 20 63.370 63.370 62.434 0.936 17919 30113 1 74 . 1 1 20 20 SER H H 20 7.040 7.040 7.889 -0.849 17919 30114 1 74 . 1 1 21 21 ASP N N 21 123.480 123.480 124.439 -0.959 17919 30115 1 74 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.603 0.092 17919 30116 1 74 . 1 1 21 21 ASP C C 21 176.360 176.360 176.347 0.013 17919 30117 1 74 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.106 0.594 17919 30118 1 74 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.814 -1.014 17919 30119 1 74 . 1 1 21 21 ASP H H 21 8.030 8.030 7.814 0.216 17919 30120 1 74 . 1 1 22 22 THR N N 22 108.800 108.800 112.552 -3.752 17919 30121 1 74 . 1 1 22 22 THR HA H 22 4.920 4.920 4.896 0.024 17919 30122 1 74 . 1 1 22 22 THR C C 22 176.750 176.750 176.217 0.533 17919 30123 1 74 . 1 1 22 22 THR CA C 22 59.690 59.690 60.908 -1.218 17919 30124 1 74 . 1 1 22 22 THR CB C 22 71.200 71.200 70.660 0.540 17919 30125 1 74 . 1 1 22 22 THR H H 22 7.900 7.900 8.703 -0.803 17919 30126 1 74 . 1 1 23 23 ILE N N 23 121.190 121.190 119.840 1.350 17919 30127 1 74 . 1 1 23 23 ILE HA H 23 3.657 3.657 4.015 -0.358 17919 30128 1 74 . 1 1 23 23 ILE C C 23 179.040 179.040 178.111 0.929 17919 30129 1 74 . 1 1 23 23 ILE CA C 23 62.260 62.260 60.821 1.439 17919 30130 1 74 . 1 1 23 23 ILE CB C 23 34.350 34.350 35.873 -1.523 17919 30131 1 74 . 1 1 23 23 ILE H H 23 8.560 8.560 8.796 -0.236 17919 30132 1 74 . 1 1 24 24 GLU N N 24 120.830 120.830 121.571 -0.741 17919 30133 1 74 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.986 -0.069 17919 30134 1 74 . 1 1 24 24 GLU C C 24 178.640 178.640 178.399 0.241 17919 30135 1 74 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.604 0.616 17919 30136 1 74 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.204 -0.924 17919 30137 1 74 . 1 1 24 24 GLU H H 24 9.760 9.760 8.122 1.638 17919 30138 1 74 . 1 1 25 25 ASN N N 25 120.570 120.570 117.550 3.020 17919 30139 1 74 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.474 0.051 17919 30140 1 74 . 1 1 25 25 ASN C C 25 178.380 178.380 177.421 0.959 17919 30141 1 74 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.143 -0.083 17919 30142 1 74 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.447 0.003 17919 30143 1 74 . 1 1 25 25 ASN H H 25 7.920 7.920 7.715 0.205 17919 30144 1 74 . 1 1 26 26 VAL N N 26 121.710 121.710 117.505 4.205 17919 30145 1 74 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.596 -0.199 17919 30146 1 74 . 1 1 26 26 VAL C C 26 177.950 177.950 177.514 0.436 17919 30147 1 74 . 1 1 26 26 VAL CA C 26 67.660 67.660 65.973 1.687 17919 30148 1 74 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.337 -0.496 17919 30149 1 74 . 1 1 26 26 VAL H H 26 8.070 8.070 7.703 0.367 17919 30150 1 74 . 1 1 27 27 LYS N N 27 118.860 118.860 120.049 -1.189 17919 30151 1 74 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.119 0.461 17919 30152 1 74 . 1 1 27 27 LYS C C 27 180.550 180.550 178.975 1.575 17919 30153 1 74 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.609 -0.359 17919 30154 1 74 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.157 1.573 17919 30155 1 74 . 1 1 27 27 LYS H H 27 8.560 8.560 7.816 0.744 17919 30156 1 74 . 1 1 28 28 ALA N N 28 123.440 123.440 119.066 4.374 17919 30157 1 74 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.160 0.000 17919 30158 1 74 . 1 1 28 28 ALA C C 28 180.300 180.300 179.106 1.194 17919 30159 1 74 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.275 1.095 17919 30160 1 74 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.406 -0.696 17919 30161 1 74 . 1 1 28 28 ALA H H 28 8.060 8.060 8.261 -0.201 17919 30162 1 74 . 1 1 29 29 LYS N N 29 119.940 119.940 119.878 0.062 17919 30163 1 74 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.067 0.140 17919 30164 1 74 . 1 1 29 29 LYS C C 29 180.320 180.320 178.760 1.560 17919 30165 1 74 . 1 1 29 29 LYS CA C 29 59.650 59.650 58.905 0.745 17919 30166 1 74 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.392 0.898 17919 30167 1 74 . 1 1 29 29 LYS H H 29 7.850 7.850 7.503 0.347 17919 30168 1 74 . 1 1 30 30 ILE N N 30 121.080 121.080 121.022 0.058 17919 30169 1 74 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.586 -0.079 17919 30170 1 74 . 1 1 30 30 ILE C C 30 178.310 178.310 177.399 0.911 17919 30171 1 74 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.547 0.603 17919 30172 1 74 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.649 -0.849 17919 30173 1 74 . 1 1 30 30 ILE H H 30 8.280 8.280 8.022 0.258 17919 30174 1 74 . 1 1 31 31 GLN N N 31 123.490 123.490 120.081 3.409 17919 30175 1 74 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.973 -0.144 17919 30176 1 74 . 1 1 31 31 GLN C C 31 178.890 178.890 178.109 0.781 17919 30177 1 74 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.400 0.600 17919 30178 1 74 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.377 -0.657 17919 30179 1 74 . 1 1 31 31 GLN H H 31 8.580 8.580 8.418 0.162 17919 30180 1 74 . 1 1 32 32 ASP N N 32 119.360 119.360 119.058 0.302 17919 30181 1 74 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.353 0.001 17919 30182 1 74 . 1 1 32 32 ASP C C 32 177.250 177.250 177.696 -0.446 17919 30183 1 74 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.904 0.286 17919 30184 1 74 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.787 -0.207 17919 30185 1 74 . 1 1 32 32 ASP H H 32 8.010 8.010 7.913 0.097 17919 30186 1 74 . 1 1 33 33 LYS N N 33 115.130 115.130 115.975 -0.845 17919 30187 1 74 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.460 -0.123 17919 30188 1 74 . 1 1 33 33 LYS C C 33 177.870 177.870 177.696 0.174 17919 30189 1 74 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.001 1.049 17919 30190 1 74 . 1 1 33 33 LYS CB C 33 34.170 34.170 34.054 0.116 17919 30191 1 74 . 1 1 33 33 LYS H H 33 7.430 7.430 7.397 0.033 17919 30192 1 74 . 1 1 34 34 GLU N N 34 113.870 113.870 116.725 -2.855 17919 30193 1 74 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.417 0.208 17919 30194 1 74 . 1 1 34 34 GLU C C 34 177.840 177.840 176.948 0.892 17919 30195 1 74 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.809 -0.638 17919 30196 1 74 . 1 1 34 34 GLU CB C 34 32.660 32.660 32.499 0.161 17919 30197 1 74 . 1 1 34 34 GLU H H 34 8.740 8.740 8.171 0.569 17919 30198 1 74 . 1 1 35 35 GLY N N 35 108.650 108.650 107.213 1.437 17919 30199 1 74 . 1 1 35 35 GLY C C 35 173.960 173.960 174.538 -0.578 17919 30200 1 74 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.280 0.800 17919 30201 1 74 . 1 1 35 35 GLY H H 35 8.530 8.530 7.643 0.887 17919 30202 1 74 . 1 1 36 36 ILE N N 36 119.880 119.880 123.120 -3.240 17919 30203 1 74 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.193 0.252 17919 30204 1 74 . 1 1 36 36 ILE C C 36 173.590 173.590 174.151 -0.561 17919 30205 1 74 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.672 -0.922 17919 30206 1 74 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.508 2.072 17919 30207 1 74 . 1 1 36 36 ILE H H 36 6.150 6.150 7.889 -1.739 17919 30208 1 74 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.747 -0.113 17919 30209 1 74 . 1 1 37 37 PRO C C 37 176.940 176.940 176.004 0.936 17919 30210 1 74 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.388 0.272 17919 30211 1 74 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.426 0.424 17919 30212 1 74 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.204 -0.087 17919 30213 1 74 . 1 1 38 38 PRO C C 38 178.320 178.320 177.573 0.747 17919 30214 1 74 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.571 0.689 17919 30215 1 74 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.871 1.019 17919 30216 1 74 . 1 1 39 39 ASP N N 39 113.380 113.380 114.441 -1.061 17919 30217 1 74 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.646 -0.216 17919 30218 1 74 . 1 1 39 39 ASP C C 39 177.090 177.090 175.972 1.118 17919 30219 1 74 . 1 1 39 39 ASP CA C 39 55.640 55.640 55.016 0.624 17919 30220 1 74 . 1 1 39 39 ASP CB C 39 39.540 39.540 39.549 -0.009 17919 30221 1 74 . 1 1 39 39 ASP H H 39 8.550 8.550 8.575 -0.025 17919 30222 1 74 . 1 1 40 40 GLN N N 40 116.780 116.780 118.720 -1.940 17919 30223 1 74 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.345 0.119 17919 30224 1 74 . 1 1 40 40 GLN C C 40 175.380 175.380 175.507 -0.127 17919 30225 1 74 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.756 -0.116 17919 30226 1 74 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.851 0.289 17919 30227 1 74 . 1 1 40 40 GLN H H 40 7.820 7.820 7.878 -0.058 17919 30228 1 74 . 1 1 41 41 GLN N N 41 117.720 117.720 119.913 -2.193 17919 30229 1 74 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.707 -0.463 17919 30230 1 74 . 1 1 41 41 GLN C C 41 176.300 176.300 174.406 1.894 17919 30231 1 74 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.045 1.425 17919 30232 1 74 . 1 1 41 41 GLN CB C 41 31.650 31.650 30.651 1.000 17919 30233 1 74 . 1 1 41 41 GLN H H 41 7.480 7.480 7.850 -0.370 17919 30234 1 74 . 1 1 42 42 ARG N N 42 122.680 122.680 126.242 -3.562 17919 30235 1 74 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.702 -0.202 17919 30236 1 74 . 1 1 42 42 ARG C C 42 174.050 174.050 173.766 0.284 17919 30237 1 74 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.795 0.255 17919 30238 1 74 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.890 -1.140 17919 30239 1 74 . 1 1 42 42 ARG H H 42 8.530 8.530 8.165 0.365 17919 30240 1 74 . 1 1 43 43 LEU N N 43 124.040 124.040 126.425 -2.385 17919 30241 1 74 . 1 1 43 43 LEU C C 43 175.290 175.290 175.751 -0.461 17919 30242 1 74 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.385 -0.405 17919 30243 1 74 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.163 2.627 17919 30244 1 74 . 1 1 43 43 LEU H H 43 8.820 8.820 8.698 0.122 17919 30245 1 74 . 1 1 44 44 ILE N N 44 121.920 121.920 118.704 3.216 17919 30246 1 74 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.121 -0.129 17919 30247 1 74 . 1 1 44 44 ILE C C 44 176.060 176.060 174.875 1.185 17919 30248 1 74 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.663 -0.683 17919 30249 1 74 . 1 1 44 44 ILE CB C 44 41.420 41.420 40.973 0.447 17919 30250 1 74 . 1 1 44 44 ILE H H 44 9.030 9.030 8.035 0.995 17919 30251 1 74 . 1 1 45 45 PHE N N 45 125.390 125.390 126.554 -1.164 17919 30252 1 74 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.966 0.079 17919 30253 1 74 . 1 1 45 45 PHE C C 45 174.470 174.470 174.404 0.066 17919 30254 1 74 . 1 1 45 45 PHE CA C 45 57.020 57.020 57.027 -0.007 17919 30255 1 74 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.030 0.730 17919 30256 1 74 . 1 1 45 45 PHE H H 45 8.830 8.830 8.609 0.221 17919 30257 1 74 . 1 1 46 46 ALA N N 46 132.200 132.200 128.585 3.615 17919 30258 1 74 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.651 0.039 17919 30259 1 74 . 1 1 46 46 ALA C C 46 177.290 177.290 177.688 -0.398 17919 30260 1 74 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.526 0.014 17919 30261 1 74 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.623 -0.053 17919 30262 1 74 . 1 1 46 46 ALA H H 46 8.810 8.810 8.964 -0.154 17919 30263 1 74 . 1 1 47 47 GLY N N 47 102.340 102.340 103.752 -1.412 17919 30264 1 74 . 1 1 47 47 GLY C C 47 173.810 173.810 174.435 -0.625 17919 30265 1 74 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.839 0.511 17919 30266 1 74 . 1 1 47 47 GLY H H 47 8.130 8.130 8.355 -0.225 17919 30267 1 74 . 1 1 48 48 LYS N N 48 121.570 121.570 123.167 -1.597 17919 30268 1 74 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.306 0.316 17919 30269 1 74 . 1 1 48 48 LYS C C 48 174.700 174.700 175.412 -0.712 17919 30270 1 74 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.322 -0.772 17919 30271 1 74 . 1 1 48 48 LYS CB C 48 34.530 34.530 33.059 1.471 17919 30272 1 74 . 1 1 48 48 LYS H H 48 7.980 7.980 7.616 0.364 17919 30273 1 74 . 1 1 49 49 GLN N N 49 122.410 122.410 127.211 -4.801 17919 30274 1 74 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.400 0.160 17919 30275 1 74 . 1 1 49 49 GLN C C 49 175.670 175.670 175.394 0.276 17919 30276 1 74 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.011 -0.271 17919 30277 1 74 . 1 1 49 49 GLN CB C 49 29.000 29.000 28.841 0.159 17919 30278 1 74 . 1 1 49 49 GLN H H 49 8.600 8.600 8.669 -0.069 17919 30279 1 74 . 1 1 50 50 LEU N N 50 125.520 125.520 129.074 -3.554 17919 30280 1 74 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.035 0.055 17919 30281 1 74 . 1 1 50 50 LEU C C 50 176.660 176.660 176.183 0.477 17919 30282 1 74 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.583 -0.343 17919 30283 1 74 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.915 -0.345 17919 30284 1 74 . 1 1 50 50 LEU H H 50 8.530 8.530 8.368 0.162 17919 30285 1 74 . 1 1 51 51 GLU N N 51 122.940 122.940 124.474 -1.534 17919 30286 1 74 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.382 0.106 17919 30287 1 74 . 1 1 51 51 GLU C C 51 175.870 175.870 177.491 -1.621 17919 30288 1 74 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.567 0.393 17919 30289 1 74 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.122 0.448 17919 30290 1 74 . 1 1 51 51 GLU H H 51 8.400 8.400 8.374 0.026 17919 30291 1 74 . 1 1 52 52 ASP N N 52 120.030 120.030 126.028 -5.998 17919 30292 1 74 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.408 -0.049 17919 30293 1 74 . 1 1 52 52 ASP C C 52 177.330 177.330 177.712 -0.382 17919 30294 1 74 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.542 -0.582 17919 30295 1 74 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.778 0.072 17919 30296 1 74 . 1 1 52 52 ASP H H 52 8.160 8.160 8.900 -0.740 17919 30297 1 74 . 1 1 53 53 GLY N N 53 106.660 106.660 104.840 1.820 17919 30298 1 74 . 1 1 53 53 GLY C C 53 174.870 174.870 173.665 1.205 17919 30299 1 74 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.669 0.501 17919 30300 1 74 . 1 1 53 53 GLY H H 53 9.390 9.390 8.609 0.781 17919 30301 1 74 . 1 1 54 54 ARG N N 54 119.050 119.050 119.783 -0.733 17919 30302 1 74 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.618 0.077 17919 30303 1 74 . 1 1 54 54 ARG C C 54 175.350 175.350 174.855 0.495 17919 30304 1 74 . 1 1 54 54 ARG CA C 54 54.390 54.390 53.766 0.624 17919 30305 1 74 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.571 -0.921 17919 30306 1 74 . 1 1 54 54 ARG H H 54 7.460 7.460 7.484 -0.024 17919 30307 1 74 . 1 1 55 55 THR N N 55 108.400 108.400 112.041 -3.641 17919 30308 1 74 . 1 1 55 55 THR HA H 55 5.240 5.240 4.902 0.338 17919 30309 1 74 . 1 1 55 55 THR C C 55 176.560 176.560 176.139 0.421 17919 30310 1 74 . 1 1 55 55 THR CA C 55 59.690 59.690 60.833 -1.143 17919 30311 1 74 . 1 1 55 55 THR CB C 55 72.260 72.260 70.942 1.319 17919 30312 1 74 . 1 1 55 55 THR H H 55 8.730 8.730 8.831 -0.101 17919 30313 1 74 . 1 1 56 56 LEU N N 56 117.920 117.920 122.315 -4.395 17919 30314 1 74 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.077 -0.017 17919 30315 1 74 . 1 1 56 56 LEU C C 56 180.810 180.810 179.227 1.583 17919 30316 1 74 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.657 0.053 17919 30317 1 74 . 1 1 56 56 LEU CB C 56 40.370 40.370 40.859 -0.489 17919 30318 1 74 . 1 1 56 56 LEU H H 56 8.140 8.140 8.441 -0.301 17919 30319 1 74 . 1 1 57 57 SER N N 57 113.330 113.330 113.556 -0.226 17919 30320 1 74 . 1 1 57 57 SER HA H 57 4.370 4.370 4.219 0.151 17919 30321 1 74 . 1 1 57 57 SER C C 57 178.310 178.310 176.794 1.516 17919 30322 1 74 . 1 1 57 57 SER CA C 57 61.080 61.080 62.042 -0.962 17919 30323 1 74 . 1 1 57 57 SER CB C 57 62.530 62.530 62.743 -0.213 17919 30324 1 74 . 1 1 57 57 SER H H 57 8.470 8.470 7.959 0.511 17919 30325 1 74 . 1 1 58 58 ASP N N 58 124.190 124.190 121.814 2.376 17919 30326 1 74 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.222 0.074 17919 30327 1 74 . 1 1 58 58 ASP C C 58 177.400 177.400 176.989 0.411 17919 30328 1 74 . 1 1 58 58 ASP CA C 58 57.180 57.180 57.225 -0.045 17919 30329 1 74 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.602 -0.502 17919 30330 1 74 . 1 1 58 58 ASP H H 58 7.930 7.930 7.996 -0.066 17919 30331 1 74 . 1 1 59 59 TYR N N 59 115.510 115.510 113.836 1.674 17919 30332 1 74 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.688 -0.018 17919 30333 1 74 . 1 1 59 59 TYR C C 59 174.700 174.700 174.861 -0.161 17919 30334 1 74 . 1 1 59 59 TYR CA C 59 58.250 58.250 55.607 2.643 17919 30335 1 74 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.126 1.944 17919 30336 1 74 . 1 1 59 59 TYR H H 59 7.250 7.250 7.093 0.157 17919 30337 1 74 . 1 1 60 60 ASN N N 60 115.900 115.900 116.159 -0.259 17919 30338 1 74 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.412 -0.057 17919 30339 1 74 . 1 1 60 60 ASN C C 60 174.340 174.340 174.495 -0.155 17919 30340 1 74 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.095 0.025 17919 30341 1 74 . 1 1 60 60 ASN CB C 60 37.410 37.410 38.036 -0.626 17919 30342 1 74 . 1 1 60 60 ASN H H 60 8.150 8.150 7.860 0.290 17919 30343 1 74 . 1 1 61 61 ILE N N 61 118.600 118.600 119.804 -1.204 17919 30344 1 74 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.945 -0.552 17919 30345 1 74 . 1 1 61 61 ILE C C 61 174.610 174.610 176.089 -1.479 17919 30346 1 74 . 1 1 61 61 ILE CA C 61 62.420 62.420 60.941 1.479 17919 30347 1 74 . 1 1 61 61 ILE CB C 61 36.740 36.740 36.985 -0.245 17919 30348 1 74 . 1 1 61 61 ILE H H 61 7.250 7.250 7.844 -0.594 17919 30349 1 74 . 1 1 62 62 GLN N N 62 124.740 124.740 125.063 -0.323 17919 30350 1 74 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.582 -0.076 17919 30351 1 74 . 1 1 62 62 GLN C C 62 175.970 175.970 174.980 0.990 17919 30352 1 74 . 1 1 62 62 GLN CA C 62 53.660 53.660 52.870 0.790 17919 30353 1 74 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.751 -0.101 17919 30354 1 74 . 1 1 62 62 GLN H H 62 7.610 7.610 8.120 -0.510 17919 30355 1 74 . 1 1 63 63 LYS N N 63 120.300 120.300 119.603 0.697 17919 30356 1 74 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.147 -0.146 17919 30357 1 74 . 1 1 63 63 LYS C C 63 175.810 175.810 176.371 -0.561 17919 30358 1 74 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.824 -0.034 17919 30359 1 74 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.581 1.069 17919 30360 1 74 . 1 1 63 63 LYS H H 63 8.490 8.490 8.523 -0.033 17919 30361 1 74 . 1 1 64 64 GLU N N 64 113.950 113.950 118.338 -4.388 17919 30362 1 74 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.335 0.130 17919 30363 1 74 . 1 1 64 64 GLU C C 64 175.250 175.250 175.301 -0.051 17919 30364 1 74 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.462 0.428 17919 30365 1 74 . 1 1 64 64 GLU CB C 64 25.900 25.900 27.630 -1.730 17919 30366 1 74 . 1 1 64 64 GLU H H 64 9.280 9.280 8.695 0.585 17919 30367 1 74 . 1 1 65 65 SER N N 65 114.730 114.730 115.638 -0.908 17919 30368 1 74 . 1 1 65 65 SER HA H 65 4.640 4.640 4.442 0.198 17919 30369 1 74 . 1 1 65 65 SER C C 65 172.160 172.160 173.685 -1.525 17919 30370 1 74 . 1 1 65 65 SER CA C 65 60.890 60.890 59.160 1.730 17919 30371 1 74 . 1 1 65 65 SER CB C 65 64.910 64.910 63.654 1.256 17919 30372 1 74 . 1 1 65 65 SER H H 65 7.670 7.670 7.857 -0.187 17919 30373 1 74 . 1 1 66 66 THR N N 66 117.110 117.110 122.124 -5.014 17919 30374 1 74 . 1 1 66 66 THR HA H 66 5.270 5.270 4.803 0.467 17919 30375 1 74 . 1 1 66 66 THR C C 66 173.950 173.950 174.353 -0.403 17919 30376 1 74 . 1 1 66 66 THR CA C 66 62.340 62.340 62.562 -0.223 17919 30377 1 74 . 1 1 66 66 THR CB C 66 70.080 70.080 69.391 0.688 17919 30378 1 74 . 1 1 66 66 THR H H 66 8.730 8.730 8.232 0.498 17919 30379 1 74 . 1 1 67 67 LEU N N 67 127.110 127.110 127.106 0.004 17919 30380 1 74 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.665 0.395 17919 30381 1 74 . 1 1 67 67 LEU C C 67 175.770 175.770 175.730 0.040 17919 30382 1 74 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.796 0.104 17919 30383 1 74 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.773 0.487 17919 30384 1 74 . 1 1 67 67 LEU H H 67 9.410 9.410 8.954 0.456 17919 30385 1 74 . 1 1 68 68 HIS N N 68 118.380 118.380 123.036 -4.656 17919 30386 1 74 . 1 1 68 68 HIS HA H 68 5.240 5.240 4.906 0.334 17919 30387 1 74 . 1 1 68 68 HIS C C 68 173.150 173.150 175.309 -2.159 17919 30388 1 74 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.443 0.557 17919 30389 1 74 . 1 1 68 68 HIS CB C 68 30.530 30.530 29.605 0.925 17919 30390 1 74 . 1 1 68 68 HIS H H 68 9.230 9.230 8.258 0.972 17919 30391 1 74 . 1 1 69 69 LEU N N 69 124.460 124.460 128.544 -4.084 17919 30392 1 74 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.295 0.895 17919 30393 1 74 . 1 1 69 69 LEU C C 69 175.270 175.270 175.032 0.238 17919 30394 1 74 . 1 1 69 69 LEU CA C 69 53.890 53.890 56.396 -2.506 17919 30395 1 74 . 1 1 69 69 LEU CB C 69 44.380 44.380 42.561 1.819 17919 30396 1 74 . 1 1 69 69 LEU H H 69 8.340 8.340 7.576 0.764 17919 30397 1 74 . 1 1 70 70 VAL N N 70 126.940 126.940 120.024 6.916 17919 30398 1 74 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.610 -0.260 17919 30399 1 74 . 1 1 70 70 VAL C C 70 174.000 174.000 174.664 -0.664 17919 30400 1 74 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.172 1.629 17919 30401 1 74 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.103 -0.193 17919 30402 1 74 . 1 1 70 70 VAL H H 70 9.200 9.200 8.875 0.325 17919 30403 1 74 . 1 1 71 71 LEU N N 71 123.130 123.130 120.011 3.119 17919 30404 1 74 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.950 0.110 17919 30405 1 74 . 1 1 71 71 LEU C C 71 177.830 177.830 177.075 0.755 17919 30406 1 74 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.937 0.003 17919 30407 1 74 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.781 -0.931 17919 30408 1 74 . 1 1 71 71 LEU H H 71 8.120 8.120 8.262 -0.142 17919 30409 1 74 . 1 1 72 72 ARG N N 72 123.490 123.490 119.845 3.645 17919 30410 1 74 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.494 -0.193 17919 30411 1 74 . 1 1 72 72 ARG C C 72 175.350 175.350 175.203 0.147 17919 30412 1 74 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.769 -0.159 17919 30413 1 74 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.259 1.091 17919 30414 1 74 . 1 1 72 72 ARG H H 72 8.580 8.580 8.245 0.335 17919 30415 1 75 . 1 1 2 2 GLN N N 2 123.220 123.220 120.362 2.858 17919 30416 1 75 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.349 -0.100 17919 30417 1 75 . 1 1 2 2 GLN C C 2 175.920 175.920 175.499 0.421 17919 30418 1 75 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.067 1.013 17919 30419 1 75 . 1 1 2 2 GLN CB C 2 30.760 30.760 31.240 -0.480 17919 30420 1 75 . 1 1 2 2 GLN H H 2 8.900 8.900 8.313 0.587 17919 30421 1 75 . 1 1 3 3 ILE N N 3 115.340 115.340 116.549 -1.209 17919 30422 1 75 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.442 -0.229 17919 30423 1 75 . 1 1 3 3 ILE C C 3 172.450 172.450 174.133 -1.683 17919 30424 1 75 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.445 0.125 17919 30425 1 75 . 1 1 3 3 ILE CB C 3 42.210 42.210 39.954 2.256 17919 30426 1 75 . 1 1 3 3 ILE H H 3 8.320 8.320 7.952 0.368 17919 30427 1 75 . 1 1 4 4 PHE N N 4 118.110 118.110 120.679 -2.569 17919 30428 1 75 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.279 0.351 17919 30429 1 75 . 1 1 4 4 PHE C C 4 175.320 175.320 175.572 -0.252 17919 30430 1 75 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.461 -0.251 17919 30431 1 75 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.213 0.267 17919 30432 1 75 . 1 1 4 4 PHE H H 4 8.610 8.610 8.553 0.057 17919 30433 1 75 . 1 1 5 5 VAL N N 5 121.000 121.000 120.947 0.053 17919 30434 1 75 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.993 -0.268 17919 30435 1 75 . 1 1 5 5 VAL C C 5 174.870 174.870 174.912 -0.042 17919 30436 1 75 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.161 -0.541 17919 30437 1 75 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.226 0.004 17919 30438 1 75 . 1 1 5 5 VAL H H 5 9.300 9.300 8.535 0.765 17919 30439 1 75 . 1 1 6 6 LYS N N 6 127.520 127.520 129.792 -2.272 17919 30440 1 75 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.091 0.276 17919 30441 1 75 . 1 1 6 6 LYS C C 6 177.140 177.140 176.548 0.592 17919 30442 1 75 . 1 1 6 6 LYS CA C 6 54.520 54.520 55.139 -0.619 17919 30443 1 75 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.613 0.437 17919 30444 1 75 . 1 1 6 6 LYS H H 6 8.820 8.820 8.650 0.170 17919 30445 1 75 . 1 1 7 7 THR N N 7 115.400 115.400 118.397 -2.997 17919 30446 1 75 . 1 1 7 7 THR HA H 7 4.970 4.970 4.408 0.562 17919 30447 1 75 . 1 1 7 7 THR C C 7 176.910 176.910 176.015 0.895 17919 30448 1 75 . 1 1 7 7 THR CA C 7 60.470 60.470 60.239 0.231 17919 30449 1 75 . 1 1 7 7 THR CB C 7 70.630 70.630 70.136 0.494 17919 30450 1 75 . 1 1 7 7 THR H H 7 8.730 8.730 8.809 -0.079 17919 30451 1 75 . 1 1 8 8 LEU N N 8 121.330 121.330 120.645 0.685 17919 30452 1 75 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.257 0.053 17919 30453 1 75 . 1 1 8 8 LEU C C 8 178.800 178.800 177.733 1.067 17919 30454 1 75 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.202 0.378 17919 30455 1 75 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.938 0.032 17919 30456 1 75 . 1 1 8 8 LEU H H 8 9.100 9.100 8.702 0.398 17919 30457 1 75 . 1 1 9 9 THR N N 9 105.590 105.590 109.236 -3.646 17919 30458 1 75 . 1 1 9 9 THR HA H 9 4.428 4.428 4.332 0.096 17919 30459 1 75 . 1 1 9 9 THR C C 9 175.520 175.520 175.664 -0.144 17919 30460 1 75 . 1 1 9 9 THR CA C 9 61.400 61.400 62.343 -0.943 17919 30461 1 75 . 1 1 9 9 THR CB C 9 69.140 69.140 69.424 -0.284 17919 30462 1 75 . 1 1 9 9 THR H H 9 7.630 7.630 7.504 0.126 17919 30463 1 75 . 1 1 10 10 GLY N N 10 108.890 108.890 111.018 -2.128 17919 30464 1 75 . 1 1 10 10 GLY C C 10 174.070 174.070 173.876 0.194 17919 30465 1 75 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.942 0.518 17919 30466 1 75 . 1 1 10 10 GLY H H 10 7.810 7.810 8.021 -0.211 17919 30467 1 75 . 1 1 11 11 LYS N N 11 121.600 121.600 121.200 0.400 17919 30468 1 75 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.315 0.046 17919 30469 1 75 . 1 1 11 11 LYS C C 11 175.940 175.940 175.473 0.467 17919 30470 1 75 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.705 -0.425 17919 30471 1 75 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.214 -0.014 17919 30472 1 75 . 1 1 11 11 LYS H H 11 7.280 7.280 7.577 -0.297 17919 30473 1 75 . 1 1 12 12 THR N N 12 120.440 120.440 121.802 -1.362 17919 30474 1 75 . 1 1 12 12 THR HA H 12 5.046 5.046 5.099 -0.053 17919 30475 1 75 . 1 1 12 12 THR C C 12 174.320 174.320 174.481 -0.161 17919 30476 1 75 . 1 1 12 12 THR CA C 12 62.390 62.390 62.092 0.298 17919 30477 1 75 . 1 1 12 12 THR CB C 12 69.910 69.910 69.477 0.433 17919 30478 1 75 . 1 1 12 12 THR H H 12 8.650 8.650 8.273 0.377 17919 30479 1 75 . 1 1 13 13 ILE N N 13 127.110 127.110 123.236 3.874 17919 30480 1 75 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.746 -0.202 17919 30481 1 75 . 1 1 13 13 ILE C C 13 175.220 175.220 174.307 0.913 17919 30482 1 75 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.575 0.405 17919 30483 1 75 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.860 0.090 17919 30484 1 75 . 1 1 13 13 ILE H H 13 9.450 9.450 8.724 0.726 17919 30485 1 75 . 1 1 14 14 THR N N 14 121.520 121.520 121.955 -0.435 17919 30486 1 75 . 1 1 14 14 THR HA H 14 4.964 4.964 4.925 0.039 17919 30487 1 75 . 1 1 14 14 THR C C 14 173.790 173.790 174.200 -0.410 17919 30488 1 75 . 1 1 14 14 THR CA C 14 61.940 61.940 62.594 -0.654 17919 30489 1 75 . 1 1 14 14 THR CB C 14 69.650 69.650 69.781 -0.131 17919 30490 1 75 . 1 1 14 14 THR H H 14 8.710 8.710 8.442 0.268 17919 30491 1 75 . 1 1 15 15 LEU N N 15 124.800 124.800 126.668 -1.868 17919 30492 1 75 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.764 0.016 17919 30493 1 75 . 1 1 15 15 LEU C C 15 174.670 174.670 175.040 -0.370 17919 30494 1 75 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.672 -0.842 17919 30495 1 75 . 1 1 15 15 LEU CB C 15 47.070 47.070 44.967 2.103 17919 30496 1 75 . 1 1 15 15 LEU H H 15 8.710 8.710 8.314 0.396 17919 30497 1 75 . 1 1 16 16 GLU N N 16 122.160 122.160 124.349 -2.189 17919 30498 1 75 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.446 0.471 17919 30499 1 75 . 1 1 16 16 GLU C C 16 175.860 175.860 175.665 0.195 17919 30500 1 75 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.763 -0.943 17919 30501 1 75 . 1 1 16 16 GLU CB C 16 29.450 29.450 29.766 -0.316 17919 30502 1 75 . 1 1 16 16 GLU H H 16 8.140 8.140 8.642 -0.502 17919 30503 1 75 . 1 1 17 17 VAL N N 17 117.210 117.210 121.751 -4.541 17919 30504 1 75 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.807 -0.093 17919 30505 1 75 . 1 1 17 17 VAL C C 17 174.160 174.160 174.661 -0.501 17919 30506 1 75 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.866 -0.436 17919 30507 1 75 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.439 0.961 17919 30508 1 75 . 1 1 17 17 VAL H H 17 8.900 8.900 8.986 -0.086 17919 30509 1 75 . 1 1 18 18 GLU N N 18 118.990 118.990 118.920 0.070 17919 30510 1 75 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.805 0.274 17919 30511 1 75 . 1 1 18 18 GLU C C 18 176.160 176.160 174.956 1.204 17919 30512 1 75 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.262 -0.542 17919 30513 1 75 . 1 1 18 18 GLU CB C 18 30.310 30.310 32.492 -2.182 17919 30514 1 75 . 1 1 18 18 GLU H H 18 8.640 8.640 8.579 0.061 17919 30515 1 75 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.172 -0.031 17919 30516 1 75 . 1 1 19 19 PRO C C 19 175.310 175.310 178.567 -3.257 17919 30517 1 75 . 1 1 19 19 PRO CA C 19 65.470 65.470 66.140 -0.670 17919 30518 1 75 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.939 0.011 17919 30519 1 75 . 1 1 20 20 SER N N 20 103.400 103.400 113.213 -9.813 17919 30520 1 75 . 1 1 20 20 SER HA H 20 4.370 4.370 4.226 0.144 17919 30521 1 75 . 1 1 20 20 SER C C 20 174.660 174.660 174.744 -0.084 17919 30522 1 75 . 1 1 20 20 SER CA C 20 57.400 57.400 59.839 -2.439 17919 30523 1 75 . 1 1 20 20 SER CB C 20 63.370 63.370 63.093 0.278 17919 30524 1 75 . 1 1 20 20 SER H H 20 7.040 7.040 8.190 -1.150 17919 30525 1 75 . 1 1 21 21 ASP N N 21 123.480 123.480 123.037 0.443 17919 30526 1 75 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.585 0.110 17919 30527 1 75 . 1 1 21 21 ASP C C 21 176.360 176.360 175.391 0.969 17919 30528 1 75 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.625 0.075 17919 30529 1 75 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.234 -0.434 17919 30530 1 75 . 1 1 21 21 ASP H H 21 8.030 8.030 7.881 0.149 17919 30531 1 75 . 1 1 22 22 THR N N 22 108.800 108.800 114.880 -6.080 17919 30532 1 75 . 1 1 22 22 THR HA H 22 4.920 4.920 4.883 0.037 17919 30533 1 75 . 1 1 22 22 THR C C 22 176.750 176.750 176.497 0.253 17919 30534 1 75 . 1 1 22 22 THR CA C 22 59.690 59.690 61.712 -2.022 17919 30535 1 75 . 1 1 22 22 THR CB C 22 71.200 71.200 70.690 0.510 17919 30536 1 75 . 1 1 22 22 THR H H 22 7.900 7.900 8.143 -0.243 17919 30537 1 75 . 1 1 23 23 ILE N N 23 121.190 121.190 124.386 -3.196 17919 30538 1 75 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.699 -0.042 17919 30539 1 75 . 1 1 23 23 ILE C C 23 179.040 179.040 177.752 1.288 17919 30540 1 75 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.052 -0.792 17919 30541 1 75 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.326 -1.976 17919 30542 1 75 . 1 1 23 23 ILE H H 23 8.560 8.560 8.751 -0.191 17919 30543 1 75 . 1 1 24 24 GLU N N 24 120.830 120.830 120.182 0.648 17919 30544 1 75 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.820 0.097 17919 30545 1 75 . 1 1 24 24 GLU C C 24 178.640 178.640 178.932 -0.292 17919 30546 1 75 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.165 0.055 17919 30547 1 75 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.405 -1.125 17919 30548 1 75 . 1 1 24 24 GLU H H 24 9.760 9.760 8.931 0.829 17919 30549 1 75 . 1 1 25 25 ASN N N 25 120.570 120.570 118.041 2.529 17919 30550 1 75 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.492 0.033 17919 30551 1 75 . 1 1 25 25 ASN C C 25 178.380 178.380 177.912 0.468 17919 30552 1 75 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.139 -0.078 17919 30553 1 75 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.570 -0.120 17919 30554 1 75 . 1 1 25 25 ASN H H 25 7.920 7.920 7.805 0.115 17919 30555 1 75 . 1 1 26 26 VAL N N 26 121.710 121.710 120.534 1.176 17919 30556 1 75 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.719 -0.322 17919 30557 1 75 . 1 1 26 26 VAL C C 26 177.950 177.950 177.974 -0.024 17919 30558 1 75 . 1 1 26 26 VAL CA C 26 67.660 67.660 65.900 1.760 17919 30559 1 75 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.327 -0.487 17919 30560 1 75 . 1 1 26 26 VAL H H 26 8.070 8.070 8.202 -0.132 17919 30561 1 75 . 1 1 27 27 LYS N N 27 118.860 118.860 119.815 -0.955 17919 30562 1 75 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.075 0.505 17919 30563 1 75 . 1 1 27 27 LYS C C 27 180.550 180.550 178.951 1.599 17919 30564 1 75 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.629 -0.379 17919 30565 1 75 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.291 1.439 17919 30566 1 75 . 1 1 27 27 LYS H H 27 8.560 8.560 8.586 -0.026 17919 30567 1 75 . 1 1 28 28 ALA N N 28 123.440 123.440 123.194 0.246 17919 30568 1 75 . 1 1 28 28 ALA HA H 28 4.160 4.160 3.972 0.188 17919 30569 1 75 . 1 1 28 28 ALA C C 28 180.300 180.300 179.120 1.180 17919 30570 1 75 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.418 -0.048 17919 30571 1 75 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.266 -0.556 17919 30572 1 75 . 1 1 28 28 ALA H H 28 8.060 8.060 8.340 -0.280 17919 30573 1 75 . 1 1 29 29 LYS N N 29 119.940 119.940 119.295 0.645 17919 30574 1 75 . 1 1 29 29 LYS HA H 29 4.207 4.207 3.939 0.268 17919 30575 1 75 . 1 1 29 29 LYS C C 29 180.320 180.320 179.281 1.039 17919 30576 1 75 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.489 0.161 17919 30577 1 75 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.280 1.010 17919 30578 1 75 . 1 1 29 29 LYS H H 29 7.850 7.850 7.719 0.131 17919 30579 1 75 . 1 1 30 30 ILE N N 30 121.080 121.080 119.651 1.429 17919 30580 1 75 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.622 -0.115 17919 30581 1 75 . 1 1 30 30 ILE C C 30 178.310 178.310 177.610 0.700 17919 30582 1 75 . 1 1 30 30 ILE CA C 30 66.150 66.150 64.855 1.295 17919 30583 1 75 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.463 -0.663 17919 30584 1 75 . 1 1 30 30 ILE H H 30 8.280 8.280 7.824 0.456 17919 30585 1 75 . 1 1 31 31 GLN N N 31 123.490 123.490 120.843 2.647 17919 30586 1 75 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.040 -0.211 17919 30587 1 75 . 1 1 31 31 GLN C C 31 178.890 178.890 178.028 0.862 17919 30588 1 75 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.066 0.934 17919 30589 1 75 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.637 -0.917 17919 30590 1 75 . 1 1 31 31 GLN H H 31 8.580 8.580 8.314 0.266 17919 30591 1 75 . 1 1 32 32 ASP N N 32 119.360 119.360 118.261 1.099 17919 30592 1 75 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.431 -0.077 17919 30593 1 75 . 1 1 32 32 ASP C C 32 177.250 177.250 178.124 -0.874 17919 30594 1 75 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.758 0.432 17919 30595 1 75 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.958 -0.378 17919 30596 1 75 . 1 1 32 32 ASP H H 32 8.010 8.010 8.396 -0.386 17919 30597 1 75 . 1 1 33 33 LYS N N 33 115.130 115.130 116.765 -1.635 17919 30598 1 75 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.458 -0.121 17919 30599 1 75 . 1 1 33 33 LYS C C 33 177.870 177.870 177.748 0.122 17919 30600 1 75 . 1 1 33 33 LYS CA C 33 58.050 58.050 56.891 1.159 17919 30601 1 75 . 1 1 33 33 LYS CB C 33 34.170 34.170 34.173 -0.003 17919 30602 1 75 . 1 1 33 33 LYS H H 33 7.430 7.430 7.540 -0.110 17919 30603 1 75 . 1 1 34 34 GLU N N 34 113.870 113.870 115.684 -1.814 17919 30604 1 75 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.499 0.126 17919 30605 1 75 . 1 1 34 34 GLU C C 34 177.840 177.840 177.179 0.661 17919 30606 1 75 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.576 -0.406 17919 30607 1 75 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.305 1.355 17919 30608 1 75 . 1 1 34 34 GLU H H 34 8.740 8.740 8.229 0.511 17919 30609 1 75 . 1 1 35 35 GLY N N 35 108.650 108.650 109.577 -0.927 17919 30610 1 75 . 1 1 35 35 GLY C C 35 173.960 173.960 174.264 -0.304 17919 30611 1 75 . 1 1 35 35 GLY CA C 35 46.080 46.080 46.210 -0.130 17919 30612 1 75 . 1 1 35 35 GLY H H 35 8.530 8.530 7.967 0.563 17919 30613 1 75 . 1 1 36 36 ILE N N 36 119.880 119.880 120.101 -0.221 17919 30614 1 75 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.377 0.068 17919 30615 1 75 . 1 1 36 36 ILE C C 36 173.590 173.590 174.187 -0.597 17919 30616 1 75 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.732 0.018 17919 30617 1 75 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.531 2.049 17919 30618 1 75 . 1 1 36 36 ILE H H 36 6.150 6.150 7.572 -1.422 17919 30619 1 75 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.579 0.055 17919 30620 1 75 . 1 1 37 37 PRO C C 37 176.940 176.940 176.613 0.327 17919 30621 1 75 . 1 1 37 37 PRO CA C 37 61.660 61.660 62.049 -0.389 17919 30622 1 75 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.363 0.487 17919 30623 1 75 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.294 -0.177 17919 30624 1 75 . 1 1 38 38 PRO C C 38 178.320 178.320 177.550 0.770 17919 30625 1 75 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.077 1.183 17919 30626 1 75 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.967 0.923 17919 30627 1 75 . 1 1 39 39 ASP N N 39 113.380 113.380 114.996 -1.616 17919 30628 1 75 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.412 0.018 17919 30629 1 75 . 1 1 39 39 ASP C C 39 177.090 177.090 177.601 -0.511 17919 30630 1 75 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.126 -0.486 17919 30631 1 75 . 1 1 39 39 ASP CB C 39 39.540 39.540 39.645 -0.105 17919 30632 1 75 . 1 1 39 39 ASP H H 39 8.550 8.550 8.685 -0.135 17919 30633 1 75 . 1 1 40 40 GLN N N 40 116.780 116.780 117.314 -0.534 17919 30634 1 75 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.367 0.097 17919 30635 1 75 . 1 1 40 40 GLN C C 40 175.380 175.380 175.826 -0.446 17919 30636 1 75 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.643 -0.003 17919 30637 1 75 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.318 0.822 17919 30638 1 75 . 1 1 40 40 GLN H H 40 7.820 7.820 7.634 0.186 17919 30639 1 75 . 1 1 41 41 GLN N N 41 117.720 117.720 118.915 -1.195 17919 30640 1 75 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.510 -0.266 17919 30641 1 75 . 1 1 41 41 GLN C C 41 176.300 176.300 175.241 1.059 17919 30642 1 75 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.397 1.073 17919 30643 1 75 . 1 1 41 41 GLN CB C 41 31.650 31.650 30.299 1.351 17919 30644 1 75 . 1 1 41 41 GLN H H 41 7.480 7.480 7.442 0.038 17919 30645 1 75 . 1 1 42 42 ARG N N 42 122.680 122.680 125.664 -2.984 17919 30646 1 75 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.576 -0.076 17919 30647 1 75 . 1 1 42 42 ARG C C 42 174.050 174.050 174.329 -0.279 17919 30648 1 75 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.019 0.031 17919 30649 1 75 . 1 1 42 42 ARG CB C 42 31.750 31.750 31.003 0.747 17919 30650 1 75 . 1 1 42 42 ARG H H 42 8.530 8.530 8.141 0.389 17919 30651 1 75 . 1 1 43 43 LEU N N 43 124.040 124.040 127.616 -3.576 17919 30652 1 75 . 1 1 43 43 LEU C C 43 175.290 175.290 175.945 -0.655 17919 30653 1 75 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.534 -1.554 17919 30654 1 75 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.329 2.461 17919 30655 1 75 . 1 1 43 43 LEU H H 43 8.820 8.820 8.764 0.056 17919 30656 1 75 . 1 1 44 44 ILE N N 44 121.920 121.920 122.712 -0.792 17919 30657 1 75 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.171 -0.179 17919 30658 1 75 . 1 1 44 44 ILE C C 44 176.060 176.060 174.601 1.459 17919 30659 1 75 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.306 -1.326 17919 30660 1 75 . 1 1 44 44 ILE CB C 44 41.420 41.420 40.577 0.843 17919 30661 1 75 . 1 1 44 44 ILE H H 44 9.030 9.030 8.840 0.190 17919 30662 1 75 . 1 1 45 45 PHE N N 45 125.390 125.390 127.895 -2.505 17919 30663 1 75 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.041 0.004 17919 30664 1 75 . 1 1 45 45 PHE C C 45 174.470 174.470 174.243 0.227 17919 30665 1 75 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.339 0.681 17919 30666 1 75 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.385 0.375 17919 30667 1 75 . 1 1 45 45 PHE H H 45 8.830 8.830 9.228 -0.398 17919 30668 1 75 . 1 1 46 46 ALA N N 46 132.200 132.200 129.294 2.906 17919 30669 1 75 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.714 -0.024 17919 30670 1 75 . 1 1 46 46 ALA C C 46 177.290 177.290 177.705 -0.415 17919 30671 1 75 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.334 0.206 17919 30672 1 75 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.540 0.030 17919 30673 1 75 . 1 1 46 46 ALA H H 46 8.810 8.810 8.685 0.125 17919 30674 1 75 . 1 1 47 47 GLY N N 47 102.340 102.340 104.191 -1.851 17919 30675 1 75 . 1 1 47 47 GLY C C 47 173.810 173.810 174.298 -0.488 17919 30676 1 75 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.966 0.384 17919 30677 1 75 . 1 1 47 47 GLY H H 47 8.130 8.130 8.491 -0.361 17919 30678 1 75 . 1 1 48 48 LYS N N 48 121.570 121.570 122.686 -1.116 17919 30679 1 75 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.550 0.072 17919 30680 1 75 . 1 1 48 48 LYS C C 48 174.700 174.700 175.253 -0.553 17919 30681 1 75 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.654 -0.103 17919 30682 1 75 . 1 1 48 48 LYS CB C 48 34.530 34.530 33.555 0.975 17919 30683 1 75 . 1 1 48 48 LYS H H 48 7.980 7.980 7.772 0.208 17919 30684 1 75 . 1 1 49 49 GLN N N 49 122.410 122.410 126.311 -3.901 17919 30685 1 75 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.519 0.041 17919 30686 1 75 . 1 1 49 49 GLN C C 49 175.670 175.670 175.529 0.141 17919 30687 1 75 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.346 -0.606 17919 30688 1 75 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.262 -0.262 17919 30689 1 75 . 1 1 49 49 GLN H H 49 8.600 8.600 8.724 -0.124 17919 30690 1 75 . 1 1 50 50 LEU N N 50 125.520 125.520 128.168 -2.648 17919 30691 1 75 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.133 -0.043 17919 30692 1 75 . 1 1 50 50 LEU C C 50 176.660 176.660 175.664 0.996 17919 30693 1 75 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.319 -0.079 17919 30694 1 75 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.837 -1.267 17919 30695 1 75 . 1 1 50 50 LEU H H 50 8.530 8.530 8.677 -0.147 17919 30696 1 75 . 1 1 51 51 GLU N N 51 122.940 122.940 121.140 1.800 17919 30697 1 75 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.545 -0.057 17919 30698 1 75 . 1 1 51 51 GLU C C 51 175.870 175.870 176.467 -0.597 17919 30699 1 75 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.190 0.770 17919 30700 1 75 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.294 -0.724 17919 30701 1 75 . 1 1 51 51 GLU H H 51 8.400 8.400 8.286 0.114 17919 30702 1 75 . 1 1 52 52 ASP N N 52 120.030 120.030 126.310 -6.280 17919 30703 1 75 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.524 -0.165 17919 30704 1 75 . 1 1 52 52 ASP C C 52 177.330 177.330 176.933 0.397 17919 30705 1 75 . 1 1 52 52 ASP CA C 52 56.960 56.960 56.898 0.062 17919 30706 1 75 . 1 1 52 52 ASP CB C 52 40.850 40.850 41.337 -0.486 17919 30707 1 75 . 1 1 52 52 ASP H H 52 8.160 8.160 8.849 -0.689 17919 30708 1 75 . 1 1 53 53 GLY N N 53 106.660 106.660 106.549 0.111 17919 30709 1 75 . 1 1 53 53 GLY C C 53 174.870 174.870 173.817 1.053 17919 30710 1 75 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.569 0.601 17919 30711 1 75 . 1 1 53 53 GLY H H 53 9.390 9.390 8.405 0.985 17919 30712 1 75 . 1 1 54 54 ARG N N 54 119.050 119.050 120.199 -1.149 17919 30713 1 75 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.722 -0.027 17919 30714 1 75 . 1 1 54 54 ARG C C 54 175.350 175.350 174.994 0.356 17919 30715 1 75 . 1 1 54 54 ARG CA C 54 54.390 54.390 53.960 0.430 17919 30716 1 75 . 1 1 54 54 ARG CB C 54 32.650 32.650 34.011 -1.361 17919 30717 1 75 . 1 1 54 54 ARG H H 54 7.460 7.460 7.628 -0.168 17919 30718 1 75 . 1 1 55 55 THR N N 55 108.400 108.400 112.757 -4.357 17919 30719 1 75 . 1 1 55 55 THR HA H 55 5.240 5.240 5.081 0.159 17919 30720 1 75 . 1 1 55 55 THR C C 55 176.560 176.560 176.331 0.229 17919 30721 1 75 . 1 1 55 55 THR CA C 55 59.690 59.690 60.496 -0.806 17919 30722 1 75 . 1 1 55 55 THR CB C 55 72.260 72.260 70.747 1.513 17919 30723 1 75 . 1 1 55 55 THR H H 55 8.730 8.730 8.735 -0.005 17919 30724 1 75 . 1 1 56 56 LEU N N 56 117.920 117.920 124.248 -6.328 17919 30725 1 75 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.933 0.127 17919 30726 1 75 . 1 1 56 56 LEU C C 56 180.810 180.810 178.811 1.999 17919 30727 1 75 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.618 0.092 17919 30728 1 75 . 1 1 56 56 LEU CB C 56 40.370 40.370 40.945 -0.575 17919 30729 1 75 . 1 1 56 56 LEU H H 56 8.140 8.140 8.899 -0.759 17919 30730 1 75 . 1 1 57 57 SER N N 57 113.330 113.330 114.252 -0.922 17919 30731 1 75 . 1 1 57 57 SER HA H 57 4.370 4.370 4.172 0.198 17919 30732 1 75 . 1 1 57 57 SER C C 57 178.310 178.310 176.885 1.425 17919 30733 1 75 . 1 1 57 57 SER CA C 57 61.080 61.080 62.218 -1.138 17919 30734 1 75 . 1 1 57 57 SER CB C 57 62.530 62.530 62.925 -0.395 17919 30735 1 75 . 1 1 57 57 SER H H 57 8.470 8.470 7.873 0.597 17919 30736 1 75 . 1 1 58 58 ASP N N 58 124.190 124.190 122.789 1.401 17919 30737 1 75 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.268 0.028 17919 30738 1 75 . 1 1 58 58 ASP C C 58 177.400 177.400 177.359 0.041 17919 30739 1 75 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.829 0.351 17919 30740 1 75 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.387 -0.287 17919 30741 1 75 . 1 1 58 58 ASP H H 58 7.930 7.930 7.723 0.207 17919 30742 1 75 . 1 1 59 59 TYR N N 59 115.510 115.510 115.816 -0.306 17919 30743 1 75 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.669 0.001 17919 30744 1 75 . 1 1 59 59 TYR C C 59 174.700 174.700 175.103 -0.403 17919 30745 1 75 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.501 0.749 17919 30746 1 75 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.691 1.379 17919 30747 1 75 . 1 1 59 59 TYR H H 59 7.250 7.250 7.221 0.029 17919 30748 1 75 . 1 1 60 60 ASN N N 60 115.900 115.900 114.565 1.335 17919 30749 1 75 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.390 -0.035 17919 30750 1 75 . 1 1 60 60 ASN C C 60 174.340 174.340 174.307 0.033 17919 30751 1 75 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.093 0.027 17919 30752 1 75 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.541 -0.131 17919 30753 1 75 . 1 1 60 60 ASN H H 60 8.150 8.150 7.780 0.370 17919 30754 1 75 . 1 1 61 61 ILE N N 61 118.600 118.600 120.603 -2.003 17919 30755 1 75 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.795 -0.402 17919 30756 1 75 . 1 1 61 61 ILE C C 61 174.610 174.610 175.153 -0.543 17919 30757 1 75 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.910 0.510 17919 30758 1 75 . 1 1 61 61 ILE CB C 61 36.740 36.740 36.695 0.045 17919 30759 1 75 . 1 1 61 61 ILE H H 61 7.250 7.250 7.969 -0.719 17919 30760 1 75 . 1 1 62 62 GLN N N 62 124.740 124.740 125.576 -0.836 17919 30761 1 75 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.761 -0.255 17919 30762 1 75 . 1 1 62 62 GLN C C 62 175.970 175.970 175.942 0.028 17919 30763 1 75 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.318 0.342 17919 30764 1 75 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.337 0.313 17919 30765 1 75 . 1 1 62 62 GLN H H 62 7.610 7.610 7.874 -0.264 17919 30766 1 75 . 1 1 63 63 LYS N N 63 120.300 120.300 121.070 -0.770 17919 30767 1 75 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.887 0.114 17919 30768 1 75 . 1 1 63 63 LYS C C 63 175.810 175.810 176.558 -0.748 17919 30769 1 75 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.968 -0.178 17919 30770 1 75 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.154 0.497 17919 30771 1 75 . 1 1 63 63 LYS H H 63 8.490 8.490 8.577 -0.087 17919 30772 1 75 . 1 1 64 64 GLU N N 64 113.950 113.950 116.882 -2.932 17919 30773 1 75 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.742 -0.277 17919 30774 1 75 . 1 1 64 64 GLU C C 64 175.250 175.250 175.480 -0.230 17919 30775 1 75 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.811 0.079 17919 30776 1 75 . 1 1 64 64 GLU CB C 64 25.900 25.900 27.580 -1.680 17919 30777 1 75 . 1 1 64 64 GLU H H 64 9.280 9.280 8.461 0.819 17919 30778 1 75 . 1 1 65 65 SER N N 65 114.730 114.730 114.157 0.573 17919 30779 1 75 . 1 1 65 65 SER HA H 65 4.640 4.640 4.458 0.182 17919 30780 1 75 . 1 1 65 65 SER C C 65 172.160 172.160 174.061 -1.901 17919 30781 1 75 . 1 1 65 65 SER CA C 65 60.890 60.890 60.226 0.664 17919 30782 1 75 . 1 1 65 65 SER CB C 65 64.910 64.910 64.192 0.718 17919 30783 1 75 . 1 1 65 65 SER H H 65 7.670 7.670 7.347 0.323 17919 30784 1 75 . 1 1 66 66 THR N N 66 117.110 117.110 118.144 -1.034 17919 30785 1 75 . 1 1 66 66 THR HA H 66 5.270 5.270 5.130 0.140 17919 30786 1 75 . 1 1 66 66 THR C C 66 173.950 173.950 173.694 0.256 17919 30787 1 75 . 1 1 66 66 THR CA C 66 62.340 62.340 61.762 0.578 17919 30788 1 75 . 1 1 66 66 THR CB C 66 70.080 70.080 70.892 -0.812 17919 30789 1 75 . 1 1 66 66 THR H H 66 8.730 8.730 8.465 0.265 17919 30790 1 75 . 1 1 67 67 LEU N N 67 127.110 127.110 126.887 0.223 17919 30791 1 75 . 1 1 67 67 LEU HA H 67 5.060 5.060 5.232 -0.172 17919 30792 1 75 . 1 1 67 67 LEU C C 67 175.770 175.770 175.195 0.575 17919 30793 1 75 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.445 0.455 17919 30794 1 75 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.270 -0.010 17919 30795 1 75 . 1 1 67 67 LEU H H 67 9.410 9.410 9.151 0.259 17919 30796 1 75 . 1 1 68 68 HIS N N 68 118.380 118.380 120.965 -2.585 17919 30797 1 75 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.315 -0.075 17919 30798 1 75 . 1 1 68 68 HIS C C 68 173.150 173.150 173.467 -0.317 17919 30799 1 75 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.121 0.879 17919 30800 1 75 . 1 1 68 68 HIS CB C 68 30.530 30.530 33.331 -2.801 17919 30801 1 75 . 1 1 68 68 HIS H H 68 9.230 9.230 8.737 0.493 17919 30802 1 75 . 1 1 69 69 LEU N N 69 124.460 124.460 128.862 -4.402 17919 30803 1 75 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.224 -0.034 17919 30804 1 75 . 1 1 69 69 LEU C C 69 175.270 175.270 174.419 0.851 17919 30805 1 75 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.558 0.332 17919 30806 1 75 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.314 0.066 17919 30807 1 75 . 1 1 69 69 LEU H H 69 8.340 8.340 7.567 0.773 17919 30808 1 75 . 1 1 70 70 VAL N N 70 126.940 126.940 125.413 1.527 17919 30809 1 75 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.405 -0.055 17919 30810 1 75 . 1 1 70 70 VAL C C 70 174.000 174.000 174.197 -0.197 17919 30811 1 75 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.419 0.381 17919 30812 1 75 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.888 -0.978 17919 30813 1 75 . 1 1 70 70 VAL H H 70 9.200 9.200 8.198 1.002 17919 30814 1 75 . 1 1 71 71 LEU N N 71 123.130 123.130 122.958 0.172 17919 30815 1 75 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.178 -0.118 17919 30816 1 75 . 1 1 71 71 LEU C C 71 177.830 177.830 177.317 0.513 17919 30817 1 75 . 1 1 71 71 LEU CA C 71 53.940 53.940 52.547 1.393 17919 30818 1 75 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.650 -0.800 17919 30819 1 75 . 1 1 71 71 LEU H H 71 8.120 8.120 8.156 -0.036 17919 30820 1 75 . 1 1 72 72 ARG N N 72 123.490 123.490 121.294 2.196 17919 30821 1 75 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.496 -0.195 17919 30822 1 75 . 1 1 72 72 ARG C C 72 175.350 175.350 174.939 0.411 17919 30823 1 75 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.802 -0.192 17919 30824 1 75 . 1 1 72 72 ARG CB C 72 31.350 31.350 31.248 0.102 17919 30825 1 75 . 1 1 72 72 ARG H H 72 8.580 8.580 8.122 0.458 17919 30826 1 76 . 1 1 2 2 GLN N N 2 123.220 123.220 121.355 1.865 17919 30827 1 76 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.138 0.111 17919 30828 1 76 . 1 1 2 2 GLN C C 2 175.920 175.920 175.156 0.764 17919 30829 1 76 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.701 0.379 17919 30830 1 76 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.080 0.680 17919 30831 1 76 . 1 1 2 2 GLN H H 2 8.900 8.900 8.527 0.373 17919 30832 1 76 . 1 1 3 3 ILE N N 3 115.340 115.340 117.423 -2.083 17919 30833 1 76 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.402 -0.189 17919 30834 1 76 . 1 1 3 3 ILE C C 3 172.450 172.450 173.534 -1.084 17919 30835 1 76 . 1 1 3 3 ILE CA C 3 59.570 59.570 58.925 0.645 17919 30836 1 76 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.493 0.717 17919 30837 1 76 . 1 1 3 3 ILE H H 3 8.320 8.320 8.123 0.197 17919 30838 1 76 . 1 1 4 4 PHE N N 4 118.110 118.110 120.683 -2.573 17919 30839 1 76 . 1 1 4 4 PHE HA H 4 5.630 5.630 4.920 0.710 17919 30840 1 76 . 1 1 4 4 PHE C C 4 175.320 175.320 175.470 -0.150 17919 30841 1 76 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.436 -0.226 17919 30842 1 76 . 1 1 4 4 PHE CB C 4 41.480 41.480 39.662 1.818 17919 30843 1 76 . 1 1 4 4 PHE H H 4 8.610 8.610 7.962 0.648 17919 30844 1 76 . 1 1 5 5 VAL N N 5 121.000 121.000 125.694 -4.694 17919 30845 1 76 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.476 0.249 17919 30846 1 76 . 1 1 5 5 VAL C C 5 174.870 174.870 175.971 -1.101 17919 30847 1 76 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.925 -1.305 17919 30848 1 76 . 1 1 5 5 VAL CB C 5 34.230 34.230 32.865 1.365 17919 30849 1 76 . 1 1 5 5 VAL H H 5 9.300 9.300 8.282 1.018 17919 30850 1 76 . 1 1 6 6 LYS N N 6 127.520 127.520 128.381 -0.861 17919 30851 1 76 . 1 1 6 6 LYS HA H 6 5.367 5.367 4.683 0.684 17919 30852 1 76 . 1 1 6 6 LYS C C 6 177.140 177.140 176.932 0.208 17919 30853 1 76 . 1 1 6 6 LYS CA C 6 54.520 54.520 53.313 1.207 17919 30854 1 76 . 1 1 6 6 LYS CB C 6 35.050 35.050 32.086 2.965 17919 30855 1 76 . 1 1 6 6 LYS H H 6 8.820 8.820 8.374 0.446 17919 30856 1 76 . 1 1 7 7 THR N N 7 115.400 115.400 115.571 -0.171 17919 30857 1 76 . 1 1 7 7 THR HA H 7 4.970 4.970 4.256 0.714 17919 30858 1 76 . 1 1 7 7 THR C C 7 176.910 176.910 176.277 0.633 17919 30859 1 76 . 1 1 7 7 THR CA C 7 60.470 60.470 62.231 -1.761 17919 30860 1 76 . 1 1 7 7 THR CB C 7 70.630 70.630 69.509 1.121 17919 30861 1 76 . 1 1 7 7 THR H H 7 8.730 8.730 7.889 0.841 17919 30862 1 76 . 1 1 8 8 LEU N N 8 121.330 121.330 121.103 0.227 17919 30863 1 76 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.135 0.175 17919 30864 1 76 . 1 1 8 8 LEU C C 8 178.800 178.800 178.488 0.312 17919 30865 1 76 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.682 -0.102 17919 30866 1 76 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.684 0.286 17919 30867 1 76 . 1 1 8 8 LEU H H 8 9.100 9.100 8.926 0.174 17919 30868 1 76 . 1 1 9 9 THR N N 9 105.590 105.590 105.823 -0.233 17919 30869 1 76 . 1 1 9 9 THR HA H 9 4.428 4.428 4.214 0.214 17919 30870 1 76 . 1 1 9 9 THR C C 9 175.520 175.520 175.922 -0.402 17919 30871 1 76 . 1 1 9 9 THR CA C 9 61.400 61.400 61.956 -0.556 17919 30872 1 76 . 1 1 9 9 THR CB C 9 69.140 69.140 68.662 0.478 17919 30873 1 76 . 1 1 9 9 THR H H 9 7.630 7.630 7.802 -0.172 17919 30874 1 76 . 1 1 10 10 GLY N N 10 108.890 108.890 110.705 -1.815 17919 30875 1 76 . 1 1 10 10 GLY C C 10 174.070 174.070 174.135 -0.065 17919 30876 1 76 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.371 0.089 17919 30877 1 76 . 1 1 10 10 GLY H H 10 7.810 7.810 8.119 -0.309 17919 30878 1 76 . 1 1 11 11 LYS N N 11 121.600 121.600 123.248 -1.648 17919 30879 1 76 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.133 0.228 17919 30880 1 76 . 1 1 11 11 LYS C C 11 175.940 175.940 176.004 -0.064 17919 30881 1 76 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.562 -0.283 17919 30882 1 76 . 1 1 11 11 LYS CB C 11 33.200 33.200 32.423 0.777 17919 30883 1 76 . 1 1 11 11 LYS H H 11 7.280 7.280 7.394 -0.114 17919 30884 1 76 . 1 1 12 12 THR N N 12 120.440 120.440 121.570 -1.130 17919 30885 1 76 . 1 1 12 12 THR HA H 12 5.046 5.046 4.411 0.635 17919 30886 1 76 . 1 1 12 12 THR C C 12 174.320 174.320 174.407 -0.087 17919 30887 1 76 . 1 1 12 12 THR CA C 12 62.390 62.390 63.801 -1.411 17919 30888 1 76 . 1 1 12 12 THR CB C 12 69.910 69.910 69.096 0.814 17919 30889 1 76 . 1 1 12 12 THR H H 12 8.650 8.650 8.301 0.349 17919 30890 1 76 . 1 1 13 13 ILE N N 13 127.110 127.110 129.843 -2.733 17919 30891 1 76 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.368 0.176 17919 30892 1 76 . 1 1 13 13 ILE C C 13 175.220 175.220 175.089 0.131 17919 30893 1 76 . 1 1 13 13 ILE CA C 13 59.980 59.980 58.349 1.631 17919 30894 1 76 . 1 1 13 13 ILE CB C 13 40.950 40.950 36.038 4.912 17919 30895 1 76 . 1 1 13 13 ILE H H 13 9.450 9.450 9.131 0.319 17919 30896 1 76 . 1 1 14 14 THR N N 14 121.520 121.520 124.127 -2.607 17919 30897 1 76 . 1 1 14 14 THR HA H 14 4.964 4.964 4.857 0.107 17919 30898 1 76 . 1 1 14 14 THR C C 14 173.790 173.790 174.007 -0.217 17919 30899 1 76 . 1 1 14 14 THR CA C 14 61.940 61.940 63.116 -1.176 17919 30900 1 76 . 1 1 14 14 THR CB C 14 69.650 69.650 69.422 0.228 17919 30901 1 76 . 1 1 14 14 THR H H 14 8.710 8.710 8.692 0.018 17919 30902 1 76 . 1 1 15 15 LEU N N 15 124.800 124.800 127.650 -2.850 17919 30903 1 76 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.703 0.077 17919 30904 1 76 . 1 1 15 15 LEU C C 15 174.670 174.670 175.255 -0.585 17919 30905 1 76 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.837 -1.007 17919 30906 1 76 . 1 1 15 15 LEU CB C 15 47.070 47.070 44.012 3.058 17919 30907 1 76 . 1 1 15 15 LEU H H 15 8.710 8.710 8.579 0.131 17919 30908 1 76 . 1 1 16 16 GLU N N 16 122.160 122.160 124.382 -2.222 17919 30909 1 76 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.979 -0.062 17919 30910 1 76 . 1 1 16 16 GLU C C 16 175.860 175.860 176.446 -0.586 17919 30911 1 76 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.518 -0.698 17919 30912 1 76 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.108 -0.658 17919 30913 1 76 . 1 1 16 16 GLU H H 16 8.140 8.140 8.738 -0.598 17919 30914 1 76 . 1 1 17 17 VAL N N 17 117.210 117.210 120.338 -3.128 17919 30915 1 76 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.978 -0.264 17919 30916 1 76 . 1 1 17 17 VAL C C 17 174.160 174.160 175.208 -1.048 17919 30917 1 76 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.010 -0.580 17919 30918 1 76 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.830 0.570 17919 30919 1 76 . 1 1 17 17 VAL H H 17 8.900 8.900 8.950 -0.050 17919 30920 1 76 . 1 1 18 18 GLU N N 18 118.990 118.990 120.787 -1.797 17919 30921 1 76 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.790 0.289 17919 30922 1 76 . 1 1 18 18 GLU C C 18 176.160 176.160 174.792 1.368 17919 30923 1 76 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.908 -0.188 17919 30924 1 76 . 1 1 18 18 GLU CB C 18 30.310 30.310 31.697 -1.387 17919 30925 1 76 . 1 1 18 18 GLU H H 18 8.640 8.640 8.155 0.485 17919 30926 1 76 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.239 -0.098 17919 30927 1 76 . 1 1 19 19 PRO C C 19 175.310 175.310 177.574 -2.264 17919 30928 1 76 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.493 -0.023 17919 30929 1 76 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.074 -0.124 17919 30930 1 76 . 1 1 20 20 SER N N 20 103.400 103.400 110.038 -6.638 17919 30931 1 76 . 1 1 20 20 SER HA H 20 4.370 4.370 4.382 -0.012 17919 30932 1 76 . 1 1 20 20 SER C C 20 174.660 174.660 173.580 1.080 17919 30933 1 76 . 1 1 20 20 SER CA C 20 57.400 57.400 57.942 -0.542 17919 30934 1 76 . 1 1 20 20 SER CB C 20 63.370 63.370 63.039 0.331 17919 30935 1 76 . 1 1 20 20 SER H H 20 7.040 7.040 7.892 -0.852 17919 30936 1 76 . 1 1 21 21 ASP N N 21 123.480 123.480 123.820 -0.340 17919 30937 1 76 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.570 0.125 17919 30938 1 76 . 1 1 21 21 ASP C C 21 176.360 176.360 175.451 0.909 17919 30939 1 76 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.435 0.265 17919 30940 1 76 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.603 -0.803 17919 30941 1 76 . 1 1 21 21 ASP H H 21 8.030 8.030 7.756 0.274 17919 30942 1 76 . 1 1 22 22 THR N N 22 108.800 108.800 114.383 -5.583 17919 30943 1 76 . 1 1 22 22 THR HA H 22 4.920 4.920 4.719 0.201 17919 30944 1 76 . 1 1 22 22 THR C C 22 176.750 176.750 175.273 1.477 17919 30945 1 76 . 1 1 22 22 THR CA C 22 59.690 59.690 61.072 -1.382 17919 30946 1 76 . 1 1 22 22 THR CB C 22 71.200 71.200 69.931 1.269 17919 30947 1 76 . 1 1 22 22 THR H H 22 7.900 7.900 8.506 -0.606 17919 30948 1 76 . 1 1 23 23 ILE N N 23 121.190 121.190 124.285 -3.095 17919 30949 1 76 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.931 -0.274 17919 30950 1 76 . 1 1 23 23 ILE C C 23 179.040 179.040 177.306 1.734 17919 30951 1 76 . 1 1 23 23 ILE CA C 23 62.260 62.260 61.767 0.493 17919 30952 1 76 . 1 1 23 23 ILE CB C 23 34.350 34.350 37.076 -2.726 17919 30953 1 76 . 1 1 23 23 ILE H H 23 8.560 8.560 9.153 -0.593 17919 30954 1 76 . 1 1 24 24 GLU N N 24 120.830 120.830 120.601 0.229 17919 30955 1 76 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.903 0.014 17919 30956 1 76 . 1 1 24 24 GLU C C 24 178.640 178.640 178.734 -0.094 17919 30957 1 76 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.757 0.463 17919 30958 1 76 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.504 -1.224 17919 30959 1 76 . 1 1 24 24 GLU H H 24 9.760 9.760 7.867 1.893 17919 30960 1 76 . 1 1 25 25 ASN N N 25 120.570 120.570 118.515 2.055 17919 30961 1 76 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.531 -0.006 17919 30962 1 76 . 1 1 25 25 ASN C C 25 178.380 178.380 177.691 0.689 17919 30963 1 76 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.987 0.073 17919 30964 1 76 . 1 1 25 25 ASN CB C 25 38.450 38.450 37.909 0.541 17919 30965 1 76 . 1 1 25 25 ASN H H 25 7.920 7.920 7.793 0.127 17919 30966 1 76 . 1 1 26 26 VAL N N 26 121.710 121.710 120.355 1.355 17919 30967 1 76 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.655 -0.258 17919 30968 1 76 . 1 1 26 26 VAL C C 26 177.950 177.950 178.017 -0.067 17919 30969 1 76 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.045 1.615 17919 30970 1 76 . 1 1 26 26 VAL CB C 26 30.840 30.840 30.995 -0.155 17919 30971 1 76 . 1 1 26 26 VAL H H 26 8.070 8.070 7.778 0.292 17919 30972 1 76 . 1 1 27 27 LYS N N 27 118.860 118.860 119.511 -0.651 17919 30973 1 76 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.249 0.331 17919 30974 1 76 . 1 1 27 27 LYS C C 27 180.550 180.550 178.858 1.692 17919 30975 1 76 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.375 -0.125 17919 30976 1 76 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.277 1.453 17919 30977 1 76 . 1 1 27 27 LYS H H 27 8.560 8.560 8.321 0.239 17919 30978 1 76 . 1 1 28 28 ALA N N 28 123.440 123.440 123.120 0.320 17919 30979 1 76 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.084 0.076 17919 30980 1 76 . 1 1 28 28 ALA C C 28 180.300 180.300 179.040 1.260 17919 30981 1 76 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.882 0.488 17919 30982 1 76 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.198 -0.488 17919 30983 1 76 . 1 1 28 28 ALA H H 28 8.060 8.060 8.199 -0.139 17919 30984 1 76 . 1 1 29 29 LYS N N 29 119.940 119.940 119.416 0.524 17919 30985 1 76 . 1 1 29 29 LYS HA H 29 4.207 4.207 3.967 0.240 17919 30986 1 76 . 1 1 29 29 LYS C C 29 180.320 180.320 178.995 1.325 17919 30987 1 76 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.452 0.198 17919 30988 1 76 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.166 1.123 17919 30989 1 76 . 1 1 29 29 LYS H H 29 7.850 7.850 7.638 0.212 17919 30990 1 76 . 1 1 30 30 ILE N N 30 121.080 121.080 118.879 2.201 17919 30991 1 76 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.790 -0.283 17919 30992 1 76 . 1 1 30 30 ILE C C 30 178.310 178.310 177.552 0.758 17919 30993 1 76 . 1 1 30 30 ILE CA C 30 66.150 66.150 63.533 2.617 17919 30994 1 76 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.054 -0.254 17919 30995 1 76 . 1 1 30 30 ILE H H 30 8.280 8.280 7.401 0.879 17919 30996 1 76 . 1 1 31 31 GLN N N 31 123.490 123.490 120.709 2.781 17919 30997 1 76 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.056 -0.227 17919 30998 1 76 . 1 1 31 31 GLN C C 31 178.890 178.890 178.467 0.423 17919 30999 1 76 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.149 0.851 17919 31000 1 76 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.503 -0.783 17919 31001 1 76 . 1 1 31 31 GLN H H 31 8.580 8.580 8.371 0.209 17919 31002 1 76 . 1 1 32 32 ASP N N 32 119.360 119.360 119.595 -0.235 17919 31003 1 76 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.379 -0.025 17919 31004 1 76 . 1 1 32 32 ASP C C 32 177.250 177.250 177.654 -0.404 17919 31005 1 76 . 1 1 32 32 ASP CA C 32 57.190 57.190 57.031 0.159 17919 31006 1 76 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.846 -0.266 17919 31007 1 76 . 1 1 32 32 ASP H H 32 8.010 8.010 8.142 -0.132 17919 31008 1 76 . 1 1 33 33 LYS N N 33 115.130 115.130 117.541 -2.411 17919 31009 1 76 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.382 -0.045 17919 31010 1 76 . 1 1 33 33 LYS C C 33 177.870 177.870 178.232 -0.362 17919 31011 1 76 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.829 0.221 17919 31012 1 76 . 1 1 33 33 LYS CB C 33 34.170 34.170 34.053 0.117 17919 31013 1 76 . 1 1 33 33 LYS H H 33 7.430 7.430 7.481 -0.051 17919 31014 1 76 . 1 1 34 34 GLU N N 34 113.870 113.870 115.559 -1.689 17919 31015 1 76 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.494 0.131 17919 31016 1 76 . 1 1 34 34 GLU C C 34 177.840 177.840 177.342 0.498 17919 31017 1 76 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.368 -0.198 17919 31018 1 76 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.160 1.500 17919 31019 1 76 . 1 1 34 34 GLU H H 34 8.740 8.740 8.123 0.617 17919 31020 1 76 . 1 1 35 35 GLY N N 35 108.650 108.650 109.092 -0.442 17919 31021 1 76 . 1 1 35 35 GLY C C 35 173.960 173.960 174.474 -0.514 17919 31022 1 76 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.929 0.151 17919 31023 1 76 . 1 1 35 35 GLY H H 35 8.530 8.530 7.986 0.544 17919 31024 1 76 . 1 1 36 36 ILE N N 36 119.880 119.880 121.274 -1.394 17919 31025 1 76 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.368 0.077 17919 31026 1 76 . 1 1 36 36 ILE C C 36 173.590 173.590 174.102 -0.512 17919 31027 1 76 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.679 0.071 17919 31028 1 76 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.943 1.637 17919 31029 1 76 . 1 1 36 36 ILE H H 36 6.150 6.150 7.677 -1.527 17919 31030 1 76 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.701 -0.067 17919 31031 1 76 . 1 1 37 37 PRO C C 37 176.940 176.940 176.426 0.514 17919 31032 1 76 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.536 0.124 17919 31033 1 76 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.179 0.671 17919 31034 1 76 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.138 -0.021 17919 31035 1 76 . 1 1 38 38 PRO C C 38 178.320 178.320 178.147 0.173 17919 31036 1 76 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.885 0.375 17919 31037 1 76 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.725 1.165 17919 31038 1 76 . 1 1 39 39 ASP N N 39 113.380 113.380 114.226 -0.846 17919 31039 1 76 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.408 0.022 17919 31040 1 76 . 1 1 39 39 ASP C C 39 177.090 177.090 177.044 0.046 17919 31041 1 76 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.096 -0.456 17919 31042 1 76 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.122 -0.582 17919 31043 1 76 . 1 1 39 39 ASP H H 39 8.550 8.550 8.633 -0.083 17919 31044 1 76 . 1 1 40 40 GLN N N 40 116.780 116.780 116.377 0.403 17919 31045 1 76 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.714 -0.250 17919 31046 1 76 . 1 1 40 40 GLN C C 40 175.380 175.380 176.277 -0.897 17919 31047 1 76 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.098 0.542 17919 31048 1 76 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.974 0.166 17919 31049 1 76 . 1 1 40 40 GLN H H 40 7.820 7.820 7.854 -0.034 17919 31050 1 76 . 1 1 41 41 GLN N N 41 117.720 117.720 119.355 -1.635 17919 31051 1 76 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.422 -0.178 17919 31052 1 76 . 1 1 41 41 GLN C C 41 176.300 176.300 176.192 0.108 17919 31053 1 76 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.269 0.201 17919 31054 1 76 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.691 1.960 17919 31055 1 76 . 1 1 41 41 GLN H H 41 7.480 7.480 7.428 0.052 17919 31056 1 76 . 1 1 42 42 ARG N N 42 122.680 122.680 122.694 -0.014 17919 31057 1 76 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.619 -0.119 17919 31058 1 76 . 1 1 42 42 ARG C C 42 174.050 174.050 174.607 -0.557 17919 31059 1 76 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.813 0.237 17919 31060 1 76 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.414 -1.664 17919 31061 1 76 . 1 1 42 42 ARG H H 42 8.530 8.530 8.215 0.315 17919 31062 1 76 . 1 1 43 43 LEU N N 43 124.040 124.040 126.633 -2.593 17919 31063 1 76 . 1 1 43 43 LEU C C 43 175.290 175.290 176.098 -0.808 17919 31064 1 76 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.204 -1.224 17919 31065 1 76 . 1 1 43 43 LEU CB C 43 45.790 45.790 42.435 3.354 17919 31066 1 76 . 1 1 43 43 LEU H H 43 8.820 8.820 8.863 -0.043 17919 31067 1 76 . 1 1 44 44 ILE N N 44 121.920 121.920 118.822 3.098 17919 31068 1 76 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.516 -0.524 17919 31069 1 76 . 1 1 44 44 ILE C C 44 176.060 176.060 174.335 1.725 17919 31070 1 76 . 1 1 44 44 ILE CA C 44 58.980 58.980 58.780 0.200 17919 31071 1 76 . 1 1 44 44 ILE CB C 44 41.420 41.420 42.042 -0.622 17919 31072 1 76 . 1 1 44 44 ILE H H 44 9.030 9.030 8.924 0.106 17919 31073 1 76 . 1 1 45 45 PHE N N 45 125.390 125.390 125.542 -0.152 17919 31074 1 76 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.057 -0.012 17919 31075 1 76 . 1 1 45 45 PHE C C 45 174.470 174.470 174.550 -0.080 17919 31076 1 76 . 1 1 45 45 PHE CA C 45 57.020 57.020 57.322 -0.302 17919 31077 1 76 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.255 0.505 17919 31078 1 76 . 1 1 45 45 PHE H H 45 8.830 8.830 9.038 -0.208 17919 31079 1 76 . 1 1 46 46 ALA N N 46 132.200 132.200 126.966 5.234 17919 31080 1 76 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.528 0.162 17919 31081 1 76 . 1 1 46 46 ALA C C 46 177.290 177.290 177.586 -0.296 17919 31082 1 76 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.887 -0.347 17919 31083 1 76 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.995 -0.425 17919 31084 1 76 . 1 1 46 46 ALA H H 46 8.810 8.810 8.272 0.538 17919 31085 1 76 . 1 1 47 47 GLY N N 47 102.340 102.340 101.474 0.866 17919 31086 1 76 . 1 1 47 47 GLY C C 47 173.810 173.810 174.433 -0.623 17919 31087 1 76 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.045 0.304 17919 31088 1 76 . 1 1 47 47 GLY H H 47 8.130 8.130 8.239 -0.109 17919 31089 1 76 . 1 1 48 48 LYS N N 48 121.570 121.570 120.440 1.130 17919 31090 1 76 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.724 -0.102 17919 31091 1 76 . 1 1 48 48 LYS C C 48 174.700 174.700 174.799 -0.099 17919 31092 1 76 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.371 0.179 17919 31093 1 76 . 1 1 48 48 LYS CB C 48 34.530 34.530 35.611 -1.081 17919 31094 1 76 . 1 1 48 48 LYS H H 48 7.980 7.980 8.083 -0.103 17919 31095 1 76 . 1 1 49 49 GLN N N 49 122.410 122.410 121.148 1.262 17919 31096 1 76 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.717 -0.157 17919 31097 1 76 . 1 1 49 49 GLN C C 49 175.670 175.670 175.751 -0.081 17919 31098 1 76 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.920 -0.180 17919 31099 1 76 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.580 -0.580 17919 31100 1 76 . 1 1 49 49 GLN H H 49 8.600 8.600 8.552 0.048 17919 31101 1 76 . 1 1 50 50 LEU N N 50 125.520 125.520 125.862 -0.342 17919 31102 1 76 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.275 -0.185 17919 31103 1 76 . 1 1 50 50 LEU C C 50 176.660 176.660 176.947 -0.287 17919 31104 1 76 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.400 -0.160 17919 31105 1 76 . 1 1 50 50 LEU CB C 50 41.570 41.570 40.389 1.181 17919 31106 1 76 . 1 1 50 50 LEU H H 50 8.530 8.530 8.570 -0.040 17919 31107 1 76 . 1 1 51 51 GLU N N 51 122.940 122.940 125.020 -2.080 17919 31108 1 76 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.451 0.037 17919 31109 1 76 . 1 1 51 51 GLU C C 51 175.870 175.870 176.306 -0.436 17919 31110 1 76 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.669 0.291 17919 31111 1 76 . 1 1 51 51 GLU CB C 51 31.570 31.570 30.857 0.713 17919 31112 1 76 . 1 1 51 51 GLU H H 51 8.400 8.400 8.460 -0.060 17919 31113 1 76 . 1 1 52 52 ASP N N 52 120.030 120.030 123.266 -3.236 17919 31114 1 76 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.543 -0.184 17919 31115 1 76 . 1 1 52 52 ASP C C 52 177.330 177.330 178.016 -0.686 17919 31116 1 76 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.276 -0.316 17919 31117 1 76 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.950 -0.100 17919 31118 1 76 . 1 1 52 52 ASP H H 52 8.160 8.160 8.794 -0.634 17919 31119 1 76 . 1 1 53 53 GLY N N 53 106.660 106.660 107.458 -0.798 17919 31120 1 76 . 1 1 53 53 GLY C C 53 174.870 174.870 174.372 0.498 17919 31121 1 76 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.069 0.100 17919 31122 1 76 . 1 1 53 53 GLY H H 53 9.390 9.390 8.439 0.951 17919 31123 1 76 . 1 1 54 54 ARG N N 54 119.050 119.050 119.917 -0.867 17919 31124 1 76 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.580 0.115 17919 31125 1 76 . 1 1 54 54 ARG C C 54 175.350 175.350 175.022 0.328 17919 31126 1 76 . 1 1 54 54 ARG CA C 54 54.390 54.390 55.000 -0.610 17919 31127 1 76 . 1 1 54 54 ARG CB C 54 32.650 32.650 31.617 1.033 17919 31128 1 76 . 1 1 54 54 ARG H H 54 7.460 7.460 7.478 -0.018 17919 31129 1 76 . 1 1 55 55 THR N N 55 108.400 108.400 111.852 -3.452 17919 31130 1 76 . 1 1 55 55 THR HA H 55 5.240 5.240 5.225 0.015 17919 31131 1 76 . 1 1 55 55 THR C C 55 176.560 176.560 176.225 0.335 17919 31132 1 76 . 1 1 55 55 THR CA C 55 59.690 59.690 59.844 -0.155 17919 31133 1 76 . 1 1 55 55 THR CB C 55 72.260 72.260 71.483 0.777 17919 31134 1 76 . 1 1 55 55 THR H H 55 8.730 8.730 8.185 0.545 17919 31135 1 76 . 1 1 56 56 LEU N N 56 117.920 117.920 121.521 -3.601 17919 31136 1 76 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.004 0.056 17919 31137 1 76 . 1 1 56 56 LEU C C 56 180.810 180.810 178.621 2.189 17919 31138 1 76 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.357 0.353 17919 31139 1 76 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.142 -0.772 17919 31140 1 76 . 1 1 56 56 LEU H H 56 8.140 8.140 8.258 -0.118 17919 31141 1 76 . 1 1 57 57 SER N N 57 113.330 113.330 113.452 -0.122 17919 31142 1 76 . 1 1 57 57 SER HA H 57 4.370 4.370 4.144 0.226 17919 31143 1 76 . 1 1 57 57 SER C C 57 178.310 178.310 176.677 1.633 17919 31144 1 76 . 1 1 57 57 SER CA C 57 61.080 61.080 60.889 0.191 17919 31145 1 76 . 1 1 57 57 SER CB C 57 62.530 62.530 62.751 -0.221 17919 31146 1 76 . 1 1 57 57 SER H H 57 8.470 8.470 8.024 0.446 17919 31147 1 76 . 1 1 58 58 ASP N N 58 124.190 124.190 122.620 1.570 17919 31148 1 76 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.356 -0.061 17919 31149 1 76 . 1 1 58 58 ASP C C 58 177.400 177.400 176.685 0.715 17919 31150 1 76 . 1 1 58 58 ASP CA C 58 57.180 57.180 55.947 1.232 17919 31151 1 76 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.625 -0.525 17919 31152 1 76 . 1 1 58 58 ASP H H 58 7.930 7.930 8.010 -0.080 17919 31153 1 76 . 1 1 59 59 TYR N N 59 115.510 115.510 115.715 -0.205 17919 31154 1 76 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.638 0.032 17919 31155 1 76 . 1 1 59 59 TYR C C 59 174.700 174.700 175.310 -0.610 17919 31156 1 76 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.277 0.973 17919 31157 1 76 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.562 1.508 17919 31158 1 76 . 1 1 59 59 TYR H H 59 7.250 7.250 7.384 -0.134 17919 31159 1 76 . 1 1 60 60 ASN N N 60 115.900 115.900 115.910 -0.010 17919 31160 1 76 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.363 -0.008 17919 31161 1 76 . 1 1 60 60 ASN C C 60 174.340 174.340 174.375 -0.035 17919 31162 1 76 . 1 1 60 60 ASN CA C 60 54.120 54.120 53.872 0.248 17919 31163 1 76 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.445 -0.035 17919 31164 1 76 . 1 1 60 60 ASN H H 60 8.150 8.150 7.798 0.352 17919 31165 1 76 . 1 1 61 61 ILE N N 61 118.600 118.600 120.346 -1.746 17919 31166 1 76 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.962 -0.569 17919 31167 1 76 . 1 1 61 61 ILE C C 61 174.610 174.610 175.437 -0.827 17919 31168 1 76 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.089 0.331 17919 31169 1 76 . 1 1 61 61 ILE CB C 61 36.740 36.740 36.528 0.212 17919 31170 1 76 . 1 1 61 61 ILE H H 61 7.250 7.250 8.139 -0.889 17919 31171 1 76 . 1 1 62 62 GLN N N 62 124.740 124.740 127.447 -2.707 17919 31172 1 76 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.681 -0.175 17919 31173 1 76 . 1 1 62 62 GLN C C 62 175.970 175.970 175.347 0.623 17919 31174 1 76 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.620 0.040 17919 31175 1 76 . 1 1 62 62 GLN CB C 62 31.650 31.650 30.342 1.308 17919 31176 1 76 . 1 1 62 62 GLN H H 62 7.610 7.610 7.994 -0.384 17919 31177 1 76 . 1 1 63 63 LYS N N 63 120.300 120.300 119.643 0.657 17919 31178 1 76 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.871 0.130 17919 31179 1 76 . 1 1 63 63 LYS C C 63 175.810 175.810 176.408 -0.598 17919 31180 1 76 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.125 -0.335 17919 31181 1 76 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.212 1.438 17919 31182 1 76 . 1 1 63 63 LYS H H 63 8.490 8.490 8.553 -0.063 17919 31183 1 76 . 1 1 64 64 GLU N N 64 113.950 113.950 117.311 -3.361 17919 31184 1 76 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.680 -0.215 17919 31185 1 76 . 1 1 64 64 GLU C C 64 175.250 175.250 175.255 -0.005 17919 31186 1 76 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.418 0.472 17919 31187 1 76 . 1 1 64 64 GLU CB C 64 25.900 25.900 27.758 -1.857 17919 31188 1 76 . 1 1 64 64 GLU H H 64 9.280 9.280 8.630 0.650 17919 31189 1 76 . 1 1 65 65 SER N N 65 114.730 114.730 115.704 -0.974 17919 31190 1 76 . 1 1 65 65 SER HA H 65 4.640 4.640 4.386 0.254 17919 31191 1 76 . 1 1 65 65 SER C C 65 172.160 172.160 173.361 -1.201 17919 31192 1 76 . 1 1 65 65 SER CA C 65 60.890 60.890 59.578 1.312 17919 31193 1 76 . 1 1 65 65 SER CB C 65 64.910 64.910 63.890 1.020 17919 31194 1 76 . 1 1 65 65 SER H H 65 7.670 7.670 7.583 0.087 17919 31195 1 76 . 1 1 66 66 THR N N 66 117.110 117.110 121.039 -3.929 17919 31196 1 76 . 1 1 66 66 THR HA H 66 5.270 5.270 4.805 0.465 17919 31197 1 76 . 1 1 66 66 THR C C 66 173.950 173.950 173.787 0.163 17919 31198 1 76 . 1 1 66 66 THR CA C 66 62.340 62.340 61.860 0.480 17919 31199 1 76 . 1 1 66 66 THR CB C 66 70.080 70.080 69.509 0.571 17919 31200 1 76 . 1 1 66 66 THR H H 66 8.730 8.730 8.210 0.520 17919 31201 1 76 . 1 1 67 67 LEU N N 67 127.110 127.110 126.954 0.156 17919 31202 1 76 . 1 1 67 67 LEU HA H 67 5.060 5.060 5.045 0.015 17919 31203 1 76 . 1 1 67 67 LEU C C 67 175.770 175.770 175.313 0.457 17919 31204 1 76 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.034 0.866 17919 31205 1 76 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.753 -0.493 17919 31206 1 76 . 1 1 67 67 LEU H H 67 9.410 9.410 8.098 1.312 17919 31207 1 76 . 1 1 68 68 HIS N N 68 118.380 118.380 116.356 2.024 17919 31208 1 76 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.693 -0.453 17919 31209 1 76 . 1 1 68 68 HIS C C 68 173.150 173.150 174.207 -1.057 17919 31210 1 76 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.662 0.338 17919 31211 1 76 . 1 1 68 68 HIS CB C 68 30.530 30.530 34.551 -4.021 17919 31212 1 76 . 1 1 68 68 HIS H H 68 9.230 9.230 8.654 0.576 17919 31213 1 76 . 1 1 69 69 LEU N N 69 124.460 124.460 122.387 2.073 17919 31214 1 76 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.340 -0.150 17919 31215 1 76 . 1 1 69 69 LEU C C 69 175.270 175.270 174.454 0.816 17919 31216 1 76 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.533 -0.643 17919 31217 1 76 . 1 1 69 69 LEU CB C 69 44.380 44.380 45.374 -0.994 17919 31218 1 76 . 1 1 69 69 LEU H H 69 8.340 8.340 8.269 0.071 17919 31219 1 76 . 1 1 70 70 VAL N N 70 126.940 126.940 125.877 1.063 17919 31220 1 76 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.611 -0.261 17919 31221 1 76 . 1 1 70 70 VAL C C 70 174.000 174.000 173.591 0.409 17919 31222 1 76 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.534 1.266 17919 31223 1 76 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.941 -1.031 17919 31224 1 76 . 1 1 70 70 VAL H H 70 9.200 9.200 8.187 1.013 17919 31225 1 76 . 1 1 71 71 LEU N N 71 123.130 123.130 129.189 -6.059 17919 31226 1 76 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.574 0.486 17919 31227 1 76 . 1 1 71 71 LEU C C 71 177.830 177.830 176.310 1.520 17919 31228 1 76 . 1 1 71 71 LEU CA C 71 53.940 53.940 54.383 -0.443 17919 31229 1 76 . 1 1 71 71 LEU CB C 71 42.850 42.850 41.594 1.256 17919 31230 1 76 . 1 1 71 71 LEU H H 71 8.120 8.120 8.534 -0.414 17919 31231 1 76 . 1 1 72 72 ARG N N 72 123.490 123.490 128.374 -4.884 17919 31232 1 76 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.389 -0.088 17919 31233 1 76 . 1 1 72 72 ARG C C 72 175.350 175.350 175.013 0.337 17919 31234 1 76 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.074 -0.464 17919 31235 1 76 . 1 1 72 72 ARG CB C 72 31.350 31.350 31.152 0.198 17919 31236 1 76 . 1 1 72 72 ARG H H 72 8.580 8.580 8.398 0.182 17919 31237 1 77 . 1 1 2 2 GLN N N 2 123.220 123.220 123.556 -0.336 17919 31238 1 77 . 1 1 2 2 GLN HA H 2 5.249 5.249 4.875 0.374 17919 31239 1 77 . 1 1 2 2 GLN C C 2 175.920 175.920 175.911 0.009 17919 31240 1 77 . 1 1 2 2 GLN CA C 2 55.080 55.080 56.556 -1.476 17919 31241 1 77 . 1 1 2 2 GLN CB C 2 30.760 30.760 28.528 2.232 17919 31242 1 77 . 1 1 2 2 GLN H H 2 8.900 8.900 8.861 0.039 17919 31243 1 77 . 1 1 3 3 ILE N N 3 115.340 115.340 115.851 -0.511 17919 31244 1 77 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.102 0.111 17919 31245 1 77 . 1 1 3 3 ILE C C 3 172.450 172.450 173.204 -0.754 17919 31246 1 77 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.048 0.522 17919 31247 1 77 . 1 1 3 3 ILE CB C 3 42.210 42.210 42.175 0.035 17919 31248 1 77 . 1 1 3 3 ILE H H 3 8.320 8.320 8.140 0.180 17919 31249 1 77 . 1 1 4 4 PHE N N 4 118.110 118.110 118.343 -0.233 17919 31250 1 77 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.395 0.235 17919 31251 1 77 . 1 1 4 4 PHE C C 4 175.320 175.320 175.298 0.022 17919 31252 1 77 . 1 1 4 4 PHE CA C 4 55.210 55.210 54.871 0.339 17919 31253 1 77 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.969 -0.489 17919 31254 1 77 . 1 1 4 4 PHE H H 4 8.610 8.610 8.103 0.507 17919 31255 1 77 . 1 1 5 5 VAL N N 5 121.000 121.000 122.810 -1.810 17919 31256 1 77 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.803 -0.078 17919 31257 1 77 . 1 1 5 5 VAL C C 5 174.870 174.870 174.969 -0.099 17919 31258 1 77 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.274 -0.654 17919 31259 1 77 . 1 1 5 5 VAL CB C 5 34.230 34.230 32.962 1.268 17919 31260 1 77 . 1 1 5 5 VAL H H 5 9.300 9.300 8.486 0.814 17919 31261 1 77 . 1 1 6 6 LYS N N 6 127.520 127.520 129.343 -1.823 17919 31262 1 77 . 1 1 6 6 LYS HA H 6 5.367 5.367 4.837 0.530 17919 31263 1 77 . 1 1 6 6 LYS C C 6 177.140 177.140 176.414 0.726 17919 31264 1 77 . 1 1 6 6 LYS CA C 6 54.520 54.520 56.031 -1.511 17919 31265 1 77 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.554 0.496 17919 31266 1 77 . 1 1 6 6 LYS H H 6 8.820 8.820 9.010 -0.190 17919 31267 1 77 . 1 1 7 7 THR N N 7 115.400 115.400 117.268 -1.868 17919 31268 1 77 . 1 1 7 7 THR HA H 7 4.970 4.970 4.628 0.342 17919 31269 1 77 . 1 1 7 7 THR C C 7 176.910 176.910 175.758 1.152 17919 31270 1 77 . 1 1 7 7 THR CA C 7 60.470 60.470 60.319 0.151 17919 31271 1 77 . 1 1 7 7 THR CB C 7 70.630 70.630 71.132 -0.502 17919 31272 1 77 . 1 1 7 7 THR H H 7 8.730 8.730 8.819 -0.089 17919 31273 1 77 . 1 1 8 8 LEU N N 8 121.330 121.330 124.825 -3.495 17919 31274 1 77 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.103 0.207 17919 31275 1 77 . 1 1 8 8 LEU C C 8 178.800 178.800 177.176 1.624 17919 31276 1 77 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.744 -0.164 17919 31277 1 77 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.035 -0.065 17919 31278 1 77 . 1 1 8 8 LEU H H 8 9.100 9.100 8.989 0.111 17919 31279 1 77 . 1 1 9 9 THR N N 9 105.590 105.590 107.778 -2.188 17919 31280 1 77 . 1 1 9 9 THR HA H 9 4.428 4.428 4.232 0.196 17919 31281 1 77 . 1 1 9 9 THR C C 9 175.520 175.520 175.580 -0.060 17919 31282 1 77 . 1 1 9 9 THR CA C 9 61.400 61.400 61.875 -0.475 17919 31283 1 77 . 1 1 9 9 THR CB C 9 69.140 69.140 68.615 0.524 17919 31284 1 77 . 1 1 9 9 THR H H 9 7.630 7.630 7.615 0.015 17919 31285 1 77 . 1 1 10 10 GLY N N 10 108.890 108.890 110.828 -1.938 17919 31286 1 77 . 1 1 10 10 GLY C C 10 174.070 174.070 174.152 -0.082 17919 31287 1 77 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.266 0.194 17919 31288 1 77 . 1 1 10 10 GLY H H 10 7.810 7.810 8.509 -0.699 17919 31289 1 77 . 1 1 11 11 LYS N N 11 121.600 121.600 121.012 0.588 17919 31290 1 77 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.444 -0.083 17919 31291 1 77 . 1 1 11 11 LYS C C 11 175.940 175.940 175.752 0.188 17919 31292 1 77 . 1 1 11 11 LYS CA C 11 56.280 56.280 55.622 0.658 17919 31293 1 77 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.217 -0.017 17919 31294 1 77 . 1 1 11 11 LYS H H 11 7.280 7.280 8.008 -0.728 17919 31295 1 77 . 1 1 12 12 THR N N 12 120.440 120.440 116.717 3.723 17919 31296 1 77 . 1 1 12 12 THR HA H 12 5.046 5.046 4.933 0.113 17919 31297 1 77 . 1 1 12 12 THR C C 12 174.320 174.320 174.573 -0.253 17919 31298 1 77 . 1 1 12 12 THR CA C 12 62.390 62.390 61.518 0.872 17919 31299 1 77 . 1 1 12 12 THR CB C 12 69.910 69.910 69.840 0.070 17919 31300 1 77 . 1 1 12 12 THR H H 12 8.650 8.650 8.244 0.406 17919 31301 1 77 . 1 1 13 13 ILE N N 13 127.110 127.110 127.719 -0.609 17919 31302 1 77 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.164 0.380 17919 31303 1 77 . 1 1 13 13 ILE C C 13 175.220 175.220 175.335 -0.115 17919 31304 1 77 . 1 1 13 13 ILE CA C 13 59.980 59.980 62.331 -2.351 17919 31305 1 77 . 1 1 13 13 ILE CB C 13 40.950 40.950 38.707 2.243 17919 31306 1 77 . 1 1 13 13 ILE H H 13 9.450 9.450 8.433 1.017 17919 31307 1 77 . 1 1 14 14 THR N N 14 121.520 121.520 123.703 -2.183 17919 31308 1 77 . 1 1 14 14 THR HA H 14 4.964 4.964 4.865 0.099 17919 31309 1 77 . 1 1 14 14 THR C C 14 173.790 173.790 174.237 -0.447 17919 31310 1 77 . 1 1 14 14 THR CA C 14 61.940 61.940 62.202 -0.262 17919 31311 1 77 . 1 1 14 14 THR CB C 14 69.650 69.650 69.633 0.017 17919 31312 1 77 . 1 1 14 14 THR H H 14 8.710 8.710 8.319 0.391 17919 31313 1 77 . 1 1 15 15 LEU N N 15 124.800 124.800 127.786 -2.986 17919 31314 1 77 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.619 0.161 17919 31315 1 77 . 1 1 15 15 LEU C C 15 174.670 174.670 175.435 -0.765 17919 31316 1 77 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.854 -1.024 17919 31317 1 77 . 1 1 15 15 LEU CB C 15 47.070 47.070 44.253 2.817 17919 31318 1 77 . 1 1 15 15 LEU H H 15 8.710 8.710 8.320 0.390 17919 31319 1 77 . 1 1 16 16 GLU N N 16 122.160 122.160 124.131 -1.971 17919 31320 1 77 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.426 0.491 17919 31321 1 77 . 1 1 16 16 GLU C C 16 175.860 175.860 175.570 0.290 17919 31322 1 77 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.554 -0.735 17919 31323 1 77 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.023 -0.572 17919 31324 1 77 . 1 1 16 16 GLU H H 16 8.140 8.140 8.637 -0.497 17919 31325 1 77 . 1 1 17 17 VAL N N 17 117.210 117.210 119.450 -2.240 17919 31326 1 77 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.522 0.192 17919 31327 1 77 . 1 1 17 17 VAL C C 17 174.160 174.160 174.439 -0.279 17919 31328 1 77 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.912 -0.482 17919 31329 1 77 . 1 1 17 17 VAL CB C 17 36.400 36.400 34.681 1.720 17919 31330 1 77 . 1 1 17 17 VAL H H 17 8.900 8.900 8.781 0.119 17919 31331 1 77 . 1 1 18 18 GLU N N 18 118.990 118.990 118.449 0.541 17919 31332 1 77 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.872 0.207 17919 31333 1 77 . 1 1 18 18 GLU C C 18 176.160 176.160 175.386 0.774 17919 31334 1 77 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.009 -0.289 17919 31335 1 77 . 1 1 18 18 GLU CB C 18 30.310 30.310 32.125 -1.815 17919 31336 1 77 . 1 1 18 18 GLU H H 18 8.640 8.640 8.045 0.595 17919 31337 1 77 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.257 -0.116 17919 31338 1 77 . 1 1 19 19 PRO C C 19 175.310 175.310 177.919 -2.609 17919 31339 1 77 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.337 0.133 17919 31340 1 77 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.078 -0.128 17919 31341 1 77 . 1 1 20 20 SER N N 20 103.400 103.400 109.623 -6.223 17919 31342 1 77 . 1 1 20 20 SER HA H 20 4.370 4.370 4.330 0.040 17919 31343 1 77 . 1 1 20 20 SER C C 20 174.660 174.660 174.490 0.170 17919 31344 1 77 . 1 1 20 20 SER CA C 20 57.400 57.400 57.859 -0.459 17919 31345 1 77 . 1 1 20 20 SER CB C 20 63.370 63.370 62.916 0.454 17919 31346 1 77 . 1 1 20 20 SER H H 20 7.040 7.040 7.948 -0.908 17919 31347 1 77 . 1 1 21 21 ASP N N 21 123.480 123.480 125.337 -1.857 17919 31348 1 77 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.627 0.068 17919 31349 1 77 . 1 1 21 21 ASP C C 21 176.360 176.360 175.808 0.552 17919 31350 1 77 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.869 -0.169 17919 31351 1 77 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.666 -0.866 17919 31352 1 77 . 1 1 21 21 ASP H H 21 8.030 8.030 7.961 0.069 17919 31353 1 77 . 1 1 22 22 THR N N 22 108.800 108.800 114.459 -5.659 17919 31354 1 77 . 1 1 22 22 THR HA H 22 4.920 4.920 4.535 0.385 17919 31355 1 77 . 1 1 22 22 THR C C 22 176.750 176.750 175.912 0.838 17919 31356 1 77 . 1 1 22 22 THR CA C 22 59.690 59.690 61.887 -2.197 17919 31357 1 77 . 1 1 22 22 THR CB C 22 71.200 71.200 69.948 1.252 17919 31358 1 77 . 1 1 22 22 THR H H 22 7.900 7.900 8.265 -0.365 17919 31359 1 77 . 1 1 23 23 ILE N N 23 121.190 121.190 122.659 -1.469 17919 31360 1 77 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.741 -0.084 17919 31361 1 77 . 1 1 23 23 ILE C C 23 179.040 179.040 177.692 1.348 17919 31362 1 77 . 1 1 23 23 ILE CA C 23 62.260 62.260 61.996 0.264 17919 31363 1 77 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.179 -1.829 17919 31364 1 77 . 1 1 23 23 ILE H H 23 8.560 8.560 8.837 -0.277 17919 31365 1 77 . 1 1 24 24 GLU N N 24 120.830 120.830 120.847 -0.017 17919 31366 1 77 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.829 0.088 17919 31367 1 77 . 1 1 24 24 GLU C C 24 178.640 178.640 178.797 -0.157 17919 31368 1 77 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.929 0.291 17919 31369 1 77 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.422 -1.142 17919 31370 1 77 . 1 1 24 24 GLU H H 24 9.760 9.760 8.366 1.394 17919 31371 1 77 . 1 1 25 25 ASN N N 25 120.570 120.570 117.189 3.381 17919 31372 1 77 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.506 0.019 17919 31373 1 77 . 1 1 25 25 ASN C C 25 178.380 178.380 178.020 0.360 17919 31374 1 77 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.972 0.088 17919 31375 1 77 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.585 -0.135 17919 31376 1 77 . 1 1 25 25 ASN H H 25 7.920 7.920 7.875 0.045 17919 31377 1 77 . 1 1 26 26 VAL N N 26 121.710 121.710 120.279 1.431 17919 31378 1 77 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.530 -0.133 17919 31379 1 77 . 1 1 26 26 VAL C C 26 177.950 177.950 178.105 -0.155 17919 31380 1 77 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.681 0.979 17919 31381 1 77 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.311 -0.471 17919 31382 1 77 . 1 1 26 26 VAL H H 26 8.070 8.070 7.706 0.364 17919 31383 1 77 . 1 1 27 27 LYS N N 27 118.860 118.860 119.546 -0.686 17919 31384 1 77 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.132 0.448 17919 31385 1 77 . 1 1 27 27 LYS C C 27 180.550 180.550 179.084 1.466 17919 31386 1 77 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.549 -0.299 17919 31387 1 77 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.055 1.675 17919 31388 1 77 . 1 1 27 27 LYS H H 27 8.560 8.560 7.678 0.882 17919 31389 1 77 . 1 1 28 28 ALA N N 28 123.440 123.440 121.941 1.499 17919 31390 1 77 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.027 0.133 17919 31391 1 77 . 1 1 28 28 ALA C C 28 180.300 180.300 179.071 1.229 17919 31392 1 77 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.624 -0.254 17919 31393 1 77 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.509 -0.799 17919 31394 1 77 . 1 1 28 28 ALA H H 28 8.060 8.060 7.845 0.215 17919 31395 1 77 . 1 1 29 29 LYS N N 29 119.940 119.940 117.872 2.068 17919 31396 1 77 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.107 0.100 17919 31397 1 77 . 1 1 29 29 LYS C C 29 180.320 180.320 178.331 1.989 17919 31398 1 77 . 1 1 29 29 LYS CA C 29 59.650 59.650 58.922 0.728 17919 31399 1 77 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.189 1.101 17919 31400 1 77 . 1 1 29 29 LYS H H 29 7.850 7.850 7.408 0.442 17919 31401 1 77 . 1 1 30 30 ILE N N 30 121.080 121.080 119.892 1.188 17919 31402 1 77 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.649 -0.142 17919 31403 1 77 . 1 1 30 30 ILE C C 30 178.310 178.310 177.362 0.948 17919 31404 1 77 . 1 1 30 30 ILE CA C 30 66.150 66.150 64.618 1.532 17919 31405 1 77 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.251 -0.451 17919 31406 1 77 . 1 1 30 30 ILE H H 30 8.280 8.280 8.229 0.051 17919 31407 1 77 . 1 1 31 31 GLN N N 31 123.490 123.490 119.902 3.588 17919 31408 1 77 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.993 -0.164 17919 31409 1 77 . 1 1 31 31 GLN C C 31 178.890 178.890 178.424 0.466 17919 31410 1 77 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.009 0.991 17919 31411 1 77 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.451 -0.731 17919 31412 1 77 . 1 1 31 31 GLN H H 31 8.580 8.580 8.193 0.387 17919 31413 1 77 . 1 1 32 32 ASP N N 32 119.360 119.360 118.873 0.487 17919 31414 1 77 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.424 -0.070 17919 31415 1 77 . 1 1 32 32 ASP C C 32 177.250 177.250 177.399 -0.149 17919 31416 1 77 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.641 0.549 17919 31417 1 77 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.601 -0.021 17919 31418 1 77 . 1 1 32 32 ASP H H 32 8.010 8.010 7.894 0.116 17919 31419 1 77 . 1 1 33 33 LYS N N 33 115.130 115.130 118.128 -2.998 17919 31420 1 77 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.391 -0.054 17919 31421 1 77 . 1 1 33 33 LYS C C 33 177.870 177.870 178.339 -0.469 17919 31422 1 77 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.383 0.666 17919 31423 1 77 . 1 1 33 33 LYS CB C 33 34.170 34.170 34.397 -0.227 17919 31424 1 77 . 1 1 33 33 LYS H H 33 7.430 7.430 7.495 -0.065 17919 31425 1 77 . 1 1 34 34 GLU N N 34 113.870 113.870 117.274 -3.404 17919 31426 1 77 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.422 0.203 17919 31427 1 77 . 1 1 34 34 GLU C C 34 177.840 177.840 177.556 0.284 17919 31428 1 77 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.573 -1.403 17919 31429 1 77 . 1 1 34 34 GLU CB C 34 32.660 32.660 30.722 1.938 17919 31430 1 77 . 1 1 34 34 GLU H H 34 8.740 8.740 7.742 0.998 17919 31431 1 77 . 1 1 35 35 GLY N N 35 108.650 108.650 109.712 -1.062 17919 31432 1 77 . 1 1 35 35 GLY C C 35 173.960 173.960 174.480 -0.520 17919 31433 1 77 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.768 0.312 17919 31434 1 77 . 1 1 35 35 GLY H H 35 8.530 8.530 8.333 0.197 17919 31435 1 77 . 1 1 36 36 ILE N N 36 119.880 119.880 117.603 2.277 17919 31436 1 77 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.438 0.007 17919 31437 1 77 . 1 1 36 36 ILE C C 36 173.590 173.590 174.049 -0.459 17919 31438 1 77 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.679 0.071 17919 31439 1 77 . 1 1 36 36 ILE CB C 36 40.580 40.580 37.887 2.693 17919 31440 1 77 . 1 1 36 36 ILE H H 36 6.150 6.150 7.620 -1.470 17919 31441 1 77 . 1 1 37 37 PRO HA H 37 4.634 4.634 5.156 -0.522 17919 31442 1 77 . 1 1 37 37 PRO C C 37 176.940 176.940 176.576 0.364 17919 31443 1 77 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.229 0.431 17919 31444 1 77 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.029 0.821 17919 31445 1 77 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.173 -0.056 17919 31446 1 77 . 1 1 38 38 PRO C C 38 178.320 178.320 178.824 -0.504 17919 31447 1 77 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.491 0.769 17919 31448 1 77 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.823 1.067 17919 31449 1 77 . 1 1 39 39 ASP N N 39 113.380 113.380 116.831 -3.451 17919 31450 1 77 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.244 0.186 17919 31451 1 77 . 1 1 39 39 ASP C C 39 177.090 177.090 178.562 -1.472 17919 31452 1 77 . 1 1 39 39 ASP CA C 39 55.640 55.640 57.687 -2.047 17919 31453 1 77 . 1 1 39 39 ASP CB C 39 39.540 39.540 39.891 -0.351 17919 31454 1 77 . 1 1 39 39 ASP H H 39 8.550 8.550 8.818 -0.268 17919 31455 1 77 . 1 1 40 40 GLN N N 40 116.780 116.780 116.326 0.454 17919 31456 1 77 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.149 0.315 17919 31457 1 77 . 1 1 40 40 GLN C C 40 175.380 175.380 176.916 -1.536 17919 31458 1 77 . 1 1 40 40 GLN CA C 40 55.640 55.640 57.085 -1.445 17919 31459 1 77 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.016 1.124 17919 31460 1 77 . 1 1 40 40 GLN H H 40 7.820 7.820 7.669 0.151 17919 31461 1 77 . 1 1 41 41 GLN N N 41 117.720 117.720 119.198 -1.478 17919 31462 1 77 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.104 0.140 17919 31463 1 77 . 1 1 41 41 GLN C C 41 176.300 176.300 175.583 0.717 17919 31464 1 77 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.686 -0.216 17919 31465 1 77 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.111 2.539 17919 31466 1 77 . 1 1 41 41 GLN H H 41 7.480 7.480 7.539 -0.059 17919 31467 1 77 . 1 1 42 42 ARG N N 42 122.680 122.680 124.573 -1.893 17919 31468 1 77 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.521 -0.021 17919 31469 1 77 . 1 1 42 42 ARG C C 42 174.050 174.050 174.426 -0.376 17919 31470 1 77 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.851 0.199 17919 31471 1 77 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.099 -1.349 17919 31472 1 77 . 1 1 42 42 ARG H H 42 8.530 8.530 8.078 0.452 17919 31473 1 77 . 1 1 43 43 LEU N N 43 124.040 124.040 125.532 -1.492 17919 31474 1 77 . 1 1 43 43 LEU C C 43 175.290 175.290 175.577 -0.287 17919 31475 1 77 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.773 -0.793 17919 31476 1 77 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.594 1.196 17919 31477 1 77 . 1 1 43 43 LEU H H 43 8.820 8.820 8.742 0.078 17919 31478 1 77 . 1 1 44 44 ILE N N 44 121.920 121.920 123.145 -1.225 17919 31479 1 77 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.848 0.144 17919 31480 1 77 . 1 1 44 44 ILE C C 44 176.060 176.060 174.596 1.464 17919 31481 1 77 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.547 -1.567 17919 31482 1 77 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.331 0.089 17919 31483 1 77 . 1 1 44 44 ILE H H 44 9.030 9.030 8.596 0.434 17919 31484 1 77 . 1 1 45 45 PHE N N 45 125.390 125.390 127.820 -2.430 17919 31485 1 77 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.019 0.026 17919 31486 1 77 . 1 1 45 45 PHE C C 45 174.470 174.470 174.476 -0.006 17919 31487 1 77 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.345 0.675 17919 31488 1 77 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.191 0.569 17919 31489 1 77 . 1 1 45 45 PHE H H 45 8.830 8.830 9.116 -0.286 17919 31490 1 77 . 1 1 46 46 ALA N N 46 132.200 132.200 129.611 2.589 17919 31491 1 77 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.638 0.052 17919 31492 1 77 . 1 1 46 46 ALA C C 46 177.290 177.290 177.471 -0.181 17919 31493 1 77 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.647 -0.107 17919 31494 1 77 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.607 -0.037 17919 31495 1 77 . 1 1 46 46 ALA H H 46 8.810 8.810 8.410 0.400 17919 31496 1 77 . 1 1 47 47 GLY N N 47 102.340 102.340 103.978 -1.638 17919 31497 1 77 . 1 1 47 47 GLY C C 47 173.810 173.810 174.350 -0.540 17919 31498 1 77 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.390 -0.040 17919 31499 1 77 . 1 1 47 47 GLY H H 47 8.130 8.130 8.466 -0.336 17919 31500 1 77 . 1 1 48 48 LYS N N 48 121.570 121.570 120.530 1.040 17919 31501 1 77 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.626 -0.004 17919 31502 1 77 . 1 1 48 48 LYS C C 48 174.700 174.700 175.673 -0.973 17919 31503 1 77 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.849 -0.299 17919 31504 1 77 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.885 -0.355 17919 31505 1 77 . 1 1 48 48 LYS H H 48 7.980 7.980 7.942 0.038 17919 31506 1 77 . 1 1 49 49 GLN N N 49 122.410 122.410 121.708 0.702 17919 31507 1 77 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.716 -0.156 17919 31508 1 77 . 1 1 49 49 GLN C C 49 175.670 175.670 175.898 -0.228 17919 31509 1 77 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.166 -0.426 17919 31510 1 77 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.727 -0.727 17919 31511 1 77 . 1 1 49 49 GLN H H 49 8.600 8.600 8.477 0.123 17919 31512 1 77 . 1 1 50 50 LEU N N 50 125.520 125.520 122.635 2.885 17919 31513 1 77 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.271 -0.181 17919 31514 1 77 . 1 1 50 50 LEU C C 50 176.660 176.660 175.804 0.856 17919 31515 1 77 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.725 0.515 17919 31516 1 77 . 1 1 50 50 LEU CB C 50 41.570 41.570 43.123 -1.553 17919 31517 1 77 . 1 1 50 50 LEU H H 50 8.530 8.530 8.433 0.097 17919 31518 1 77 . 1 1 51 51 GLU N N 51 122.940 122.940 123.360 -0.420 17919 31519 1 77 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.546 -0.058 17919 31520 1 77 . 1 1 51 51 GLU C C 51 175.870 175.870 176.381 -0.511 17919 31521 1 77 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.424 0.536 17919 31522 1 77 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.005 -0.435 17919 31523 1 77 . 1 1 51 51 GLU H H 51 8.400 8.400 8.242 0.158 17919 31524 1 77 . 1 1 52 52 ASP N N 52 120.030 120.030 127.347 -7.317 17919 31525 1 77 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.527 -0.168 17919 31526 1 77 . 1 1 52 52 ASP C C 52 177.330 177.330 177.120 0.210 17919 31527 1 77 . 1 1 52 52 ASP CA C 52 56.960 56.960 56.305 0.655 17919 31528 1 77 . 1 1 52 52 ASP CB C 52 40.850 40.850 41.055 -0.205 17919 31529 1 77 . 1 1 52 52 ASP H H 52 8.160 8.160 8.719 -0.559 17919 31530 1 77 . 1 1 53 53 GLY N N 53 106.660 106.660 105.445 1.215 17919 31531 1 77 . 1 1 53 53 GLY C C 53 174.870 174.870 174.162 0.708 17919 31532 1 77 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.202 -0.032 17919 31533 1 77 . 1 1 53 53 GLY H H 53 9.390 9.390 8.761 0.629 17919 31534 1 77 . 1 1 54 54 ARG N N 54 119.050 119.050 118.396 0.654 17919 31535 1 77 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.697 -0.002 17919 31536 1 77 . 1 1 54 54 ARG C C 54 175.350 175.350 174.874 0.476 17919 31537 1 77 . 1 1 54 54 ARG CA C 54 54.390 54.390 53.466 0.924 17919 31538 1 77 . 1 1 54 54 ARG CB C 54 32.650 32.650 31.876 0.774 17919 31539 1 77 . 1 1 54 54 ARG H H 54 7.460 7.460 7.329 0.131 17919 31540 1 77 . 1 1 55 55 THR N N 55 108.400 108.400 110.958 -2.558 17919 31541 1 77 . 1 1 55 55 THR HA H 55 5.240 5.240 4.754 0.486 17919 31542 1 77 . 1 1 55 55 THR C C 55 176.560 176.560 176.099 0.461 17919 31543 1 77 . 1 1 55 55 THR CA C 55 59.690 59.690 60.796 -1.106 17919 31544 1 77 . 1 1 55 55 THR CB C 55 72.260 72.260 70.942 1.318 17919 31545 1 77 . 1 1 55 55 THR H H 55 8.730 8.730 8.290 0.440 17919 31546 1 77 . 1 1 56 56 LEU N N 56 117.920 117.920 121.073 -3.153 17919 31547 1 77 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.959 0.101 17919 31548 1 77 . 1 1 56 56 LEU C C 56 180.810 180.810 178.876 1.934 17919 31549 1 77 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.212 0.498 17919 31550 1 77 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.602 -1.232 17919 31551 1 77 . 1 1 56 56 LEU H H 56 8.140 8.140 8.536 -0.396 17919 31552 1 77 . 1 1 57 57 SER N N 57 113.330 113.330 115.965 -2.635 17919 31553 1 77 . 1 1 57 57 SER HA H 57 4.370 4.370 4.032 0.338 17919 31554 1 77 . 1 1 57 57 SER C C 57 178.310 178.310 176.963 1.347 17919 31555 1 77 . 1 1 57 57 SER CA C 57 61.080 61.080 62.116 -1.036 17919 31556 1 77 . 1 1 57 57 SER CB C 57 62.530 62.530 62.509 0.021 17919 31557 1 77 . 1 1 57 57 SER H H 57 8.470 8.470 7.907 0.563 17919 31558 1 77 . 1 1 58 58 ASP N N 58 124.190 124.190 121.250 2.940 17919 31559 1 77 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.235 0.061 17919 31560 1 77 . 1 1 58 58 ASP C C 58 177.400 177.400 177.042 0.358 17919 31561 1 77 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.965 0.215 17919 31562 1 77 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.376 -0.276 17919 31563 1 77 . 1 1 58 58 ASP H H 58 7.930 7.930 7.866 0.064 17919 31564 1 77 . 1 1 59 59 TYR N N 59 115.510 115.510 114.526 0.984 17919 31565 1 77 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.693 -0.023 17919 31566 1 77 . 1 1 59 59 TYR C C 59 174.700 174.700 175.128 -0.428 17919 31567 1 77 . 1 1 59 59 TYR CA C 59 58.250 58.250 56.921 1.329 17919 31568 1 77 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.242 1.828 17919 31569 1 77 . 1 1 59 59 TYR H H 59 7.250 7.250 7.204 0.046 17919 31570 1 77 . 1 1 60 60 ASN N N 60 115.900 115.900 116.736 -0.836 17919 31571 1 77 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.494 -0.139 17919 31572 1 77 . 1 1 60 60 ASN C C 60 174.340 174.340 174.360 -0.020 17919 31573 1 77 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.076 0.044 17919 31574 1 77 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.270 0.140 17919 31575 1 77 . 1 1 60 60 ASN H H 60 8.150 8.150 8.268 -0.118 17919 31576 1 77 . 1 1 61 61 ILE N N 61 118.600 118.600 120.013 -1.413 17919 31577 1 77 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.750 -0.357 17919 31578 1 77 . 1 1 61 61 ILE C C 61 174.610 174.610 175.469 -0.859 17919 31579 1 77 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.229 1.191 17919 31580 1 77 . 1 1 61 61 ILE CB C 61 36.740 36.740 36.154 0.586 17919 31581 1 77 . 1 1 61 61 ILE H H 61 7.250 7.250 7.927 -0.677 17919 31582 1 77 . 1 1 62 62 GLN N N 62 124.740 124.740 125.628 -0.888 17919 31583 1 77 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.477 0.029 17919 31584 1 77 . 1 1 62 62 GLN C C 62 175.970 175.970 176.324 -0.354 17919 31585 1 77 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.530 0.130 17919 31586 1 77 . 1 1 62 62 GLN CB C 62 31.650 31.650 29.830 1.820 17919 31587 1 77 . 1 1 62 62 GLN H H 62 7.610 7.610 7.948 -0.338 17919 31588 1 77 . 1 1 63 63 LYS N N 63 120.300 120.300 120.620 -0.320 17919 31589 1 77 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.968 0.033 17919 31590 1 77 . 1 1 63 63 LYS C C 63 175.810 175.810 176.477 -0.667 17919 31591 1 77 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.367 0.423 17919 31592 1 77 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.630 1.020 17919 31593 1 77 . 1 1 63 63 LYS H H 63 8.490 8.490 8.514 -0.024 17919 31594 1 77 . 1 1 64 64 GLU N N 64 113.950 113.950 118.418 -4.468 17919 31595 1 77 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.510 -0.045 17919 31596 1 77 . 1 1 64 64 GLU C C 64 175.250 175.250 175.599 -0.349 17919 31597 1 77 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.713 0.177 17919 31598 1 77 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.117 -2.217 17919 31599 1 77 . 1 1 64 64 GLU H H 64 9.280 9.280 8.979 0.301 17919 31600 1 77 . 1 1 65 65 SER N N 65 114.730 114.730 114.699 0.031 17919 31601 1 77 . 1 1 65 65 SER HA H 65 4.640 4.640 4.379 0.261 17919 31602 1 77 . 1 1 65 65 SER C C 65 172.160 172.160 173.625 -1.465 17919 31603 1 77 . 1 1 65 65 SER CA C 65 60.890 60.890 60.004 0.886 17919 31604 1 77 . 1 1 65 65 SER CB C 65 64.910 64.910 64.085 0.825 17919 31605 1 77 . 1 1 65 65 SER H H 65 7.670 7.670 7.526 0.144 17919 31606 1 77 . 1 1 66 66 THR N N 66 117.110 117.110 117.148 -0.038 17919 31607 1 77 . 1 1 66 66 THR HA H 66 5.270 5.270 5.093 0.177 17919 31608 1 77 . 1 1 66 66 THR C C 66 173.950 173.950 173.615 0.335 17919 31609 1 77 . 1 1 66 66 THR CA C 66 62.340 62.340 61.955 0.385 17919 31610 1 77 . 1 1 66 66 THR CB C 66 70.080 70.080 70.484 -0.404 17919 31611 1 77 . 1 1 66 66 THR H H 66 8.730 8.730 8.427 0.303 17919 31612 1 77 . 1 1 67 67 LEU N N 67 127.110 127.110 127.630 -0.520 17919 31613 1 77 . 1 1 67 67 LEU HA H 67 5.060 5.060 5.225 -0.165 17919 31614 1 77 . 1 1 67 67 LEU C C 67 175.770 175.770 175.891 -0.121 17919 31615 1 77 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.729 0.171 17919 31616 1 77 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.528 0.732 17919 31617 1 77 . 1 1 67 67 LEU H H 67 9.410 9.410 9.001 0.409 17919 31618 1 77 . 1 1 68 68 HIS N N 68 118.380 118.380 120.894 -2.514 17919 31619 1 77 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.540 -0.300 17919 31620 1 77 . 1 1 68 68 HIS C C 68 173.150 173.150 173.696 -0.546 17919 31621 1 77 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.125 0.875 17919 31622 1 77 . 1 1 68 68 HIS CB C 68 30.530 30.530 33.557 -3.027 17919 31623 1 77 . 1 1 68 68 HIS H H 68 9.230 9.230 8.340 0.890 17919 31624 1 77 . 1 1 69 69 LEU N N 69 124.460 124.460 123.596 0.864 17919 31625 1 77 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.128 0.062 17919 31626 1 77 . 1 1 69 69 LEU C C 69 175.270 175.270 173.969 1.301 17919 31627 1 77 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.619 -0.729 17919 31628 1 77 . 1 1 69 69 LEU CB C 69 44.380 44.380 45.633 -1.253 17919 31629 1 77 . 1 1 69 69 LEU H H 69 8.340 8.340 7.504 0.836 17919 31630 1 77 . 1 1 70 70 VAL N N 70 126.940 126.940 125.351 1.589 17919 31631 1 77 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.418 -0.068 17919 31632 1 77 . 1 1 70 70 VAL C C 70 174.000 174.000 174.487 -0.487 17919 31633 1 77 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.663 0.137 17919 31634 1 77 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.002 -0.091 17919 31635 1 77 . 1 1 70 70 VAL H H 70 9.200 9.200 7.850 1.350 17919 31636 1 77 . 1 1 71 71 LEU N N 71 123.130 123.130 124.619 -1.489 17919 31637 1 77 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.796 0.264 17919 31638 1 77 . 1 1 71 71 LEU C C 71 177.830 177.830 177.108 0.722 17919 31639 1 77 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.639 0.301 17919 31640 1 77 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.456 -0.606 17919 31641 1 77 . 1 1 71 71 LEU H H 71 8.120 8.120 8.338 -0.218 17919 31642 1 77 . 1 1 72 72 ARG N N 72 123.490 123.490 122.989 0.501 17919 31643 1 77 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.395 -0.094 17919 31644 1 77 . 1 1 72 72 ARG C C 72 175.350 175.350 174.191 1.159 17919 31645 1 77 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.284 -0.674 17919 31646 1 77 . 1 1 72 72 ARG CB C 72 31.350 31.350 31.168 0.183 17919 31647 1 77 . 1 1 72 72 ARG H H 72 8.580 8.580 8.191 0.389 17919 31648 1 78 . 1 1 2 2 GLN N N 2 123.220 123.220 122.789 0.431 17919 31649 1 78 . 1 1 2 2 GLN HA H 2 5.249 5.249 4.859 0.390 17919 31650 1 78 . 1 1 2 2 GLN C C 2 175.920 175.920 175.009 0.911 17919 31651 1 78 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.909 0.171 17919 31652 1 78 . 1 1 2 2 GLN CB C 2 30.760 30.760 29.595 1.165 17919 31653 1 78 . 1 1 2 2 GLN H H 2 8.900 8.900 8.586 0.314 17919 31654 1 78 . 1 1 3 3 ILE N N 3 115.340 115.340 115.213 0.127 17919 31655 1 78 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.095 0.118 17919 31656 1 78 . 1 1 3 3 ILE C C 3 172.450 172.450 173.593 -1.143 17919 31657 1 78 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.584 -0.014 17919 31658 1 78 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.358 0.852 17919 31659 1 78 . 1 1 3 3 ILE H H 3 8.320 8.320 7.577 0.743 17919 31660 1 78 . 1 1 4 4 PHE N N 4 118.110 118.110 118.166 -0.056 17919 31661 1 78 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.399 0.231 17919 31662 1 78 . 1 1 4 4 PHE C C 4 175.320 175.320 174.823 0.497 17919 31663 1 78 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.142 0.068 17919 31664 1 78 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.071 -0.591 17919 31665 1 78 . 1 1 4 4 PHE H H 4 8.610 8.610 7.812 0.798 17919 31666 1 78 . 1 1 5 5 VAL N N 5 121.000 121.000 121.692 -0.692 17919 31667 1 78 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.810 -0.085 17919 31668 1 78 . 1 1 5 5 VAL C C 5 174.870 174.870 175.568 -0.698 17919 31669 1 78 . 1 1 5 5 VAL CA C 5 60.620 60.620 60.466 0.154 17919 31670 1 78 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.288 0.942 17919 31671 1 78 . 1 1 5 5 VAL H H 5 9.300 9.300 8.501 0.799 17919 31672 1 78 . 1 1 6 6 LYS N N 6 127.520 127.520 127.612 -0.092 17919 31673 1 78 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.344 0.023 17919 31674 1 78 . 1 1 6 6 LYS C C 6 177.140 177.140 176.628 0.512 17919 31675 1 78 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.113 0.407 17919 31676 1 78 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.482 0.568 17919 31677 1 78 . 1 1 6 6 LYS H H 6 8.820 8.820 8.996 -0.176 17919 31678 1 78 . 1 1 7 7 THR N N 7 115.400 115.400 112.547 2.853 17919 31679 1 78 . 1 1 7 7 THR HA H 7 4.970 4.970 4.654 0.316 17919 31680 1 78 . 1 1 7 7 THR C C 7 176.910 176.910 176.066 0.844 17919 31681 1 78 . 1 1 7 7 THR CA C 7 60.470 60.470 59.102 1.368 17919 31682 1 78 . 1 1 7 7 THR CB C 7 70.630 70.630 71.335 -0.705 17919 31683 1 78 . 1 1 7 7 THR H H 7 8.730 8.730 8.112 0.618 17919 31684 1 78 . 1 1 8 8 LEU N N 8 121.330 121.330 120.001 1.329 17919 31685 1 78 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.152 0.158 17919 31686 1 78 . 1 1 8 8 LEU C C 8 178.800 178.800 178.014 0.786 17919 31687 1 78 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.543 0.037 17919 31688 1 78 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.007 -0.037 17919 31689 1 78 . 1 1 8 8 LEU H H 8 9.100 9.100 8.635 0.465 17919 31690 1 78 . 1 1 9 9 THR N N 9 105.590 105.590 106.972 -1.382 17919 31691 1 78 . 1 1 9 9 THR HA H 9 4.428 4.428 4.287 0.141 17919 31692 1 78 . 1 1 9 9 THR C C 9 175.520 175.520 175.425 0.095 17919 31693 1 78 . 1 1 9 9 THR CA C 9 61.400 61.400 61.700 -0.300 17919 31694 1 78 . 1 1 9 9 THR CB C 9 69.140 69.140 68.256 0.884 17919 31695 1 78 . 1 1 9 9 THR H H 9 7.630 7.630 7.847 -0.217 17919 31696 1 78 . 1 1 10 10 GLY N N 10 108.890 108.890 109.734 -0.844 17919 31697 1 78 . 1 1 10 10 GLY C C 10 174.070 174.070 174.465 -0.395 17919 31698 1 78 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.690 -0.230 17919 31699 1 78 . 1 1 10 10 GLY H H 10 7.810 7.810 7.521 0.289 17919 31700 1 78 . 1 1 11 11 LYS N N 11 121.600 121.600 119.954 1.646 17919 31701 1 78 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.581 -0.220 17919 31702 1 78 . 1 1 11 11 LYS C C 11 175.940 175.940 175.512 0.428 17919 31703 1 78 . 1 1 11 11 LYS CA C 11 56.280 56.280 54.798 1.482 17919 31704 1 78 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.563 -0.363 17919 31705 1 78 . 1 1 11 11 LYS H H 11 7.280 7.280 7.644 -0.364 17919 31706 1 78 . 1 1 12 12 THR N N 12 120.440 120.440 116.513 3.927 17919 31707 1 78 . 1 1 12 12 THR HA H 12 5.046 5.046 5.115 -0.069 17919 31708 1 78 . 1 1 12 12 THR C C 12 174.320 174.320 174.462 -0.142 17919 31709 1 78 . 1 1 12 12 THR CA C 12 62.390 62.390 61.170 1.220 17919 31710 1 78 . 1 1 12 12 THR CB C 12 69.910 69.910 70.219 -0.309 17919 31711 1 78 . 1 1 12 12 THR H H 12 8.650 8.650 8.304 0.346 17919 31712 1 78 . 1 1 13 13 ILE N N 13 127.110 127.110 120.955 6.155 17919 31713 1 78 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.754 -0.210 17919 31714 1 78 . 1 1 13 13 ILE C C 13 175.220 175.220 173.598 1.622 17919 31715 1 78 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.747 0.233 17919 31716 1 78 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.126 -0.176 17919 31717 1 78 . 1 1 13 13 ILE H H 13 9.450 9.450 8.605 0.845 17919 31718 1 78 . 1 1 14 14 THR N N 14 121.520 121.520 123.516 -1.996 17919 31719 1 78 . 1 1 14 14 THR HA H 14 4.964 4.964 4.917 0.047 17919 31720 1 78 . 1 1 14 14 THR C C 14 173.790 173.790 174.093 -0.303 17919 31721 1 78 . 1 1 14 14 THR CA C 14 61.940 61.940 62.144 -0.204 17919 31722 1 78 . 1 1 14 14 THR CB C 14 69.650 69.650 69.827 -0.177 17919 31723 1 78 . 1 1 14 14 THR H H 14 8.710 8.710 8.392 0.318 17919 31724 1 78 . 1 1 15 15 LEU N N 15 124.800 124.800 126.617 -1.817 17919 31725 1 78 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.841 -0.061 17919 31726 1 78 . 1 1 15 15 LEU C C 15 174.670 174.670 175.437 -0.767 17919 31727 1 78 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.763 -0.933 17919 31728 1 78 . 1 1 15 15 LEU CB C 15 47.070 47.070 43.901 3.169 17919 31729 1 78 . 1 1 15 15 LEU H H 15 8.710 8.710 8.381 0.329 17919 31730 1 78 . 1 1 16 16 GLU N N 16 122.160 122.160 122.921 -0.761 17919 31731 1 78 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.689 0.228 17919 31732 1 78 . 1 1 16 16 GLU C C 16 175.860 175.860 175.157 0.703 17919 31733 1 78 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.445 -0.625 17919 31734 1 78 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.396 -0.946 17919 31735 1 78 . 1 1 16 16 GLU H H 16 8.140 8.140 8.483 -0.343 17919 31736 1 78 . 1 1 17 17 VAL N N 17 117.210 117.210 119.060 -1.850 17919 31737 1 78 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.613 0.101 17919 31738 1 78 . 1 1 17 17 VAL C C 17 174.160 174.160 175.327 -1.167 17919 31739 1 78 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.629 -1.199 17919 31740 1 78 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.005 1.395 17919 31741 1 78 . 1 1 17 17 VAL H H 17 8.900 8.900 7.974 0.926 17919 31742 1 78 . 1 1 18 18 GLU N N 18 118.990 118.990 122.180 -3.190 17919 31743 1 78 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.965 0.114 17919 31744 1 78 . 1 1 18 18 GLU C C 18 176.160 176.160 175.610 0.550 17919 31745 1 78 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.596 0.124 17919 31746 1 78 . 1 1 18 18 GLU CB C 18 30.310 30.310 31.656 -1.346 17919 31747 1 78 . 1 1 18 18 GLU H H 18 8.640 8.640 8.691 -0.051 17919 31748 1 78 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.214 -0.073 17919 31749 1 78 . 1 1 19 19 PRO C C 19 175.310 175.310 177.828 -2.518 17919 31750 1 78 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.637 -0.167 17919 31751 1 78 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.958 -0.008 17919 31752 1 78 . 1 1 20 20 SER N N 20 103.400 103.400 108.414 -5.014 17919 31753 1 78 . 1 1 20 20 SER HA H 20 4.370 4.370 4.354 0.016 17919 31754 1 78 . 1 1 20 20 SER C C 20 174.660 174.660 174.490 0.170 17919 31755 1 78 . 1 1 20 20 SER CA C 20 57.400 57.400 58.241 -0.841 17919 31756 1 78 . 1 1 20 20 SER CB C 20 63.370 63.370 62.757 0.613 17919 31757 1 78 . 1 1 20 20 SER H H 20 7.040 7.040 7.939 -0.899 17919 31758 1 78 . 1 1 21 21 ASP N N 21 123.480 123.480 125.038 -1.558 17919 31759 1 78 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.638 0.057 17919 31760 1 78 . 1 1 21 21 ASP C C 21 176.360 176.360 176.116 0.244 17919 31761 1 78 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.205 0.495 17919 31762 1 78 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.456 -0.656 17919 31763 1 78 . 1 1 21 21 ASP H H 21 8.030 8.030 8.017 0.013 17919 31764 1 78 . 1 1 22 22 THR N N 22 108.800 108.800 112.623 -3.823 17919 31765 1 78 . 1 1 22 22 THR HA H 22 4.920 4.920 4.824 0.096 17919 31766 1 78 . 1 1 22 22 THR C C 22 176.750 176.750 175.984 0.766 17919 31767 1 78 . 1 1 22 22 THR CA C 22 59.690 59.690 60.894 -1.204 17919 31768 1 78 . 1 1 22 22 THR CB C 22 71.200 71.200 70.830 0.370 17919 31769 1 78 . 1 1 22 22 THR H H 22 7.900 7.900 8.248 -0.348 17919 31770 1 78 . 1 1 23 23 ILE N N 23 121.190 121.190 122.118 -0.928 17919 31771 1 78 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.820 -0.163 17919 31772 1 78 . 1 1 23 23 ILE C C 23 179.040 179.040 177.729 1.311 17919 31773 1 78 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.260 -0.000 17919 31774 1 78 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.269 -1.919 17919 31775 1 78 . 1 1 23 23 ILE H H 23 8.560 8.560 9.009 -0.449 17919 31776 1 78 . 1 1 24 24 GLU N N 24 120.830 120.830 120.731 0.099 17919 31777 1 78 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.857 0.060 17919 31778 1 78 . 1 1 24 24 GLU C C 24 178.640 178.640 178.782 -0.142 17919 31779 1 78 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.130 0.090 17919 31780 1 78 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.375 -1.095 17919 31781 1 78 . 1 1 24 24 GLU H H 24 9.760 9.760 7.792 1.968 17919 31782 1 78 . 1 1 25 25 ASN N N 25 120.570 120.570 117.571 2.999 17919 31783 1 78 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.477 0.048 17919 31784 1 78 . 1 1 25 25 ASN C C 25 178.380 178.380 178.037 0.343 17919 31785 1 78 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.019 0.041 17919 31786 1 78 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.635 -0.185 17919 31787 1 78 . 1 1 25 25 ASN H H 25 7.920 7.920 7.623 0.297 17919 31788 1 78 . 1 1 26 26 VAL N N 26 121.710 121.710 120.421 1.289 17919 31789 1 78 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.640 -0.243 17919 31790 1 78 . 1 1 26 26 VAL C C 26 177.950 177.950 177.795 0.155 17919 31791 1 78 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.208 1.452 17919 31792 1 78 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.781 -0.941 17919 31793 1 78 . 1 1 26 26 VAL H H 26 8.070 8.070 8.170 -0.100 17919 31794 1 78 . 1 1 27 27 LYS N N 27 118.860 118.860 119.363 -0.503 17919 31795 1 78 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.257 0.323 17919 31796 1 78 . 1 1 27 27 LYS C C 27 180.550 180.550 178.878 1.672 17919 31797 1 78 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.069 0.180 17919 31798 1 78 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.242 1.488 17919 31799 1 78 . 1 1 27 27 LYS H H 27 8.560 8.560 8.390 0.170 17919 31800 1 78 . 1 1 28 28 ALA N N 28 123.440 123.440 122.329 1.111 17919 31801 1 78 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.083 0.077 17919 31802 1 78 . 1 1 28 28 ALA C C 28 180.300 180.300 178.915 1.385 17919 31803 1 78 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.278 0.092 17919 31804 1 78 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.265 -0.555 17919 31805 1 78 . 1 1 28 28 ALA H H 28 8.060 8.060 8.609 -0.549 17919 31806 1 78 . 1 1 29 29 LYS N N 29 119.940 119.940 119.337 0.603 17919 31807 1 78 . 1 1 29 29 LYS HA H 29 4.207 4.207 3.961 0.246 17919 31808 1 78 . 1 1 29 29 LYS C C 29 180.320 180.320 179.101 1.219 17919 31809 1 78 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.405 0.245 17919 31810 1 78 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.143 1.147 17919 31811 1 78 . 1 1 29 29 LYS H H 29 7.850 7.850 7.408 0.442 17919 31812 1 78 . 1 1 30 30 ILE N N 30 121.080 121.080 119.745 1.335 17919 31813 1 78 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.575 -0.068 17919 31814 1 78 . 1 1 30 30 ILE C C 30 178.310 178.310 177.555 0.755 17919 31815 1 78 . 1 1 30 30 ILE CA C 30 66.150 66.150 64.945 1.206 17919 31816 1 78 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.474 -0.674 17919 31817 1 78 . 1 1 30 30 ILE H H 30 8.280 8.280 7.581 0.699 17919 31818 1 78 . 1 1 31 31 GLN N N 31 123.490 123.490 120.364 3.126 17919 31819 1 78 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.055 -0.226 17919 31820 1 78 . 1 1 31 31 GLN C C 31 178.890 178.890 178.640 0.250 17919 31821 1 78 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.020 0.980 17919 31822 1 78 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.407 -0.687 17919 31823 1 78 . 1 1 31 31 GLN H H 31 8.580 8.580 8.012 0.568 17919 31824 1 78 . 1 1 32 32 ASP N N 32 119.360 119.360 119.584 -0.224 17919 31825 1 78 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.362 -0.008 17919 31826 1 78 . 1 1 32 32 ASP C C 32 177.250 177.250 177.857 -0.607 17919 31827 1 78 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.962 0.228 17919 31828 1 78 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.881 -0.301 17919 31829 1 78 . 1 1 32 32 ASP H H 32 8.010 8.010 7.858 0.152 17919 31830 1 78 . 1 1 33 33 LYS N N 33 115.130 115.130 119.062 -3.932 17919 31831 1 78 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.220 0.117 17919 31832 1 78 . 1 1 33 33 LYS C C 33 177.870 177.870 178.506 -0.636 17919 31833 1 78 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.923 0.127 17919 31834 1 78 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.112 1.058 17919 31835 1 78 . 1 1 33 33 LYS H H 33 7.430 7.430 7.496 -0.066 17919 31836 1 78 . 1 1 34 34 GLU N N 34 113.870 113.870 115.440 -1.570 17919 31837 1 78 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.451 0.174 17919 31838 1 78 . 1 1 34 34 GLU C C 34 177.840 177.840 177.467 0.373 17919 31839 1 78 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.421 -1.251 17919 31840 1 78 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.189 1.471 17919 31841 1 78 . 1 1 34 34 GLU H H 34 8.740 8.740 8.075 0.665 17919 31842 1 78 . 1 1 35 35 GLY N N 35 108.650 108.650 109.641 -0.991 17919 31843 1 78 . 1 1 35 35 GLY C C 35 173.960 173.960 174.267 -0.307 17919 31844 1 78 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.664 0.416 17919 31845 1 78 . 1 1 35 35 GLY H H 35 8.530 8.530 8.196 0.334 17919 31846 1 78 . 1 1 36 36 ILE N N 36 119.880 119.880 118.777 1.103 17919 31847 1 78 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.441 0.004 17919 31848 1 78 . 1 1 36 36 ILE C C 36 173.590 173.590 174.224 -0.634 17919 31849 1 78 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.666 0.084 17919 31850 1 78 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.324 2.256 17919 31851 1 78 . 1 1 36 36 ILE H H 36 6.150 6.150 7.519 -1.369 17919 31852 1 78 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.766 -0.132 17919 31853 1 78 . 1 1 37 37 PRO C C 37 176.940 176.940 176.441 0.499 17919 31854 1 78 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.175 0.485 17919 31855 1 78 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.139 0.711 17919 31856 1 78 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.079 0.038 17919 31857 1 78 . 1 1 38 38 PRO C C 38 178.320 178.320 178.756 -0.436 17919 31858 1 78 . 1 1 38 38 PRO CA C 38 66.260 66.260 66.072 0.188 17919 31859 1 78 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.877 1.013 17919 31860 1 78 . 1 1 39 39 ASP N N 39 113.380 113.380 116.207 -2.827 17919 31861 1 78 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.306 0.124 17919 31862 1 78 . 1 1 39 39 ASP C C 39 177.090 177.090 178.292 -1.202 17919 31863 1 78 . 1 1 39 39 ASP CA C 39 55.640 55.640 57.171 -1.531 17919 31864 1 78 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.499 -0.959 17919 31865 1 78 . 1 1 39 39 ASP H H 39 8.550 8.550 8.560 -0.010 17919 31866 1 78 . 1 1 40 40 GLN N N 40 116.780 116.780 116.765 0.015 17919 31867 1 78 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.267 0.197 17919 31868 1 78 . 1 1 40 40 GLN C C 40 175.380 175.380 176.750 -1.370 17919 31869 1 78 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.608 -0.968 17919 31870 1 78 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.212 0.928 17919 31871 1 78 . 1 1 40 40 GLN H H 40 7.820 7.820 8.027 -0.207 17919 31872 1 78 . 1 1 41 41 GLN N N 41 117.720 117.720 118.859 -1.139 17919 31873 1 78 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.466 -0.222 17919 31874 1 78 . 1 1 41 41 GLN C C 41 176.300 176.300 175.954 0.346 17919 31875 1 78 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.678 -0.207 17919 31876 1 78 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.271 2.379 17919 31877 1 78 . 1 1 41 41 GLN H H 41 7.480 7.480 7.537 -0.057 17919 31878 1 78 . 1 1 42 42 ARG N N 42 122.680 122.680 121.931 0.749 17919 31879 1 78 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.607 -0.107 17919 31880 1 78 . 1 1 42 42 ARG C C 42 174.050 174.050 174.856 -0.806 17919 31881 1 78 . 1 1 42 42 ARG CA C 42 55.050 55.050 53.065 1.985 17919 31882 1 78 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.379 -0.629 17919 31883 1 78 . 1 1 42 42 ARG H H 42 8.530 8.530 8.666 -0.136 17919 31884 1 78 . 1 1 43 43 LEU N N 43 124.040 124.040 125.086 -1.046 17919 31885 1 78 . 1 1 43 43 LEU C C 43 175.290 175.290 175.575 -0.285 17919 31886 1 78 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.183 -1.203 17919 31887 1 78 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.921 1.869 17919 31888 1 78 . 1 1 43 43 LEU H H 43 8.820 8.820 8.758 0.062 17919 31889 1 78 . 1 1 44 44 ILE N N 44 121.920 121.920 122.216 -0.296 17919 31890 1 78 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.925 0.067 17919 31891 1 78 . 1 1 44 44 ILE C C 44 176.060 176.060 174.265 1.795 17919 31892 1 78 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.531 -1.551 17919 31893 1 78 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.753 -0.333 17919 31894 1 78 . 1 1 44 44 ILE H H 44 9.030 9.030 8.283 0.747 17919 31895 1 78 . 1 1 45 45 PHE N N 45 125.390 125.390 127.514 -2.124 17919 31896 1 78 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.009 0.036 17919 31897 1 78 . 1 1 45 45 PHE C C 45 174.470 174.470 174.393 0.077 17919 31898 1 78 . 1 1 45 45 PHE CA C 45 57.020 57.020 55.714 1.306 17919 31899 1 78 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.127 0.633 17919 31900 1 78 . 1 1 45 45 PHE H H 45 8.830 8.830 9.073 -0.243 17919 31901 1 78 . 1 1 46 46 ALA N N 46 132.200 132.200 129.276 2.924 17919 31902 1 78 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.703 -0.013 17919 31903 1 78 . 1 1 46 46 ALA C C 46 177.290 177.290 178.091 -0.801 17919 31904 1 78 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.619 -0.079 17919 31905 1 78 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.832 -0.262 17919 31906 1 78 . 1 1 46 46 ALA H H 46 8.810 8.810 8.911 -0.101 17919 31907 1 78 . 1 1 47 47 GLY N N 47 102.340 102.340 103.444 -1.104 17919 31908 1 78 . 1 1 47 47 GLY C C 47 173.810 173.810 174.093 -0.283 17919 31909 1 78 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.495 -0.145 17919 31910 1 78 . 1 1 47 47 GLY H H 47 8.130 8.130 8.551 -0.421 17919 31911 1 78 . 1 1 48 48 LYS N N 48 121.570 121.570 120.411 1.159 17919 31912 1 78 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.649 -0.027 17919 31913 1 78 . 1 1 48 48 LYS C C 48 174.700 174.700 175.596 -0.896 17919 31914 1 78 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.675 -0.125 17919 31915 1 78 . 1 1 48 48 LYS CB C 48 34.530 34.530 35.038 -0.508 17919 31916 1 78 . 1 1 48 48 LYS H H 48 7.980 7.980 7.662 0.318 17919 31917 1 78 . 1 1 49 49 GLN N N 49 122.410 122.410 124.339 -1.929 17919 31918 1 78 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.328 0.232 17919 31919 1 78 . 1 1 49 49 GLN C C 49 175.670 175.670 175.672 -0.002 17919 31920 1 78 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.485 -0.745 17919 31921 1 78 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.449 -0.449 17919 31922 1 78 . 1 1 49 49 GLN H H 49 8.600 8.600 8.636 -0.036 17919 31923 1 78 . 1 1 50 50 LEU N N 50 125.520 125.520 128.368 -2.848 17919 31924 1 78 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.110 -0.020 17919 31925 1 78 . 1 1 50 50 LEU C C 50 176.660 176.660 176.055 0.605 17919 31926 1 78 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.010 0.230 17919 31927 1 78 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.331 0.239 17919 31928 1 78 . 1 1 50 50 LEU H H 50 8.530 8.530 9.044 -0.514 17919 31929 1 78 . 1 1 51 51 GLU N N 51 122.940 122.940 124.295 -1.355 17919 31930 1 78 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.465 0.023 17919 31931 1 78 . 1 1 51 51 GLU C C 51 175.870 175.870 176.539 -0.669 17919 31932 1 78 . 1 1 51 51 GLU CA C 51 55.960 55.960 54.142 1.818 17919 31933 1 78 . 1 1 51 51 GLU CB C 51 31.570 31.570 30.916 0.654 17919 31934 1 78 . 1 1 51 51 GLU H H 51 8.400 8.400 8.451 -0.051 17919 31935 1 78 . 1 1 52 52 ASP N N 52 120.030 120.030 123.567 -3.537 17919 31936 1 78 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.448 -0.089 17919 31937 1 78 . 1 1 52 52 ASP C C 52 177.330 177.330 178.295 -0.965 17919 31938 1 78 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.594 -0.634 17919 31939 1 78 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.835 0.015 17919 31940 1 78 . 1 1 52 52 ASP H H 52 8.160 8.160 8.842 -0.682 17919 31941 1 78 . 1 1 53 53 GLY N N 53 106.660 106.660 107.718 -1.058 17919 31942 1 78 . 1 1 53 53 GLY C C 53 174.870 174.870 173.889 0.981 17919 31943 1 78 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.141 0.029 17919 31944 1 78 . 1 1 53 53 GLY H H 53 9.390 9.390 8.610 0.780 17919 31945 1 78 . 1 1 54 54 ARG N N 54 119.050 119.050 119.424 -0.374 17919 31946 1 78 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.652 0.043 17919 31947 1 78 . 1 1 54 54 ARG C C 54 175.350 175.350 174.926 0.424 17919 31948 1 78 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.104 0.286 17919 31949 1 78 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.888 -1.238 17919 31950 1 78 . 1 1 54 54 ARG H H 54 7.460 7.460 7.568 -0.108 17919 31951 1 78 . 1 1 55 55 THR N N 55 108.400 108.400 112.649 -4.249 17919 31952 1 78 . 1 1 55 55 THR HA H 55 5.240 5.240 4.955 0.285 17919 31953 1 78 . 1 1 55 55 THR C C 55 176.560 176.560 176.904 -0.344 17919 31954 1 78 . 1 1 55 55 THR CA C 55 59.690 59.690 60.407 -0.717 17919 31955 1 78 . 1 1 55 55 THR CB C 55 72.260 72.260 70.861 1.399 17919 31956 1 78 . 1 1 55 55 THR H H 55 8.730 8.730 9.023 -0.293 17919 31957 1 78 . 1 1 56 56 LEU N N 56 117.920 117.920 121.859 -3.939 17919 31958 1 78 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.967 0.093 17919 31959 1 78 . 1 1 56 56 LEU C C 56 180.810 180.810 178.469 2.341 17919 31960 1 78 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.395 0.315 17919 31961 1 78 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.489 -1.119 17919 31962 1 78 . 1 1 56 56 LEU H H 56 8.140 8.140 8.720 -0.580 17919 31963 1 78 . 1 1 57 57 SER N N 57 113.330 113.330 113.408 -0.078 17919 31964 1 78 . 1 1 57 57 SER HA H 57 4.370 4.370 4.332 0.038 17919 31965 1 78 . 1 1 57 57 SER C C 57 178.310 178.310 176.394 1.916 17919 31966 1 78 . 1 1 57 57 SER CA C 57 61.080 61.080 61.312 -0.232 17919 31967 1 78 . 1 1 57 57 SER CB C 57 62.530 62.530 62.784 -0.254 17919 31968 1 78 . 1 1 57 57 SER H H 57 8.470 8.470 8.365 0.105 17919 31969 1 78 . 1 1 58 58 ASP N N 58 124.190 124.190 122.768 1.422 17919 31970 1 78 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.359 -0.063 17919 31971 1 78 . 1 1 58 58 ASP C C 58 177.400 177.400 177.026 0.374 17919 31972 1 78 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.571 0.609 17919 31973 1 78 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.359 -0.259 17919 31974 1 78 . 1 1 58 58 ASP H H 58 7.930 7.930 7.862 0.068 17919 31975 1 78 . 1 1 59 59 TYR N N 59 115.510 115.510 114.907 0.603 17919 31976 1 78 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.685 -0.015 17919 31977 1 78 . 1 1 59 59 TYR C C 59 174.700 174.700 175.031 -0.331 17919 31978 1 78 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.146 1.104 17919 31979 1 78 . 1 1 59 59 TYR CB C 59 40.070 40.070 39.019 1.051 17919 31980 1 78 . 1 1 59 59 TYR H H 59 7.250 7.250 7.322 -0.072 17919 31981 1 78 . 1 1 60 60 ASN N N 60 115.900 115.900 117.681 -1.781 17919 31982 1 78 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.440 -0.085 17919 31983 1 78 . 1 1 60 60 ASN C C 60 174.340 174.340 174.916 -0.576 17919 31984 1 78 . 1 1 60 60 ASN CA C 60 54.120 54.120 53.576 0.544 17919 31985 1 78 . 1 1 60 60 ASN CB C 60 37.410 37.410 38.122 -0.712 17919 31986 1 78 . 1 1 60 60 ASN H H 60 8.150 8.150 7.652 0.498 17919 31987 1 78 . 1 1 61 61 ILE N N 61 118.600 118.600 120.952 -2.352 17919 31988 1 78 . 1 1 61 61 ILE HA H 61 3.393 3.393 4.095 -0.702 17919 31989 1 78 . 1 1 61 61 ILE C C 61 174.610 174.610 175.408 -0.798 17919 31990 1 78 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.200 1.220 17919 31991 1 78 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.340 -0.600 17919 31992 1 78 . 1 1 61 61 ILE H H 61 7.250 7.250 7.814 -0.564 17919 31993 1 78 . 1 1 62 62 GLN N N 62 124.740 124.740 128.118 -3.378 17919 31994 1 78 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.513 -0.007 17919 31995 1 78 . 1 1 62 62 GLN C C 62 175.970 175.970 175.371 0.599 17919 31996 1 78 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.791 -0.131 17919 31997 1 78 . 1 1 62 62 GLN CB C 62 31.650 31.650 29.801 1.849 17919 31998 1 78 . 1 1 62 62 GLN H H 62 7.610 7.610 8.332 -0.722 17919 31999 1 78 . 1 1 63 63 LYS N N 63 120.300 120.300 119.697 0.603 17919 32000 1 78 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.973 0.028 17919 32001 1 78 . 1 1 63 63 LYS C C 63 175.810 175.810 177.278 -1.468 17919 32002 1 78 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.430 -0.640 17919 32003 1 78 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.344 0.306 17919 32004 1 78 . 1 1 63 63 LYS H H 63 8.490 8.490 8.380 0.110 17919 32005 1 78 . 1 1 64 64 GLU N N 64 113.950 113.950 119.601 -5.651 17919 32006 1 78 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.462 0.003 17919 32007 1 78 . 1 1 64 64 GLU C C 64 175.250 175.250 174.930 0.320 17919 32008 1 78 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.560 0.330 17919 32009 1 78 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.634 -2.734 17919 32010 1 78 . 1 1 64 64 GLU H H 64 9.280 9.280 8.649 0.631 17919 32011 1 78 . 1 1 65 65 SER N N 65 114.730 114.730 114.927 -0.197 17919 32012 1 78 . 1 1 65 65 SER HA H 65 4.640 4.640 4.658 -0.018 17919 32013 1 78 . 1 1 65 65 SER C C 65 172.160 172.160 173.998 -1.838 17919 32014 1 78 . 1 1 65 65 SER CA C 65 60.890 60.890 58.318 2.572 17919 32015 1 78 . 1 1 65 65 SER CB C 65 64.910 64.910 64.128 0.782 17919 32016 1 78 . 1 1 65 65 SER H H 65 7.670 7.670 7.410 0.260 17919 32017 1 78 . 1 1 66 66 THR N N 66 117.110 117.110 121.426 -4.316 17919 32018 1 78 . 1 1 66 66 THR HA H 66 5.270 5.270 5.125 0.145 17919 32019 1 78 . 1 1 66 66 THR C C 66 173.950 173.950 174.659 -0.709 17919 32020 1 78 . 1 1 66 66 THR CA C 66 62.340 62.340 62.073 0.267 17919 32021 1 78 . 1 1 66 66 THR CB C 66 70.080 70.080 69.282 0.798 17919 32022 1 78 . 1 1 66 66 THR H H 66 8.730 8.730 8.587 0.143 17919 32023 1 78 . 1 1 67 67 LEU N N 67 127.110 127.110 127.574 -0.464 17919 32024 1 78 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.821 0.239 17919 32025 1 78 . 1 1 67 67 LEU C C 67 175.770 175.770 175.346 0.424 17919 32026 1 78 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.807 0.093 17919 32027 1 78 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.333 -0.073 17919 32028 1 78 . 1 1 67 67 LEU H H 67 9.410 9.410 8.546 0.864 17919 32029 1 78 . 1 1 68 68 HIS N N 68 118.380 118.380 120.032 -1.652 17919 32030 1 78 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.334 -0.094 17919 32031 1 78 . 1 1 68 68 HIS C C 68 173.150 173.150 173.927 -0.777 17919 32032 1 78 . 1 1 68 68 HIS CA C 68 55.000 55.000 53.995 1.005 17919 32033 1 78 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.325 -1.795 17919 32034 1 78 . 1 1 68 68 HIS H H 68 9.230 9.230 8.617 0.613 17919 32035 1 78 . 1 1 69 69 LEU N N 69 124.460 124.460 129.733 -5.273 17919 32036 1 78 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.122 0.068 17919 32037 1 78 . 1 1 69 69 LEU C C 69 175.270 175.270 174.774 0.496 17919 32038 1 78 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.671 0.219 17919 32039 1 78 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.403 -0.023 17919 32040 1 78 . 1 1 69 69 LEU H H 69 8.340 8.340 7.848 0.492 17919 32041 1 78 . 1 1 70 70 VAL N N 70 126.940 126.940 123.010 3.930 17919 32042 1 78 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.577 -0.227 17919 32043 1 78 . 1 1 70 70 VAL C C 70 174.000 174.000 174.303 -0.303 17919 32044 1 78 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.478 1.321 17919 32045 1 78 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.644 -0.734 17919 32046 1 78 . 1 1 70 70 VAL H H 70 9.200 9.200 8.522 0.678 17919 32047 1 78 . 1 1 71 71 LEU N N 71 123.130 123.130 121.590 1.540 17919 32048 1 78 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.982 0.078 17919 32049 1 78 . 1 1 71 71 LEU C C 71 177.830 177.830 177.281 0.549 17919 32050 1 78 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.124 0.816 17919 32051 1 78 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.613 0.237 17919 32052 1 78 . 1 1 71 71 LEU H H 71 8.120 8.120 8.306 -0.186 17919 32053 1 78 . 1 1 72 72 ARG N N 72 123.490 123.490 126.605 -3.115 17919 32054 1 78 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.127 0.174 17919 32055 1 78 . 1 1 72 72 ARG C C 72 175.350 175.350 174.729 0.621 17919 32056 1 78 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.370 -0.760 17919 32057 1 78 . 1 1 72 72 ARG CB C 72 31.350 31.350 31.112 0.238 17919 32058 1 78 . 1 1 72 72 ARG H H 72 8.580 8.580 8.350 0.230 17919 32059 1 79 . 1 1 2 2 GLN N N 2 123.220 123.220 122.721 0.499 17919 32060 1 79 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.052 0.197 17919 32061 1 79 . 1 1 2 2 GLN C C 2 175.920 175.920 175.724 0.196 17919 32062 1 79 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.693 0.387 17919 32063 1 79 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.583 0.177 17919 32064 1 79 . 1 1 2 2 GLN H H 2 8.900 8.900 8.404 0.496 17919 32065 1 79 . 1 1 3 3 ILE N N 3 115.340 115.340 114.491 0.849 17919 32066 1 79 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.053 0.160 17919 32067 1 79 . 1 1 3 3 ILE C C 3 172.450 172.450 173.723 -1.273 17919 32068 1 79 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.399 0.171 17919 32069 1 79 . 1 1 3 3 ILE CB C 3 42.210 42.210 40.883 1.327 17919 32070 1 79 . 1 1 3 3 ILE H H 3 8.320 8.320 7.927 0.393 17919 32071 1 79 . 1 1 4 4 PHE N N 4 118.110 118.110 119.682 -1.572 17919 32072 1 79 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.510 0.120 17919 32073 1 79 . 1 1 4 4 PHE C C 4 175.320 175.320 175.629 -0.309 17919 32074 1 79 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.170 0.040 17919 32075 1 79 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.228 0.252 17919 32076 1 79 . 1 1 4 4 PHE H H 4 8.610 8.610 8.306 0.304 17919 32077 1 79 . 1 1 5 5 VAL N N 5 121.000 121.000 120.478 0.522 17919 32078 1 79 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.698 0.027 17919 32079 1 79 . 1 1 5 5 VAL C C 5 174.870 174.870 175.028 -0.158 17919 32080 1 79 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.597 -0.978 17919 32081 1 79 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.596 -0.366 17919 32082 1 79 . 1 1 5 5 VAL H H 5 9.300 9.300 9.116 0.184 17919 32083 1 79 . 1 1 6 6 LYS N N 6 127.520 127.520 128.620 -1.100 17919 32084 1 79 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.493 -0.126 17919 32085 1 79 . 1 1 6 6 LYS C C 6 177.140 177.140 176.803 0.337 17919 32086 1 79 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.711 -0.191 17919 32087 1 79 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.272 0.778 17919 32088 1 79 . 1 1 6 6 LYS H H 6 8.820 8.820 8.927 -0.107 17919 32089 1 79 . 1 1 7 7 THR N N 7 115.400 115.400 117.139 -1.739 17919 32090 1 79 . 1 1 7 7 THR HA H 7 4.970 4.970 4.606 0.364 17919 32091 1 79 . 1 1 7 7 THR C C 7 176.910 176.910 176.274 0.636 17919 32092 1 79 . 1 1 7 7 THR CA C 7 60.470 60.470 60.421 0.049 17919 32093 1 79 . 1 1 7 7 THR CB C 7 70.630 70.630 70.130 0.500 17919 32094 1 79 . 1 1 7 7 THR H H 7 8.730 8.730 8.111 0.619 17919 32095 1 79 . 1 1 8 8 LEU N N 8 121.330 121.330 121.136 0.194 17919 32096 1 79 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.292 0.018 17919 32097 1 79 . 1 1 8 8 LEU C C 8 178.800 178.800 178.563 0.237 17919 32098 1 79 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.697 -0.117 17919 32099 1 79 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.671 0.299 17919 32100 1 79 . 1 1 8 8 LEU H H 8 9.100 9.100 8.928 0.172 17919 32101 1 79 . 1 1 9 9 THR N N 9 105.590 105.590 109.039 -3.449 17919 32102 1 79 . 1 1 9 9 THR HA H 9 4.428 4.428 4.355 0.073 17919 32103 1 79 . 1 1 9 9 THR C C 9 175.520 175.520 175.769 -0.249 17919 32104 1 79 . 1 1 9 9 THR CA C 9 61.400 61.400 61.708 -0.308 17919 32105 1 79 . 1 1 9 9 THR CB C 9 69.140 69.140 69.349 -0.209 17919 32106 1 79 . 1 1 9 9 THR H H 9 7.630 7.630 7.763 -0.133 17919 32107 1 79 . 1 1 10 10 GLY N N 10 108.890 108.890 111.592 -2.702 17919 32108 1 79 . 1 1 10 10 GLY C C 10 174.070 174.070 173.532 0.538 17919 32109 1 79 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.117 0.343 17919 32110 1 79 . 1 1 10 10 GLY H H 10 7.810 7.810 8.255 -0.445 17919 32111 1 79 . 1 1 11 11 LYS N N 11 121.600 121.600 120.392 1.208 17919 32112 1 79 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.228 0.133 17919 32113 1 79 . 1 1 11 11 LYS C C 11 175.940 175.940 175.526 0.414 17919 32114 1 79 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.233 0.047 17919 32115 1 79 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.179 0.021 17919 32116 1 79 . 1 1 11 11 LYS H H 11 7.280 7.280 8.144 -0.864 17919 32117 1 79 . 1 1 12 12 THR N N 12 120.440 120.440 121.387 -0.947 17919 32118 1 79 . 1 1 12 12 THR HA H 12 5.046 5.046 4.617 0.429 17919 32119 1 79 . 1 1 12 12 THR C C 12 174.320 174.320 174.787 -0.467 17919 32120 1 79 . 1 1 12 12 THR CA C 12 62.390 62.390 62.996 -0.606 17919 32121 1 79 . 1 1 12 12 THR CB C 12 69.910 69.910 69.020 0.890 17919 32122 1 79 . 1 1 12 12 THR H H 12 8.650 8.650 8.260 0.390 17919 32123 1 79 . 1 1 13 13 ILE N N 13 127.110 127.110 129.849 -2.739 17919 32124 1 79 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.257 0.287 17919 32125 1 79 . 1 1 13 13 ILE C C 13 175.220 175.220 175.354 -0.134 17919 32126 1 79 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.905 -0.925 17919 32127 1 79 . 1 1 13 13 ILE CB C 13 40.950 40.950 38.931 2.019 17919 32128 1 79 . 1 1 13 13 ILE H H 13 9.450 9.450 9.031 0.419 17919 32129 1 79 . 1 1 14 14 THR N N 14 121.520 121.520 123.788 -2.268 17919 32130 1 79 . 1 1 14 14 THR HA H 14 4.964 4.964 4.925 0.039 17919 32131 1 79 . 1 1 14 14 THR C C 14 173.790 173.790 174.518 -0.728 17919 32132 1 79 . 1 1 14 14 THR CA C 14 61.940 61.940 62.287 -0.347 17919 32133 1 79 . 1 1 14 14 THR CB C 14 69.650 69.650 69.504 0.146 17919 32134 1 79 . 1 1 14 14 THR H H 14 8.710 8.710 8.565 0.145 17919 32135 1 79 . 1 1 15 15 LEU N N 15 124.800 124.800 126.662 -1.862 17919 32136 1 79 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.638 0.142 17919 32137 1 79 . 1 1 15 15 LEU C C 15 174.670 174.670 175.690 -1.020 17919 32138 1 79 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.744 -0.914 17919 32139 1 79 . 1 1 15 15 LEU CB C 15 47.070 47.070 44.353 2.717 17919 32140 1 79 . 1 1 15 15 LEU H H 15 8.710 8.710 8.337 0.373 17919 32141 1 79 . 1 1 16 16 GLU N N 16 122.160 122.160 121.872 0.288 17919 32142 1 79 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.306 0.611 17919 32143 1 79 . 1 1 16 16 GLU C C 16 175.860 175.860 175.772 0.088 17919 32144 1 79 . 1 1 16 16 GLU CA C 16 54.820 54.820 56.361 -1.541 17919 32145 1 79 . 1 1 16 16 GLU CB C 16 29.450 29.450 29.603 -0.153 17919 32146 1 79 . 1 1 16 16 GLU H H 16 8.140 8.140 8.586 -0.446 17919 32147 1 79 . 1 1 17 17 VAL N N 17 117.210 117.210 121.224 -4.014 17919 32148 1 79 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.663 0.051 17919 32149 1 79 . 1 1 17 17 VAL C C 17 174.160 174.160 175.077 -0.917 17919 32150 1 79 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.599 -0.169 17919 32151 1 79 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.237 1.163 17919 32152 1 79 . 1 1 17 17 VAL H H 17 8.900 8.900 7.999 0.901 17919 32153 1 79 . 1 1 18 18 GLU N N 18 118.990 118.990 117.217 1.773 17919 32154 1 79 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.747 0.332 17919 32155 1 79 . 1 1 18 18 GLU C C 18 176.160 176.160 174.698 1.462 17919 32156 1 79 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.651 -0.931 17919 32157 1 79 . 1 1 18 18 GLU CB C 18 30.310 30.310 32.232 -1.922 17919 32158 1 79 . 1 1 18 18 GLU H H 18 8.640 8.640 8.116 0.524 17919 32159 1 79 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.372 -0.231 17919 32160 1 79 . 1 1 19 19 PRO C C 19 175.310 175.310 177.620 -2.310 17919 32161 1 79 . 1 1 19 19 PRO CA C 19 65.470 65.470 64.988 0.482 17919 32162 1 79 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.130 -0.180 17919 32163 1 79 . 1 1 20 20 SER N N 20 103.400 103.400 110.093 -6.693 17919 32164 1 79 . 1 1 20 20 SER HA H 20 4.370 4.370 4.398 -0.028 17919 32165 1 79 . 1 1 20 20 SER C C 20 174.660 174.660 174.215 0.445 17919 32166 1 79 . 1 1 20 20 SER CA C 20 57.400 57.400 58.143 -0.743 17919 32167 1 79 . 1 1 20 20 SER CB C 20 63.370 63.370 63.252 0.117 17919 32168 1 79 . 1 1 20 20 SER H H 20 7.040 7.040 7.885 -0.845 17919 32169 1 79 . 1 1 21 21 ASP N N 21 123.480 123.480 123.580 -0.100 17919 32170 1 79 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.623 0.072 17919 32171 1 79 . 1 1 21 21 ASP C C 21 176.360 176.360 175.713 0.647 17919 32172 1 79 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.487 0.213 17919 32173 1 79 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.728 -0.928 17919 32174 1 79 . 1 1 21 21 ASP H H 21 8.030 8.030 7.528 0.502 17919 32175 1 79 . 1 1 22 22 THR N N 22 108.800 108.800 113.941 -5.141 17919 32176 1 79 . 1 1 22 22 THR HA H 22 4.920 4.920 4.672 0.248 17919 32177 1 79 . 1 1 22 22 THR C C 22 176.750 176.750 176.004 0.746 17919 32178 1 79 . 1 1 22 22 THR CA C 22 59.690 59.690 61.864 -2.174 17919 32179 1 79 . 1 1 22 22 THR CB C 22 71.200 71.200 69.666 1.534 17919 32180 1 79 . 1 1 22 22 THR H H 22 7.900 7.900 8.337 -0.437 17919 32181 1 79 . 1 1 23 23 ILE N N 23 121.190 121.190 123.568 -2.378 17919 32182 1 79 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.777 -0.120 17919 32183 1 79 . 1 1 23 23 ILE C C 23 179.040 179.040 177.441 1.599 17919 32184 1 79 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.781 -0.521 17919 32185 1 79 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.690 -2.340 17919 32186 1 79 . 1 1 23 23 ILE H H 23 8.560 8.560 8.924 -0.364 17919 32187 1 79 . 1 1 24 24 GLU N N 24 120.830 120.830 120.925 -0.095 17919 32188 1 79 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.931 -0.014 17919 32189 1 79 . 1 1 24 24 GLU C C 24 178.640 178.640 178.299 0.341 17919 32190 1 79 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.706 0.514 17919 32191 1 79 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.464 -1.184 17919 32192 1 79 . 1 1 24 24 GLU H H 24 9.760 9.760 8.143 1.617 17919 32193 1 79 . 1 1 25 25 ASN N N 25 120.570 120.570 118.652 1.918 17919 32194 1 79 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.457 0.068 17919 32195 1 79 . 1 1 25 25 ASN C C 25 178.380 178.380 177.967 0.413 17919 32196 1 79 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.152 -0.092 17919 32197 1 79 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.236 0.214 17919 32198 1 79 . 1 1 25 25 ASN H H 25 7.920 7.920 7.735 0.185 17919 32199 1 79 . 1 1 26 26 VAL N N 26 121.710 121.710 119.043 2.667 17919 32200 1 79 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.618 -0.221 17919 32201 1 79 . 1 1 26 26 VAL C C 26 177.950 177.950 178.236 -0.286 17919 32202 1 79 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.419 1.241 17919 32203 1 79 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.056 -0.216 17919 32204 1 79 . 1 1 26 26 VAL H H 26 8.070 8.070 7.817 0.253 17919 32205 1 79 . 1 1 27 27 LYS N N 27 118.860 118.860 119.554 -0.694 17919 32206 1 79 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.132 0.448 17919 32207 1 79 . 1 1 27 27 LYS C C 27 180.550 180.550 179.134 1.416 17919 32208 1 79 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.636 -0.386 17919 32209 1 79 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.082 1.648 17919 32210 1 79 . 1 1 27 27 LYS H H 27 8.560 8.560 7.498 1.062 17919 32211 1 79 . 1 1 28 28 ALA N N 28 123.440 123.440 119.943 3.497 17919 32212 1 79 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.077 0.083 17919 32213 1 79 . 1 1 28 28 ALA C C 28 180.300 180.300 179.049 1.251 17919 32214 1 79 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.660 0.709 17919 32215 1 79 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.465 -0.755 17919 32216 1 79 . 1 1 28 28 ALA H H 28 8.060 8.060 8.255 -0.195 17919 32217 1 79 . 1 1 29 29 LYS N N 29 119.940 119.940 119.417 0.523 17919 32218 1 79 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.059 0.148 17919 32219 1 79 . 1 1 29 29 LYS C C 29 180.320 180.320 179.044 1.276 17919 32220 1 79 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.235 0.415 17919 32221 1 79 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.248 1.042 17919 32222 1 79 . 1 1 29 29 LYS H H 29 7.850 7.850 7.591 0.259 17919 32223 1 79 . 1 1 30 30 ILE N N 30 121.080 121.080 120.939 0.141 17919 32224 1 79 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.696 -0.189 17919 32225 1 79 . 1 1 30 30 ILE C C 30 178.310 178.310 177.087 1.223 17919 32226 1 79 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.393 0.757 17919 32227 1 79 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.547 -0.748 17919 32228 1 79 . 1 1 30 30 ILE H H 30 8.280 8.280 7.748 0.532 17919 32229 1 79 . 1 1 31 31 GLN N N 31 123.490 123.490 120.999 2.491 17919 32230 1 79 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.024 -0.195 17919 32231 1 79 . 1 1 31 31 GLN C C 31 178.890 178.890 178.446 0.444 17919 32232 1 79 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.407 0.593 17919 32233 1 79 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.292 -0.572 17919 32234 1 79 . 1 1 31 31 GLN H H 31 8.580 8.580 8.077 0.503 17919 32235 1 79 . 1 1 32 32 ASP N N 32 119.360 119.360 119.610 -0.250 17919 32236 1 79 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.364 -0.010 17919 32237 1 79 . 1 1 32 32 ASP C C 32 177.250 177.250 177.923 -0.673 17919 32238 1 79 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.859 0.331 17919 32239 1 79 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.865 -0.285 17919 32240 1 79 . 1 1 32 32 ASP H H 32 8.010 8.010 7.800 0.210 17919 32241 1 79 . 1 1 33 33 LYS N N 33 115.130 115.130 116.906 -1.776 17919 32242 1 79 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.381 -0.044 17919 32243 1 79 . 1 1 33 33 LYS C C 33 177.870 177.870 178.307 -0.437 17919 32244 1 79 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.323 -0.273 17919 32245 1 79 . 1 1 33 33 LYS CB C 33 34.170 34.170 34.008 0.162 17919 32246 1 79 . 1 1 33 33 LYS H H 33 7.430 7.430 7.790 -0.360 17919 32247 1 79 . 1 1 34 34 GLU N N 34 113.870 113.870 115.717 -1.847 17919 32248 1 79 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.381 0.244 17919 32249 1 79 . 1 1 34 34 GLU C C 34 177.840 177.840 177.520 0.320 17919 32250 1 79 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.525 -1.355 17919 32251 1 79 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.081 1.579 17919 32252 1 79 . 1 1 34 34 GLU H H 34 8.740 8.740 8.085 0.655 17919 32253 1 79 . 1 1 35 35 GLY N N 35 108.650 108.650 108.636 0.014 17919 32254 1 79 . 1 1 35 35 GLY C C 35 173.960 173.960 174.316 -0.356 17919 32255 1 79 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.846 0.234 17919 32256 1 79 . 1 1 35 35 GLY H H 35 8.530 8.530 8.218 0.312 17919 32257 1 79 . 1 1 36 36 ILE N N 36 119.880 119.880 121.564 -1.684 17919 32258 1 79 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.433 0.012 17919 32259 1 79 . 1 1 36 36 ILE C C 36 173.590 173.590 174.240 -0.650 17919 32260 1 79 . 1 1 36 36 ILE CA C 36 57.750 57.750 56.386 1.365 17919 32261 1 79 . 1 1 36 36 ILE CB C 36 40.580 40.580 37.150 3.430 17919 32262 1 79 . 1 1 36 36 ILE H H 36 6.150 6.150 7.612 -1.462 17919 32263 1 79 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.586 0.048 17919 32264 1 79 . 1 1 37 37 PRO C C 37 176.940 176.940 175.869 1.071 17919 32265 1 79 . 1 1 37 37 PRO CA C 37 61.660 61.660 62.301 -0.641 17919 32266 1 79 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.496 0.354 17919 32267 1 79 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.244 -0.127 17919 32268 1 79 . 1 1 38 38 PRO C C 38 178.320 178.320 178.477 -0.157 17919 32269 1 79 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.659 0.601 17919 32270 1 79 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.951 0.939 17919 32271 1 79 . 1 1 39 39 ASP N N 39 113.380 113.380 115.226 -1.846 17919 32272 1 79 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.421 0.009 17919 32273 1 79 . 1 1 39 39 ASP C C 39 177.090 177.090 177.853 -0.763 17919 32274 1 79 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.691 -1.051 17919 32275 1 79 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.571 -1.030 17919 32276 1 79 . 1 1 39 39 ASP H H 39 8.550 8.550 8.820 -0.270 17919 32277 1 79 . 1 1 40 40 GLN N N 40 116.780 116.780 117.924 -1.144 17919 32278 1 79 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.301 0.163 17919 32279 1 79 . 1 1 40 40 GLN C C 40 175.380 175.380 176.492 -1.112 17919 32280 1 79 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.371 -0.731 17919 32281 1 79 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.682 0.458 17919 32282 1 79 . 1 1 40 40 GLN H H 40 7.820 7.820 7.496 0.324 17919 32283 1 79 . 1 1 41 41 GLN N N 41 117.720 117.720 119.524 -1.804 17919 32284 1 79 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.235 0.009 17919 32285 1 79 . 1 1 41 41 GLN C C 41 176.300 176.300 175.859 0.441 17919 32286 1 79 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.815 -0.345 17919 32287 1 79 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.202 2.448 17919 32288 1 79 . 1 1 41 41 GLN H H 41 7.480 7.480 7.417 0.063 17919 32289 1 79 . 1 1 42 42 ARG N N 42 122.680 122.680 124.852 -2.172 17919 32290 1 79 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.574 -0.074 17919 32291 1 79 . 1 1 42 42 ARG C C 42 174.050 174.050 174.537 -0.487 17919 32292 1 79 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.494 0.556 17919 32293 1 79 . 1 1 42 42 ARG CB C 42 31.750 31.750 30.969 0.781 17919 32294 1 79 . 1 1 42 42 ARG H H 42 8.530 8.530 8.528 0.002 17919 32295 1 79 . 1 1 43 43 LEU N N 43 124.040 124.040 127.115 -3.075 17919 32296 1 79 . 1 1 43 43 LEU C C 43 175.290 175.290 175.678 -0.388 17919 32297 1 79 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.860 -0.880 17919 32298 1 79 . 1 1 43 43 LEU CB C 43 45.790 45.790 42.836 2.954 17919 32299 1 79 . 1 1 43 43 LEU H H 43 8.820 8.820 8.792 0.028 17919 32300 1 79 . 1 1 44 44 ILE N N 44 121.920 121.920 126.318 -4.398 17919 32301 1 79 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.042 -0.050 17919 32302 1 79 . 1 1 44 44 ILE C C 44 176.060 176.060 174.979 1.081 17919 32303 1 79 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.205 -0.224 17919 32304 1 79 . 1 1 44 44 ILE CB C 44 41.420 41.420 39.723 1.697 17919 32305 1 79 . 1 1 44 44 ILE H H 44 9.030 9.030 7.906 1.124 17919 32306 1 79 . 1 1 45 45 PHE N N 45 125.390 125.390 126.531 -1.141 17919 32307 1 79 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.967 0.078 17919 32308 1 79 . 1 1 45 45 PHE C C 45 174.470 174.470 174.225 0.245 17919 32309 1 79 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.903 0.117 17919 32310 1 79 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.050 0.710 17919 32311 1 79 . 1 1 45 45 PHE H H 45 8.830 8.830 8.906 -0.076 17919 32312 1 79 . 1 1 46 46 ALA N N 46 132.200 132.200 126.838 5.362 17919 32313 1 79 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.525 0.165 17919 32314 1 79 . 1 1 46 46 ALA C C 46 177.290 177.290 178.093 -0.803 17919 32315 1 79 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.955 -0.414 17919 32316 1 79 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.680 -0.111 17919 32317 1 79 . 1 1 46 46 ALA H H 46 8.810 8.810 8.580 0.230 17919 32318 1 79 . 1 1 47 47 GLY N N 47 102.340 102.340 102.039 0.301 17919 32319 1 79 . 1 1 47 47 GLY C C 47 173.810 173.810 174.345 -0.535 17919 32320 1 79 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.695 0.655 17919 32321 1 79 . 1 1 47 47 GLY H H 47 8.130 8.130 8.325 -0.195 17919 32322 1 79 . 1 1 48 48 LYS N N 48 121.570 121.570 121.388 0.182 17919 32323 1 79 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.588 0.034 17919 32324 1 79 . 1 1 48 48 LYS C C 48 174.700 174.700 175.275 -0.575 17919 32325 1 79 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.614 -0.064 17919 32326 1 79 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.365 0.165 17919 32327 1 79 . 1 1 48 48 LYS H H 48 7.980 7.980 8.010 -0.030 17919 32328 1 79 . 1 1 49 49 GLN N N 49 122.410 122.410 125.254 -2.844 17919 32329 1 79 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.636 -0.076 17919 32330 1 79 . 1 1 49 49 GLN C C 49 175.670 175.670 175.538 0.132 17919 32331 1 79 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.935 -0.195 17919 32332 1 79 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.178 -0.178 17919 32333 1 79 . 1 1 49 49 GLN H H 49 8.600 8.600 8.627 -0.027 17919 32334 1 79 . 1 1 50 50 LEU N N 50 125.520 125.520 129.139 -3.619 17919 32335 1 79 . 1 1 50 50 LEU HA H 50 4.090 4.090 3.957 0.133 17919 32336 1 79 . 1 1 50 50 LEU C C 50 176.660 176.660 177.094 -0.434 17919 32337 1 79 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.818 -0.578 17919 32338 1 79 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.531 0.040 17919 32339 1 79 . 1 1 50 50 LEU H H 50 8.530 8.530 8.249 0.281 17919 32340 1 79 . 1 1 51 51 GLU N N 51 122.940 122.940 124.681 -1.741 17919 32341 1 79 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.433 0.055 17919 32342 1 79 . 1 1 51 51 GLU C C 51 175.870 175.870 176.948 -1.078 17919 32343 1 79 . 1 1 51 51 GLU CA C 51 55.960 55.960 56.438 -0.478 17919 32344 1 79 . 1 1 51 51 GLU CB C 51 31.570 31.570 30.686 0.884 17919 32345 1 79 . 1 1 51 51 GLU H H 51 8.400 8.400 8.801 -0.401 17919 32346 1 79 . 1 1 52 52 ASP N N 52 120.030 120.030 122.968 -2.938 17919 32347 1 79 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.447 -0.088 17919 32348 1 79 . 1 1 52 52 ASP C C 52 177.330 177.330 177.125 0.205 17919 32349 1 79 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.382 -0.422 17919 32350 1 79 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.804 0.046 17919 32351 1 79 . 1 1 52 52 ASP H H 52 8.160 8.160 8.721 -0.561 17919 32352 1 79 . 1 1 53 53 GLY N N 53 106.660 106.660 103.963 2.697 17919 32353 1 79 . 1 1 53 53 GLY C C 53 174.870 174.870 175.003 -0.133 17919 32354 1 79 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.425 0.745 17919 32355 1 79 . 1 1 53 53 GLY H H 53 9.390 9.390 8.325 1.065 17919 32356 1 79 . 1 1 54 54 ARG N N 54 119.050 119.050 120.949 -1.899 17919 32357 1 79 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.177 0.518 17919 32358 1 79 . 1 1 54 54 ARG C C 54 175.350 175.350 176.236 -0.886 17919 32359 1 79 . 1 1 54 54 ARG CA C 54 54.390 54.390 55.965 -1.575 17919 32360 1 79 . 1 1 54 54 ARG CB C 54 32.650 32.650 30.352 2.297 17919 32361 1 79 . 1 1 54 54 ARG H H 54 7.460 7.460 7.608 -0.148 17919 32362 1 79 . 1 1 55 55 THR N N 55 108.400 108.400 111.319 -2.919 17919 32363 1 79 . 1 1 55 55 THR HA H 55 5.240 5.240 5.015 0.225 17919 32364 1 79 . 1 1 55 55 THR C C 55 176.560 176.560 176.872 -0.312 17919 32365 1 79 . 1 1 55 55 THR CA C 55 59.690 59.690 59.718 -0.028 17919 32366 1 79 . 1 1 55 55 THR CB C 55 72.260 72.260 71.538 0.722 17919 32367 1 79 . 1 1 55 55 THR H H 55 8.730 8.730 8.748 -0.018 17919 32368 1 79 . 1 1 56 56 LEU N N 56 117.920 117.920 121.470 -3.550 17919 32369 1 79 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.001 0.059 17919 32370 1 79 . 1 1 56 56 LEU C C 56 180.810 180.810 178.594 2.216 17919 32371 1 79 . 1 1 56 56 LEU CA C 56 58.710 58.710 57.933 0.777 17919 32372 1 79 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.351 -0.981 17919 32373 1 79 . 1 1 56 56 LEU H H 56 8.140 8.140 8.409 -0.269 17919 32374 1 79 . 1 1 57 57 SER N N 57 113.330 113.330 115.317 -1.987 17919 32375 1 79 . 1 1 57 57 SER HA H 57 4.370 4.370 4.130 0.240 17919 32376 1 79 . 1 1 57 57 SER C C 57 178.310 178.310 176.707 1.603 17919 32377 1 79 . 1 1 57 57 SER CA C 57 61.080 61.080 62.274 -1.194 17919 32378 1 79 . 1 1 57 57 SER CB C 57 62.530 62.530 62.550 -0.021 17919 32379 1 79 . 1 1 57 57 SER H H 57 8.470 8.470 8.080 0.390 17919 32380 1 79 . 1 1 58 58 ASP N N 58 124.190 124.190 121.835 2.355 17919 32381 1 79 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.373 -0.077 17919 32382 1 79 . 1 1 58 58 ASP C C 58 177.400 177.400 177.187 0.213 17919 32383 1 79 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.663 0.517 17919 32384 1 79 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.544 -0.444 17919 32385 1 79 . 1 1 58 58 ASP H H 58 7.930 7.930 7.803 0.127 17919 32386 1 79 . 1 1 59 59 TYR N N 59 115.510 115.510 115.088 0.422 17919 32387 1 79 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.732 -0.062 17919 32388 1 79 . 1 1 59 59 TYR C C 59 174.700 174.700 175.303 -0.603 17919 32389 1 79 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.059 1.190 17919 32390 1 79 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.321 1.749 17919 32391 1 79 . 1 1 59 59 TYR H H 59 7.250 7.250 7.490 -0.240 17919 32392 1 79 . 1 1 60 60 ASN N N 60 115.900 115.900 118.540 -2.640 17919 32393 1 79 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.408 -0.053 17919 32394 1 79 . 1 1 60 60 ASN C C 60 174.340 174.340 174.486 -0.146 17919 32395 1 79 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.078 0.042 17919 32396 1 79 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.749 -0.339 17919 32397 1 79 . 1 1 60 60 ASN H H 60 8.150 8.150 7.770 0.380 17919 32398 1 79 . 1 1 61 61 ILE N N 61 118.600 118.600 120.583 -1.983 17919 32399 1 79 . 1 1 61 61 ILE HA H 61 3.393 3.393 4.006 -0.613 17919 32400 1 79 . 1 1 61 61 ILE C C 61 174.610 174.610 174.369 0.241 17919 32401 1 79 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.336 1.084 17919 32402 1 79 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.221 -0.481 17919 32403 1 79 . 1 1 61 61 ILE H H 61 7.250 7.250 8.156 -0.906 17919 32404 1 79 . 1 1 62 62 GLN N N 62 124.740 124.740 126.257 -1.517 17919 32405 1 79 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.690 -0.184 17919 32406 1 79 . 1 1 62 62 GLN C C 62 175.970 175.970 175.353 0.617 17919 32407 1 79 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.419 0.241 17919 32408 1 79 . 1 1 62 62 GLN CB C 62 31.650 31.650 30.781 0.869 17919 32409 1 79 . 1 1 62 62 GLN H H 62 7.610 7.610 8.114 -0.504 17919 32410 1 79 . 1 1 63 63 LYS N N 63 120.300 120.300 119.444 0.856 17919 32411 1 79 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.881 0.120 17919 32412 1 79 . 1 1 63 63 LYS C C 63 175.810 175.810 176.624 -0.814 17919 32413 1 79 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.312 -0.522 17919 32414 1 79 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.033 0.617 17919 32415 1 79 . 1 1 63 63 LYS H H 63 8.490 8.490 8.477 0.013 17919 32416 1 79 . 1 1 64 64 GLU N N 64 113.950 113.950 118.939 -4.989 17919 32417 1 79 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.478 -0.013 17919 32418 1 79 . 1 1 64 64 GLU C C 64 175.250 175.250 176.284 -1.034 17919 32419 1 79 . 1 1 64 64 GLU CA C 64 57.890 57.890 58.096 -0.206 17919 32420 1 79 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.814 -2.914 17919 32421 1 79 . 1 1 64 64 GLU H H 64 9.280 9.280 8.853 0.427 17919 32422 1 79 . 1 1 65 65 SER N N 65 114.730 114.730 115.071 -0.341 17919 32423 1 79 . 1 1 65 65 SER HA H 65 4.640 4.640 4.323 0.317 17919 32424 1 79 . 1 1 65 65 SER C C 65 172.160 172.160 173.873 -1.713 17919 32425 1 79 . 1 1 65 65 SER CA C 65 60.890 60.890 60.651 0.239 17919 32426 1 79 . 1 1 65 65 SER CB C 65 64.910 64.910 63.633 1.278 17919 32427 1 79 . 1 1 65 65 SER H H 65 7.670 7.670 7.429 0.240 17919 32428 1 79 . 1 1 66 66 THR N N 66 117.110 117.110 120.615 -3.505 17919 32429 1 79 . 1 1 66 66 THR HA H 66 5.270 5.270 4.894 0.376 17919 32430 1 79 . 1 1 66 66 THR C C 66 173.950 173.950 174.215 -0.265 17919 32431 1 79 . 1 1 66 66 THR CA C 66 62.340 62.340 62.269 0.071 17919 32432 1 79 . 1 1 66 66 THR CB C 66 70.080 70.080 69.355 0.725 17919 32433 1 79 . 1 1 66 66 THR H H 66 8.730 8.730 8.382 0.348 17919 32434 1 79 . 1 1 67 67 LEU N N 67 127.110 127.110 127.318 -0.208 17919 32435 1 79 . 1 1 67 67 LEU HA H 67 5.060 5.060 5.113 -0.053 17919 32436 1 79 . 1 1 67 67 LEU C C 67 175.770 175.770 175.716 0.054 17919 32437 1 79 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.493 0.407 17919 32438 1 79 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.540 -0.280 17919 32439 1 79 . 1 1 67 67 LEU H H 67 9.410 9.410 8.778 0.632 17919 32440 1 79 . 1 1 68 68 HIS N N 68 118.380 118.380 115.492 2.888 17919 32441 1 79 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.597 -0.357 17919 32442 1 79 . 1 1 68 68 HIS C C 68 173.150 173.150 174.249 -1.099 17919 32443 1 79 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.814 0.186 17919 32444 1 79 . 1 1 68 68 HIS CB C 68 30.530 30.530 34.187 -3.657 17919 32445 1 79 . 1 1 68 68 HIS H H 68 9.230 9.230 8.782 0.448 17919 32446 1 79 . 1 1 69 69 LEU N N 69 124.460 124.460 120.438 4.022 17919 32447 1 79 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.195 -0.005 17919 32448 1 79 . 1 1 69 69 LEU C C 69 175.270 175.270 174.738 0.532 17919 32449 1 79 . 1 1 69 69 LEU CA C 69 53.890 53.890 55.011 -1.121 17919 32450 1 79 . 1 1 69 69 LEU CB C 69 44.380 44.380 45.097 -0.717 17919 32451 1 79 . 1 1 69 69 LEU H H 69 8.340 8.340 8.203 0.137 17919 32452 1 79 . 1 1 70 70 VAL N N 70 126.940 126.940 124.429 2.511 17919 32453 1 79 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.525 -0.175 17919 32454 1 79 . 1 1 70 70 VAL C C 70 174.000 174.000 174.133 -0.133 17919 32455 1 79 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.634 0.166 17919 32456 1 79 . 1 1 70 70 VAL CB C 70 34.910 34.910 36.197 -1.286 17919 32457 1 79 . 1 1 70 70 VAL H H 70 9.200 9.200 8.698 0.502 17919 32458 1 79 . 1 1 71 71 LEU N N 71 123.130 123.130 120.847 2.283 17919 32459 1 79 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.173 -0.113 17919 32460 1 79 . 1 1 71 71 LEU C C 71 177.830 177.830 176.757 1.073 17919 32461 1 79 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.066 0.874 17919 32462 1 79 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.673 -0.823 17919 32463 1 79 . 1 1 71 71 LEU H H 71 8.120 8.120 8.152 -0.032 17919 32464 1 79 . 1 1 72 72 ARG N N 72 123.490 123.490 121.388 2.102 17919 32465 1 79 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.564 -0.263 17919 32466 1 79 . 1 1 72 72 ARG C C 72 175.350 175.350 175.159 0.191 17919 32467 1 79 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.736 -0.126 17919 32468 1 79 . 1 1 72 72 ARG CB C 72 31.350 31.350 31.742 -0.392 17919 32469 1 79 . 1 1 72 72 ARG H H 72 8.580 8.580 8.192 0.388 17919 32470 1 80 . 1 1 2 2 GLN N N 2 123.220 123.220 121.643 1.577 17919 32471 1 80 . 1 1 2 2 GLN HA H 2 5.249 5.249 4.984 0.265 17919 32472 1 80 . 1 1 2 2 GLN C C 2 175.920 175.920 174.549 1.371 17919 32473 1 80 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.149 0.931 17919 32474 1 80 . 1 1 2 2 GLN CB C 2 30.760 30.760 28.840 1.920 17919 32475 1 80 . 1 1 2 2 GLN H H 2 8.900 8.900 8.340 0.560 17919 32476 1 80 . 1 1 3 3 ILE N N 3 115.340 115.340 117.916 -2.576 17919 32477 1 80 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.430 -0.217 17919 32478 1 80 . 1 1 3 3 ILE C C 3 172.450 172.450 173.709 -1.259 17919 32479 1 80 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.706 -0.136 17919 32480 1 80 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.547 0.663 17919 32481 1 80 . 1 1 3 3 ILE H H 3 8.320 8.320 7.866 0.454 17919 32482 1 80 . 1 1 4 4 PHE N N 4 118.110 118.110 121.481 -3.371 17919 32483 1 80 . 1 1 4 4 PHE HA H 4 5.630 5.630 4.845 0.785 17919 32484 1 80 . 1 1 4 4 PHE C C 4 175.320 175.320 175.703 -0.383 17919 32485 1 80 . 1 1 4 4 PHE CA C 4 55.210 55.210 56.777 -1.567 17919 32486 1 80 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.133 0.347 17919 32487 1 80 . 1 1 4 4 PHE H H 4 8.610 8.610 8.306 0.304 17919 32488 1 80 . 1 1 5 5 VAL N N 5 121.000 121.000 122.954 -1.954 17919 32489 1 80 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.853 -0.128 17919 32490 1 80 . 1 1 5 5 VAL C C 5 174.870 174.870 174.705 0.165 17919 32491 1 80 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.425 -0.805 17919 32492 1 80 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.524 0.706 17919 32493 1 80 . 1 1 5 5 VAL H H 5 9.300 9.300 9.020 0.280 17919 32494 1 80 . 1 1 6 6 LYS N N 6 127.520 127.520 129.077 -1.557 17919 32495 1 80 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.375 -0.008 17919 32496 1 80 . 1 1 6 6 LYS C C 6 177.140 177.140 176.531 0.609 17919 32497 1 80 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.181 0.339 17919 32498 1 80 . 1 1 6 6 LYS CB C 6 35.050 35.050 36.191 -1.141 17919 32499 1 80 . 1 1 6 6 LYS H H 6 8.820 8.820 9.300 -0.480 17919 32500 1 80 . 1 1 7 7 THR N N 7 115.400 115.400 118.534 -3.134 17919 32501 1 80 . 1 1 7 7 THR HA H 7 4.970 4.970 4.289 0.681 17919 32502 1 80 . 1 1 7 7 THR C C 7 176.910 176.910 175.200 1.710 17919 32503 1 80 . 1 1 7 7 THR CA C 7 60.470 60.470 61.900 -1.430 17919 32504 1 80 . 1 1 7 7 THR CB C 7 70.630 70.630 69.716 0.914 17919 32505 1 80 . 1 1 7 7 THR H H 7 8.730 8.730 8.732 -0.002 17919 32506 1 80 . 1 1 8 8 LEU N N 8 121.330 121.330 119.666 1.664 17919 32507 1 80 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.255 0.055 17919 32508 1 80 . 1 1 8 8 LEU C C 8 178.800 178.800 178.235 0.565 17919 32509 1 80 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.682 -0.102 17919 32510 1 80 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.986 -0.015 17919 32511 1 80 . 1 1 8 8 LEU H H 8 9.100 9.100 8.598 0.502 17919 32512 1 80 . 1 1 9 9 THR N N 9 105.590 105.590 108.235 -2.645 17919 32513 1 80 . 1 1 9 9 THR HA H 9 4.428 4.428 4.308 0.120 17919 32514 1 80 . 1 1 9 9 THR C C 9 175.520 175.520 175.316 0.204 17919 32515 1 80 . 1 1 9 9 THR CA C 9 61.400 61.400 62.532 -1.131 17919 32516 1 80 . 1 1 9 9 THR CB C 9 69.140 69.140 69.070 0.070 17919 32517 1 80 . 1 1 9 9 THR H H 9 7.630 7.630 7.873 -0.243 17919 32518 1 80 . 1 1 10 10 GLY N N 10 108.890 108.890 110.014 -1.124 17919 32519 1 80 . 1 1 10 10 GLY C C 10 174.070 174.070 173.438 0.632 17919 32520 1 80 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.557 0.903 17919 32521 1 80 . 1 1 10 10 GLY H H 10 7.810 7.810 7.889 -0.079 17919 32522 1 80 . 1 1 11 11 LYS N N 11 121.600 121.600 122.019 -0.419 17919 32523 1 80 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.715 -0.354 17919 32524 1 80 . 1 1 11 11 LYS C C 11 175.940 175.940 175.220 0.720 17919 32525 1 80 . 1 1 11 11 LYS CA C 11 56.280 56.280 54.689 1.591 17919 32526 1 80 . 1 1 11 11 LYS CB C 11 33.200 33.200 34.810 -1.610 17919 32527 1 80 . 1 1 11 11 LYS H H 11 7.280 7.280 8.293 -1.013 17919 32528 1 80 . 1 1 12 12 THR N N 12 120.440 120.440 118.972 1.468 17919 32529 1 80 . 1 1 12 12 THR HA H 12 5.046 5.046 5.148 -0.102 17919 32530 1 80 . 1 1 12 12 THR C C 12 174.320 174.320 174.252 0.068 17919 32531 1 80 . 1 1 12 12 THR CA C 12 62.390 62.390 61.557 0.833 17919 32532 1 80 . 1 1 12 12 THR CB C 12 69.910 69.910 70.163 -0.253 17919 32533 1 80 . 1 1 12 12 THR H H 12 8.650 8.650 8.401 0.249 17919 32534 1 80 . 1 1 13 13 ILE N N 13 127.110 127.110 124.744 2.366 17919 32535 1 80 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.597 -0.053 17919 32536 1 80 . 1 1 13 13 ILE C C 13 175.220 175.220 174.681 0.539 17919 32537 1 80 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.148 -0.168 17919 32538 1 80 . 1 1 13 13 ILE CB C 13 40.950 40.950 42.271 -1.321 17919 32539 1 80 . 1 1 13 13 ILE H H 13 9.450 9.450 9.216 0.234 17919 32540 1 80 . 1 1 14 14 THR N N 14 121.520 121.520 123.469 -1.949 17919 32541 1 80 . 1 1 14 14 THR HA H 14 4.964 4.964 4.450 0.514 17919 32542 1 80 . 1 1 14 14 THR C C 14 173.790 173.790 174.005 -0.215 17919 32543 1 80 . 1 1 14 14 THR CA C 14 61.940 61.940 62.267 -0.328 17919 32544 1 80 . 1 1 14 14 THR CB C 14 69.650 69.650 69.243 0.408 17919 32545 1 80 . 1 1 14 14 THR H H 14 8.710 8.710 8.480 0.230 17919 32546 1 80 . 1 1 15 15 LEU N N 15 124.800 124.800 127.466 -2.666 17919 32547 1 80 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.657 0.123 17919 32548 1 80 . 1 1 15 15 LEU C C 15 174.670 174.670 175.512 -0.842 17919 32549 1 80 . 1 1 15 15 LEU CA C 15 52.830 52.830 54.034 -1.204 17919 32550 1 80 . 1 1 15 15 LEU CB C 15 47.070 47.070 44.484 2.586 17919 32551 1 80 . 1 1 15 15 LEU H H 15 8.710 8.710 8.118 0.592 17919 32552 1 80 . 1 1 16 16 GLU N N 16 122.160 122.160 121.915 0.245 17919 32553 1 80 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.840 0.077 17919 32554 1 80 . 1 1 16 16 GLU C C 16 175.860 175.860 176.252 -0.392 17919 32555 1 80 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.155 -0.335 17919 32556 1 80 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.953 -1.503 17919 32557 1 80 . 1 1 16 16 GLU H H 16 8.140 8.140 8.466 -0.326 17919 32558 1 80 . 1 1 17 17 VAL N N 17 117.210 117.210 119.638 -2.428 17919 32559 1 80 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.825 -0.111 17919 32560 1 80 . 1 1 17 17 VAL C C 17 174.160 174.160 175.082 -0.922 17919 32561 1 80 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.072 -0.642 17919 32562 1 80 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.261 1.139 17919 32563 1 80 . 1 1 17 17 VAL H H 17 8.900 8.900 8.862 0.038 17919 32564 1 80 . 1 1 18 18 GLU N N 18 118.990 118.990 120.805 -1.815 17919 32565 1 80 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.982 0.097 17919 32566 1 80 . 1 1 18 18 GLU C C 18 176.160 176.160 175.378 0.782 17919 32567 1 80 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.867 -0.147 17919 32568 1 80 . 1 1 18 18 GLU CB C 18 30.310 30.310 32.802 -2.492 17919 32569 1 80 . 1 1 18 18 GLU H H 18 8.640 8.640 9.208 -0.568 17919 32570 1 80 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.208 -0.067 17919 32571 1 80 . 1 1 19 19 PRO C C 19 175.310 175.310 176.947 -1.637 17919 32572 1 80 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.407 0.063 17919 32573 1 80 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.950 -0.000 17919 32574 1 80 . 1 1 20 20 SER N N 20 103.400 103.400 107.702 -4.302 17919 32575 1 80 . 1 1 20 20 SER HA H 20 4.370 4.370 4.336 0.034 17919 32576 1 80 . 1 1 20 20 SER C C 20 174.660 174.660 174.347 0.313 17919 32577 1 80 . 1 1 20 20 SER CA C 20 57.400 57.400 57.980 -0.580 17919 32578 1 80 . 1 1 20 20 SER CB C 20 63.370 63.370 62.745 0.625 17919 32579 1 80 . 1 1 20 20 SER H H 20 7.040 7.040 8.112 -1.072 17919 32580 1 80 . 1 1 21 21 ASP N N 21 123.480 123.480 124.535 -1.055 17919 32581 1 80 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.475 0.220 17919 32582 1 80 . 1 1 21 21 ASP C C 21 176.360 176.360 176.176 0.184 17919 32583 1 80 . 1 1 21 21 ASP CA C 21 55.700 55.700 56.402 -0.702 17919 32584 1 80 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.773 -0.973 17919 32585 1 80 . 1 1 21 21 ASP H H 21 8.030 8.030 7.922 0.108 17919 32586 1 80 . 1 1 22 22 THR N N 22 108.800 108.800 112.504 -3.704 17919 32587 1 80 . 1 1 22 22 THR HA H 22 4.920 4.920 4.708 0.212 17919 32588 1 80 . 1 1 22 22 THR C C 22 176.750 176.750 176.567 0.183 17919 32589 1 80 . 1 1 22 22 THR CA C 22 59.690 59.690 60.510 -0.820 17919 32590 1 80 . 1 1 22 22 THR CB C 22 71.200 71.200 70.955 0.245 17919 32591 1 80 . 1 1 22 22 THR H H 22 7.900 7.900 8.905 -1.005 17919 32592 1 80 . 1 1 23 23 ILE N N 23 121.190 121.190 122.327 -1.137 17919 32593 1 80 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.689 -0.032 17919 32594 1 80 . 1 1 23 23 ILE C C 23 179.040 179.040 177.919 1.121 17919 32595 1 80 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.707 -1.447 17919 32596 1 80 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.433 -2.083 17919 32597 1 80 . 1 1 23 23 ILE H H 23 8.560 8.560 9.240 -0.680 17919 32598 1 80 . 1 1 24 24 GLU N N 24 120.830 120.830 119.668 1.162 17919 32599 1 80 . 1 1 24 24 GLU HA H 24 3.917 3.917 4.075 -0.158 17919 32600 1 80 . 1 1 24 24 GLU C C 24 178.640 178.640 178.690 -0.050 17919 32601 1 80 . 1 1 24 24 GLU CA C 24 60.220 60.220 58.847 1.373 17919 32602 1 80 . 1 1 24 24 GLU CB C 24 28.280 28.280 28.977 -0.697 17919 32603 1 80 . 1 1 24 24 GLU H H 24 9.760 9.760 8.073 1.687 17919 32604 1 80 . 1 1 25 25 ASN N N 25 120.570 120.570 118.497 2.073 17919 32605 1 80 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.526 -0.001 17919 32606 1 80 . 1 1 25 25 ASN C C 25 178.380 178.380 177.540 0.840 17919 32607 1 80 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.172 -0.112 17919 32608 1 80 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.553 -0.103 17919 32609 1 80 . 1 1 25 25 ASN H H 25 7.920 7.920 7.846 0.074 17919 32610 1 80 . 1 1 26 26 VAL N N 26 121.710 121.710 120.022 1.688 17919 32611 1 80 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.586 -0.189 17919 32612 1 80 . 1 1 26 26 VAL C C 26 177.950 177.950 177.266 0.684 17919 32613 1 80 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.511 1.149 17919 32614 1 80 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.554 -0.714 17919 32615 1 80 . 1 1 26 26 VAL H H 26 8.070 8.070 7.866 0.204 17919 32616 1 80 . 1 1 27 27 LYS N N 27 118.860 118.860 120.113 -1.253 17919 32617 1 80 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.194 0.386 17919 32618 1 80 . 1 1 27 27 LYS C C 27 180.550 180.550 178.953 1.597 17919 32619 1 80 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.595 -0.345 17919 32620 1 80 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.288 1.442 17919 32621 1 80 . 1 1 27 27 LYS H H 27 8.560 8.560 8.425 0.135 17919 32622 1 80 . 1 1 28 28 ALA N N 28 123.440 123.440 118.731 4.709 17919 32623 1 80 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.159 0.001 17919 32624 1 80 . 1 1 28 28 ALA C C 28 180.300 180.300 178.690 1.610 17919 32625 1 80 . 1 1 28 28 ALA CA C 28 55.370 55.370 53.922 1.448 17919 32626 1 80 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.225 -0.515 17919 32627 1 80 . 1 1 28 28 ALA H H 28 8.060 8.060 8.285 -0.225 17919 32628 1 80 . 1 1 29 29 LYS N N 29 119.940 119.940 119.838 0.102 17919 32629 1 80 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.112 0.095 17919 32630 1 80 . 1 1 29 29 LYS C C 29 180.320 180.320 178.537 1.783 17919 32631 1 80 . 1 1 29 29 LYS CA C 29 59.650 59.650 58.974 0.676 17919 32632 1 80 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.565 0.725 17919 32633 1 80 . 1 1 29 29 LYS H H 29 7.850 7.850 7.442 0.407 17919 32634 1 80 . 1 1 30 30 ILE N N 30 121.080 121.080 120.893 0.187 17919 32635 1 80 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.505 0.002 17919 32636 1 80 . 1 1 30 30 ILE C C 30 178.310 178.310 177.677 0.633 17919 32637 1 80 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.653 0.498 17919 32638 1 80 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.240 -0.440 17919 32639 1 80 . 1 1 30 30 ILE H H 30 8.280 8.280 7.820 0.460 17919 32640 1 80 . 1 1 31 31 GLN N N 31 123.490 123.490 119.079 4.411 17919 32641 1 80 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.962 -0.133 17919 32642 1 80 . 1 1 31 31 GLN C C 31 178.890 178.890 177.577 1.313 17919 32643 1 80 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.410 0.590 17919 32644 1 80 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.466 -0.746 17919 32645 1 80 . 1 1 31 31 GLN H H 31 8.580 8.580 8.270 0.310 17919 32646 1 80 . 1 1 32 32 ASP N N 32 119.360 119.360 118.554 0.806 17919 32647 1 80 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.416 -0.062 17919 32648 1 80 . 1 1 32 32 ASP C C 32 177.250 177.250 178.242 -0.992 17919 32649 1 80 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.413 0.777 17919 32650 1 80 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.814 -0.234 17919 32651 1 80 . 1 1 32 32 ASP H H 32 8.010 8.010 7.871 0.139 17919 32652 1 80 . 1 1 33 33 LYS N N 33 115.130 115.130 117.204 -2.074 17919 32653 1 80 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.308 0.029 17919 32654 1 80 . 1 1 33 33 LYS C C 33 177.870 177.870 177.453 0.417 17919 32655 1 80 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.673 0.377 17919 32656 1 80 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.188 0.982 17919 32657 1 80 . 1 1 33 33 LYS H H 33 7.430 7.430 8.055 -0.625 17919 32658 1 80 . 1 1 34 34 GLU N N 34 113.870 113.870 115.023 -1.153 17919 32659 1 80 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.451 0.174 17919 32660 1 80 . 1 1 34 34 GLU C C 34 177.840 177.840 176.853 0.987 17919 32661 1 80 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.001 -0.831 17919 32662 1 80 . 1 1 34 34 GLU CB C 34 32.660 32.660 32.267 0.393 17919 32663 1 80 . 1 1 34 34 GLU H H 34 8.740 8.740 8.047 0.693 17919 32664 1 80 . 1 1 35 35 GLY N N 35 108.650 108.650 106.899 1.751 17919 32665 1 80 . 1 1 35 35 GLY C C 35 173.960 173.960 174.762 -0.802 17919 32666 1 80 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.435 0.645 17919 32667 1 80 . 1 1 35 35 GLY H H 35 8.530 8.530 7.753 0.777 17919 32668 1 80 . 1 1 36 36 ILE N N 36 119.880 119.880 124.185 -4.305 17919 32669 1 80 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.163 0.282 17919 32670 1 80 . 1 1 36 36 ILE C C 36 173.590 173.590 174.435 -0.845 17919 32671 1 80 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.953 -1.203 17919 32672 1 80 . 1 1 36 36 ILE CB C 36 40.580 40.580 37.847 2.733 17919 32673 1 80 . 1 1 36 36 ILE H H 36 6.150 6.150 7.833 -1.683 17919 32674 1 80 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.530 0.104 17919 32675 1 80 . 1 1 37 37 PRO C C 37 176.940 176.940 176.107 0.833 17919 32676 1 80 . 1 1 37 37 PRO CA C 37 61.660 61.660 62.142 -0.482 17919 32677 1 80 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.256 0.594 17919 32678 1 80 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.206 -0.089 17919 32679 1 80 . 1 1 38 38 PRO C C 38 178.320 178.320 178.116 0.204 17919 32680 1 80 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.541 0.719 17919 32681 1 80 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.783 1.107 17919 32682 1 80 . 1 1 39 39 ASP N N 39 113.380 113.380 115.851 -2.471 17919 32683 1 80 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.321 0.109 17919 32684 1 80 . 1 1 39 39 ASP C C 39 177.090 177.090 177.374 -0.284 17919 32685 1 80 . 1 1 39 39 ASP CA C 39 55.640 55.640 57.056 -1.416 17919 32686 1 80 . 1 1 39 39 ASP CB C 39 39.540 39.540 39.513 0.027 17919 32687 1 80 . 1 1 39 39 ASP H H 39 8.550 8.550 8.948 -0.398 17919 32688 1 80 . 1 1 40 40 GLN N N 40 116.780 116.780 117.575 -0.795 17919 32689 1 80 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.311 0.153 17919 32690 1 80 . 1 1 40 40 GLN C C 40 175.380 175.380 176.341 -0.961 17919 32691 1 80 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.811 -0.171 17919 32692 1 80 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.715 0.425 17919 32693 1 80 . 1 1 40 40 GLN H H 40 7.820 7.820 7.606 0.214 17919 32694 1 80 . 1 1 41 41 GLN N N 41 117.720 117.720 119.107 -1.387 17919 32695 1 80 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.508 -0.264 17919 32696 1 80 . 1 1 41 41 GLN C C 41 176.300 176.300 175.490 0.810 17919 32697 1 80 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.823 0.647 17919 32698 1 80 . 1 1 41 41 GLN CB C 41 31.650 31.650 30.031 1.619 17919 32699 1 80 . 1 1 41 41 GLN H H 41 7.480 7.480 7.415 0.065 17919 32700 1 80 . 1 1 42 42 ARG N N 42 122.680 122.680 125.198 -2.518 17919 32701 1 80 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.675 -0.175 17919 32702 1 80 . 1 1 42 42 ARG C C 42 174.050 174.050 174.028 0.022 17919 32703 1 80 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.845 0.205 17919 32704 1 80 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.081 -1.331 17919 32705 1 80 . 1 1 42 42 ARG H H 42 8.530 8.530 8.335 0.195 17919 32706 1 80 . 1 1 43 43 LEU N N 43 124.040 124.040 126.159 -2.119 17919 32707 1 80 . 1 1 43 43 LEU C C 43 175.290 175.290 175.283 0.007 17919 32708 1 80 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.719 -0.740 17919 32709 1 80 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.660 2.130 17919 32710 1 80 . 1 1 43 43 LEU H H 43 8.820 8.820 8.694 0.126 17919 32711 1 80 . 1 1 44 44 ILE N N 44 121.920 121.920 118.278 3.642 17919 32712 1 80 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.058 -0.066 17919 32713 1 80 . 1 1 44 44 ILE C C 44 176.060 176.060 173.947 2.113 17919 32714 1 80 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.248 -0.268 17919 32715 1 80 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.816 -0.396 17919 32716 1 80 . 1 1 44 44 ILE H H 44 9.030 9.030 7.926 1.104 17919 32717 1 80 . 1 1 45 45 PHE N N 45 125.390 125.390 125.758 -0.368 17919 32718 1 80 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.009 0.036 17919 32719 1 80 . 1 1 45 45 PHE C C 45 174.470 174.470 174.767 -0.297 17919 32720 1 80 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.907 0.113 17919 32721 1 80 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.841 0.919 17919 32722 1 80 . 1 1 45 45 PHE H H 45 8.830 8.830 8.288 0.542 17919 32723 1 80 . 1 1 46 46 ALA N N 46 132.200 132.200 130.242 1.958 17919 32724 1 80 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.684 0.006 17919 32725 1 80 . 1 1 46 46 ALA C C 46 177.290 177.290 177.829 -0.539 17919 32726 1 80 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.261 0.279 17919 32727 1 80 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.364 0.206 17919 32728 1 80 . 1 1 46 46 ALA H H 46 8.810 8.810 8.662 0.148 17919 32729 1 80 . 1 1 47 47 GLY N N 47 102.340 102.340 104.191 -1.851 17919 32730 1 80 . 1 1 47 47 GLY C C 47 173.810 173.810 173.865 -0.055 17919 32731 1 80 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.835 0.515 17919 32732 1 80 . 1 1 47 47 GLY H H 47 8.130 8.130 8.510 -0.380 17919 32733 1 80 . 1 1 48 48 LYS N N 48 121.570 121.570 120.951 0.619 17919 32734 1 80 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.550 0.072 17919 32735 1 80 . 1 1 48 48 LYS C C 48 174.700 174.700 175.252 -0.552 17919 32736 1 80 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.928 -0.378 17919 32737 1 80 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.775 -0.245 17919 32738 1 80 . 1 1 48 48 LYS H H 48 7.980 7.980 7.556 0.424 17919 32739 1 80 . 1 1 49 49 GLN N N 49 122.410 122.410 125.473 -3.063 17919 32740 1 80 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.136 0.424 17919 32741 1 80 . 1 1 49 49 GLN C C 49 175.670 175.670 175.179 0.491 17919 32742 1 80 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.364 -0.624 17919 32743 1 80 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.063 -0.063 17919 32744 1 80 . 1 1 49 49 GLN H H 49 8.600 8.600 8.600 0.000 17919 32745 1 80 . 1 1 50 50 LEU N N 50 125.520 125.520 127.490 -1.970 17919 32746 1 80 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.186 -0.096 17919 32747 1 80 . 1 1 50 50 LEU C C 50 176.660 176.660 176.258 0.402 17919 32748 1 80 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.778 0.462 17919 32749 1 80 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.550 -0.980 17919 32750 1 80 . 1 1 50 50 LEU H H 50 8.530 8.530 7.956 0.574 17919 32751 1 80 . 1 1 51 51 GLU N N 51 122.940 122.940 122.337 0.603 17919 32752 1 80 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.485 0.003 17919 32753 1 80 . 1 1 51 51 GLU C C 51 175.870 175.870 176.935 -1.065 17919 32754 1 80 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.496 0.464 17919 32755 1 80 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.377 0.193 17919 32756 1 80 . 1 1 51 51 GLU H H 51 8.400 8.400 8.699 -0.299 17919 32757 1 80 . 1 1 52 52 ASP N N 52 120.030 120.030 126.446 -6.416 17919 32758 1 80 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.591 -0.232 17919 32759 1 80 . 1 1 52 52 ASP C C 52 177.330 177.330 176.547 0.783 17919 32760 1 80 . 1 1 52 52 ASP CA C 52 56.960 56.960 55.639 1.321 17919 32761 1 80 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.969 -0.119 17919 32762 1 80 . 1 1 52 52 ASP H H 52 8.160 8.160 8.785 -0.625 17919 32763 1 80 . 1 1 53 53 GLY N N 53 106.660 106.660 105.288 1.372 17919 32764 1 80 . 1 1 53 53 GLY C C 53 174.870 174.870 173.988 0.882 17919 32765 1 80 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.762 0.408 17919 32766 1 80 . 1 1 53 53 GLY H H 53 9.390 9.390 8.411 0.979 17919 32767 1 80 . 1 1 54 54 ARG N N 54 119.050 119.050 120.388 -1.338 17919 32768 1 80 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.734 -0.039 17919 32769 1 80 . 1 1 54 54 ARG C C 54 175.350 175.350 174.812 0.538 17919 32770 1 80 . 1 1 54 54 ARG CA C 54 54.390 54.390 53.905 0.485 17919 32771 1 80 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.627 -0.976 17919 32772 1 80 . 1 1 54 54 ARG H H 54 7.460 7.460 7.549 -0.089 17919 32773 1 80 . 1 1 55 55 THR N N 55 108.400 108.400 112.654 -4.254 17919 32774 1 80 . 1 1 55 55 THR HA H 55 5.240 5.240 5.014 0.226 17919 32775 1 80 . 1 1 55 55 THR C C 55 176.560 176.560 176.101 0.459 17919 32776 1 80 . 1 1 55 55 THR CA C 55 59.690 59.690 60.842 -1.152 17919 32777 1 80 . 1 1 55 55 THR CB C 55 72.260 72.260 71.086 1.174 17919 32778 1 80 . 1 1 55 55 THR H H 55 8.730 8.730 9.012 -0.282 17919 32779 1 80 . 1 1 56 56 LEU N N 56 117.920 117.920 120.504 -2.584 17919 32780 1 80 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.244 -0.184 17919 32781 1 80 . 1 1 56 56 LEU C C 56 180.810 180.810 178.909 1.901 17919 32782 1 80 . 1 1 56 56 LEU CA C 56 58.710 58.710 57.459 1.250 17919 32783 1 80 . 1 1 56 56 LEU CB C 56 40.370 40.370 40.161 0.209 17919 32784 1 80 . 1 1 56 56 LEU H H 56 8.140 8.140 8.240 -0.100 17919 32785 1 80 . 1 1 57 57 SER N N 57 113.330 113.330 115.641 -2.311 17919 32786 1 80 . 1 1 57 57 SER HA H 57 4.370 4.370 4.226 0.144 17919 32787 1 80 . 1 1 57 57 SER C C 57 178.310 178.310 177.107 1.203 17919 32788 1 80 . 1 1 57 57 SER CA C 57 61.080 61.080 61.374 -0.294 17919 32789 1 80 . 1 1 57 57 SER CB C 57 62.530 62.530 62.329 0.201 17919 32790 1 80 . 1 1 57 57 SER H H 57 8.470 8.470 7.897 0.573 17919 32791 1 80 . 1 1 58 58 ASP N N 58 124.190 124.190 124.057 0.133 17919 32792 1 80 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.169 0.127 17919 32793 1 80 . 1 1 58 58 ASP C C 58 177.400 177.400 177.308 0.092 17919 32794 1 80 . 1 1 58 58 ASP CA C 58 57.180 57.180 57.127 0.053 17919 32795 1 80 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.043 0.057 17919 32796 1 80 . 1 1 58 58 ASP H H 58 7.930 7.930 7.797 0.133 17919 32797 1 80 . 1 1 59 59 TYR N N 59 115.510 115.510 114.501 1.009 17919 32798 1 80 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.675 -0.005 17919 32799 1 80 . 1 1 59 59 TYR C C 59 174.700 174.700 175.329 -0.629 17919 32800 1 80 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.214 1.036 17919 32801 1 80 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.895 1.175 17919 32802 1 80 . 1 1 59 59 TYR H H 59 7.250 7.250 7.200 0.050 17919 32803 1 80 . 1 1 60 60 ASN N N 60 115.900 115.900 116.294 -0.394 17919 32804 1 80 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.396 -0.041 17919 32805 1 80 . 1 1 60 60 ASN C C 60 174.340 174.340 174.421 -0.081 17919 32806 1 80 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.367 -0.247 17919 32807 1 80 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.923 -0.513 17919 32808 1 80 . 1 1 60 60 ASN H H 60 8.150 8.150 7.728 0.422 17919 32809 1 80 . 1 1 61 61 ILE N N 61 118.600 118.600 120.352 -1.752 17919 32810 1 80 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.604 -0.211 17919 32811 1 80 . 1 1 61 61 ILE C C 61 174.610 174.610 175.726 -1.116 17919 32812 1 80 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.112 1.308 17919 32813 1 80 . 1 1 61 61 ILE CB C 61 36.740 36.740 36.280 0.460 17919 32814 1 80 . 1 1 61 61 ILE H H 61 7.250 7.250 8.165 -0.915 17919 32815 1 80 . 1 1 62 62 GLN N N 62 124.740 124.740 125.607 -0.867 17919 32816 1 80 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.624 -0.118 17919 32817 1 80 . 1 1 62 62 GLN C C 62 175.970 175.970 175.694 0.276 17919 32818 1 80 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.866 -0.206 17919 32819 1 80 . 1 1 62 62 GLN CB C 62 31.650 31.650 30.773 0.876 17919 32820 1 80 . 1 1 62 62 GLN H H 62 7.610 7.610 8.140 -0.530 17919 32821 1 80 . 1 1 63 63 LYS N N 63 120.300 120.300 119.651 0.649 17919 32822 1 80 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.894 0.107 17919 32823 1 80 . 1 1 63 63 LYS C C 63 175.810 175.810 176.603 -0.793 17919 32824 1 80 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.474 -0.684 17919 32825 1 80 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.917 0.733 17919 32826 1 80 . 1 1 63 63 LYS H H 63 8.490 8.490 8.513 -0.023 17919 32827 1 80 . 1 1 64 64 GLU N N 64 113.950 113.950 119.163 -5.213 17919 32828 1 80 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.855 -0.390 17919 32829 1 80 . 1 1 64 64 GLU C C 64 175.250 175.250 175.970 -0.720 17919 32830 1 80 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.968 -0.078 17919 32831 1 80 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.672 -2.772 17919 32832 1 80 . 1 1 64 64 GLU H H 64 9.280 9.280 8.831 0.449 17919 32833 1 80 . 1 1 65 65 SER N N 65 114.730 114.730 115.875 -1.145 17919 32834 1 80 . 1 1 65 65 SER HA H 65 4.640 4.640 4.436 0.204 17919 32835 1 80 . 1 1 65 65 SER C C 65 172.160 172.160 174.375 -2.215 17919 32836 1 80 . 1 1 65 65 SER CA C 65 60.890 60.890 60.530 0.360 17919 32837 1 80 . 1 1 65 65 SER CB C 65 64.910 64.910 63.667 1.243 17919 32838 1 80 . 1 1 65 65 SER H H 65 7.670 7.670 7.637 0.033 17919 32839 1 80 . 1 1 66 66 THR N N 66 117.110 117.110 121.211 -4.101 17919 32840 1 80 . 1 1 66 66 THR HA H 66 5.270 5.270 4.836 0.434 17919 32841 1 80 . 1 1 66 66 THR C C 66 173.950 173.950 174.241 -0.291 17919 32842 1 80 . 1 1 66 66 THR CA C 66 62.340 62.340 62.598 -0.258 17919 32843 1 80 . 1 1 66 66 THR CB C 66 70.080 70.080 69.717 0.363 17919 32844 1 80 . 1 1 66 66 THR H H 66 8.730 8.730 8.501 0.229 17919 32845 1 80 . 1 1 67 67 LEU N N 67 127.110 127.110 127.162 -0.052 17919 32846 1 80 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.725 0.335 17919 32847 1 80 . 1 1 67 67 LEU C C 67 175.770 175.770 175.291 0.479 17919 32848 1 80 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.870 0.030 17919 32849 1 80 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.763 -0.503 17919 32850 1 80 . 1 1 67 67 LEU H H 67 9.410 9.410 9.245 0.165 17919 32851 1 80 . 1 1 68 68 HIS N N 68 118.380 118.380 124.196 -5.816 17919 32852 1 80 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.139 0.101 17919 32853 1 80 . 1 1 68 68 HIS C C 68 173.150 173.150 174.821 -1.671 17919 32854 1 80 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.068 0.932 17919 32855 1 80 . 1 1 68 68 HIS CB C 68 30.530 30.530 29.895 0.635 17919 32856 1 80 . 1 1 68 68 HIS H H 68 9.230 9.230 8.693 0.537 17919 32857 1 80 . 1 1 69 69 LEU N N 69 124.460 124.460 129.701 -5.241 17919 32858 1 80 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.347 0.843 17919 32859 1 80 . 1 1 69 69 LEU C C 69 175.270 175.270 174.855 0.415 17919 32860 1 80 . 1 1 69 69 LEU CA C 69 53.890 53.890 55.639 -1.748 17919 32861 1 80 . 1 1 69 69 LEU CB C 69 44.380 44.380 41.779 2.601 17919 32862 1 80 . 1 1 69 69 LEU H H 69 8.340 8.340 8.160 0.180 17919 32863 1 80 . 1 1 70 70 VAL N N 70 126.940 126.940 127.797 -0.857 17919 32864 1 80 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.357 -0.007 17919 32865 1 80 . 1 1 70 70 VAL C C 70 174.000 174.000 174.493 -0.493 17919 32866 1 80 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.757 0.043 17919 32867 1 80 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.485 -0.575 17919 32868 1 80 . 1 1 70 70 VAL H H 70 9.200 9.200 8.620 0.580 17919 32869 1 80 . 1 1 71 71 LEU N N 71 123.130 123.130 121.999 1.131 17919 32870 1 80 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.955 0.105 17919 32871 1 80 . 1 1 71 71 LEU C C 71 177.830 177.830 176.957 0.873 17919 32872 1 80 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.742 0.198 17919 32873 1 80 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.049 -0.199 17919 32874 1 80 . 1 1 71 71 LEU H H 71 8.120 8.120 8.300 -0.180 17919 32875 1 80 . 1 1 72 72 ARG N N 72 123.490 123.490 123.012 0.478 17919 32876 1 80 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.210 0.091 17919 32877 1 80 . 1 1 72 72 ARG C C 72 175.350 175.350 176.077 -0.727 17919 32878 1 80 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.704 -1.094 17919 32879 1 80 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.210 1.140 17919 32880 1 80 . 1 1 72 72 ARG H H 72 8.580 8.580 8.584 -0.004 17919 32881 1 81 . 1 1 2 2 GLN N N 2 123.220 123.220 118.804 4.416 17919 32882 1 81 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.203 0.046 17919 32883 1 81 . 1 1 2 2 GLN C C 2 175.920 175.920 175.327 0.593 17919 32884 1 81 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.535 0.545 17919 32885 1 81 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.791 -0.031 17919 32886 1 81 . 1 1 2 2 GLN H H 2 8.900 8.900 8.250 0.650 17919 32887 1 81 . 1 1 3 3 ILE N N 3 115.340 115.340 116.796 -1.456 17919 32888 1 81 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.249 -0.036 17919 32889 1 81 . 1 1 3 3 ILE C C 3 172.450 172.450 173.389 -0.939 17919 32890 1 81 . 1 1 3 3 ILE CA C 3 59.570 59.570 60.066 -0.496 17919 32891 1 81 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.636 0.574 17919 32892 1 81 . 1 1 3 3 ILE H H 3 8.320 8.320 7.558 0.762 17919 32893 1 81 . 1 1 4 4 PHE N N 4 118.110 118.110 119.645 -1.535 17919 32894 1 81 . 1 1 4 4 PHE HA H 4 5.630 5.630 4.973 0.657 17919 32895 1 81 . 1 1 4 4 PHE C C 4 175.320 175.320 175.387 -0.067 17919 32896 1 81 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.900 -0.690 17919 32897 1 81 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.012 -0.532 17919 32898 1 81 . 1 1 4 4 PHE H H 4 8.610 8.610 7.825 0.785 17919 32899 1 81 . 1 1 5 5 VAL N N 5 121.000 121.000 121.258 -0.258 17919 32900 1 81 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.760 -0.035 17919 32901 1 81 . 1 1 5 5 VAL C C 5 174.870 174.870 175.503 -0.633 17919 32902 1 81 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.127 -0.507 17919 32903 1 81 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.664 0.566 17919 32904 1 81 . 1 1 5 5 VAL H H 5 9.300 9.300 8.568 0.732 17919 32905 1 81 . 1 1 6 6 LYS N N 6 127.520 127.520 128.296 -0.776 17919 32906 1 81 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.071 0.296 17919 32907 1 81 . 1 1 6 6 LYS C C 6 177.140 177.140 176.972 0.168 17919 32908 1 81 . 1 1 6 6 LYS CA C 6 54.520 54.520 55.595 -1.075 17919 32909 1 81 . 1 1 6 6 LYS CB C 6 35.050 35.050 33.556 1.494 17919 32910 1 81 . 1 1 6 6 LYS H H 6 8.820 8.820 9.031 -0.211 17919 32911 1 81 . 1 1 7 7 THR N N 7 115.400 115.400 118.021 -2.621 17919 32912 1 81 . 1 1 7 7 THR HA H 7 4.970 4.970 4.476 0.494 17919 32913 1 81 . 1 1 7 7 THR C C 7 176.910 176.910 176.603 0.307 17919 32914 1 81 . 1 1 7 7 THR CA C 7 60.470 60.470 60.673 -0.203 17919 32915 1 81 . 1 1 7 7 THR CB C 7 70.630 70.630 69.968 0.662 17919 32916 1 81 . 1 1 7 7 THR H H 7 8.730 8.730 8.173 0.557 17919 32917 1 81 . 1 1 8 8 LEU N N 8 121.330 121.330 121.512 -0.182 17919 32918 1 81 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.101 0.209 17919 32919 1 81 . 1 1 8 8 LEU C C 8 178.800 178.800 177.959 0.841 17919 32920 1 81 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.928 -0.348 17919 32921 1 81 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.540 0.430 17919 32922 1 81 . 1 1 8 8 LEU H H 8 9.100 9.100 8.917 0.183 17919 32923 1 81 . 1 1 9 9 THR N N 9 105.590 105.590 105.514 0.076 17919 32924 1 81 . 1 1 9 9 THR HA H 9 4.428 4.428 4.326 0.102 17919 32925 1 81 . 1 1 9 9 THR C C 9 175.520 175.520 175.659 -0.139 17919 32926 1 81 . 1 1 9 9 THR CA C 9 61.400 61.400 61.902 -0.502 17919 32927 1 81 . 1 1 9 9 THR CB C 9 69.140 69.140 69.335 -0.195 17919 32928 1 81 . 1 1 9 9 THR H H 9 7.630 7.630 7.617 0.013 17919 32929 1 81 . 1 1 10 10 GLY N N 10 108.890 108.890 111.360 -2.470 17919 32930 1 81 . 1 1 10 10 GLY C C 10 174.070 174.070 173.749 0.321 17919 32931 1 81 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.876 0.584 17919 32932 1 81 . 1 1 10 10 GLY H H 10 7.810 7.810 7.947 -0.137 17919 32933 1 81 . 1 1 11 11 LYS N N 11 121.600 121.600 121.049 0.551 17919 32934 1 81 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.277 0.084 17919 32935 1 81 . 1 1 11 11 LYS C C 11 175.940 175.940 175.693 0.247 17919 32936 1 81 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.637 -0.357 17919 32937 1 81 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.167 0.033 17919 32938 1 81 . 1 1 11 11 LYS H H 11 7.280 7.280 7.867 -0.587 17919 32939 1 81 . 1 1 12 12 THR N N 12 120.440 120.440 120.885 -0.445 17919 32940 1 81 . 1 1 12 12 THR HA H 12 5.046 5.046 4.593 0.453 17919 32941 1 81 . 1 1 12 12 THR C C 12 174.320 174.320 174.539 -0.219 17919 32942 1 81 . 1 1 12 12 THR CA C 12 62.390 62.390 62.909 -0.519 17919 32943 1 81 . 1 1 12 12 THR CB C 12 69.910 69.910 69.525 0.385 17919 32944 1 81 . 1 1 12 12 THR H H 12 8.650 8.650 8.246 0.404 17919 32945 1 81 . 1 1 13 13 ILE N N 13 127.110 127.110 127.420 -0.310 17919 32946 1 81 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.513 0.031 17919 32947 1 81 . 1 1 13 13 ILE C C 13 175.220 175.220 174.863 0.357 17919 32948 1 81 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.132 0.848 17919 32949 1 81 . 1 1 13 13 ILE CB C 13 40.950 40.950 38.055 2.895 17919 32950 1 81 . 1 1 13 13 ILE H H 13 9.450 9.450 8.650 0.800 17919 32951 1 81 . 1 1 14 14 THR N N 14 121.520 121.520 122.919 -1.399 17919 32952 1 81 . 1 1 14 14 THR HA H 14 4.964 4.964 4.397 0.567 17919 32953 1 81 . 1 1 14 14 THR C C 14 173.790 173.790 174.103 -0.313 17919 32954 1 81 . 1 1 14 14 THR CA C 14 61.940 61.940 63.296 -1.356 17919 32955 1 81 . 1 1 14 14 THR CB C 14 69.650 69.650 69.579 0.071 17919 32956 1 81 . 1 1 14 14 THR H H 14 8.710 8.710 8.526 0.184 17919 32957 1 81 . 1 1 15 15 LEU N N 15 124.800 124.800 127.321 -2.521 17919 32958 1 81 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.821 -0.041 17919 32959 1 81 . 1 1 15 15 LEU C C 15 174.670 174.670 175.294 -0.624 17919 32960 1 81 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.522 -0.692 17919 32961 1 81 . 1 1 15 15 LEU CB C 15 47.070 47.070 44.913 2.157 17919 32962 1 81 . 1 1 15 15 LEU H H 15 8.710 8.710 8.140 0.570 17919 32963 1 81 . 1 1 16 16 GLU N N 16 122.160 122.160 122.337 -0.177 17919 32964 1 81 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.213 -0.296 17919 32965 1 81 . 1 1 16 16 GLU C C 16 175.860 175.860 176.515 -0.655 17919 32966 1 81 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.177 -0.357 17919 32967 1 81 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.151 -0.701 17919 32968 1 81 . 1 1 16 16 GLU H H 16 8.140 8.140 8.516 -0.376 17919 32969 1 81 . 1 1 17 17 VAL N N 17 117.210 117.210 118.936 -1.726 17919 32970 1 81 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.760 -0.046 17919 32971 1 81 . 1 1 17 17 VAL C C 17 174.160 174.160 174.968 -0.808 17919 32972 1 81 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.815 -0.385 17919 32973 1 81 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.363 1.037 17919 32974 1 81 . 1 1 17 17 VAL H H 17 8.900 8.900 8.854 0.046 17919 32975 1 81 . 1 1 18 18 GLU N N 18 118.990 118.990 119.849 -0.859 17919 32976 1 81 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.828 0.251 17919 32977 1 81 . 1 1 18 18 GLU C C 18 176.160 176.160 175.176 0.984 17919 32978 1 81 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.644 0.076 17919 32979 1 81 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.683 -0.373 17919 32980 1 81 . 1 1 18 18 GLU H H 18 8.640 8.640 8.262 0.378 17919 32981 1 81 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.111 0.030 17919 32982 1 81 . 1 1 19 19 PRO C C 19 175.310 175.310 177.573 -2.263 17919 32983 1 81 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.909 -0.439 17919 32984 1 81 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.874 0.076 17919 32985 1 81 . 1 1 20 20 SER N N 20 103.400 103.400 107.879 -4.479 17919 32986 1 81 . 1 1 20 20 SER HA H 20 4.370 4.370 4.409 -0.039 17919 32987 1 81 . 1 1 20 20 SER C C 20 174.660 174.660 173.880 0.780 17919 32988 1 81 . 1 1 20 20 SER CA C 20 57.400 57.400 57.012 0.388 17919 32989 1 81 . 1 1 20 20 SER CB C 20 63.370 63.370 62.876 0.494 17919 32990 1 81 . 1 1 20 20 SER H H 20 7.040 7.040 8.152 -1.112 17919 32991 1 81 . 1 1 21 21 ASP N N 21 123.480 123.480 125.563 -2.083 17919 32992 1 81 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.531 0.164 17919 32993 1 81 . 1 1 21 21 ASP C C 21 176.360 176.360 175.851 0.509 17919 32994 1 81 . 1 1 21 21 ASP CA C 21 55.700 55.700 56.103 -0.403 17919 32995 1 81 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.530 -0.730 17919 32996 1 81 . 1 1 21 21 ASP H H 21 8.030 8.030 7.743 0.287 17919 32997 1 81 . 1 1 22 22 THR N N 22 108.800 108.800 114.635 -5.835 17919 32998 1 81 . 1 1 22 22 THR HA H 22 4.920 4.920 4.502 0.418 17919 32999 1 81 . 1 1 22 22 THR C C 22 176.750 176.750 175.562 1.188 17919 33000 1 81 . 1 1 22 22 THR CA C 22 59.690 59.690 61.897 -2.207 17919 33001 1 81 . 1 1 22 22 THR CB C 22 71.200 71.200 69.781 1.419 17919 33002 1 81 . 1 1 22 22 THR H H 22 7.900 7.900 8.475 -0.575 17919 33003 1 81 . 1 1 23 23 ILE N N 23 121.190 121.190 121.067 0.123 17919 33004 1 81 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.976 -0.319 17919 33005 1 81 . 1 1 23 23 ILE C C 23 179.040 179.040 177.341 1.699 17919 33006 1 81 . 1 1 23 23 ILE CA C 23 62.260 62.260 60.463 1.797 17919 33007 1 81 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.232 -1.882 17919 33008 1 81 . 1 1 23 23 ILE H H 23 8.560 8.560 8.520 0.040 17919 33009 1 81 . 1 1 24 24 GLU N N 24 120.830 120.830 121.414 -0.584 17919 33010 1 81 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.967 -0.050 17919 33011 1 81 . 1 1 24 24 GLU C C 24 178.640 178.640 178.083 0.557 17919 33012 1 81 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.561 0.659 17919 33013 1 81 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.591 -1.311 17919 33014 1 81 . 1 1 24 24 GLU H H 24 9.760 9.760 8.458 1.302 17919 33015 1 81 . 1 1 25 25 ASN N N 25 120.570 120.570 117.808 2.762 17919 33016 1 81 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.535 -0.010 17919 33017 1 81 . 1 1 25 25 ASN C C 25 178.380 178.380 177.981 0.399 17919 33018 1 81 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.432 -0.372 17919 33019 1 81 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.634 -0.184 17919 33020 1 81 . 1 1 25 25 ASN H H 25 7.920 7.920 7.885 0.035 17919 33021 1 81 . 1 1 26 26 VAL N N 26 121.710 121.710 118.336 3.374 17919 33022 1 81 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.679 -0.282 17919 33023 1 81 . 1 1 26 26 VAL C C 26 177.950 177.950 177.882 0.068 17919 33024 1 81 . 1 1 26 26 VAL CA C 26 67.660 67.660 65.464 2.196 17919 33025 1 81 . 1 1 26 26 VAL CB C 26 30.840 30.840 30.544 0.296 17919 33026 1 81 . 1 1 26 26 VAL H H 26 8.070 8.070 7.988 0.082 17919 33027 1 81 . 1 1 27 27 LYS N N 27 118.860 118.860 121.037 -2.177 17919 33028 1 81 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.141 0.439 17919 33029 1 81 . 1 1 27 27 LYS C C 27 180.550 180.550 179.062 1.488 17919 33030 1 81 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.725 -0.475 17919 33031 1 81 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.166 1.564 17919 33032 1 81 . 1 1 27 27 LYS H H 27 8.560 8.560 7.564 0.996 17919 33033 1 81 . 1 1 28 28 ALA N N 28 123.440 123.440 120.736 2.704 17919 33034 1 81 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.151 0.009 17919 33035 1 81 . 1 1 28 28 ALA C C 28 180.300 180.300 178.920 1.380 17919 33036 1 81 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.417 0.953 17919 33037 1 81 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.412 -0.702 17919 33038 1 81 . 1 1 28 28 ALA H H 28 8.060 8.060 8.072 -0.012 17919 33039 1 81 . 1 1 29 29 LYS N N 29 119.940 119.940 119.799 0.141 17919 33040 1 81 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.058 0.149 17919 33041 1 81 . 1 1 29 29 LYS C C 29 180.320 180.320 179.214 1.106 17919 33042 1 81 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.177 0.473 17919 33043 1 81 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.344 0.946 17919 33044 1 81 . 1 1 29 29 LYS H H 29 7.850 7.850 7.458 0.392 17919 33045 1 81 . 1 1 30 30 ILE N N 30 121.080 121.080 120.190 0.890 17919 33046 1 81 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.665 -0.158 17919 33047 1 81 . 1 1 30 30 ILE C C 30 178.310 178.310 177.420 0.890 17919 33048 1 81 . 1 1 30 30 ILE CA C 30 66.150 66.150 64.169 1.981 17919 33049 1 81 . 1 1 30 30 ILE CB C 30 36.800 36.800 36.701 0.099 17919 33050 1 81 . 1 1 30 30 ILE H H 30 8.280 8.280 8.302 -0.022 17919 33051 1 81 . 1 1 31 31 GLN N N 31 123.490 123.490 119.736 3.754 17919 33052 1 81 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.910 -0.081 17919 33053 1 81 . 1 1 31 31 GLN C C 31 178.890 178.890 178.164 0.726 17919 33054 1 81 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.121 0.879 17919 33055 1 81 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.384 -0.664 17919 33056 1 81 . 1 1 31 31 GLN H H 31 8.580 8.580 7.827 0.753 17919 33057 1 81 . 1 1 32 32 ASP N N 32 119.360 119.360 118.029 1.331 17919 33058 1 81 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.395 -0.041 17919 33059 1 81 . 1 1 32 32 ASP C C 32 177.250 177.250 177.526 -0.276 17919 33060 1 81 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.770 0.420 17919 33061 1 81 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.876 -0.296 17919 33062 1 81 . 1 1 32 32 ASP H H 32 8.010 8.010 7.792 0.218 17919 33063 1 81 . 1 1 33 33 LYS N N 33 115.130 115.130 118.510 -3.380 17919 33064 1 81 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.378 -0.041 17919 33065 1 81 . 1 1 33 33 LYS C C 33 177.870 177.870 178.745 -0.875 17919 33066 1 81 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.658 0.392 17919 33067 1 81 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.420 0.749 17919 33068 1 81 . 1 1 33 33 LYS H H 33 7.430 7.430 7.552 -0.122 17919 33069 1 81 . 1 1 34 34 GLU N N 34 113.870 113.870 116.237 -2.367 17919 33070 1 81 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.409 0.216 17919 33071 1 81 . 1 1 34 34 GLU C C 34 177.840 177.840 177.434 0.406 17919 33072 1 81 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.066 -0.896 17919 33073 1 81 . 1 1 34 34 GLU CB C 34 32.660 32.660 30.991 1.669 17919 33074 1 81 . 1 1 34 34 GLU H H 34 8.740 8.740 8.467 0.273 17919 33075 1 81 . 1 1 35 35 GLY N N 35 108.650 108.650 109.040 -0.390 17919 33076 1 81 . 1 1 35 35 GLY C C 35 173.960 173.960 174.673 -0.713 17919 33077 1 81 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.580 0.501 17919 33078 1 81 . 1 1 35 35 GLY H H 35 8.530 8.530 7.629 0.901 17919 33079 1 81 . 1 1 36 36 ILE N N 36 119.880 119.880 121.818 -1.938 17919 33080 1 81 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.187 0.258 17919 33081 1 81 . 1 1 36 36 ILE C C 36 173.590 173.590 174.561 -0.971 17919 33082 1 81 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.683 -0.933 17919 33083 1 81 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.208 2.372 17919 33084 1 81 . 1 1 36 36 ILE H H 36 6.150 6.150 7.826 -1.676 17919 33085 1 81 . 1 1 37 37 PRO HA H 37 4.634 4.634 5.022 -0.388 17919 33086 1 81 . 1 1 37 37 PRO C C 37 176.940 176.940 176.557 0.383 17919 33087 1 81 . 1 1 37 37 PRO CA C 37 61.660 61.660 60.966 0.694 17919 33088 1 81 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.511 0.340 17919 33089 1 81 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.204 -0.087 17919 33090 1 81 . 1 1 38 38 PRO C C 38 178.320 178.320 178.634 -0.314 17919 33091 1 81 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.413 0.847 17919 33092 1 81 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.806 1.084 17919 33093 1 81 . 1 1 39 39 ASP N N 39 113.380 113.380 118.725 -5.345 17919 33094 1 81 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.248 0.182 17919 33095 1 81 . 1 1 39 39 ASP C C 39 177.090 177.090 177.933 -0.843 17919 33096 1 81 . 1 1 39 39 ASP CA C 39 55.640 55.640 57.578 -1.938 17919 33097 1 81 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.440 -0.900 17919 33098 1 81 . 1 1 39 39 ASP H H 39 8.550 8.550 8.659 -0.109 17919 33099 1 81 . 1 1 40 40 GLN N N 40 116.780 116.780 116.115 0.665 17919 33100 1 81 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.164 0.300 17919 33101 1 81 . 1 1 40 40 GLN C C 40 175.380 175.380 176.887 -1.507 17919 33102 1 81 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.912 -1.272 17919 33103 1 81 . 1 1 40 40 GLN CB C 40 30.140 30.140 28.972 1.168 17919 33104 1 81 . 1 1 40 40 GLN H H 40 7.820 7.820 7.784 0.036 17919 33105 1 81 . 1 1 41 41 GLN N N 41 117.720 117.720 118.812 -1.092 17919 33106 1 81 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.675 -0.431 17919 33107 1 81 . 1 1 41 41 GLN C C 41 176.300 176.300 175.147 1.153 17919 33108 1 81 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.636 0.834 17919 33109 1 81 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.811 1.839 17919 33110 1 81 . 1 1 41 41 GLN H H 41 7.480 7.480 7.674 -0.194 17919 33111 1 81 . 1 1 42 42 ARG N N 42 122.680 122.680 125.079 -2.399 17919 33112 1 81 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.544 -0.044 17919 33113 1 81 . 1 1 42 42 ARG C C 42 174.050 174.050 173.769 0.281 17919 33114 1 81 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.321 -0.271 17919 33115 1 81 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.303 -0.553 17919 33116 1 81 . 1 1 42 42 ARG H H 42 8.530 8.530 8.420 0.110 17919 33117 1 81 . 1 1 43 43 LEU N N 43 124.040 124.040 126.422 -2.382 17919 33118 1 81 . 1 1 43 43 LEU C C 43 175.290 175.290 175.465 -0.175 17919 33119 1 81 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.096 -1.116 17919 33120 1 81 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.916 0.874 17919 33121 1 81 . 1 1 43 43 LEU H H 43 8.820 8.820 8.667 0.153 17919 33122 1 81 . 1 1 44 44 ILE N N 44 121.920 121.920 118.166 3.754 17919 33123 1 81 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.031 -0.039 17919 33124 1 81 . 1 1 44 44 ILE C C 44 176.060 176.060 173.824 2.236 17919 33125 1 81 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.557 -0.577 17919 33126 1 81 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.042 0.378 17919 33127 1 81 . 1 1 44 44 ILE H H 44 9.030 9.030 9.255 -0.225 17919 33128 1 81 . 1 1 45 45 PHE N N 45 125.390 125.390 128.118 -2.728 17919 33129 1 81 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.024 0.021 17919 33130 1 81 . 1 1 45 45 PHE C C 45 174.470 174.470 174.794 -0.324 17919 33131 1 81 . 1 1 45 45 PHE CA C 45 57.020 57.020 57.949 -0.929 17919 33132 1 81 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.965 0.795 17919 33133 1 81 . 1 1 45 45 PHE H H 45 8.830 8.830 7.985 0.845 17919 33134 1 81 . 1 1 46 46 ALA N N 46 132.200 132.200 128.485 3.715 17919 33135 1 81 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.663 0.027 17919 33136 1 81 . 1 1 46 46 ALA C C 46 177.290 177.290 177.795 -0.505 17919 33137 1 81 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.670 -0.130 17919 33138 1 81 . 1 1 46 46 ALA CB C 46 16.570 16.570 17.190 -0.620 17919 33139 1 81 . 1 1 46 46 ALA H H 46 8.810 8.810 8.281 0.529 17919 33140 1 81 . 1 1 47 47 GLY N N 47 102.340 102.340 102.953 -0.613 17919 33141 1 81 . 1 1 47 47 GLY C C 47 173.810 173.810 174.163 -0.353 17919 33142 1 81 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.043 0.307 17919 33143 1 81 . 1 1 47 47 GLY H H 47 8.130 8.130 8.592 -0.462 17919 33144 1 81 . 1 1 48 48 LYS N N 48 121.570 121.570 122.231 -0.661 17919 33145 1 81 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.640 -0.018 17919 33146 1 81 . 1 1 48 48 LYS C C 48 174.700 174.700 175.644 -0.944 17919 33147 1 81 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.858 -0.309 17919 33148 1 81 . 1 1 48 48 LYS CB C 48 34.530 34.530 33.590 0.940 17919 33149 1 81 . 1 1 48 48 LYS H H 48 7.980 7.980 7.552 0.428 17919 33150 1 81 . 1 1 49 49 GLN N N 49 122.410 122.410 123.681 -1.271 17919 33151 1 81 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.615 -0.055 17919 33152 1 81 . 1 1 49 49 GLN C C 49 175.670 175.670 175.195 0.475 17919 33153 1 81 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.735 0.005 17919 33154 1 81 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.720 -0.720 17919 33155 1 81 . 1 1 49 49 GLN H H 49 8.600 8.600 8.515 0.085 17919 33156 1 81 . 1 1 50 50 LEU N N 50 125.520 125.520 124.552 0.968 17919 33157 1 81 . 1 1 50 50 LEU HA H 50 4.090 4.090 3.842 0.248 17919 33158 1 81 . 1 1 50 50 LEU C C 50 176.660 176.660 175.206 1.454 17919 33159 1 81 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.816 0.424 17919 33160 1 81 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.228 -0.658 17919 33161 1 81 . 1 1 50 50 LEU H H 50 8.530 8.530 8.164 0.366 17919 33162 1 81 . 1 1 51 51 GLU N N 51 122.940 122.940 122.858 0.082 17919 33163 1 81 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.628 -0.140 17919 33164 1 81 . 1 1 51 51 GLU C C 51 175.870 175.870 176.351 -0.481 17919 33165 1 81 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.095 0.865 17919 33166 1 81 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.969 -1.399 17919 33167 1 81 . 1 1 51 51 GLU H H 51 8.400 8.400 8.428 -0.028 17919 33168 1 81 . 1 1 52 52 ASP N N 52 120.030 120.030 123.829 -3.799 17919 33169 1 81 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.433 -0.074 17919 33170 1 81 . 1 1 52 52 ASP C C 52 177.330 177.330 178.108 -0.778 17919 33171 1 81 . 1 1 52 52 ASP CA C 52 56.960 56.960 58.236 -1.276 17919 33172 1 81 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.722 0.128 17919 33173 1 81 . 1 1 52 52 ASP H H 52 8.160 8.160 8.851 -0.691 17919 33174 1 81 . 1 1 53 53 GLY N N 53 106.660 106.660 104.757 1.903 17919 33175 1 81 . 1 1 53 53 GLY C C 53 174.870 174.870 174.621 0.249 17919 33176 1 81 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.123 0.047 17919 33177 1 81 . 1 1 53 53 GLY H H 53 9.390 9.390 8.312 1.078 17919 33178 1 81 . 1 1 54 54 ARG N N 54 119.050 119.050 120.440 -1.390 17919 33179 1 81 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.701 -0.006 17919 33180 1 81 . 1 1 54 54 ARG C C 54 175.350 175.350 175.302 0.048 17919 33181 1 81 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.426 -0.036 17919 33182 1 81 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.482 0.168 17919 33183 1 81 . 1 1 54 54 ARG H H 54 7.460 7.460 7.875 -0.415 17919 33184 1 81 . 1 1 55 55 THR N N 55 108.400 108.400 113.150 -4.750 17919 33185 1 81 . 1 1 55 55 THR HA H 55 5.240 5.240 4.683 0.557 17919 33186 1 81 . 1 1 55 55 THR C C 55 176.560 176.560 176.328 0.232 17919 33187 1 81 . 1 1 55 55 THR CA C 55 59.690 59.690 61.119 -1.429 17919 33188 1 81 . 1 1 55 55 THR CB C 55 72.260 72.260 70.075 2.186 17919 33189 1 81 . 1 1 55 55 THR H H 55 8.730 8.730 8.259 0.471 17919 33190 1 81 . 1 1 56 56 LEU N N 56 117.920 117.920 121.535 -3.615 17919 33191 1 81 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.005 0.056 17919 33192 1 81 . 1 1 56 56 LEU C C 56 180.810 180.810 178.814 1.996 17919 33193 1 81 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.753 -0.043 17919 33194 1 81 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.248 -0.878 17919 33195 1 81 . 1 1 56 56 LEU H H 56 8.140 8.140 8.644 -0.504 17919 33196 1 81 . 1 1 57 57 SER N N 57 113.330 113.330 111.803 1.527 17919 33197 1 81 . 1 1 57 57 SER HA H 57 4.370 4.370 4.198 0.172 17919 33198 1 81 . 1 1 57 57 SER C C 57 178.310 178.310 176.915 1.395 17919 33199 1 81 . 1 1 57 57 SER CA C 57 61.080 61.080 60.743 0.337 17919 33200 1 81 . 1 1 57 57 SER CB C 57 62.530 62.530 62.461 0.070 17919 33201 1 81 . 1 1 57 57 SER H H 57 8.470 8.470 7.866 0.604 17919 33202 1 81 . 1 1 58 58 ASP N N 58 124.190 124.190 124.059 0.131 17919 33203 1 81 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.235 0.061 17919 33204 1 81 . 1 1 58 58 ASP C C 58 177.400 177.400 176.486 0.914 17919 33205 1 81 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.418 0.762 17919 33206 1 81 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.536 -0.436 17919 33207 1 81 . 1 1 58 58 ASP H H 58 7.930 7.930 7.826 0.104 17919 33208 1 81 . 1 1 59 59 TYR N N 59 115.510 115.510 115.489 0.021 17919 33209 1 81 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.624 0.046 17919 33210 1 81 . 1 1 59 59 TYR C C 59 174.700 174.700 174.972 -0.272 17919 33211 1 81 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.589 0.661 17919 33212 1 81 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.081 1.989 17919 33213 1 81 . 1 1 59 59 TYR H H 59 7.250 7.250 7.454 -0.204 17919 33214 1 81 . 1 1 60 60 ASN N N 60 115.900 115.900 116.672 -0.772 17919 33215 1 81 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.339 0.016 17919 33216 1 81 . 1 1 60 60 ASN C C 60 174.340 174.340 174.388 -0.048 17919 33217 1 81 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.237 -0.117 17919 33218 1 81 . 1 1 60 60 ASN CB C 60 37.410 37.410 36.349 1.061 17919 33219 1 81 . 1 1 60 60 ASN H H 60 8.150 8.150 7.856 0.294 17919 33220 1 81 . 1 1 61 61 ILE N N 61 118.600 118.600 120.837 -2.237 17919 33221 1 81 . 1 1 61 61 ILE HA H 61 3.393 3.393 4.065 -0.672 17919 33222 1 81 . 1 1 61 61 ILE C C 61 174.610 174.610 175.342 -0.732 17919 33223 1 81 . 1 1 61 61 ILE CA C 61 62.420 62.420 60.597 1.823 17919 33224 1 81 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.253 -0.513 17919 33225 1 81 . 1 1 61 61 ILE H H 61 7.250 7.250 7.528 -0.278 17919 33226 1 81 . 1 1 62 62 GLN N N 62 124.740 124.740 126.946 -2.206 17919 33227 1 81 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.471 0.035 17919 33228 1 81 . 1 1 62 62 GLN C C 62 175.970 175.970 175.386 0.584 17919 33229 1 81 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.863 -0.203 17919 33230 1 81 . 1 1 62 62 GLN CB C 62 31.650 31.650 29.553 2.097 17919 33231 1 81 . 1 1 62 62 GLN H H 62 7.610 7.610 8.302 -0.692 17919 33232 1 81 . 1 1 63 63 LYS N N 63 120.300 120.300 118.812 1.488 17919 33233 1 81 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.961 0.040 17919 33234 1 81 . 1 1 63 63 LYS C C 63 175.810 175.810 177.565 -1.755 17919 33235 1 81 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.004 -0.214 17919 33236 1 81 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.242 0.408 17919 33237 1 81 . 1 1 63 63 LYS H H 63 8.490 8.490 8.460 0.030 17919 33238 1 81 . 1 1 64 64 GLU N N 64 113.950 113.950 119.746 -5.796 17919 33239 1 81 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.799 -0.334 17919 33240 1 81 . 1 1 64 64 GLU C C 64 175.250 175.250 175.131 0.119 17919 33241 1 81 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.787 0.103 17919 33242 1 81 . 1 1 64 64 GLU CB C 64 25.900 25.900 29.589 -3.689 17919 33243 1 81 . 1 1 64 64 GLU H H 64 9.280 9.280 9.048 0.232 17919 33244 1 81 . 1 1 65 65 SER N N 65 114.730 114.730 115.923 -1.193 17919 33245 1 81 . 1 1 65 65 SER HA H 65 4.640 4.640 4.457 0.183 17919 33246 1 81 . 1 1 65 65 SER C C 65 172.160 172.160 174.220 -2.060 17919 33247 1 81 . 1 1 65 65 SER CA C 65 60.890 60.890 59.444 1.446 17919 33248 1 81 . 1 1 65 65 SER CB C 65 64.910 64.910 63.416 1.494 17919 33249 1 81 . 1 1 65 65 SER H H 65 7.670 7.670 7.636 0.034 17919 33250 1 81 . 1 1 66 66 THR N N 66 117.110 117.110 122.480 -5.370 17919 33251 1 81 . 1 1 66 66 THR HA H 66 5.270 5.270 4.481 0.789 17919 33252 1 81 . 1 1 66 66 THR C C 66 173.950 173.950 174.279 -0.329 17919 33253 1 81 . 1 1 66 66 THR CA C 66 62.340 62.340 63.532 -1.192 17919 33254 1 81 . 1 1 66 66 THR CB C 66 70.080 70.080 69.340 0.740 17919 33255 1 81 . 1 1 66 66 THR H H 66 8.730 8.730 8.389 0.341 17919 33256 1 81 . 1 1 67 67 LEU N N 67 127.110 127.110 127.506 -0.396 17919 33257 1 81 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.858 0.202 17919 33258 1 81 . 1 1 67 67 LEU C C 67 175.770 175.770 175.663 0.107 17919 33259 1 81 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.198 0.702 17919 33260 1 81 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.442 -0.182 17919 33261 1 81 . 1 1 67 67 LEU H H 67 9.410 9.410 8.719 0.691 17919 33262 1 81 . 1 1 68 68 HIS N N 68 118.380 118.380 118.600 -0.220 17919 33263 1 81 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.093 0.147 17919 33264 1 81 . 1 1 68 68 HIS C C 68 173.150 173.150 174.238 -1.088 17919 33265 1 81 . 1 1 68 68 HIS CA C 68 55.000 55.000 55.402 -0.402 17919 33266 1 81 . 1 1 68 68 HIS CB C 68 30.530 30.530 30.997 -0.467 17919 33267 1 81 . 1 1 68 68 HIS H H 68 9.230 9.230 8.479 0.751 17919 33268 1 81 . 1 1 69 69 LEU N N 69 124.460 124.460 127.407 -2.947 17919 33269 1 81 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.213 -0.023 17919 33270 1 81 . 1 1 69 69 LEU C C 69 175.270 175.270 174.852 0.418 17919 33271 1 81 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.493 0.397 17919 33272 1 81 . 1 1 69 69 LEU CB C 69 44.380 44.380 43.370 1.010 17919 33273 1 81 . 1 1 69 69 LEU H H 69 8.340 8.340 7.947 0.393 17919 33274 1 81 . 1 1 70 70 VAL N N 70 126.940 126.940 123.147 3.793 17919 33275 1 81 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.624 -0.274 17919 33276 1 81 . 1 1 70 70 VAL C C 70 174.000 174.000 174.329 -0.329 17919 33277 1 81 . 1 1 70 70 VAL CA C 70 60.800 60.800 58.904 1.896 17919 33278 1 81 . 1 1 70 70 VAL CB C 70 34.910 34.910 34.872 0.038 17919 33279 1 81 . 1 1 70 70 VAL H H 70 9.200 9.200 8.850 0.350 17919 33280 1 81 . 1 1 71 71 LEU N N 71 123.130 123.130 121.216 1.914 17919 33281 1 81 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.962 0.098 17919 33282 1 81 . 1 1 71 71 LEU C C 71 177.830 177.830 177.941 -0.111 17919 33283 1 81 . 1 1 71 71 LEU CA C 71 53.940 53.940 54.257 -0.317 17919 33284 1 81 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.226 0.624 17919 33285 1 81 . 1 1 71 71 LEU H H 71 8.120 8.120 8.350 -0.230 17919 33286 1 81 . 1 1 72 72 ARG N N 72 123.490 123.490 125.159 -1.669 17919 33287 1 81 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.422 -0.121 17919 33288 1 81 . 1 1 72 72 ARG C C 72 175.350 175.350 175.598 -0.248 17919 33289 1 81 . 1 1 72 72 ARG CA C 72 55.610 55.610 54.958 0.652 17919 33290 1 81 . 1 1 72 72 ARG CB C 72 31.350 31.350 29.253 2.097 17919 33291 1 81 . 1 1 72 72 ARG H H 72 8.580 8.580 8.379 0.201 17919 33292 1 82 . 1 1 2 2 GLN N N 2 123.220 123.220 122.016 1.204 17919 33293 1 82 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.406 -0.157 17919 33294 1 82 . 1 1 2 2 GLN C C 2 175.920 175.920 175.169 0.751 17919 33295 1 82 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.781 0.300 17919 33296 1 82 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.757 0.003 17919 33297 1 82 . 1 1 2 2 GLN H H 2 8.900 8.900 8.363 0.537 17919 33298 1 82 . 1 1 3 3 ILE N N 3 115.340 115.340 118.572 -3.232 17919 33299 1 82 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.365 -0.152 17919 33300 1 82 . 1 1 3 3 ILE C C 3 172.450 172.450 173.817 -1.367 17919 33301 1 82 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.316 0.254 17919 33302 1 82 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.074 1.136 17919 33303 1 82 . 1 1 3 3 ILE H H 3 8.320 8.320 8.738 -0.418 17919 33304 1 82 . 1 1 4 4 PHE N N 4 118.110 118.110 121.671 -3.561 17919 33305 1 82 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.333 0.297 17919 33306 1 82 . 1 1 4 4 PHE C C 4 175.320 175.320 175.103 0.217 17919 33307 1 82 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.393 -0.183 17919 33308 1 82 . 1 1 4 4 PHE CB C 4 41.480 41.480 40.522 0.958 17919 33309 1 82 . 1 1 4 4 PHE H H 4 8.610 8.610 8.776 -0.166 17919 33310 1 82 . 1 1 5 5 VAL N N 5 121.000 121.000 124.518 -3.518 17919 33311 1 82 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.934 -0.209 17919 33312 1 82 . 1 1 5 5 VAL C C 5 174.870 174.870 175.374 -0.504 17919 33313 1 82 . 1 1 5 5 VAL CA C 5 60.620 60.620 60.754 -0.134 17919 33314 1 82 . 1 1 5 5 VAL CB C 5 34.230 34.230 32.611 1.619 17919 33315 1 82 . 1 1 5 5 VAL H H 5 9.300 9.300 8.643 0.657 17919 33316 1 82 . 1 1 6 6 LYS N N 6 127.520 127.520 128.623 -1.103 17919 33317 1 82 . 1 1 6 6 LYS HA H 6 5.367 5.367 4.984 0.383 17919 33318 1 82 . 1 1 6 6 LYS C C 6 177.140 177.140 176.841 0.299 17919 33319 1 82 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.949 -0.429 17919 33320 1 82 . 1 1 6 6 LYS CB C 6 35.050 35.050 33.484 1.566 17919 33321 1 82 . 1 1 6 6 LYS H H 6 8.820 8.820 8.304 0.516 17919 33322 1 82 . 1 1 7 7 THR N N 7 115.400 115.400 117.157 -1.757 17919 33323 1 82 . 1 1 7 7 THR HA H 7 4.970 4.970 4.248 0.722 17919 33324 1 82 . 1 1 7 7 THR C C 7 176.910 176.910 176.022 0.888 17919 33325 1 82 . 1 1 7 7 THR CA C 7 60.470 60.470 60.956 -0.486 17919 33326 1 82 . 1 1 7 7 THR CB C 7 70.630 70.630 69.663 0.967 17919 33327 1 82 . 1 1 7 7 THR H H 7 8.730 8.730 8.079 0.651 17919 33328 1 82 . 1 1 8 8 LEU N N 8 121.330 121.330 119.051 2.279 17919 33329 1 82 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.481 -0.171 17919 33330 1 82 . 1 1 8 8 LEU C C 8 178.800 178.800 177.762 1.038 17919 33331 1 82 . 1 1 8 8 LEU CA C 8 57.580 57.580 56.658 0.922 17919 33332 1 82 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.101 -0.131 17919 33333 1 82 . 1 1 8 8 LEU H H 8 9.100 9.100 8.607 0.493 17919 33334 1 82 . 1 1 9 9 THR N N 9 105.590 105.590 110.010 -4.420 17919 33335 1 82 . 1 1 9 9 THR HA H 9 4.428 4.428 4.433 -0.005 17919 33336 1 82 . 1 1 9 9 THR C C 9 175.520 175.520 175.333 0.187 17919 33337 1 82 . 1 1 9 9 THR CA C 9 61.400 61.400 61.680 -0.280 17919 33338 1 82 . 1 1 9 9 THR CB C 9 69.140 69.140 69.412 -0.272 17919 33339 1 82 . 1 1 9 9 THR H H 9 7.630 7.630 7.493 0.137 17919 33340 1 82 . 1 1 10 10 GLY N N 10 108.890 108.890 110.765 -1.875 17919 33341 1 82 . 1 1 10 10 GLY C C 10 174.070 174.070 173.771 0.299 17919 33342 1 82 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.815 0.645 17919 33343 1 82 . 1 1 10 10 GLY H H 10 7.810 7.810 8.629 -0.819 17919 33344 1 82 . 1 1 11 11 LYS N N 11 121.600 121.600 120.258 1.342 17919 33345 1 82 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.775 -0.414 17919 33346 1 82 . 1 1 11 11 LYS C C 11 175.940 175.940 175.281 0.659 17919 33347 1 82 . 1 1 11 11 LYS CA C 11 56.280 56.280 54.874 1.406 17919 33348 1 82 . 1 1 11 11 LYS CB C 11 33.200 33.200 34.864 -1.664 17919 33349 1 82 . 1 1 11 11 LYS H H 11 7.280 7.280 7.666 -0.386 17919 33350 1 82 . 1 1 12 12 THR N N 12 120.440 120.440 118.207 2.233 17919 33351 1 82 . 1 1 12 12 THR HA H 12 5.046 5.046 4.650 0.396 17919 33352 1 82 . 1 1 12 12 THR C C 12 174.320 174.320 174.274 0.046 17919 33353 1 82 . 1 1 12 12 THR CA C 12 62.390 62.390 62.205 0.185 17919 33354 1 82 . 1 1 12 12 THR CB C 12 69.910 69.910 69.562 0.348 17919 33355 1 82 . 1 1 12 12 THR H H 12 8.650 8.650 8.358 0.292 17919 33356 1 82 . 1 1 13 13 ILE N N 13 127.110 127.110 124.349 2.761 17919 33357 1 82 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.665 -0.121 17919 33358 1 82 . 1 1 13 13 ILE C C 13 175.220 175.220 174.494 0.726 17919 33359 1 82 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.778 0.202 17919 33360 1 82 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.904 0.046 17919 33361 1 82 . 1 1 13 13 ILE H H 13 9.450 9.450 8.825 0.625 17919 33362 1 82 . 1 1 14 14 THR N N 14 121.520 121.520 117.585 3.935 17919 33363 1 82 . 1 1 14 14 THR HA H 14 4.964 4.964 5.324 -0.360 17919 33364 1 82 . 1 1 14 14 THR C C 14 173.790 173.790 174.031 -0.241 17919 33365 1 82 . 1 1 14 14 THR CA C 14 61.940 61.940 60.550 1.390 17919 33366 1 82 . 1 1 14 14 THR CB C 14 69.650 69.650 70.662 -1.012 17919 33367 1 82 . 1 1 14 14 THR H H 14 8.710 8.710 8.273 0.437 17919 33368 1 82 . 1 1 15 15 LEU N N 15 124.800 124.800 126.087 -1.287 17919 33369 1 82 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.709 0.071 17919 33370 1 82 . 1 1 15 15 LEU C C 15 174.670 174.670 175.468 -0.798 17919 33371 1 82 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.766 -0.936 17919 33372 1 82 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.974 1.096 17919 33373 1 82 . 1 1 15 15 LEU H H 15 8.710 8.710 8.655 0.055 17919 33374 1 82 . 1 1 16 16 GLU N N 16 122.160 122.160 123.127 -0.967 17919 33375 1 82 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.806 0.111 17919 33376 1 82 . 1 1 16 16 GLU C C 16 175.860 175.860 175.795 0.065 17919 33377 1 82 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.481 -0.661 17919 33378 1 82 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.204 -0.754 17919 33379 1 82 . 1 1 16 16 GLU H H 16 8.140 8.140 8.735 -0.595 17919 33380 1 82 . 1 1 17 17 VAL N N 17 117.210 117.210 119.884 -2.674 17919 33381 1 82 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.721 -0.007 17919 33382 1 82 . 1 1 17 17 VAL C C 17 174.160 174.160 174.864 -0.704 17919 33383 1 82 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.834 -0.404 17919 33384 1 82 . 1 1 17 17 VAL CB C 17 36.400 36.400 34.535 1.865 17919 33385 1 82 . 1 1 17 17 VAL H H 17 8.900 8.900 8.578 0.322 17919 33386 1 82 . 1 1 18 18 GLU N N 18 118.990 118.990 119.299 -0.309 17919 33387 1 82 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.860 0.219 17919 33388 1 82 . 1 1 18 18 GLU C C 18 176.160 176.160 175.189 0.971 17919 33389 1 82 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.016 -0.296 17919 33390 1 82 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.280 0.030 17919 33391 1 82 . 1 1 18 18 GLU H H 18 8.640 8.640 8.847 -0.207 17919 33392 1 82 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.349 -0.208 17919 33393 1 82 . 1 1 19 19 PRO C C 19 175.310 175.310 178.315 -3.005 17919 33394 1 82 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.538 -0.068 17919 33395 1 82 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.054 -0.104 17919 33396 1 82 . 1 1 20 20 SER N N 20 103.400 103.400 110.934 -7.534 17919 33397 1 82 . 1 1 20 20 SER HA H 20 4.370 4.370 4.197 0.173 17919 33398 1 82 . 1 1 20 20 SER C C 20 174.660 174.660 174.568 0.092 17919 33399 1 82 . 1 1 20 20 SER CA C 20 57.400 57.400 59.862 -2.462 17919 33400 1 82 . 1 1 20 20 SER CB C 20 63.370 63.370 62.971 0.399 17919 33401 1 82 . 1 1 20 20 SER H H 20 7.040 7.040 8.109 -1.069 17919 33402 1 82 . 1 1 21 21 ASP N N 21 123.480 123.480 121.433 2.047 17919 33403 1 82 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.812 -0.117 17919 33404 1 82 . 1 1 21 21 ASP C C 21 176.360 176.360 175.658 0.702 17919 33405 1 82 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.580 1.120 17919 33406 1 82 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.647 -0.847 17919 33407 1 82 . 1 1 21 21 ASP H H 21 8.030 8.030 7.540 0.490 17919 33408 1 82 . 1 1 22 22 THR N N 22 108.800 108.800 110.588 -1.788 17919 33409 1 82 . 1 1 22 22 THR HA H 22 4.920 4.920 4.455 0.465 17919 33410 1 82 . 1 1 22 22 THR C C 22 176.750 176.750 176.066 0.684 17919 33411 1 82 . 1 1 22 22 THR CA C 22 59.690 59.690 61.530 -1.840 17919 33412 1 82 . 1 1 22 22 THR CB C 22 71.200 71.200 70.190 1.010 17919 33413 1 82 . 1 1 22 22 THR H H 22 7.900 7.900 8.201 -0.301 17919 33414 1 82 . 1 1 23 23 ILE N N 23 121.190 121.190 123.494 -2.304 17919 33415 1 82 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.658 -0.001 17919 33416 1 82 . 1 1 23 23 ILE C C 23 179.040 179.040 177.685 1.355 17919 33417 1 82 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.240 -0.980 17919 33418 1 82 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.647 -2.297 17919 33419 1 82 . 1 1 23 23 ILE H H 23 8.560 8.560 8.405 0.155 17919 33420 1 82 . 1 1 24 24 GLU N N 24 120.830 120.830 119.621 1.209 17919 33421 1 82 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.897 0.020 17919 33422 1 82 . 1 1 24 24 GLU C C 24 178.640 178.640 178.545 0.095 17919 33423 1 82 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.877 0.344 17919 33424 1 82 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.442 -1.162 17919 33425 1 82 . 1 1 24 24 GLU H H 24 9.760 9.760 8.110 1.650 17919 33426 1 82 . 1 1 25 25 ASN N N 25 120.570 120.570 117.531 3.039 17919 33427 1 82 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.568 -0.043 17919 33428 1 82 . 1 1 25 25 ASN C C 25 178.380 178.380 177.971 0.409 17919 33429 1 82 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.719 0.341 17919 33430 1 82 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.699 -0.249 17919 33431 1 82 . 1 1 25 25 ASN H H 25 7.920 7.920 7.622 0.298 17919 33432 1 82 . 1 1 26 26 VAL N N 26 121.710 121.710 120.950 0.760 17919 33433 1 82 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.494 -0.097 17919 33434 1 82 . 1 1 26 26 VAL C C 26 177.950 177.950 177.577 0.373 17919 33435 1 82 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.950 0.710 17919 33436 1 82 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.415 -0.575 17919 33437 1 82 . 1 1 26 26 VAL H H 26 8.070 8.070 8.245 -0.175 17919 33438 1 82 . 1 1 27 27 LYS N N 27 118.860 118.860 118.560 0.300 17919 33439 1 82 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.235 0.345 17919 33440 1 82 . 1 1 27 27 LYS C C 27 180.550 180.550 179.036 1.514 17919 33441 1 82 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.098 0.152 17919 33442 1 82 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.225 1.505 17919 33443 1 82 . 1 1 27 27 LYS H H 27 8.560 8.560 7.723 0.837 17919 33444 1 82 . 1 1 28 28 ALA N N 28 123.440 123.440 123.265 0.175 17919 33445 1 82 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.019 0.141 17919 33446 1 82 . 1 1 28 28 ALA C C 28 180.300 180.300 178.943 1.357 17919 33447 1 82 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.324 0.046 17919 33448 1 82 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.324 -0.614 17919 33449 1 82 . 1 1 28 28 ALA H H 28 8.060 8.060 7.802 0.258 17919 33450 1 82 . 1 1 29 29 LYS N N 29 119.940 119.940 119.001 0.939 17919 33451 1 82 . 1 1 29 29 LYS HA H 29 4.207 4.207 3.991 0.216 17919 33452 1 82 . 1 1 29 29 LYS C C 29 180.320 180.320 179.209 1.111 17919 33453 1 82 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.110 0.540 17919 33454 1 82 . 1 1 29 29 LYS CB C 29 33.290 33.290 31.917 1.373 17919 33455 1 82 . 1 1 29 29 LYS H H 29 7.850 7.850 7.417 0.433 17919 33456 1 82 . 1 1 30 30 ILE N N 30 121.080 121.080 119.540 1.540 17919 33457 1 82 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.599 -0.092 17919 33458 1 82 . 1 1 30 30 ILE C C 30 178.310 178.310 177.629 0.681 17919 33459 1 82 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.545 0.605 17919 33460 1 82 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.615 -0.815 17919 33461 1 82 . 1 1 30 30 ILE H H 30 8.280 8.280 8.252 0.028 17919 33462 1 82 . 1 1 31 31 GLN N N 31 123.490 123.490 119.676 3.814 17919 33463 1 82 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.039 -0.210 17919 33464 1 82 . 1 1 31 31 GLN C C 31 178.890 178.890 178.400 0.490 17919 33465 1 82 . 1 1 31 31 GLN CA C 31 60.000 60.000 58.940 1.060 17919 33466 1 82 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.519 -0.799 17919 33467 1 82 . 1 1 31 31 GLN H H 31 8.580 8.580 7.917 0.663 17919 33468 1 82 . 1 1 32 32 ASP N N 32 119.360 119.360 120.644 -1.284 17919 33469 1 82 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.380 -0.026 17919 33470 1 82 . 1 1 32 32 ASP C C 32 177.250 177.250 177.927 -0.677 17919 33471 1 82 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.887 0.303 17919 33472 1 82 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.805 -0.225 17919 33473 1 82 . 1 1 32 32 ASP H H 32 8.010 8.010 8.169 -0.159 17919 33474 1 82 . 1 1 33 33 LYS N N 33 115.130 115.130 118.013 -2.883 17919 33475 1 82 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.266 0.071 17919 33476 1 82 . 1 1 33 33 LYS C C 33 177.870 177.870 177.534 0.336 17919 33477 1 82 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.415 0.635 17919 33478 1 82 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.405 0.765 17919 33479 1 82 . 1 1 33 33 LYS H H 33 7.430 7.430 7.772 -0.342 17919 33480 1 82 . 1 1 34 34 GLU N N 34 113.870 113.870 114.392 -0.522 17919 33481 1 82 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.507 0.118 17919 33482 1 82 . 1 1 34 34 GLU C C 34 177.840 177.840 176.716 1.124 17919 33483 1 82 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.259 -1.089 17919 33484 1 82 . 1 1 34 34 GLU CB C 34 32.660 32.660 32.363 0.297 17919 33485 1 82 . 1 1 34 34 GLU H H 34 8.740 8.740 7.984 0.756 17919 33486 1 82 . 1 1 35 35 GLY N N 35 108.650 108.650 107.779 0.871 17919 33487 1 82 . 1 1 35 35 GLY C C 35 173.960 173.960 174.860 -0.900 17919 33488 1 82 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.227 0.853 17919 33489 1 82 . 1 1 35 35 GLY H H 35 8.530 8.530 7.951 0.579 17919 33490 1 82 . 1 1 36 36 ILE N N 36 119.880 119.880 120.842 -0.962 17919 33491 1 82 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.237 0.208 17919 33492 1 82 . 1 1 36 36 ILE C C 36 173.590 173.590 174.191 -0.601 17919 33493 1 82 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.700 0.050 17919 33494 1 82 . 1 1 36 36 ILE CB C 36 40.580 40.580 36.488 4.092 17919 33495 1 82 . 1 1 36 36 ILE H H 36 6.150 6.150 7.617 -1.467 17919 33496 1 82 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.779 -0.145 17919 33497 1 82 . 1 1 37 37 PRO C C 37 176.940 176.940 176.173 0.767 17919 33498 1 82 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.440 0.220 17919 33499 1 82 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.624 0.226 17919 33500 1 82 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.171 -0.054 17919 33501 1 82 . 1 1 38 38 PRO C C 38 178.320 178.320 178.628 -0.308 17919 33502 1 82 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.573 0.687 17919 33503 1 82 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.927 0.963 17919 33504 1 82 . 1 1 39 39 ASP N N 39 113.380 113.380 117.099 -3.719 17919 33505 1 82 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.398 0.032 17919 33506 1 82 . 1 1 39 39 ASP C C 39 177.090 177.090 177.861 -0.771 17919 33507 1 82 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.948 -1.308 17919 33508 1 82 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.598 -1.058 17919 33509 1 82 . 1 1 39 39 ASP H H 39 8.550 8.550 8.606 -0.056 17919 33510 1 82 . 1 1 40 40 GLN N N 40 116.780 116.780 118.302 -1.522 17919 33511 1 82 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.075 0.389 17919 33512 1 82 . 1 1 40 40 GLN C C 40 175.380 175.380 176.149 -0.769 17919 33513 1 82 . 1 1 40 40 GLN CA C 40 55.640 55.640 57.735 -2.095 17919 33514 1 82 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.194 0.946 17919 33515 1 82 . 1 1 40 40 GLN H H 40 7.820 7.820 7.774 0.046 17919 33516 1 82 . 1 1 41 41 GLN N N 41 117.720 117.720 118.683 -0.963 17919 33517 1 82 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.487 -0.243 17919 33518 1 82 . 1 1 41 41 GLN C C 41 176.300 176.300 175.388 0.912 17919 33519 1 82 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.260 0.210 17919 33520 1 82 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.679 1.971 17919 33521 1 82 . 1 1 41 41 GLN H H 41 7.480 7.480 7.354 0.126 17919 33522 1 82 . 1 1 42 42 ARG N N 42 122.680 122.680 122.538 0.142 17919 33523 1 82 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.693 -0.193 17919 33524 1 82 . 1 1 42 42 ARG C C 42 174.050 174.050 174.554 -0.504 17919 33525 1 82 . 1 1 42 42 ARG CA C 42 55.050 55.050 53.623 1.427 17919 33526 1 82 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.446 -0.696 17919 33527 1 82 . 1 1 42 42 ARG H H 42 8.530 8.530 8.174 0.356 17919 33528 1 82 . 1 1 43 43 LEU N N 43 124.040 124.040 125.571 -1.531 17919 33529 1 82 . 1 1 43 43 LEU C C 43 175.290 175.290 175.653 -0.363 17919 33530 1 82 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.333 -1.353 17919 33531 1 82 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.378 2.412 17919 33532 1 82 . 1 1 43 43 LEU H H 43 8.820 8.820 8.734 0.086 17919 33533 1 82 . 1 1 44 44 ILE N N 44 121.920 121.920 121.636 0.284 17919 33534 1 82 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.641 0.351 17919 33535 1 82 . 1 1 44 44 ILE C C 44 176.060 176.060 174.302 1.758 17919 33536 1 82 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.294 -1.314 17919 33537 1 82 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.375 0.045 17919 33538 1 82 . 1 1 44 44 ILE H H 44 9.030 9.030 8.098 0.932 17919 33539 1 82 . 1 1 45 45 PHE N N 45 125.390 125.390 127.982 -2.592 17919 33540 1 82 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.007 0.038 17919 33541 1 82 . 1 1 45 45 PHE C C 45 174.470 174.470 174.417 0.053 17919 33542 1 82 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.804 0.216 17919 33543 1 82 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.623 1.137 17919 33544 1 82 . 1 1 45 45 PHE H H 45 8.830 8.830 8.289 0.541 17919 33545 1 82 . 1 1 46 46 ALA N N 46 132.200 132.200 130.049 2.151 17919 33546 1 82 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.627 0.063 17919 33547 1 82 . 1 1 46 46 ALA C C 46 177.290 177.290 177.644 -0.354 17919 33548 1 82 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.502 0.038 17919 33549 1 82 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.264 0.306 17919 33550 1 82 . 1 1 46 46 ALA H H 46 8.810 8.810 8.910 -0.100 17919 33551 1 82 . 1 1 47 47 GLY N N 47 102.340 102.340 104.065 -1.725 17919 33552 1 82 . 1 1 47 47 GLY C C 47 173.810 173.810 174.403 -0.593 17919 33553 1 82 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.918 0.432 17919 33554 1 82 . 1 1 47 47 GLY H H 47 8.130 8.130 8.364 -0.234 17919 33555 1 82 . 1 1 48 48 LYS N N 48 121.570 121.570 122.180 -0.610 17919 33556 1 82 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.482 0.140 17919 33557 1 82 . 1 1 48 48 LYS C C 48 174.700 174.700 175.462 -0.762 17919 33558 1 82 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.061 -0.511 17919 33559 1 82 . 1 1 48 48 LYS CB C 48 34.530 34.530 33.616 0.914 17919 33560 1 82 . 1 1 48 48 LYS H H 48 7.980 7.980 7.688 0.292 17919 33561 1 82 . 1 1 49 49 GLN N N 49 122.410 122.410 127.230 -4.820 17919 33562 1 82 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.513 0.047 17919 33563 1 82 . 1 1 49 49 GLN C C 49 175.670 175.670 175.412 0.258 17919 33564 1 82 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.902 -0.162 17919 33565 1 82 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.173 -0.173 17919 33566 1 82 . 1 1 49 49 GLN H H 49 8.600 8.600 8.714 -0.114 17919 33567 1 82 . 1 1 50 50 LEU N N 50 125.520 125.520 128.020 -2.500 17919 33568 1 82 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.317 -0.227 17919 33569 1 82 . 1 1 50 50 LEU C C 50 176.660 176.660 176.391 0.269 17919 33570 1 82 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.879 -0.639 17919 33571 1 82 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.640 -1.070 17919 33572 1 82 . 1 1 50 50 LEU H H 50 8.530 8.530 8.044 0.486 17919 33573 1 82 . 1 1 51 51 GLU N N 51 122.940 122.940 120.005 2.935 17919 33574 1 82 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.613 -0.125 17919 33575 1 82 . 1 1 51 51 GLU C C 51 175.870 175.870 176.200 -0.330 17919 33576 1 82 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.282 0.678 17919 33577 1 82 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.481 0.089 17919 33578 1 82 . 1 1 51 51 GLU H H 51 8.400 8.400 8.319 0.081 17919 33579 1 82 . 1 1 52 52 ASP N N 52 120.030 120.030 124.287 -4.257 17919 33580 1 82 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.363 -0.004 17919 33581 1 82 . 1 1 52 52 ASP C C 52 177.330 177.330 177.749 -0.419 17919 33582 1 82 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.598 -0.638 17919 33583 1 82 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.895 -0.045 17919 33584 1 82 . 1 1 52 52 ASP H H 52 8.160 8.160 8.752 -0.592 17919 33585 1 82 . 1 1 53 53 GLY N N 53 106.660 106.660 105.108 1.552 17919 33586 1 82 . 1 1 53 53 GLY C C 53 174.870 174.870 174.095 0.775 17919 33587 1 82 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.673 0.497 17919 33588 1 82 . 1 1 53 53 GLY H H 53 9.390 9.390 8.392 0.998 17919 33589 1 82 . 1 1 54 54 ARG N N 54 119.050 119.050 121.379 -2.329 17919 33590 1 82 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.662 0.033 17919 33591 1 82 . 1 1 54 54 ARG C C 54 175.350 175.350 175.148 0.202 17919 33592 1 82 . 1 1 54 54 ARG CA C 54 54.390 54.390 55.180 -0.790 17919 33593 1 82 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.462 0.188 17919 33594 1 82 . 1 1 54 54 ARG H H 54 7.460 7.460 7.986 -0.526 17919 33595 1 82 . 1 1 55 55 THR N N 55 108.400 108.400 114.226 -5.826 17919 33596 1 82 . 1 1 55 55 THR HA H 55 5.240 5.240 5.033 0.207 17919 33597 1 82 . 1 1 55 55 THR C C 55 176.560 176.560 175.534 1.026 17919 33598 1 82 . 1 1 55 55 THR CA C 55 59.690 59.690 60.247 -0.557 17919 33599 1 82 . 1 1 55 55 THR CB C 55 72.260 72.260 71.367 0.893 17919 33600 1 82 . 1 1 55 55 THR H H 55 8.730 8.730 8.067 0.663 17919 33601 1 82 . 1 1 56 56 LEU N N 56 117.920 117.920 122.405 -4.485 17919 33602 1 82 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.106 -0.046 17919 33603 1 82 . 1 1 56 56 LEU C C 56 180.810 180.810 178.747 2.063 17919 33604 1 82 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.571 0.140 17919 33605 1 82 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.413 -1.043 17919 33606 1 82 . 1 1 56 56 LEU H H 56 8.140 8.140 8.617 -0.477 17919 33607 1 82 . 1 1 57 57 SER N N 57 113.330 113.330 114.377 -1.047 17919 33608 1 82 . 1 1 57 57 SER HA H 57 4.370 4.370 4.066 0.304 17919 33609 1 82 . 1 1 57 57 SER C C 57 178.310 178.310 176.832 1.478 17919 33610 1 82 . 1 1 57 57 SER CA C 57 61.080 61.080 61.199 -0.119 17919 33611 1 82 . 1 1 57 57 SER CB C 57 62.530 62.530 62.603 -0.073 17919 33612 1 82 . 1 1 57 57 SER H H 57 8.470 8.470 7.986 0.484 17919 33613 1 82 . 1 1 58 58 ASP N N 58 124.190 124.190 121.708 2.482 17919 33614 1 82 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.424 -0.128 17919 33615 1 82 . 1 1 58 58 ASP C C 58 177.400 177.400 176.543 0.857 17919 33616 1 82 . 1 1 58 58 ASP CA C 58 57.180 57.180 55.736 1.444 17919 33617 1 82 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.834 -0.734 17919 33618 1 82 . 1 1 58 58 ASP H H 58 7.930 7.930 7.827 0.103 17919 33619 1 82 . 1 1 59 59 TYR N N 59 115.510 115.510 115.864 -0.354 17919 33620 1 82 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.646 0.024 17919 33621 1 82 . 1 1 59 59 TYR C C 59 174.700 174.700 175.283 -0.583 17919 33622 1 82 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.335 0.915 17919 33623 1 82 . 1 1 59 59 TYR CB C 59 40.070 40.070 37.962 2.108 17919 33624 1 82 . 1 1 59 59 TYR H H 59 7.250 7.250 7.221 0.029 17919 33625 1 82 . 1 1 60 60 ASN N N 60 115.900 115.900 116.563 -0.663 17919 33626 1 82 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.353 0.002 17919 33627 1 82 . 1 1 60 60 ASN C C 60 174.340 174.340 174.550 -0.210 17919 33628 1 82 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.377 -0.257 17919 33629 1 82 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.436 -0.026 17919 33630 1 82 . 1 1 60 60 ASN H H 60 8.150 8.150 7.770 0.380 17919 33631 1 82 . 1 1 61 61 ILE N N 61 118.600 118.600 119.929 -1.329 17919 33632 1 82 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.572 -0.179 17919 33633 1 82 . 1 1 61 61 ILE C C 61 174.610 174.610 175.471 -0.861 17919 33634 1 82 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.353 0.066 17919 33635 1 82 . 1 1 61 61 ILE CB C 61 36.740 36.740 36.508 0.232 17919 33636 1 82 . 1 1 61 61 ILE H H 61 7.250 7.250 8.127 -0.877 17919 33637 1 82 . 1 1 62 62 GLN N N 62 124.740 124.740 126.520 -1.780 17919 33638 1 82 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.492 0.014 17919 33639 1 82 . 1 1 62 62 GLN C C 62 175.970 175.970 175.700 0.270 17919 33640 1 82 . 1 1 62 62 GLN CA C 62 53.660 53.660 54.705 -1.045 17919 33641 1 82 . 1 1 62 62 GLN CB C 62 31.650 31.650 30.695 0.955 17919 33642 1 82 . 1 1 62 62 GLN H H 62 7.610 7.610 7.664 -0.054 17919 33643 1 82 . 1 1 63 63 LYS N N 63 120.300 120.300 118.779 1.521 17919 33644 1 82 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.912 0.089 17919 33645 1 82 . 1 1 63 63 LYS C C 63 175.810 175.810 177.484 -1.674 17919 33646 1 82 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.749 0.041 17919 33647 1 82 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.142 0.508 17919 33648 1 82 . 1 1 63 63 LYS H H 63 8.490 8.490 8.325 0.165 17919 33649 1 82 . 1 1 64 64 GLU N N 64 113.950 113.950 118.232 -4.282 17919 33650 1 82 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.552 -0.087 17919 33651 1 82 . 1 1 64 64 GLU C C 64 175.250 175.250 175.569 -0.319 17919 33652 1 82 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.266 0.624 17919 33653 1 82 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.110 -2.210 17919 33654 1 82 . 1 1 64 64 GLU H H 64 9.280 9.280 8.451 0.829 17919 33655 1 82 . 1 1 65 65 SER N N 65 114.730 114.730 114.470 0.260 17919 33656 1 82 . 1 1 65 65 SER HA H 65 4.640 4.640 4.640 -0.000 17919 33657 1 82 . 1 1 65 65 SER C C 65 172.160 172.160 174.124 -1.964 17919 33658 1 82 . 1 1 65 65 SER CA C 65 60.890 60.890 59.260 1.630 17919 33659 1 82 . 1 1 65 65 SER CB C 65 64.910 64.910 64.174 0.736 17919 33660 1 82 . 1 1 65 65 SER H H 65 7.670 7.670 7.471 0.199 17919 33661 1 82 . 1 1 66 66 THR N N 66 117.110 117.110 119.079 -1.969 17919 33662 1 82 . 1 1 66 66 THR HA H 66 5.270 5.270 5.304 -0.034 17919 33663 1 82 . 1 1 66 66 THR C C 66 173.950 173.950 174.024 -0.074 17919 33664 1 82 . 1 1 66 66 THR CA C 66 62.340 62.340 62.165 0.175 17919 33665 1 82 . 1 1 66 66 THR CB C 66 70.080 70.080 70.154 -0.074 17919 33666 1 82 . 1 1 66 66 THR H H 66 8.730 8.730 8.625 0.105 17919 33667 1 82 . 1 1 67 67 LEU N N 67 127.110 127.110 127.313 -0.203 17919 33668 1 82 . 1 1 67 67 LEU HA H 67 5.060 5.060 5.088 -0.028 17919 33669 1 82 . 1 1 67 67 LEU C C 67 175.770 175.770 175.315 0.455 17919 33670 1 82 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.855 0.045 17919 33671 1 82 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.579 -0.319 17919 33672 1 82 . 1 1 67 67 LEU H H 67 9.410 9.410 8.862 0.548 17919 33673 1 82 . 1 1 68 68 HIS N N 68 118.380 118.380 122.397 -4.017 17919 33674 1 82 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.138 0.102 17919 33675 1 82 . 1 1 68 68 HIS C C 68 173.150 173.150 174.370 -1.220 17919 33676 1 82 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.878 0.122 17919 33677 1 82 . 1 1 68 68 HIS CB C 68 30.530 30.530 31.268 -0.738 17919 33678 1 82 . 1 1 68 68 HIS H H 68 9.230 9.230 8.840 0.390 17919 33679 1 82 . 1 1 69 69 LEU N N 69 124.460 124.460 129.634 -5.174 17919 33680 1 82 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.008 0.182 17919 33681 1 82 . 1 1 69 69 LEU C C 69 175.270 175.270 174.992 0.278 17919 33682 1 82 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.273 -0.383 17919 33683 1 82 . 1 1 69 69 LEU CB C 69 44.380 44.380 43.643 0.737 17919 33684 1 82 . 1 1 69 69 LEU H H 69 8.340 8.340 8.402 -0.062 17919 33685 1 82 . 1 1 70 70 VAL N N 70 126.940 126.940 126.169 0.771 17919 33686 1 82 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.398 -0.048 17919 33687 1 82 . 1 1 70 70 VAL C C 70 174.000 174.000 174.625 -0.625 17919 33688 1 82 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.686 0.114 17919 33689 1 82 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.214 -0.304 17919 33690 1 82 . 1 1 70 70 VAL H H 70 9.200 9.200 8.967 0.233 17919 33691 1 82 . 1 1 71 71 LEU N N 71 123.130 123.130 122.636 0.494 17919 33692 1 82 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.064 -0.004 17919 33693 1 82 . 1 1 71 71 LEU C C 71 177.830 177.830 176.775 1.055 17919 33694 1 82 . 1 1 71 71 LEU CA C 71 53.940 53.940 52.895 1.045 17919 33695 1 82 . 1 1 71 71 LEU CB C 71 42.850 42.850 44.063 -1.213 17919 33696 1 82 . 1 1 71 71 LEU H H 71 8.120 8.120 8.225 -0.105 17919 33697 1 82 . 1 1 72 72 ARG N N 72 123.490 123.490 122.879 0.611 17919 33698 1 82 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.282 0.019 17919 33699 1 82 . 1 1 72 72 ARG C C 72 175.350 175.350 176.043 -0.693 17919 33700 1 82 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.378 -0.768 17919 33701 1 82 . 1 1 72 72 ARG CB C 72 31.350 31.350 29.633 1.717 17919 33702 1 82 . 1 1 72 72 ARG H H 72 8.580 8.580 8.213 0.367 17919 33703 1 83 . 1 1 2 2 GLN N N 2 123.220 123.220 125.666 -2.446 17919 33704 1 83 . 1 1 2 2 GLN HA H 2 5.249 5.249 4.817 0.432 17919 33705 1 83 . 1 1 2 2 GLN C C 2 175.920 175.920 175.401 0.519 17919 33706 1 83 . 1 1 2 2 GLN CA C 2 55.080 55.080 56.510 -1.430 17919 33707 1 83 . 1 1 2 2 GLN CB C 2 30.760 30.760 29.195 1.565 17919 33708 1 83 . 1 1 2 2 GLN H H 2 8.900 8.900 8.540 0.360 17919 33709 1 83 . 1 1 3 3 ILE N N 3 115.340 115.340 118.981 -3.641 17919 33710 1 83 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.378 -0.165 17919 33711 1 83 . 1 1 3 3 ILE C C 3 172.450 172.450 173.614 -1.164 17919 33712 1 83 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.193 0.377 17919 33713 1 83 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.582 0.628 17919 33714 1 83 . 1 1 3 3 ILE H H 3 8.320 8.320 8.431 -0.111 17919 33715 1 83 . 1 1 4 4 PHE N N 4 118.110 118.110 120.652 -2.542 17919 33716 1 83 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.237 0.393 17919 33717 1 83 . 1 1 4 4 PHE C C 4 175.320 175.320 175.249 0.071 17919 33718 1 83 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.345 -0.135 17919 33719 1 83 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.460 0.020 17919 33720 1 83 . 1 1 4 4 PHE H H 4 8.610 8.610 8.735 -0.125 17919 33721 1 83 . 1 1 5 5 VAL N N 5 121.000 121.000 123.244 -2.244 17919 33722 1 83 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.844 -0.119 17919 33723 1 83 . 1 1 5 5 VAL C C 5 174.870 174.870 175.335 -0.465 17919 33724 1 83 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.480 -0.860 17919 33725 1 83 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.198 1.032 17919 33726 1 83 . 1 1 5 5 VAL H H 5 9.300 9.300 8.734 0.566 17919 33727 1 83 . 1 1 6 6 LYS N N 6 127.520 127.520 128.627 -1.107 17919 33728 1 83 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.205 0.162 17919 33729 1 83 . 1 1 6 6 LYS C C 6 177.140 177.140 176.384 0.756 17919 33730 1 83 . 1 1 6 6 LYS CA C 6 54.520 54.520 55.222 -0.702 17919 33731 1 83 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.264 -0.214 17919 33732 1 83 . 1 1 6 6 LYS H H 6 8.820 8.820 9.000 -0.180 17919 33733 1 83 . 1 1 7 7 THR N N 7 115.400 115.400 114.391 1.009 17919 33734 1 83 . 1 1 7 7 THR HA H 7 4.970 4.970 4.673 0.297 17919 33735 1 83 . 1 1 7 7 THR C C 7 176.910 176.910 175.345 1.565 17919 33736 1 83 . 1 1 7 7 THR CA C 7 60.470 60.470 59.586 0.884 17919 33737 1 83 . 1 1 7 7 THR CB C 7 70.630 70.630 70.868 -0.238 17919 33738 1 83 . 1 1 7 7 THR H H 7 8.730 8.730 8.159 0.571 17919 33739 1 83 . 1 1 8 8 LEU N N 8 121.330 121.330 120.343 0.987 17919 33740 1 83 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.545 -0.235 17919 33741 1 83 . 1 1 8 8 LEU C C 8 178.800 178.800 178.578 0.222 17919 33742 1 83 . 1 1 8 8 LEU CA C 8 57.580 57.580 56.937 0.643 17919 33743 1 83 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.711 0.259 17919 33744 1 83 . 1 1 8 8 LEU H H 8 9.100 9.100 8.649 0.451 17919 33745 1 83 . 1 1 9 9 THR N N 9 105.590 105.590 111.993 -6.403 17919 33746 1 83 . 1 1 9 9 THR HA H 9 4.428 4.428 4.400 0.028 17919 33747 1 83 . 1 1 9 9 THR C C 9 175.520 175.520 175.332 0.188 17919 33748 1 83 . 1 1 9 9 THR CA C 9 61.400 61.400 61.203 0.198 17919 33749 1 83 . 1 1 9 9 THR CB C 9 69.140 69.140 67.008 2.132 17919 33750 1 83 . 1 1 9 9 THR H H 9 7.630 7.630 7.857 -0.227 17919 33751 1 83 . 1 1 10 10 GLY N N 10 108.890 108.890 111.405 -2.515 17919 33752 1 83 . 1 1 10 10 GLY C C 10 174.070 174.070 173.711 0.359 17919 33753 1 83 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.129 0.331 17919 33754 1 83 . 1 1 10 10 GLY H H 10 7.810 7.810 8.114 -0.304 17919 33755 1 83 . 1 1 11 11 LYS N N 11 121.600 121.600 121.033 0.567 17919 33756 1 83 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.736 -0.375 17919 33757 1 83 . 1 1 11 11 LYS C C 11 175.940 175.940 175.515 0.425 17919 33758 1 83 . 1 1 11 11 LYS CA C 11 56.280 56.280 54.803 1.477 17919 33759 1 83 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.998 -0.798 17919 33760 1 83 . 1 1 11 11 LYS H H 11 7.280 7.280 7.840 -0.560 17919 33761 1 83 . 1 1 12 12 THR N N 12 120.440 120.440 119.408 1.032 17919 33762 1 83 . 1 1 12 12 THR HA H 12 5.046 5.046 5.133 -0.087 17919 33763 1 83 . 1 1 12 12 THR C C 12 174.320 174.320 174.417 -0.097 17919 33764 1 83 . 1 1 12 12 THR CA C 12 62.390 62.390 61.594 0.796 17919 33765 1 83 . 1 1 12 12 THR CB C 12 69.910 69.910 70.097 -0.186 17919 33766 1 83 . 1 1 12 12 THR H H 12 8.650 8.650 8.284 0.366 17919 33767 1 83 . 1 1 13 13 ILE N N 13 127.110 127.110 124.408 2.702 17919 33768 1 83 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.571 -0.027 17919 33769 1 83 . 1 1 13 13 ILE C C 13 175.220 175.220 175.338 -0.118 17919 33770 1 83 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.932 0.048 17919 33771 1 83 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.993 -0.043 17919 33772 1 83 . 1 1 13 13 ILE H H 13 9.450 9.450 9.029 0.421 17919 33773 1 83 . 1 1 14 14 THR N N 14 121.520 121.520 121.326 0.194 17919 33774 1 83 . 1 1 14 14 THR HA H 14 4.964 4.964 5.068 -0.104 17919 33775 1 83 . 1 1 14 14 THR C C 14 173.790 173.790 173.896 -0.106 17919 33776 1 83 . 1 1 14 14 THR CA C 14 61.940 61.940 61.673 0.267 17919 33777 1 83 . 1 1 14 14 THR CB C 14 69.650 69.650 70.311 -0.661 17919 33778 1 83 . 1 1 14 14 THR H H 14 8.710 8.710 8.360 0.350 17919 33779 1 83 . 1 1 15 15 LEU N N 15 124.800 124.800 127.033 -2.233 17919 33780 1 83 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.663 0.117 17919 33781 1 83 . 1 1 15 15 LEU C C 15 174.670 174.670 174.624 0.046 17919 33782 1 83 . 1 1 15 15 LEU CA C 15 52.830 52.830 54.247 -1.417 17919 33783 1 83 . 1 1 15 15 LEU CB C 15 47.070 47.070 46.110 0.960 17919 33784 1 83 . 1 1 15 15 LEU H H 15 8.710 8.710 8.513 0.197 17919 33785 1 83 . 1 1 16 16 GLU N N 16 122.160 122.160 122.883 -0.723 17919 33786 1 83 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.492 0.425 17919 33787 1 83 . 1 1 16 16 GLU C C 16 175.860 175.860 175.556 0.304 17919 33788 1 83 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.341 -0.521 17919 33789 1 83 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.151 -0.701 17919 33790 1 83 . 1 1 16 16 GLU H H 16 8.140 8.140 8.697 -0.557 17919 33791 1 83 . 1 1 17 17 VAL N N 17 117.210 117.210 122.362 -5.152 17919 33792 1 83 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.490 0.224 17919 33793 1 83 . 1 1 17 17 VAL C C 17 174.160 174.160 174.871 -0.711 17919 33794 1 83 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.242 -0.812 17919 33795 1 83 . 1 1 17 17 VAL CB C 17 36.400 36.400 34.896 1.504 17919 33796 1 83 . 1 1 17 17 VAL H H 17 8.900 8.900 7.975 0.925 17919 33797 1 83 . 1 1 18 18 GLU N N 18 118.990 118.990 117.484 1.506 17919 33798 1 83 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.767 0.312 17919 33799 1 83 . 1 1 18 18 GLU C C 18 176.160 176.160 175.176 0.984 17919 33800 1 83 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.425 -0.705 17919 33801 1 83 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.760 -0.450 17919 33802 1 83 . 1 1 18 18 GLU H H 18 8.640 8.640 8.322 0.318 17919 33803 1 83 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.260 -0.119 17919 33804 1 83 . 1 1 19 19 PRO C C 19 175.310 175.310 177.984 -2.674 17919 33805 1 83 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.866 -0.396 17919 33806 1 83 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.040 -0.090 17919 33807 1 83 . 1 1 20 20 SER N N 20 103.400 103.400 109.211 -5.811 17919 33808 1 83 . 1 1 20 20 SER HA H 20 4.370 4.370 4.171 0.199 17919 33809 1 83 . 1 1 20 20 SER C C 20 174.660 174.660 174.513 0.147 17919 33810 1 83 . 1 1 20 20 SER CA C 20 57.400 57.400 58.889 -1.489 17919 33811 1 83 . 1 1 20 20 SER CB C 20 63.370 63.370 62.741 0.629 17919 33812 1 83 . 1 1 20 20 SER H H 20 7.040 7.040 8.291 -1.251 17919 33813 1 83 . 1 1 21 21 ASP N N 21 123.480 123.480 123.559 -0.079 17919 33814 1 83 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.598 0.097 17919 33815 1 83 . 1 1 21 21 ASP C C 21 176.360 176.360 175.825 0.535 17919 33816 1 83 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.217 0.483 17919 33817 1 83 . 1 1 21 21 ASP CB C 21 40.800 40.800 42.033 -1.233 17919 33818 1 83 . 1 1 21 21 ASP H H 21 8.030 8.030 7.766 0.264 17919 33819 1 83 . 1 1 22 22 THR N N 22 108.800 108.800 113.977 -5.177 17919 33820 1 83 . 1 1 22 22 THR HA H 22 4.920 4.920 4.841 0.079 17919 33821 1 83 . 1 1 22 22 THR C C 22 176.750 176.750 175.449 1.301 17919 33822 1 83 . 1 1 22 22 THR CA C 22 59.690 59.690 60.857 -1.167 17919 33823 1 83 . 1 1 22 22 THR CB C 22 71.200 71.200 70.968 0.232 17919 33824 1 83 . 1 1 22 22 THR H H 22 7.900 7.900 8.163 -0.263 17919 33825 1 83 . 1 1 23 23 ILE N N 23 121.190 121.190 121.934 -0.744 17919 33826 1 83 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.942 -0.285 17919 33827 1 83 . 1 1 23 23 ILE C C 23 179.040 179.040 177.912 1.128 17919 33828 1 83 . 1 1 23 23 ILE CA C 23 62.260 62.260 61.315 0.945 17919 33829 1 83 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.436 -2.086 17919 33830 1 83 . 1 1 23 23 ILE H H 23 8.560 8.560 9.009 -0.449 17919 33831 1 83 . 1 1 24 24 GLU N N 24 120.830 120.830 120.454 0.376 17919 33832 1 83 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.891 0.026 17919 33833 1 83 . 1 1 24 24 GLU C C 24 178.640 178.640 178.678 -0.038 17919 33834 1 83 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.943 0.277 17919 33835 1 83 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.385 -1.105 17919 33836 1 83 . 1 1 24 24 GLU H H 24 9.760 9.760 8.726 1.034 17919 33837 1 83 . 1 1 25 25 ASN N N 25 120.570 120.570 117.253 3.317 17919 33838 1 83 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.620 -0.095 17919 33839 1 83 . 1 1 25 25 ASN C C 25 178.380 178.380 177.912 0.468 17919 33840 1 83 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.677 0.383 17919 33841 1 83 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.215 0.235 17919 33842 1 83 . 1 1 25 25 ASN H H 25 7.920 7.920 7.754 0.166 17919 33843 1 83 . 1 1 26 26 VAL N N 26 121.710 121.710 119.915 1.795 17919 33844 1 83 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.523 -0.126 17919 33845 1 83 . 1 1 26 26 VAL C C 26 177.950 177.950 177.850 0.100 17919 33846 1 83 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.461 1.199 17919 33847 1 83 . 1 1 26 26 VAL CB C 26 30.840 30.840 30.962 -0.122 17919 33848 1 83 . 1 1 26 26 VAL H H 26 8.070 8.070 7.658 0.412 17919 33849 1 83 . 1 1 27 27 LYS N N 27 118.860 118.860 119.798 -0.938 17919 33850 1 83 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.176 0.404 17919 33851 1 83 . 1 1 27 27 LYS C C 27 180.550 180.550 179.024 1.526 17919 33852 1 83 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.283 -0.033 17919 33853 1 83 . 1 1 27 27 LYS CB C 27 33.730 33.730 31.982 1.748 17919 33854 1 83 . 1 1 27 27 LYS H H 27 8.560 8.560 7.474 1.086 17919 33855 1 83 . 1 1 28 28 ALA N N 28 123.440 123.440 122.249 1.191 17919 33856 1 83 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.047 0.113 17919 33857 1 83 . 1 1 28 28 ALA C C 28 180.300 180.300 179.039 1.261 17919 33858 1 83 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.147 0.223 17919 33859 1 83 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.386 -0.676 17919 33860 1 83 . 1 1 28 28 ALA H H 28 8.060 8.060 8.273 -0.213 17919 33861 1 83 . 1 1 29 29 LYS N N 29 119.940 119.940 119.640 0.300 17919 33862 1 83 . 1 1 29 29 LYS HA H 29 4.207 4.207 3.983 0.224 17919 33863 1 83 . 1 1 29 29 LYS C C 29 180.320 180.320 179.157 1.163 17919 33864 1 83 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.437 0.213 17919 33865 1 83 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.165 1.125 17919 33866 1 83 . 1 1 29 29 LYS H H 29 7.850 7.850 7.429 0.421 17919 33867 1 83 . 1 1 30 30 ILE N N 30 121.080 121.080 119.717 1.363 17919 33868 1 83 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.636 -0.129 17919 33869 1 83 . 1 1 30 30 ILE C C 30 178.310 178.310 177.517 0.793 17919 33870 1 83 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.377 0.773 17919 33871 1 83 . 1 1 30 30 ILE CB C 30 36.800 36.800 36.887 -0.087 17919 33872 1 83 . 1 1 30 30 ILE H H 30 8.280 8.280 8.323 -0.043 17919 33873 1 83 . 1 1 31 31 GLN N N 31 123.490 123.490 120.463 3.027 17919 33874 1 83 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.904 -0.075 17919 33875 1 83 . 1 1 31 31 GLN C C 31 178.890 178.890 178.534 0.356 17919 33876 1 83 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.499 0.501 17919 33877 1 83 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.344 -0.624 17919 33878 1 83 . 1 1 31 31 GLN H H 31 8.580 8.580 8.061 0.519 17919 33879 1 83 . 1 1 32 32 ASP N N 32 119.360 119.360 119.767 -0.407 17919 33880 1 83 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.389 -0.035 17919 33881 1 83 . 1 1 32 32 ASP C C 32 177.250 177.250 177.906 -0.656 17919 33882 1 83 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.671 0.519 17919 33883 1 83 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.562 0.018 17919 33884 1 83 . 1 1 32 32 ASP H H 32 8.010 8.010 8.344 -0.334 17919 33885 1 83 . 1 1 33 33 LYS N N 33 115.130 115.130 118.281 -3.151 17919 33886 1 83 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.306 0.031 17919 33887 1 83 . 1 1 33 33 LYS C C 33 177.870 177.870 178.463 -0.593 17919 33888 1 83 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.598 0.452 17919 33889 1 83 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.008 1.162 17919 33890 1 83 . 1 1 33 33 LYS H H 33 7.430 7.430 7.686 -0.256 17919 33891 1 83 . 1 1 34 34 GLU N N 34 113.870 113.870 115.083 -1.213 17919 33892 1 83 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.412 0.213 17919 33893 1 83 . 1 1 34 34 GLU C C 34 177.840 177.840 177.540 0.300 17919 33894 1 83 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.308 -1.138 17919 33895 1 83 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.509 1.151 17919 33896 1 83 . 1 1 34 34 GLU H H 34 8.740 8.740 8.336 0.404 17919 33897 1 83 . 1 1 35 35 GLY N N 35 108.650 108.650 107.731 0.919 17919 33898 1 83 . 1 1 35 35 GLY C C 35 173.960 173.960 174.167 -0.207 17919 33899 1 83 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.524 0.556 17919 33900 1 83 . 1 1 35 35 GLY H H 35 8.530 8.530 8.302 0.228 17919 33901 1 83 . 1 1 36 36 ILE N N 36 119.880 119.880 122.611 -2.731 17919 33902 1 83 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.458 -0.013 17919 33903 1 83 . 1 1 36 36 ILE C C 36 173.590 173.590 174.658 -1.068 17919 33904 1 83 . 1 1 36 36 ILE CA C 36 57.750 57.750 56.736 1.014 17919 33905 1 83 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.087 2.493 17919 33906 1 83 . 1 1 36 36 ILE H H 36 6.150 6.150 7.741 -1.591 17919 33907 1 83 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.665 -0.031 17919 33908 1 83 . 1 1 37 37 PRO C C 37 176.940 176.940 176.428 0.512 17919 33909 1 83 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.944 -0.284 17919 33910 1 83 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.376 0.474 17919 33911 1 83 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.188 -0.071 17919 33912 1 83 . 1 1 38 38 PRO C C 38 178.320 178.320 178.320 0.000 17919 33913 1 83 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.451 0.809 17919 33914 1 83 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.664 1.226 17919 33915 1 83 . 1 1 39 39 ASP N N 39 113.380 113.380 117.222 -3.842 17919 33916 1 83 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.222 0.208 17919 33917 1 83 . 1 1 39 39 ASP C C 39 177.090 177.090 177.436 -0.346 17919 33918 1 83 . 1 1 39 39 ASP CA C 39 55.640 55.640 57.338 -1.698 17919 33919 1 83 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.325 -0.785 17919 33920 1 83 . 1 1 39 39 ASP H H 39 8.550 8.550 8.677 -0.127 17919 33921 1 83 . 1 1 40 40 GLN N N 40 116.780 116.780 116.894 -0.114 17919 33922 1 83 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.263 0.201 17919 33923 1 83 . 1 1 40 40 GLN C C 40 175.380 175.380 176.386 -1.006 17919 33924 1 83 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.451 -0.811 17919 33925 1 83 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.280 0.860 17919 33926 1 83 . 1 1 40 40 GLN H H 40 7.820 7.820 7.738 0.082 17919 33927 1 83 . 1 1 41 41 GLN N N 41 117.720 117.720 119.209 -1.489 17919 33928 1 83 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.439 -0.195 17919 33929 1 83 . 1 1 41 41 GLN C C 41 176.300 176.300 174.923 1.377 17919 33930 1 83 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.689 0.781 17919 33931 1 83 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.766 1.884 17919 33932 1 83 . 1 1 41 41 GLN H H 41 7.480 7.480 7.475 0.005 17919 33933 1 83 . 1 1 42 42 ARG N N 42 122.680 122.680 123.809 -1.129 17919 33934 1 83 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.588 -0.088 17919 33935 1 83 . 1 1 42 42 ARG C C 42 174.050 174.050 175.028 -0.978 17919 33936 1 83 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.129 -0.079 17919 33937 1 83 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.032 -0.282 17919 33938 1 83 . 1 1 42 42 ARG H H 42 8.530 8.530 8.529 0.001 17919 33939 1 83 . 1 1 43 43 LEU N N 43 124.040 124.040 125.219 -1.179 17919 33940 1 83 . 1 1 43 43 LEU C C 43 175.290 175.290 175.493 -0.203 17919 33941 1 83 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.310 -1.330 17919 33942 1 83 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.522 2.268 17919 33943 1 83 . 1 1 43 43 LEU H H 43 8.820 8.820 8.686 0.134 17919 33944 1 83 . 1 1 44 44 ILE N N 44 121.920 121.920 119.952 1.968 17919 33945 1 83 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.814 0.178 17919 33946 1 83 . 1 1 44 44 ILE C C 44 176.060 176.060 174.575 1.485 17919 33947 1 83 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.113 -1.133 17919 33948 1 83 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.122 0.298 17919 33949 1 83 . 1 1 44 44 ILE H H 44 9.030 9.030 7.954 1.076 17919 33950 1 83 . 1 1 45 45 PHE N N 45 125.390 125.390 127.225 -1.835 17919 33951 1 83 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.933 0.112 17919 33952 1 83 . 1 1 45 45 PHE C C 45 174.470 174.470 174.088 0.382 17919 33953 1 83 . 1 1 45 45 PHE CA C 45 57.020 57.020 57.623 -0.603 17919 33954 1 83 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.958 0.802 17919 33955 1 83 . 1 1 45 45 PHE H H 45 8.830 8.830 8.902 -0.072 17919 33956 1 83 . 1 1 46 46 ALA N N 46 132.200 132.200 130.159 2.041 17919 33957 1 83 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.666 0.024 17919 33958 1 83 . 1 1 46 46 ALA C C 46 177.290 177.290 177.876 -0.586 17919 33959 1 83 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.555 -0.015 17919 33960 1 83 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.594 -0.024 17919 33961 1 83 . 1 1 46 46 ALA H H 46 8.810 8.810 8.774 0.036 17919 33962 1 83 . 1 1 47 47 GLY N N 47 102.340 102.340 103.930 -1.590 17919 33963 1 83 . 1 1 47 47 GLY C C 47 173.810 173.810 174.277 -0.467 17919 33964 1 83 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.147 0.203 17919 33965 1 83 . 1 1 47 47 GLY H H 47 8.130 8.130 8.441 -0.311 17919 33966 1 83 . 1 1 48 48 LYS N N 48 121.570 121.570 121.959 -0.389 17919 33967 1 83 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.561 0.061 17919 33968 1 83 . 1 1 48 48 LYS C C 48 174.700 174.700 175.153 -0.453 17919 33969 1 83 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.153 0.397 17919 33970 1 83 . 1 1 48 48 LYS CB C 48 34.530 34.530 33.872 0.658 17919 33971 1 83 . 1 1 48 48 LYS H H 48 7.980 7.980 7.679 0.301 17919 33972 1 83 . 1 1 49 49 GLN N N 49 122.410 122.410 127.320 -4.910 17919 33973 1 83 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.704 -0.144 17919 33974 1 83 . 1 1 49 49 GLN C C 49 175.670 175.670 175.482 0.188 17919 33975 1 83 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.044 -0.304 17919 33976 1 83 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.369 -0.369 17919 33977 1 83 . 1 1 49 49 GLN H H 49 8.600 8.600 8.721 -0.121 17919 33978 1 83 . 1 1 50 50 LEU N N 50 125.520 125.520 127.576 -2.056 17919 33979 1 83 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.210 -0.120 17919 33980 1 83 . 1 1 50 50 LEU C C 50 176.660 176.660 176.630 0.030 17919 33981 1 83 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.349 -0.108 17919 33982 1 83 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.355 -0.785 17919 33983 1 83 . 1 1 50 50 LEU H H 50 8.530 8.530 7.864 0.666 17919 33984 1 83 . 1 1 51 51 GLU N N 51 122.940 122.940 117.569 5.371 17919 33985 1 83 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.530 -0.042 17919 33986 1 83 . 1 1 51 51 GLU C C 51 175.870 175.870 175.800 0.070 17919 33987 1 83 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.941 0.019 17919 33988 1 83 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.721 -0.151 17919 33989 1 83 . 1 1 51 51 GLU H H 51 8.400 8.400 8.346 0.054 17919 33990 1 83 . 1 1 52 52 ASP N N 52 120.030 120.030 125.156 -5.126 17919 33991 1 83 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.481 -0.122 17919 33992 1 83 . 1 1 52 52 ASP C C 52 177.330 177.330 177.957 -0.627 17919 33993 1 83 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.200 -0.240 17919 33994 1 83 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.975 -0.125 17919 33995 1 83 . 1 1 52 52 ASP H H 52 8.160 8.160 8.828 -0.668 17919 33996 1 83 . 1 1 53 53 GLY N N 53 106.660 106.660 106.089 0.571 17919 33997 1 83 . 1 1 53 53 GLY C C 53 174.870 174.870 174.687 0.183 17919 33998 1 83 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.916 0.254 17919 33999 1 83 . 1 1 53 53 GLY H H 53 9.390 9.390 8.305 1.085 17919 34000 1 83 . 1 1 54 54 ARG N N 54 119.050 119.050 121.825 -2.775 17919 34001 1 83 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.518 0.177 17919 34002 1 83 . 1 1 54 54 ARG C C 54 175.350 175.350 175.710 -0.360 17919 34003 1 83 . 1 1 54 54 ARG CA C 54 54.390 54.390 55.459 -1.069 17919 34004 1 83 . 1 1 54 54 ARG CB C 54 32.650 32.650 31.398 1.252 17919 34005 1 83 . 1 1 54 54 ARG H H 54 7.460 7.460 7.790 -0.330 17919 34006 1 83 . 1 1 55 55 THR N N 55 108.400 108.400 113.267 -4.867 17919 34007 1 83 . 1 1 55 55 THR HA H 55 5.240 5.240 5.048 0.192 17919 34008 1 83 . 1 1 55 55 THR C C 55 176.560 176.560 175.571 0.989 17919 34009 1 83 . 1 1 55 55 THR CA C 55 59.690 59.690 60.285 -0.595 17919 34010 1 83 . 1 1 55 55 THR CB C 55 72.260 72.260 71.212 1.048 17919 34011 1 83 . 1 1 55 55 THR H H 55 8.730 8.730 8.062 0.668 17919 34012 1 83 . 1 1 56 56 LEU N N 56 117.920 117.920 121.121 -3.201 17919 34013 1 83 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.090 -0.030 17919 34014 1 83 . 1 1 56 56 LEU C C 56 180.810 180.810 178.845 1.965 17919 34015 1 83 . 1 1 56 56 LEU CA C 56 58.710 58.710 57.623 1.087 17919 34016 1 83 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.621 -1.251 17919 34017 1 83 . 1 1 56 56 LEU H H 56 8.140 8.140 8.781 -0.641 17919 34018 1 83 . 1 1 57 57 SER N N 57 113.330 113.330 115.242 -1.912 17919 34019 1 83 . 1 1 57 57 SER HA H 57 4.370 4.370 4.077 0.293 17919 34020 1 83 . 1 1 57 57 SER C C 57 178.310 178.310 177.002 1.308 17919 34021 1 83 . 1 1 57 57 SER CA C 57 61.080 61.080 61.453 -0.373 17919 34022 1 83 . 1 1 57 57 SER CB C 57 62.530 62.530 62.206 0.324 17919 34023 1 83 . 1 1 57 57 SER H H 57 8.470 8.470 7.950 0.520 17919 34024 1 83 . 1 1 58 58 ASP N N 58 124.190 124.190 122.891 1.299 17919 34025 1 83 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.223 0.073 17919 34026 1 83 . 1 1 58 58 ASP C C 58 177.400 177.400 176.822 0.578 17919 34027 1 83 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.416 0.763 17919 34028 1 83 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.549 -0.449 17919 34029 1 83 . 1 1 58 58 ASP H H 58 7.930 7.930 7.874 0.056 17919 34030 1 83 . 1 1 59 59 TYR N N 59 115.510 115.510 114.391 1.119 17919 34031 1 83 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.760 -0.090 17919 34032 1 83 . 1 1 59 59 TYR C C 59 174.700 174.700 174.816 -0.116 17919 34033 1 83 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.303 0.947 17919 34034 1 83 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.665 1.405 17919 34035 1 83 . 1 1 59 59 TYR H H 59 7.250 7.250 7.236 0.014 17919 34036 1 83 . 1 1 60 60 ASN N N 60 115.900 115.900 116.300 -0.400 17919 34037 1 83 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.352 0.003 17919 34038 1 83 . 1 1 60 60 ASN C C 60 174.340 174.340 174.504 -0.164 17919 34039 1 83 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.379 -0.259 17919 34040 1 83 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.820 -0.410 17919 34041 1 83 . 1 1 60 60 ASN H H 60 8.150 8.150 7.644 0.506 17919 34042 1 83 . 1 1 61 61 ILE N N 61 118.600 118.600 119.235 -0.635 17919 34043 1 83 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.614 -0.221 17919 34044 1 83 . 1 1 61 61 ILE C C 61 174.610 174.610 175.331 -0.721 17919 34045 1 83 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.458 -0.038 17919 34046 1 83 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.208 -0.467 17919 34047 1 83 . 1 1 61 61 ILE H H 61 7.250 7.250 7.691 -0.441 17919 34048 1 83 . 1 1 62 62 GLN N N 62 124.740 124.740 125.130 -0.390 17919 34049 1 83 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.715 -0.209 17919 34050 1 83 . 1 1 62 62 GLN C C 62 175.970 175.970 175.214 0.756 17919 34051 1 83 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.887 -0.227 17919 34052 1 83 . 1 1 62 62 GLN CB C 62 31.650 31.650 33.947 -2.297 17919 34053 1 83 . 1 1 62 62 GLN H H 62 7.610 7.610 7.996 -0.386 17919 34054 1 83 . 1 1 63 63 LYS N N 63 120.300 120.300 121.983 -1.683 17919 34055 1 83 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.008 -0.007 17919 34056 1 83 . 1 1 63 63 LYS C C 63 175.810 175.810 176.848 -1.038 17919 34057 1 83 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.410 0.380 17919 34058 1 83 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.689 0.961 17919 34059 1 83 . 1 1 63 63 LYS H H 63 8.490 8.490 8.688 -0.198 17919 34060 1 83 . 1 1 64 64 GLU N N 64 113.950 113.950 119.845 -5.895 17919 34061 1 83 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.407 0.058 17919 34062 1 83 . 1 1 64 64 GLU C C 64 175.250 175.250 176.317 -1.067 17919 34063 1 83 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.380 0.510 17919 34064 1 83 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.160 -2.260 17919 34065 1 83 . 1 1 64 64 GLU H H 64 9.280 9.280 8.572 0.708 17919 34066 1 83 . 1 1 65 65 SER N N 65 114.730 114.730 115.199 -0.469 17919 34067 1 83 . 1 1 65 65 SER HA H 65 4.640 4.640 4.444 0.196 17919 34068 1 83 . 1 1 65 65 SER C C 65 172.160 172.160 174.002 -1.842 17919 34069 1 83 . 1 1 65 65 SER CA C 65 60.890 60.890 60.580 0.310 17919 34070 1 83 . 1 1 65 65 SER CB C 65 64.910 64.910 63.996 0.914 17919 34071 1 83 . 1 1 65 65 SER H H 65 7.670 7.670 7.691 -0.021 17919 34072 1 83 . 1 1 66 66 THR N N 66 117.110 117.110 118.166 -1.056 17919 34073 1 83 . 1 1 66 66 THR HA H 66 5.270 5.270 5.244 0.026 17919 34074 1 83 . 1 1 66 66 THR C C 66 173.950 173.950 174.004 -0.054 17919 34075 1 83 . 1 1 66 66 THR CA C 66 62.340 62.340 62.085 0.255 17919 34076 1 83 . 1 1 66 66 THR CB C 66 70.080 70.080 70.563 -0.483 17919 34077 1 83 . 1 1 66 66 THR H H 66 8.730 8.730 8.567 0.163 17919 34078 1 83 . 1 1 67 67 LEU N N 67 127.110 127.110 127.126 -0.016 17919 34079 1 83 . 1 1 67 67 LEU HA H 67 5.060 5.060 5.051 0.009 17919 34080 1 83 . 1 1 67 67 LEU C C 67 175.770 175.770 175.269 0.501 17919 34081 1 83 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.141 -0.241 17919 34082 1 83 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.334 -0.074 17919 34083 1 83 . 1 1 67 67 LEU H H 67 9.410 9.410 8.849 0.561 17919 34084 1 83 . 1 1 68 68 HIS N N 68 118.380 118.380 122.435 -4.055 17919 34085 1 83 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.223 0.017 17919 34086 1 83 . 1 1 68 68 HIS C C 68 173.150 173.150 174.810 -1.660 17919 34087 1 83 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.153 0.848 17919 34088 1 83 . 1 1 68 68 HIS CB C 68 30.530 30.530 30.148 0.382 17919 34089 1 83 . 1 1 68 68 HIS H H 68 9.230 9.230 8.493 0.737 17919 34090 1 83 . 1 1 69 69 LEU N N 69 124.460 124.460 129.388 -4.928 17919 34091 1 83 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.850 0.340 17919 34092 1 83 . 1 1 69 69 LEU C C 69 175.270 175.270 174.612 0.658 17919 34093 1 83 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.832 -0.942 17919 34094 1 83 . 1 1 69 69 LEU CB C 69 44.380 44.380 43.199 1.181 17919 34095 1 83 . 1 1 69 69 LEU H H 69 8.340 8.340 7.651 0.689 17919 34096 1 83 . 1 1 70 70 VAL N N 70 126.940 126.940 126.972 -0.032 17919 34097 1 83 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.275 0.075 17919 34098 1 83 . 1 1 70 70 VAL C C 70 174.000 174.000 174.817 -0.817 17919 34099 1 83 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.857 -0.057 17919 34100 1 83 . 1 1 70 70 VAL CB C 70 34.910 34.910 33.902 1.008 17919 34101 1 83 . 1 1 70 70 VAL H H 70 9.200 9.200 8.925 0.275 17919 34102 1 83 . 1 1 71 71 LEU N N 71 123.130 123.130 126.932 -3.802 17919 34103 1 83 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.755 0.305 17919 34104 1 83 . 1 1 71 71 LEU C C 71 177.830 177.830 177.646 0.184 17919 34105 1 83 . 1 1 71 71 LEU CA C 71 53.940 53.940 54.376 -0.436 17919 34106 1 83 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.808 0.042 17919 34107 1 83 . 1 1 71 71 LEU H H 71 8.120 8.120 8.457 -0.337 17919 34108 1 83 . 1 1 72 72 ARG N N 72 123.490 123.490 124.348 -0.858 17919 34109 1 83 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.198 0.103 17919 34110 1 83 . 1 1 72 72 ARG C C 72 175.350 175.350 175.117 0.233 17919 34111 1 83 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.590 -0.980 17919 34112 1 83 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.860 0.490 17919 34113 1 83 . 1 1 72 72 ARG H H 72 8.580 8.580 8.086 0.494 17919 34114 1 84 . 1 1 2 2 GLN N N 2 123.220 123.220 118.456 4.764 17919 34115 1 84 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.247 0.002 17919 34116 1 84 . 1 1 2 2 GLN C C 2 175.920 175.920 174.582 1.338 17919 34117 1 84 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.737 0.343 17919 34118 1 84 . 1 1 2 2 GLN CB C 2 30.760 30.760 32.431 -1.671 17919 34119 1 84 . 1 1 2 2 GLN H H 2 8.900 8.900 8.400 0.500 17919 34120 1 84 . 1 1 3 3 ILE N N 3 115.340 115.340 115.524 -0.184 17919 34121 1 84 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.263 -0.050 17919 34122 1 84 . 1 1 3 3 ILE C C 3 172.450 172.450 173.250 -0.800 17919 34123 1 84 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.507 0.063 17919 34124 1 84 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.650 0.560 17919 34125 1 84 . 1 1 3 3 ILE H H 3 8.320 8.320 8.795 -0.475 17919 34126 1 84 . 1 1 4 4 PHE N N 4 118.110 118.110 119.373 -1.263 17919 34127 1 84 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.542 0.088 17919 34128 1 84 . 1 1 4 4 PHE C C 4 175.320 175.320 175.207 0.113 17919 34129 1 84 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.345 -0.135 17919 34130 1 84 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.125 -0.645 17919 34131 1 84 . 1 1 4 4 PHE H H 4 8.610 8.610 8.707 -0.097 17919 34132 1 84 . 1 1 5 5 VAL N N 5 121.000 121.000 121.285 -0.285 17919 34133 1 84 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.793 -0.068 17919 34134 1 84 . 1 1 5 5 VAL C C 5 174.870 174.870 174.792 0.078 17919 34135 1 84 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.359 -0.739 17919 34136 1 84 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.505 -0.275 17919 34137 1 84 . 1 1 5 5 VAL H H 5 9.300 9.300 9.036 0.264 17919 34138 1 84 . 1 1 6 6 LYS N N 6 127.520 127.520 129.375 -1.855 17919 34139 1 84 . 1 1 6 6 LYS HA H 6 5.367 5.367 4.980 0.387 17919 34140 1 84 . 1 1 6 6 LYS C C 6 177.140 177.140 176.464 0.676 17919 34141 1 84 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.874 -0.354 17919 34142 1 84 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.627 0.423 17919 34143 1 84 . 1 1 6 6 LYS H H 6 8.820 8.820 8.359 0.461 17919 34144 1 84 . 1 1 7 7 THR N N 7 115.400 115.400 117.355 -1.955 17919 34145 1 84 . 1 1 7 7 THR HA H 7 4.970 4.970 4.309 0.661 17919 34146 1 84 . 1 1 7 7 THR C C 7 176.910 176.910 176.341 0.569 17919 34147 1 84 . 1 1 7 7 THR CA C 7 60.470 60.470 61.331 -0.861 17919 34148 1 84 . 1 1 7 7 THR CB C 7 70.630 70.630 70.001 0.629 17919 34149 1 84 . 1 1 7 7 THR H H 7 8.730 8.730 8.483 0.247 17919 34150 1 84 . 1 1 8 8 LEU N N 8 121.330 121.330 120.902 0.428 17919 34151 1 84 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.241 0.069 17919 34152 1 84 . 1 1 8 8 LEU C C 8 178.800 178.800 177.647 1.153 17919 34153 1 84 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.691 -0.111 17919 34154 1 84 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.259 -0.289 17919 34155 1 84 . 1 1 8 8 LEU H H 8 9.100 9.100 8.136 0.964 17919 34156 1 84 . 1 1 9 9 THR N N 9 105.590 105.590 106.898 -1.308 17919 34157 1 84 . 1 1 9 9 THR HA H 9 4.428 4.428 4.339 0.089 17919 34158 1 84 . 1 1 9 9 THR C C 9 175.520 175.520 175.390 0.130 17919 34159 1 84 . 1 1 9 9 THR CA C 9 61.400 61.400 61.813 -0.413 17919 34160 1 84 . 1 1 9 9 THR CB C 9 69.140 69.140 69.192 -0.052 17919 34161 1 84 . 1 1 9 9 THR H H 9 7.630 7.630 7.668 -0.038 17919 34162 1 84 . 1 1 10 10 GLY N N 10 108.890 108.890 110.950 -2.060 17919 34163 1 84 . 1 1 10 10 GLY C C 10 174.070 174.070 174.020 0.050 17919 34164 1 84 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.706 0.754 17919 34165 1 84 . 1 1 10 10 GLY H H 10 7.810 7.810 7.507 0.303 17919 34166 1 84 . 1 1 11 11 LYS N N 11 121.600 121.600 123.768 -2.168 17919 34167 1 84 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.186 0.175 17919 34168 1 84 . 1 1 11 11 LYS C C 11 175.940 175.940 175.465 0.475 17919 34169 1 84 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.529 -0.249 17919 34170 1 84 . 1 1 11 11 LYS CB C 11 33.200 33.200 32.623 0.577 17919 34171 1 84 . 1 1 11 11 LYS H H 11 7.280 7.280 7.820 -0.540 17919 34172 1 84 . 1 1 12 12 THR N N 12 120.440 120.440 122.431 -1.991 17919 34173 1 84 . 1 1 12 12 THR HA H 12 5.046 5.046 4.893 0.153 17919 34174 1 84 . 1 1 12 12 THR C C 12 174.320 174.320 174.677 -0.357 17919 34175 1 84 . 1 1 12 12 THR CA C 12 62.390 62.390 62.296 0.094 17919 34176 1 84 . 1 1 12 12 THR CB C 12 69.910 69.910 69.270 0.640 17919 34177 1 84 . 1 1 12 12 THR H H 12 8.650 8.650 8.313 0.337 17919 34178 1 84 . 1 1 13 13 ILE N N 13 127.110 127.110 123.092 4.018 17919 34179 1 84 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.751 -0.207 17919 34180 1 84 . 1 1 13 13 ILE C C 13 175.220 175.220 174.100 1.120 17919 34181 1 84 . 1 1 13 13 ILE CA C 13 59.980 59.980 58.703 1.277 17919 34182 1 84 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.538 -0.587 17919 34183 1 84 . 1 1 13 13 ILE H H 13 9.450 9.450 8.842 0.608 17919 34184 1 84 . 1 1 14 14 THR N N 14 121.520 121.520 118.743 2.777 17919 34185 1 84 . 1 1 14 14 THR HA H 14 4.964 4.964 5.204 -0.240 17919 34186 1 84 . 1 1 14 14 THR C C 14 173.790 173.790 173.983 -0.193 17919 34187 1 84 . 1 1 14 14 THR CA C 14 61.940 61.940 61.145 0.794 17919 34188 1 84 . 1 1 14 14 THR CB C 14 69.650 69.650 70.249 -0.599 17919 34189 1 84 . 1 1 14 14 THR H H 14 8.710 8.710 8.366 0.344 17919 34190 1 84 . 1 1 15 15 LEU N N 15 124.800 124.800 126.273 -1.473 17919 34191 1 84 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.779 0.001 17919 34192 1 84 . 1 1 15 15 LEU C C 15 174.670 174.670 175.171 -0.501 17919 34193 1 84 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.716 -0.886 17919 34194 1 84 . 1 1 15 15 LEU CB C 15 47.070 47.070 44.196 2.874 17919 34195 1 84 . 1 1 15 15 LEU H H 15 8.710 8.710 8.869 -0.159 17919 34196 1 84 . 1 1 16 16 GLU N N 16 122.160 122.160 124.512 -2.352 17919 34197 1 84 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.780 0.137 17919 34198 1 84 . 1 1 16 16 GLU C C 16 175.860 175.860 175.544 0.316 17919 34199 1 84 . 1 1 16 16 GLU CA C 16 54.820 54.820 56.010 -1.190 17919 34200 1 84 . 1 1 16 16 GLU CB C 16 29.450 29.450 29.972 -0.522 17919 34201 1 84 . 1 1 16 16 GLU H H 16 8.140 8.140 8.504 -0.364 17919 34202 1 84 . 1 1 17 17 VAL N N 17 117.210 117.210 119.848 -2.638 17919 34203 1 84 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.917 -0.203 17919 34204 1 84 . 1 1 17 17 VAL C C 17 174.160 174.160 174.393 -0.233 17919 34205 1 84 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.311 -0.881 17919 34206 1 84 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.108 1.292 17919 34207 1 84 . 1 1 17 17 VAL H H 17 8.900 8.900 8.275 0.625 17919 34208 1 84 . 1 1 18 18 GLU N N 18 118.990 118.990 121.095 -2.105 17919 34209 1 84 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.913 0.166 17919 34210 1 84 . 1 1 18 18 GLU C C 18 176.160 176.160 175.978 0.182 17919 34211 1 84 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.062 -0.342 17919 34212 1 84 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.533 -0.223 17919 34213 1 84 . 1 1 18 18 GLU H H 18 8.640 8.640 9.255 -0.615 17919 34214 1 84 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.107 0.034 17919 34215 1 84 . 1 1 19 19 PRO C C 19 175.310 175.310 178.944 -3.634 17919 34216 1 84 . 1 1 19 19 PRO CA C 19 65.470 65.470 66.205 -0.735 17919 34217 1 84 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.836 0.114 17919 34218 1 84 . 1 1 20 20 SER N N 20 103.400 103.400 111.791 -8.391 17919 34219 1 84 . 1 1 20 20 SER HA H 20 4.370 4.370 4.186 0.184 17919 34220 1 84 . 1 1 20 20 SER C C 20 174.660 174.660 175.079 -0.419 17919 34221 1 84 . 1 1 20 20 SER CA C 20 57.400 57.400 60.040 -2.640 17919 34222 1 84 . 1 1 20 20 SER CB C 20 63.370 63.370 62.957 0.413 17919 34223 1 84 . 1 1 20 20 SER H H 20 7.040 7.040 8.184 -1.144 17919 34224 1 84 . 1 1 21 21 ASP N N 21 123.480 123.480 122.601 0.879 17919 34225 1 84 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.741 -0.046 17919 34226 1 84 . 1 1 21 21 ASP C C 21 176.360 176.360 175.632 0.728 17919 34227 1 84 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.194 0.506 17919 34228 1 84 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.781 -0.980 17919 34229 1 84 . 1 1 21 21 ASP H H 21 8.030 8.030 7.725 0.305 17919 34230 1 84 . 1 1 22 22 THR N N 22 108.800 108.800 114.290 -5.490 17919 34231 1 84 . 1 1 22 22 THR HA H 22 4.920 4.920 5.002 -0.082 17919 34232 1 84 . 1 1 22 22 THR C C 22 176.750 176.750 176.388 0.362 17919 34233 1 84 . 1 1 22 22 THR CA C 22 59.690 59.690 61.336 -1.646 17919 34234 1 84 . 1 1 22 22 THR CB C 22 71.200 71.200 69.893 1.307 17919 34235 1 84 . 1 1 22 22 THR H H 22 7.900 7.900 8.303 -0.403 17919 34236 1 84 . 1 1 23 23 ILE N N 23 121.190 121.190 123.263 -2.073 17919 34237 1 84 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.668 -0.011 17919 34238 1 84 . 1 1 23 23 ILE C C 23 179.040 179.040 177.698 1.342 17919 34239 1 84 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.182 -0.922 17919 34240 1 84 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.550 -2.200 17919 34241 1 84 . 1 1 23 23 ILE H H 23 8.560 8.560 9.118 -0.558 17919 34242 1 84 . 1 1 24 24 GLU N N 24 120.830 120.830 119.726 1.104 17919 34243 1 84 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.843 0.074 17919 34244 1 84 . 1 1 24 24 GLU C C 24 178.640 178.640 178.492 0.148 17919 34245 1 84 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.894 0.326 17919 34246 1 84 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.459 -1.179 17919 34247 1 84 . 1 1 24 24 GLU H H 24 9.760 9.760 8.261 1.499 17919 34248 1 84 . 1 1 25 25 ASN N N 25 120.570 120.570 117.920 2.650 17919 34249 1 84 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.508 0.017 17919 34250 1 84 . 1 1 25 25 ASN C C 25 178.380 178.380 177.955 0.425 17919 34251 1 84 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.849 0.211 17919 34252 1 84 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.450 0.000 17919 34253 1 84 . 1 1 25 25 ASN H H 25 7.920 7.920 7.553 0.367 17919 34254 1 84 . 1 1 26 26 VAL N N 26 121.710 121.710 120.775 0.935 17919 34255 1 84 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.766 -0.369 17919 34256 1 84 . 1 1 26 26 VAL C C 26 177.950 177.950 177.191 0.759 17919 34257 1 84 . 1 1 26 26 VAL CA C 26 67.660 67.660 65.221 2.439 17919 34258 1 84 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.389 -0.549 17919 34259 1 84 . 1 1 26 26 VAL H H 26 8.070 8.070 8.085 -0.015 17919 34260 1 84 . 1 1 27 27 LYS N N 27 118.860 118.860 119.745 -0.885 17919 34261 1 84 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.245 0.335 17919 34262 1 84 . 1 1 27 27 LYS C C 27 180.550 180.550 179.215 1.335 17919 34263 1 84 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.380 -0.130 17919 34264 1 84 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.276 1.454 17919 34265 1 84 . 1 1 27 27 LYS H H 27 8.560 8.560 8.186 0.374 17919 34266 1 84 . 1 1 28 28 ALA N N 28 123.440 123.440 122.812 0.628 17919 34267 1 84 . 1 1 28 28 ALA HA H 28 4.160 4.160 3.975 0.185 17919 34268 1 84 . 1 1 28 28 ALA C C 28 180.300 180.300 178.987 1.313 17919 34269 1 84 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.331 0.039 17919 34270 1 84 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.247 -0.537 17919 34271 1 84 . 1 1 28 28 ALA H H 28 8.060 8.060 8.070 -0.010 17919 34272 1 84 . 1 1 29 29 LYS N N 29 119.940 119.940 119.474 0.466 17919 34273 1 84 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.011 0.196 17919 34274 1 84 . 1 1 29 29 LYS C C 29 180.320 180.320 179.164 1.156 17919 34275 1 84 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.437 0.213 17919 34276 1 84 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.342 0.949 17919 34277 1 84 . 1 1 29 29 LYS H H 29 7.850 7.850 7.568 0.282 17919 34278 1 84 . 1 1 30 30 ILE N N 30 121.080 121.080 119.589 1.491 17919 34279 1 84 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.569 -0.062 17919 34280 1 84 . 1 1 30 30 ILE C C 30 178.310 178.310 177.619 0.691 17919 34281 1 84 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.023 1.127 17919 34282 1 84 . 1 1 30 30 ILE CB C 30 36.800 36.800 36.825 -0.025 17919 34283 1 84 . 1 1 30 30 ILE H H 30 8.280 8.280 8.047 0.233 17919 34284 1 84 . 1 1 31 31 GLN N N 31 123.490 123.490 119.068 4.422 17919 34285 1 84 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.952 -0.123 17919 34286 1 84 . 1 1 31 31 GLN C C 31 178.890 178.890 178.515 0.375 17919 34287 1 84 . 1 1 31 31 GLN CA C 31 60.000 60.000 58.975 1.025 17919 34288 1 84 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.427 -0.707 17919 34289 1 84 . 1 1 31 31 GLN H H 31 8.580 8.580 7.805 0.775 17919 34290 1 84 . 1 1 32 32 ASP N N 32 119.360 119.360 119.284 0.076 17919 34291 1 84 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.431 -0.077 17919 34292 1 84 . 1 1 32 32 ASP C C 32 177.250 177.250 177.853 -0.603 17919 34293 1 84 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.667 0.523 17919 34294 1 84 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.909 -0.329 17919 34295 1 84 . 1 1 32 32 ASP H H 32 8.010 8.010 8.395 -0.385 17919 34296 1 84 . 1 1 33 33 LYS N N 33 115.130 115.130 117.459 -2.329 17919 34297 1 84 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.357 -0.020 17919 34298 1 84 . 1 1 33 33 LYS C C 33 177.870 177.870 177.997 -0.127 17919 34299 1 84 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.128 -0.078 17919 34300 1 84 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.980 0.190 17919 34301 1 84 . 1 1 33 33 LYS H H 33 7.430 7.430 7.513 -0.083 17919 34302 1 84 . 1 1 34 34 GLU N N 34 113.870 113.870 114.439 -0.569 17919 34303 1 84 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.481 0.144 17919 34304 1 84 . 1 1 34 34 GLU C C 34 177.840 177.840 177.439 0.401 17919 34305 1 84 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.009 -0.839 17919 34306 1 84 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.296 1.364 17919 34307 1 84 . 1 1 34 34 GLU H H 34 8.740 8.740 8.357 0.383 17919 34308 1 84 . 1 1 35 35 GLY N N 35 108.650 108.650 109.205 -0.555 17919 34309 1 84 . 1 1 35 35 GLY C C 35 173.960 173.960 174.080 -0.120 17919 34310 1 84 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.438 0.643 17919 34311 1 84 . 1 1 35 35 GLY H H 35 8.530 8.530 7.729 0.801 17919 34312 1 84 . 1 1 36 36 ILE N N 36 119.880 119.880 118.091 1.789 17919 34313 1 84 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.374 0.071 17919 34314 1 84 . 1 1 36 36 ILE C C 36 173.590 173.590 174.142 -0.552 17919 34315 1 84 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.674 0.076 17919 34316 1 84 . 1 1 36 36 ILE CB C 36 40.580 40.580 37.259 3.321 17919 34317 1 84 . 1 1 36 36 ILE H H 36 6.150 6.150 7.688 -1.538 17919 34318 1 84 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.761 -0.127 17919 34319 1 84 . 1 1 37 37 PRO C C 37 176.940 176.940 176.048 0.892 17919 34320 1 84 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.444 0.216 17919 34321 1 84 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.491 0.358 17919 34322 1 84 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.118 -0.001 17919 34323 1 84 . 1 1 38 38 PRO C C 38 178.320 178.320 177.971 0.349 17919 34324 1 84 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.857 0.403 17919 34325 1 84 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.899 0.991 17919 34326 1 84 . 1 1 39 39 ASP N N 39 113.380 113.380 115.515 -2.135 17919 34327 1 84 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.315 0.115 17919 34328 1 84 . 1 1 39 39 ASP C C 39 177.090 177.090 177.319 -0.229 17919 34329 1 84 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.511 -0.871 17919 34330 1 84 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.478 -0.938 17919 34331 1 84 . 1 1 39 39 ASP H H 39 8.550 8.550 8.340 0.210 17919 34332 1 84 . 1 1 40 40 GLN N N 40 116.780 116.780 118.150 -1.370 17919 34333 1 84 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.125 0.339 17919 34334 1 84 . 1 1 40 40 GLN C C 40 175.380 175.380 176.514 -1.134 17919 34335 1 84 . 1 1 40 40 GLN CA C 40 55.640 55.640 57.239 -1.599 17919 34336 1 84 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.318 0.822 17919 34337 1 84 . 1 1 40 40 GLN H H 40 7.820 7.820 7.918 -0.098 17919 34338 1 84 . 1 1 41 41 GLN N N 41 117.720 117.720 119.275 -1.555 17919 34339 1 84 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.217 0.027 17919 34340 1 84 . 1 1 41 41 GLN C C 41 176.300 176.300 175.305 0.995 17919 34341 1 84 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.945 -0.475 17919 34342 1 84 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.208 2.442 17919 34343 1 84 . 1 1 41 41 GLN H H 41 7.480 7.480 7.344 0.136 17919 34344 1 84 . 1 1 42 42 ARG N N 42 122.680 122.680 122.398 0.282 17919 34345 1 84 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.638 -0.138 17919 34346 1 84 . 1 1 42 42 ARG C C 42 174.050 174.050 174.685 -0.635 17919 34347 1 84 . 1 1 42 42 ARG CA C 42 55.050 55.050 53.825 1.224 17919 34348 1 84 . 1 1 42 42 ARG CB C 42 31.750 31.750 31.845 -0.095 17919 34349 1 84 . 1 1 42 42 ARG H H 42 8.530 8.530 7.972 0.558 17919 34350 1 84 . 1 1 43 43 LEU N N 43 124.040 124.040 125.400 -1.360 17919 34351 1 84 . 1 1 43 43 LEU C C 43 175.290 175.290 175.795 -0.505 17919 34352 1 84 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.337 -0.357 17919 34353 1 84 . 1 1 43 43 LEU CB C 43 45.790 45.790 45.174 0.616 17919 34354 1 84 . 1 1 43 43 LEU H H 43 8.820 8.820 8.757 0.063 17919 34355 1 84 . 1 1 44 44 ILE N N 44 121.920 121.920 119.592 2.328 17919 34356 1 84 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.131 -0.139 17919 34357 1 84 . 1 1 44 44 ILE C C 44 176.060 176.060 174.345 1.715 17919 34358 1 84 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.048 -1.068 17919 34359 1 84 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.828 -0.408 17919 34360 1 84 . 1 1 44 44 ILE H H 44 9.030 9.030 9.054 -0.024 17919 34361 1 84 . 1 1 45 45 PHE N N 45 125.390 125.390 125.988 -0.598 17919 34362 1 84 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.015 0.030 17919 34363 1 84 . 1 1 45 45 PHE C C 45 174.470 174.470 174.467 0.003 17919 34364 1 84 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.319 0.701 17919 34365 1 84 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.394 0.366 17919 34366 1 84 . 1 1 45 45 PHE H H 45 8.830 8.830 9.098 -0.268 17919 34367 1 84 . 1 1 46 46 ALA N N 46 132.200 132.200 127.780 4.420 17919 34368 1 84 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.582 0.108 17919 34369 1 84 . 1 1 46 46 ALA C C 46 177.290 177.290 177.586 -0.296 17919 34370 1 84 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.681 -0.141 17919 34371 1 84 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.573 -0.003 17919 34372 1 84 . 1 1 46 46 ALA H H 46 8.810 8.810 8.380 0.430 17919 34373 1 84 . 1 1 47 47 GLY N N 47 102.340 102.340 103.827 -1.487 17919 34374 1 84 . 1 1 47 47 GLY C C 47 173.810 173.810 174.181 -0.371 17919 34375 1 84 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.817 0.533 17919 34376 1 84 . 1 1 47 47 GLY H H 47 8.130 8.130 8.376 -0.246 17919 34377 1 84 . 1 1 48 48 LYS N N 48 121.570 121.570 122.001 -0.431 17919 34378 1 84 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.696 -0.074 17919 34379 1 84 . 1 1 48 48 LYS C C 48 174.700 174.700 175.637 -0.937 17919 34380 1 84 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.944 -0.394 17919 34381 1 84 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.937 -0.407 17919 34382 1 84 . 1 1 48 48 LYS H H 48 7.980 7.980 7.794 0.186 17919 34383 1 84 . 1 1 49 49 GLN N N 49 122.410 122.410 124.227 -1.817 17919 34384 1 84 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.557 0.003 17919 34385 1 84 . 1 1 49 49 GLN C C 49 175.670 175.670 175.349 0.321 17919 34386 1 84 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.604 -0.864 17919 34387 1 84 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.596 -0.596 17919 34388 1 84 . 1 1 49 49 GLN H H 49 8.600 8.600 8.609 -0.009 17919 34389 1 84 . 1 1 50 50 LEU N N 50 125.520 125.520 126.588 -1.068 17919 34390 1 84 . 1 1 50 50 LEU HA H 50 4.090 4.090 3.681 0.409 17919 34391 1 84 . 1 1 50 50 LEU C C 50 176.660 176.660 175.203 1.457 17919 34392 1 84 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.254 -0.014 17919 34393 1 84 . 1 1 50 50 LEU CB C 50 41.570 41.570 43.343 -1.773 17919 34394 1 84 . 1 1 50 50 LEU H H 50 8.530 8.530 8.641 -0.111 17919 34395 1 84 . 1 1 51 51 GLU N N 51 122.940 122.940 122.830 0.110 17919 34396 1 84 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.486 0.002 17919 34397 1 84 . 1 1 51 51 GLU C C 51 175.870 175.870 175.760 0.110 17919 34398 1 84 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.452 0.508 17919 34399 1 84 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.853 -1.283 17919 34400 1 84 . 1 1 51 51 GLU H H 51 8.400 8.400 8.152 0.248 17919 34401 1 84 . 1 1 52 52 ASP N N 52 120.030 120.030 120.655 -0.625 17919 34402 1 84 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.527 -0.168 17919 34403 1 84 . 1 1 52 52 ASP C C 52 177.330 177.330 177.793 -0.463 17919 34404 1 84 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.117 -0.157 17919 34405 1 84 . 1 1 52 52 ASP CB C 52 40.850 40.850 41.049 -0.199 17919 34406 1 84 . 1 1 52 52 ASP H H 52 8.160 8.160 8.707 -0.547 17919 34407 1 84 . 1 1 53 53 GLY N N 53 106.660 106.660 105.486 1.174 17919 34408 1 84 . 1 1 53 53 GLY C C 53 174.870 174.870 174.084 0.786 17919 34409 1 84 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.862 0.308 17919 34410 1 84 . 1 1 53 53 GLY H H 53 9.390 9.390 8.415 0.975 17919 34411 1 84 . 1 1 54 54 ARG N N 54 119.050 119.050 120.295 -1.245 17919 34412 1 84 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.804 -0.109 17919 34413 1 84 . 1 1 54 54 ARG C C 54 175.350 175.350 175.273 0.077 17919 34414 1 84 . 1 1 54 54 ARG CA C 54 54.390 54.390 53.974 0.416 17919 34415 1 84 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.752 -1.103 17919 34416 1 84 . 1 1 54 54 ARG H H 54 7.460 7.460 7.421 0.039 17919 34417 1 84 . 1 1 55 55 THR N N 55 108.400 108.400 113.248 -4.848 17919 34418 1 84 . 1 1 55 55 THR HA H 55 5.240 5.240 4.980 0.260 17919 34419 1 84 . 1 1 55 55 THR C C 55 176.560 176.560 176.082 0.478 17919 34420 1 84 . 1 1 55 55 THR CA C 55 59.690 59.690 60.343 -0.653 17919 34421 1 84 . 1 1 55 55 THR CB C 55 72.260 72.260 70.740 1.520 17919 34422 1 84 . 1 1 55 55 THR H H 55 8.730 8.730 9.172 -0.442 17919 34423 1 84 . 1 1 56 56 LEU N N 56 117.920 117.920 122.587 -4.667 17919 34424 1 84 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.920 0.140 17919 34425 1 84 . 1 1 56 56 LEU C C 56 180.810 180.810 178.645 2.165 17919 34426 1 84 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.630 0.080 17919 34427 1 84 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.557 -1.187 17919 34428 1 84 . 1 1 56 56 LEU H H 56 8.140 8.140 8.673 -0.533 17919 34429 1 84 . 1 1 57 57 SER N N 57 113.330 113.330 113.196 0.134 17919 34430 1 84 . 1 1 57 57 SER HA H 57 4.370 4.370 4.120 0.250 17919 34431 1 84 . 1 1 57 57 SER C C 57 178.310 178.310 176.402 1.908 17919 34432 1 84 . 1 1 57 57 SER CA C 57 61.080 61.080 61.788 -0.708 17919 34433 1 84 . 1 1 57 57 SER CB C 57 62.530 62.530 62.739 -0.209 17919 34434 1 84 . 1 1 57 57 SER H H 57 8.470 8.470 7.881 0.589 17919 34435 1 84 . 1 1 58 58 ASP N N 58 124.190 124.190 120.632 3.558 17919 34436 1 84 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.307 -0.011 17919 34437 1 84 . 1 1 58 58 ASP C C 58 177.400 177.400 176.525 0.875 17919 34438 1 84 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.495 0.685 17919 34439 1 84 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.500 -0.400 17919 34440 1 84 . 1 1 58 58 ASP H H 58 7.930 7.930 7.930 0.000 17919 34441 1 84 . 1 1 59 59 TYR N N 59 115.510 115.510 114.809 0.701 17919 34442 1 84 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.704 -0.034 17919 34443 1 84 . 1 1 59 59 TYR C C 59 174.700 174.700 175.115 -0.415 17919 34444 1 84 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.175 1.075 17919 34445 1 84 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.641 1.429 17919 34446 1 84 . 1 1 59 59 TYR H H 59 7.250 7.250 7.205 0.045 17919 34447 1 84 . 1 1 60 60 ASN N N 60 115.900 115.900 114.883 1.017 17919 34448 1 84 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.344 0.011 17919 34449 1 84 . 1 1 60 60 ASN C C 60 174.340 174.340 174.356 -0.016 17919 34450 1 84 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.668 -0.548 17919 34451 1 84 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.986 -0.576 17919 34452 1 84 . 1 1 60 60 ASN H H 60 8.150 8.150 7.747 0.403 17919 34453 1 84 . 1 1 61 61 ILE N N 61 118.600 118.600 119.732 -1.132 17919 34454 1 84 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.655 -0.262 17919 34455 1 84 . 1 1 61 61 ILE C C 61 174.610 174.610 175.261 -0.651 17919 34456 1 84 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.040 1.380 17919 34457 1 84 . 1 1 61 61 ILE CB C 61 36.740 36.740 36.449 0.291 17919 34458 1 84 . 1 1 61 61 ILE H H 61 7.250 7.250 7.425 -0.175 17919 34459 1 84 . 1 1 62 62 GLN N N 62 124.740 124.740 123.333 1.407 17919 34460 1 84 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.703 -0.197 17919 34461 1 84 . 1 1 62 62 GLN C C 62 175.970 175.970 175.623 0.347 17919 34462 1 84 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.733 -0.072 17919 34463 1 84 . 1 1 62 62 GLN CB C 62 31.650 31.650 32.603 -0.953 17919 34464 1 84 . 1 1 62 62 GLN H H 62 7.610 7.610 7.848 -0.238 17919 34465 1 84 . 1 1 63 63 LYS N N 63 120.300 120.300 121.686 -1.386 17919 34466 1 84 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.902 0.099 17919 34467 1 84 . 1 1 63 63 LYS C C 63 175.810 175.810 176.413 -0.603 17919 34468 1 84 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.831 -0.041 17919 34469 1 84 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.084 1.566 17919 34470 1 84 . 1 1 63 63 LYS H H 63 8.490 8.490 8.627 -0.137 17919 34471 1 84 . 1 1 64 64 GLU N N 64 113.950 113.950 117.007 -3.057 17919 34472 1 84 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.582 -0.117 17919 34473 1 84 . 1 1 64 64 GLU C C 64 175.250 175.250 175.273 -0.023 17919 34474 1 84 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.227 0.663 17919 34475 1 84 . 1 1 64 64 GLU CB C 64 25.900 25.900 27.687 -1.787 17919 34476 1 84 . 1 1 64 64 GLU H H 64 9.280 9.280 8.547 0.733 17919 34477 1 84 . 1 1 65 65 SER N N 65 114.730 114.730 115.481 -0.751 17919 34478 1 84 . 1 1 65 65 SER HA H 65 4.640 4.640 4.639 0.001 17919 34479 1 84 . 1 1 65 65 SER C C 65 172.160 172.160 173.487 -1.327 17919 34480 1 84 . 1 1 65 65 SER CA C 65 60.890 60.890 59.233 1.657 17919 34481 1 84 . 1 1 65 65 SER CB C 65 64.910 64.910 64.648 0.262 17919 34482 1 84 . 1 1 65 65 SER H H 65 7.670 7.670 7.574 0.096 17919 34483 1 84 . 1 1 66 66 THR N N 66 117.110 117.110 118.295 -1.185 17919 34484 1 84 . 1 1 66 66 THR HA H 66 5.270 5.270 5.028 0.242 17919 34485 1 84 . 1 1 66 66 THR C C 66 173.950 173.950 173.654 0.296 17919 34486 1 84 . 1 1 66 66 THR CA C 66 62.340 62.340 62.063 0.277 17919 34487 1 84 . 1 1 66 66 THR CB C 66 70.080 70.080 70.154 -0.074 17919 34488 1 84 . 1 1 66 66 THR H H 66 8.730 8.730 8.616 0.114 17919 34489 1 84 . 1 1 67 67 LEU N N 67 127.110 127.110 126.676 0.434 17919 34490 1 84 . 1 1 67 67 LEU HA H 67 5.060 5.060 5.145 -0.085 17919 34491 1 84 . 1 1 67 67 LEU C C 67 175.770 175.770 175.297 0.473 17919 34492 1 84 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.754 0.146 17919 34493 1 84 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.929 -0.669 17919 34494 1 84 . 1 1 67 67 LEU H H 67 9.410 9.410 8.692 0.718 17919 34495 1 84 . 1 1 68 68 HIS N N 68 118.380 118.380 120.397 -2.017 17919 34496 1 84 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.459 -0.219 17919 34497 1 84 . 1 1 68 68 HIS C C 68 173.150 173.150 173.852 -0.702 17919 34498 1 84 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.109 0.891 17919 34499 1 84 . 1 1 68 68 HIS CB C 68 30.530 30.530 33.330 -2.800 17919 34500 1 84 . 1 1 68 68 HIS H H 68 9.230 9.230 8.988 0.242 17919 34501 1 84 . 1 1 69 69 LEU N N 69 124.460 124.460 125.025 -0.565 17919 34502 1 84 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.267 -0.077 17919 34503 1 84 . 1 1 69 69 LEU C C 69 175.270 175.270 174.182 1.088 17919 34504 1 84 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.197 -0.307 17919 34505 1 84 . 1 1 69 69 LEU CB C 69 44.380 44.380 45.114 -0.734 17919 34506 1 84 . 1 1 69 69 LEU H H 69 8.340 8.340 7.376 0.964 17919 34507 1 84 . 1 1 70 70 VAL N N 70 126.940 126.940 125.314 1.626 17919 34508 1 84 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.550 -0.200 17919 34509 1 84 . 1 1 70 70 VAL C C 70 174.000 174.000 174.800 -0.800 17919 34510 1 84 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.814 0.986 17919 34511 1 84 . 1 1 70 70 VAL CB C 70 34.910 34.910 34.661 0.249 17919 34512 1 84 . 1 1 70 70 VAL H H 70 9.200 9.200 8.184 1.016 17919 34513 1 84 . 1 1 71 71 LEU N N 71 123.130 123.130 121.282 1.848 17919 34514 1 84 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.087 -0.027 17919 34515 1 84 . 1 1 71 71 LEU C C 71 177.830 177.830 176.720 1.110 17919 34516 1 84 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.459 0.481 17919 34517 1 84 . 1 1 71 71 LEU CB C 71 42.850 42.850 44.831 -1.982 17919 34518 1 84 . 1 1 71 71 LEU H H 71 8.120 8.120 8.281 -0.161 17919 34519 1 84 . 1 1 72 72 ARG N N 72 123.490 123.490 123.275 0.215 17919 34520 1 84 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.527 -0.226 17919 34521 1 84 . 1 1 72 72 ARG C C 72 175.350 175.350 175.366 -0.016 17919 34522 1 84 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.464 0.146 17919 34523 1 84 . 1 1 72 72 ARG CB C 72 31.350 31.350 31.620 -0.270 17919 34524 1 84 . 1 1 72 72 ARG H H 72 8.580 8.580 8.085 0.495 17919 34525 1 85 . 1 1 2 2 GLN N N 2 123.220 123.220 121.760 1.460 17919 34526 1 85 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.015 0.234 17919 34527 1 85 . 1 1 2 2 GLN C C 2 175.920 175.920 175.111 0.809 17919 34528 1 85 . 1 1 2 2 GLN CA C 2 55.080 55.080 55.640 -0.560 17919 34529 1 85 . 1 1 2 2 GLN CB C 2 30.760 30.760 29.523 1.237 17919 34530 1 85 . 1 1 2 2 GLN H H 2 8.900 8.900 8.400 0.500 17919 34531 1 85 . 1 1 3 3 ILE N N 3 115.340 115.340 117.007 -1.667 17919 34532 1 85 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.063 0.150 17919 34533 1 85 . 1 1 3 3 ILE C C 3 172.450 172.450 173.731 -1.281 17919 34534 1 85 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.239 0.331 17919 34535 1 85 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.167 1.043 17919 34536 1 85 . 1 1 3 3 ILE H H 3 8.320 8.320 7.668 0.652 17919 34537 1 85 . 1 1 4 4 PHE N N 4 118.110 118.110 118.689 -0.579 17919 34538 1 85 . 1 1 4 4 PHE HA H 4 5.630 5.630 4.964 0.666 17919 34539 1 85 . 1 1 4 4 PHE C C 4 175.320 175.320 175.068 0.252 17919 34540 1 85 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.200 0.010 17919 34541 1 85 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.294 0.186 17919 34542 1 85 . 1 1 4 4 PHE H H 4 8.610 8.610 8.479 0.131 17919 34543 1 85 . 1 1 5 5 VAL N N 5 121.000 121.000 123.176 -2.176 17919 34544 1 85 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.911 -0.186 17919 34545 1 85 . 1 1 5 5 VAL C C 5 174.870 174.870 175.321 -0.451 17919 34546 1 85 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.593 -0.973 17919 34547 1 85 . 1 1 5 5 VAL CB C 5 34.230 34.230 32.479 1.751 17919 34548 1 85 . 1 1 5 5 VAL H H 5 9.300 9.300 8.818 0.482 17919 34549 1 85 . 1 1 6 6 LYS N N 6 127.520 127.520 129.206 -1.686 17919 34550 1 85 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.000 0.367 17919 34551 1 85 . 1 1 6 6 LYS C C 6 177.140 177.140 176.741 0.399 17919 34552 1 85 . 1 1 6 6 LYS CA C 6 54.520 54.520 55.444 -0.924 17919 34553 1 85 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.241 -0.191 17919 34554 1 85 . 1 1 6 6 LYS H H 6 8.820 8.820 8.723 0.097 17919 34555 1 85 . 1 1 7 7 THR N N 7 115.400 115.400 116.315 -0.915 17919 34556 1 85 . 1 1 7 7 THR HA H 7 4.970 4.970 4.761 0.209 17919 34557 1 85 . 1 1 7 7 THR C C 7 176.910 176.910 176.649 0.261 17919 34558 1 85 . 1 1 7 7 THR CA C 7 60.470 60.470 60.807 -0.337 17919 34559 1 85 . 1 1 7 7 THR CB C 7 70.630 70.630 70.004 0.626 17919 34560 1 85 . 1 1 7 7 THR H H 7 8.730 8.730 8.619 0.111 17919 34561 1 85 . 1 1 8 8 LEU N N 8 121.330 121.330 120.834 0.496 17919 34562 1 85 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.385 -0.075 17919 34563 1 85 . 1 1 8 8 LEU C C 8 178.800 178.800 177.813 0.987 17919 34564 1 85 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.629 -0.049 17919 34565 1 85 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.976 -0.006 17919 34566 1 85 . 1 1 8 8 LEU H H 8 9.100 9.100 8.705 0.395 17919 34567 1 85 . 1 1 9 9 THR N N 9 105.590 105.590 109.407 -3.817 17919 34568 1 85 . 1 1 9 9 THR HA H 9 4.428 4.428 4.344 0.084 17919 34569 1 85 . 1 1 9 9 THR C C 9 175.520 175.520 175.182 0.338 17919 34570 1 85 . 1 1 9 9 THR CA C 9 61.400 61.400 62.641 -1.240 17919 34571 1 85 . 1 1 9 9 THR CB C 9 69.140 69.140 69.107 0.033 17919 34572 1 85 . 1 1 9 9 THR H H 9 7.630 7.630 7.926 -0.296 17919 34573 1 85 . 1 1 10 10 GLY N N 10 108.890 108.890 110.259 -1.369 17919 34574 1 85 . 1 1 10 10 GLY C C 10 174.070 174.070 173.571 0.499 17919 34575 1 85 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.821 0.639 17919 34576 1 85 . 1 1 10 10 GLY H H 10 7.810 7.810 7.663 0.147 17919 34577 1 85 . 1 1 11 11 LYS N N 11 121.600 121.600 121.120 0.480 17919 34578 1 85 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.434 -0.073 17919 34579 1 85 . 1 1 11 11 LYS C C 11 175.940 175.940 175.392 0.548 17919 34580 1 85 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.131 0.149 17919 34581 1 85 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.058 0.142 17919 34582 1 85 . 1 1 11 11 LYS H H 11 7.280 7.280 7.726 -0.446 17919 34583 1 85 . 1 1 12 12 THR N N 12 120.440 120.440 116.996 3.444 17919 34584 1 85 . 1 1 12 12 THR HA H 12 5.046 5.046 5.009 0.037 17919 34585 1 85 . 1 1 12 12 THR C C 12 174.320 174.320 174.137 0.183 17919 34586 1 85 . 1 1 12 12 THR CA C 12 62.390 62.390 61.990 0.400 17919 34587 1 85 . 1 1 12 12 THR CB C 12 69.910 69.910 70.549 -0.638 17919 34588 1 85 . 1 1 12 12 THR H H 12 8.650 8.650 8.280 0.369 17919 34589 1 85 . 1 1 13 13 ILE N N 13 127.110 127.110 126.565 0.545 17919 34590 1 85 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.381 0.163 17919 34591 1 85 . 1 1 13 13 ILE C C 13 175.220 175.220 174.920 0.300 17919 34592 1 85 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.669 -0.688 17919 34593 1 85 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.850 0.100 17919 34594 1 85 . 1 1 13 13 ILE H H 13 9.450 9.450 9.139 0.311 17919 34595 1 85 . 1 1 14 14 THR N N 14 121.520 121.520 124.783 -3.263 17919 34596 1 85 . 1 1 14 14 THR HA H 14 4.964 4.964 4.666 0.298 17919 34597 1 85 . 1 1 14 14 THR C C 14 173.790 173.790 173.881 -0.091 17919 34598 1 85 . 1 1 14 14 THR CA C 14 61.940 61.940 63.296 -1.356 17919 34599 1 85 . 1 1 14 14 THR CB C 14 69.650 69.650 68.936 0.714 17919 34600 1 85 . 1 1 14 14 THR H H 14 8.710 8.710 8.703 0.007 17919 34601 1 85 . 1 1 15 15 LEU N N 15 124.800 124.800 127.706 -2.906 17919 34602 1 85 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.828 -0.048 17919 34603 1 85 . 1 1 15 15 LEU C C 15 174.670 174.670 175.553 -0.883 17919 34604 1 85 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.971 -1.141 17919 34605 1 85 . 1 1 15 15 LEU CB C 15 47.070 47.070 44.248 2.822 17919 34606 1 85 . 1 1 15 15 LEU H H 15 8.710 8.710 7.935 0.775 17919 34607 1 85 . 1 1 16 16 GLU N N 16 122.160 122.160 122.340 -0.180 17919 34608 1 85 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.372 -0.455 17919 34609 1 85 . 1 1 16 16 GLU C C 16 175.860 175.860 175.898 -0.038 17919 34610 1 85 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.686 -0.866 17919 34611 1 85 . 1 1 16 16 GLU CB C 16 29.450 29.450 31.406 -1.956 17919 34612 1 85 . 1 1 16 16 GLU H H 16 8.140 8.140 8.741 -0.601 17919 34613 1 85 . 1 1 17 17 VAL N N 17 117.210 117.210 120.760 -3.550 17919 34614 1 85 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.659 0.055 17919 34615 1 85 . 1 1 17 17 VAL C C 17 174.160 174.160 174.222 -0.062 17919 34616 1 85 . 1 1 17 17 VAL CA C 17 58.430 58.430 60.061 -1.631 17919 34617 1 85 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.814 0.586 17919 34618 1 85 . 1 1 17 17 VAL H H 17 8.900 8.900 8.883 0.017 17919 34619 1 85 . 1 1 18 18 GLU N N 18 118.990 118.990 122.442 -3.452 17919 34620 1 85 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.874 0.205 17919 34621 1 85 . 1 1 18 18 GLU C C 18 176.160 176.160 175.587 0.573 17919 34622 1 85 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.903 -0.183 17919 34623 1 85 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.330 -0.020 17919 34624 1 85 . 1 1 18 18 GLU H H 18 8.640 8.640 8.329 0.311 17919 34625 1 85 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.201 -0.060 17919 34626 1 85 . 1 1 19 19 PRO C C 19 175.310 175.310 177.832 -2.522 17919 34627 1 85 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.965 -0.495 17919 34628 1 85 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.076 -0.126 17919 34629 1 85 . 1 1 20 20 SER N N 20 103.400 103.400 108.681 -5.281 17919 34630 1 85 . 1 1 20 20 SER HA H 20 4.370 4.370 4.305 0.065 17919 34631 1 85 . 1 1 20 20 SER C C 20 174.660 174.660 174.748 -0.088 17919 34632 1 85 . 1 1 20 20 SER CA C 20 57.400 57.400 59.065 -1.665 17919 34633 1 85 . 1 1 20 20 SER CB C 20 63.370 63.370 62.784 0.586 17919 34634 1 85 . 1 1 20 20 SER H H 20 7.040 7.040 7.966 -0.926 17919 34635 1 85 . 1 1 21 21 ASP N N 21 123.480 123.480 125.007 -1.527 17919 34636 1 85 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.632 0.063 17919 34637 1 85 . 1 1 21 21 ASP C C 21 176.360 176.360 176.114 0.246 17919 34638 1 85 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.717 -0.017 17919 34639 1 85 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.286 -0.486 17919 34640 1 85 . 1 1 21 21 ASP H H 21 8.030 8.030 7.668 0.362 17919 34641 1 85 . 1 1 22 22 THR N N 22 108.800 108.800 112.264 -3.464 17919 34642 1 85 . 1 1 22 22 THR HA H 22 4.920 4.920 4.614 0.306 17919 34643 1 85 . 1 1 22 22 THR C C 22 176.750 176.750 175.900 0.850 17919 34644 1 85 . 1 1 22 22 THR CA C 22 59.690 59.690 61.414 -1.724 17919 34645 1 85 . 1 1 22 22 THR CB C 22 71.200 71.200 70.737 0.463 17919 34646 1 85 . 1 1 22 22 THR H H 22 7.900 7.900 7.924 -0.024 17919 34647 1 85 . 1 1 23 23 ILE N N 23 121.190 121.190 123.691 -2.501 17919 34648 1 85 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.654 0.003 17919 34649 1 85 . 1 1 23 23 ILE C C 23 179.040 179.040 177.133 1.907 17919 34650 1 85 . 1 1 23 23 ILE CA C 23 62.260 62.260 65.632 -3.372 17919 34651 1 85 . 1 1 23 23 ILE CB C 23 34.350 34.350 37.707 -3.357 17919 34652 1 85 . 1 1 23 23 ILE H H 23 8.560 8.560 8.866 -0.306 17919 34653 1 85 . 1 1 24 24 GLU N N 24 120.830 120.830 120.340 0.490 17919 34654 1 85 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.852 0.065 17919 34655 1 85 . 1 1 24 24 GLU C C 24 178.640 178.640 178.691 -0.051 17919 34656 1 85 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.102 0.118 17919 34657 1 85 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.331 -1.050 17919 34658 1 85 . 1 1 24 24 GLU H H 24 9.760 9.760 8.468 1.292 17919 34659 1 85 . 1 1 25 25 ASN N N 25 120.570 120.570 118.085 2.485 17919 34660 1 85 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.479 0.046 17919 34661 1 85 . 1 1 25 25 ASN C C 25 178.380 178.380 177.877 0.503 17919 34662 1 85 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.431 -0.371 17919 34663 1 85 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.831 -0.381 17919 34664 1 85 . 1 1 25 25 ASN H H 25 7.920 7.920 7.745 0.175 17919 34665 1 85 . 1 1 26 26 VAL N N 26 121.710 121.710 120.709 1.001 17919 34666 1 85 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.681 -0.284 17919 34667 1 85 . 1 1 26 26 VAL C C 26 177.950 177.950 177.571 0.379 17919 34668 1 85 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.040 1.620 17919 34669 1 85 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.788 -0.948 17919 34670 1 85 . 1 1 26 26 VAL H H 26 8.070 8.070 7.868 0.202 17919 34671 1 85 . 1 1 27 27 LYS N N 27 118.860 118.860 120.653 -1.793 17919 34672 1 85 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.199 0.381 17919 34673 1 85 . 1 1 27 27 LYS C C 27 180.550 180.550 178.829 1.721 17919 34674 1 85 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.934 -0.684 17919 34675 1 85 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.312 1.418 17919 34676 1 85 . 1 1 27 27 LYS H H 27 8.560 8.560 8.382 0.178 17919 34677 1 85 . 1 1 28 28 ALA N N 28 123.440 123.440 121.158 2.282 17919 34678 1 85 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.154 0.006 17919 34679 1 85 . 1 1 28 28 ALA C C 28 180.300 180.300 179.195 1.105 17919 34680 1 85 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.461 0.909 17919 34681 1 85 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.354 -0.644 17919 34682 1 85 . 1 1 28 28 ALA H H 28 8.060 8.060 8.218 -0.158 17919 34683 1 85 . 1 1 29 29 LYS N N 29 119.940 119.940 120.463 -0.523 17919 34684 1 85 . 1 1 29 29 LYS HA H 29 4.207 4.207 3.995 0.212 17919 34685 1 85 . 1 1 29 29 LYS C C 29 180.320 180.320 178.765 1.555 17919 34686 1 85 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.474 0.176 17919 34687 1 85 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.303 0.987 17919 34688 1 85 . 1 1 29 29 LYS H H 29 7.850 7.850 7.863 -0.013 17919 34689 1 85 . 1 1 30 30 ILE N N 30 121.080 121.080 120.583 0.497 17919 34690 1 85 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.512 -0.005 17919 34691 1 85 . 1 1 30 30 ILE C C 30 178.310 178.310 177.325 0.985 17919 34692 1 85 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.958 0.192 17919 34693 1 85 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.679 -0.880 17919 34694 1 85 . 1 1 30 30 ILE H H 30 8.280 8.280 8.089 0.191 17919 34695 1 85 . 1 1 31 31 GLN N N 31 123.490 123.490 119.374 4.116 17919 34696 1 85 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.799 0.030 17919 34697 1 85 . 1 1 31 31 GLN C C 31 178.890 178.890 177.953 0.937 17919 34698 1 85 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.265 0.735 17919 34699 1 85 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.410 -0.690 17919 34700 1 85 . 1 1 31 31 GLN H H 31 8.580 8.580 8.109 0.471 17919 34701 1 85 . 1 1 32 32 ASP N N 32 119.360 119.360 118.586 0.774 17919 34702 1 85 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.439 -0.085 17919 34703 1 85 . 1 1 32 32 ASP C C 32 177.250 177.250 178.412 -1.162 17919 34704 1 85 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.629 0.561 17919 34705 1 85 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.872 -0.292 17919 34706 1 85 . 1 1 32 32 ASP H H 32 8.010 8.010 7.726 0.284 17919 34707 1 85 . 1 1 33 33 LYS N N 33 115.130 115.130 118.552 -3.422 17919 34708 1 85 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.219 0.118 17919 34709 1 85 . 1 1 33 33 LYS C C 33 177.870 177.870 178.225 -0.355 17919 34710 1 85 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.656 -0.606 17919 34711 1 85 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.437 0.733 17919 34712 1 85 . 1 1 33 33 LYS H H 33 7.430 7.430 7.679 -0.249 17919 34713 1 85 . 1 1 34 34 GLU N N 34 113.870 113.870 116.180 -2.310 17919 34714 1 85 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.454 0.171 17919 34715 1 85 . 1 1 34 34 GLU C C 34 177.840 177.840 176.858 0.982 17919 34716 1 85 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.484 -0.314 17919 34717 1 85 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.480 1.180 17919 34718 1 85 . 1 1 34 34 GLU H H 34 8.740 8.740 8.360 0.380 17919 34719 1 85 . 1 1 35 35 GLY N N 35 108.650 108.650 108.150 0.500 17919 34720 1 85 . 1 1 35 35 GLY C C 35 173.960 173.960 174.728 -0.768 17919 34721 1 85 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.955 0.125 17919 34722 1 85 . 1 1 35 35 GLY H H 35 8.530 8.530 7.844 0.686 17919 34723 1 85 . 1 1 36 36 ILE N N 36 119.880 119.880 122.587 -2.707 17919 34724 1 85 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.361 0.084 17919 34725 1 85 . 1 1 36 36 ILE C C 36 173.590 173.590 174.375 -0.785 17919 34726 1 85 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.023 -0.272 17919 34727 1 85 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.884 1.696 17919 34728 1 85 . 1 1 36 36 ILE H H 36 6.150 6.150 7.657 -1.507 17919 34729 1 85 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.891 -0.257 17919 34730 1 85 . 1 1 37 37 PRO C C 37 176.940 176.940 175.765 1.175 17919 34731 1 85 . 1 1 37 37 PRO CA C 37 61.660 61.660 60.783 0.877 17919 34732 1 85 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.367 0.483 17919 34733 1 85 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.273 -0.156 17919 34734 1 85 . 1 1 38 38 PRO C C 38 178.320 178.320 177.623 0.697 17919 34735 1 85 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.254 1.006 17919 34736 1 85 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.603 1.287 17919 34737 1 85 . 1 1 39 39 ASP N N 39 113.380 113.380 116.766 -3.386 17919 34738 1 85 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.407 0.023 17919 34739 1 85 . 1 1 39 39 ASP C C 39 177.090 177.090 176.236 0.854 17919 34740 1 85 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.108 -0.468 17919 34741 1 85 . 1 1 39 39 ASP CB C 39 39.540 39.540 39.613 -0.073 17919 34742 1 85 . 1 1 39 39 ASP H H 39 8.550 8.550 8.592 -0.042 17919 34743 1 85 . 1 1 40 40 GLN N N 40 116.780 116.780 117.144 -0.364 17919 34744 1 85 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.475 -0.011 17919 34745 1 85 . 1 1 40 40 GLN C C 40 175.380 175.380 175.209 0.171 17919 34746 1 85 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.584 0.056 17919 34747 1 85 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.898 0.242 17919 34748 1 85 . 1 1 40 40 GLN H H 40 7.820 7.820 7.785 0.035 17919 34749 1 85 . 1 1 41 41 GLN N N 41 117.720 117.720 119.944 -2.224 17919 34750 1 85 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.473 -0.229 17919 34751 1 85 . 1 1 41 41 GLN C C 41 176.300 176.300 174.762 1.538 17919 34752 1 85 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.471 0.999 17919 34753 1 85 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.405 2.245 17919 34754 1 85 . 1 1 41 41 GLN H H 41 7.480 7.480 7.608 -0.128 17919 34755 1 85 . 1 1 42 42 ARG N N 42 122.680 122.680 127.218 -4.538 17919 34756 1 85 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.601 -0.101 17919 34757 1 85 . 1 1 42 42 ARG C C 42 174.050 174.050 173.693 0.357 17919 34758 1 85 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.314 -0.264 17919 34759 1 85 . 1 1 42 42 ARG CB C 42 31.750 31.750 31.892 -0.141 17919 34760 1 85 . 1 1 42 42 ARG H H 42 8.530 8.530 8.003 0.527 17919 34761 1 85 . 1 1 43 43 LEU N N 43 124.040 124.040 128.001 -3.961 17919 34762 1 85 . 1 1 43 43 LEU C C 43 175.290 175.290 174.489 0.801 17919 34763 1 85 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.734 -0.754 17919 34764 1 85 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.441 1.349 17919 34765 1 85 . 1 1 43 43 LEU H H 43 8.820 8.820 8.703 0.117 17919 34766 1 85 . 1 1 44 44 ILE N N 44 121.920 121.920 121.607 0.313 17919 34767 1 85 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.508 -0.516 17919 34768 1 85 . 1 1 44 44 ILE C C 44 176.060 176.060 173.635 2.425 17919 34769 1 85 . 1 1 44 44 ILE CA C 44 58.980 58.980 58.976 0.004 17919 34770 1 85 . 1 1 44 44 ILE CB C 44 41.420 41.420 42.101 -0.681 17919 34771 1 85 . 1 1 44 44 ILE H H 44 9.030 9.030 7.949 1.081 17919 34772 1 85 . 1 1 45 45 PHE N N 45 125.390 125.390 125.540 -0.150 17919 34773 1 85 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.968 0.077 17919 34774 1 85 . 1 1 45 45 PHE C C 45 174.470 174.470 174.363 0.107 17919 34775 1 85 . 1 1 45 45 PHE CA C 45 57.020 57.020 58.191 -1.171 17919 34776 1 85 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.536 1.224 17919 34777 1 85 . 1 1 45 45 PHE H H 45 8.830 8.830 8.603 0.227 17919 34778 1 85 . 1 1 46 46 ALA N N 46 132.200 132.200 128.841 3.359 17919 34779 1 85 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.636 0.054 17919 34780 1 85 . 1 1 46 46 ALA C C 46 177.290 177.290 177.190 0.100 17919 34781 1 85 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.941 -0.400 17919 34782 1 85 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.841 -0.271 17919 34783 1 85 . 1 1 46 46 ALA H H 46 8.810 8.810 8.582 0.228 17919 34784 1 85 . 1 1 47 47 GLY N N 47 102.340 102.340 103.712 -1.372 17919 34785 1 85 . 1 1 47 47 GLY C C 47 173.810 173.810 174.196 -0.386 17919 34786 1 85 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.534 -0.184 17919 34787 1 85 . 1 1 47 47 GLY H H 47 8.130 8.130 8.289 -0.159 17919 34788 1 85 . 1 1 48 48 LYS N N 48 121.570 121.570 120.068 1.502 17919 34789 1 85 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.623 -0.001 17919 34790 1 85 . 1 1 48 48 LYS C C 48 174.700 174.700 175.501 -0.801 17919 34791 1 85 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.107 -0.557 17919 34792 1 85 . 1 1 48 48 LYS CB C 48 34.530 34.530 35.075 -0.545 17919 34793 1 85 . 1 1 48 48 LYS H H 48 7.980 7.980 7.933 0.047 17919 34794 1 85 . 1 1 49 49 GLN N N 49 122.410 122.410 122.806 -0.396 17919 34795 1 85 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.588 -0.028 17919 34796 1 85 . 1 1 49 49 GLN C C 49 175.670 175.670 175.650 0.020 17919 34797 1 85 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.612 0.128 17919 34798 1 85 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.620 -0.620 17919 34799 1 85 . 1 1 49 49 GLN H H 49 8.600 8.600 8.432 0.168 17919 34800 1 85 . 1 1 50 50 LEU N N 50 125.520 125.520 126.423 -0.903 17919 34801 1 85 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.102 -0.012 17919 34802 1 85 . 1 1 50 50 LEU C C 50 176.660 176.660 176.269 0.391 17919 34803 1 85 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.924 0.316 17919 34804 1 85 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.364 0.206 17919 34805 1 85 . 1 1 50 50 LEU H H 50 8.530 8.530 8.018 0.512 17919 34806 1 85 . 1 1 51 51 GLU N N 51 122.940 122.940 124.816 -1.876 17919 34807 1 85 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.295 0.193 17919 34808 1 85 . 1 1 51 51 GLU C C 51 175.870 175.870 176.924 -1.054 17919 34809 1 85 . 1 1 51 51 GLU CA C 51 55.960 55.960 56.588 -0.628 17919 34810 1 85 . 1 1 51 51 GLU CB C 51 31.570 31.570 30.821 0.749 17919 34811 1 85 . 1 1 51 51 GLU H H 51 8.400 8.400 9.059 -0.659 17919 34812 1 85 . 1 1 52 52 ASP N N 52 120.030 120.030 123.809 -3.779 17919 34813 1 85 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.484 -0.125 17919 34814 1 85 . 1 1 52 52 ASP C C 52 177.330 177.330 178.065 -0.735 17919 34815 1 85 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.363 -0.403 17919 34816 1 85 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.736 0.114 17919 34817 1 85 . 1 1 52 52 ASP H H 52 8.160 8.160 8.910 -0.750 17919 34818 1 85 . 1 1 53 53 GLY N N 53 106.660 106.660 105.607 1.053 17919 34819 1 85 . 1 1 53 53 GLY C C 53 174.870 174.870 174.354 0.516 17919 34820 1 85 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.755 0.415 17919 34821 1 85 . 1 1 53 53 GLY H H 53 9.390 9.390 8.414 0.976 17919 34822 1 85 . 1 1 54 54 ARG N N 54 119.050 119.050 120.761 -1.711 17919 34823 1 85 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.540 0.155 17919 34824 1 85 . 1 1 54 54 ARG C C 54 175.350 175.350 175.707 -0.357 17919 34825 1 85 . 1 1 54 54 ARG CA C 54 54.390 54.390 55.348 -0.958 17919 34826 1 85 . 1 1 54 54 ARG CB C 54 32.650 32.650 31.573 1.077 17919 34827 1 85 . 1 1 54 54 ARG H H 54 7.460 7.460 7.925 -0.465 17919 34828 1 85 . 1 1 55 55 THR N N 55 108.400 108.400 111.266 -2.866 17919 34829 1 85 . 1 1 55 55 THR HA H 55 5.240 5.240 4.964 0.276 17919 34830 1 85 . 1 1 55 55 THR C C 55 176.560 176.560 176.273 0.287 17919 34831 1 85 . 1 1 55 55 THR CA C 55 59.690 59.690 59.664 0.026 17919 34832 1 85 . 1 1 55 55 THR CB C 55 72.260 72.260 71.706 0.554 17919 34833 1 85 . 1 1 55 55 THR H H 55 8.730 8.730 8.168 0.562 17919 34834 1 85 . 1 1 56 56 LEU N N 56 117.920 117.920 120.717 -2.797 17919 34835 1 85 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.898 0.162 17919 34836 1 85 . 1 1 56 56 LEU C C 56 180.810 180.810 178.873 1.937 17919 34837 1 85 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.230 0.480 17919 34838 1 85 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.476 -1.106 17919 34839 1 85 . 1 1 56 56 LEU H H 56 8.140 8.140 8.403 -0.263 17919 34840 1 85 . 1 1 57 57 SER N N 57 113.330 113.330 115.189 -1.859 17919 34841 1 85 . 1 1 57 57 SER HA H 57 4.370 4.370 4.137 0.233 17919 34842 1 85 . 1 1 57 57 SER C C 57 178.310 178.310 176.813 1.497 17919 34843 1 85 . 1 1 57 57 SER CA C 57 61.080 61.080 61.552 -0.472 17919 34844 1 85 . 1 1 57 57 SER CB C 57 62.530 62.530 62.501 0.029 17919 34845 1 85 . 1 1 57 57 SER H H 57 8.470 8.470 7.917 0.553 17919 34846 1 85 . 1 1 58 58 ASP N N 58 124.190 124.190 122.237 1.953 17919 34847 1 85 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.261 0.035 17919 34848 1 85 . 1 1 58 58 ASP C C 58 177.400 177.400 177.312 0.088 17919 34849 1 85 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.772 0.409 17919 34850 1 85 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.193 -0.093 17919 34851 1 85 . 1 1 58 58 ASP H H 58 7.930 7.930 7.733 0.197 17919 34852 1 85 . 1 1 59 59 TYR N N 59 115.510 115.510 114.886 0.624 17919 34853 1 85 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.785 -0.115 17919 34854 1 85 . 1 1 59 59 TYR C C 59 174.700 174.700 174.766 -0.066 17919 34855 1 85 . 1 1 59 59 TYR CA C 59 58.250 58.250 56.669 1.581 17919 34856 1 85 . 1 1 59 59 TYR CB C 59 40.070 40.070 37.971 2.099 17919 34857 1 85 . 1 1 59 59 TYR H H 59 7.250 7.250 7.255 -0.005 17919 34858 1 85 . 1 1 60 60 ASN N N 60 115.900 115.900 115.022 0.878 17919 34859 1 85 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.354 0.001 17919 34860 1 85 . 1 1 60 60 ASN C C 60 174.340 174.340 174.304 0.036 17919 34861 1 85 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.435 -0.315 17919 34862 1 85 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.367 0.043 17919 34863 1 85 . 1 1 60 60 ASN H H 60 8.150 8.150 7.992 0.158 17919 34864 1 85 . 1 1 61 61 ILE N N 61 118.600 118.600 120.779 -2.179 17919 34865 1 85 . 1 1 61 61 ILE HA H 61 3.393 3.393 4.068 -0.675 17919 34866 1 85 . 1 1 61 61 ILE C C 61 174.610 174.610 175.394 -0.784 17919 34867 1 85 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.629 0.791 17919 34868 1 85 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.771 -1.031 17919 34869 1 85 . 1 1 61 61 ILE H H 61 7.250 7.250 7.529 -0.279 17919 34870 1 85 . 1 1 62 62 GLN N N 62 124.740 124.740 127.293 -2.553 17919 34871 1 85 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.587 -0.081 17919 34872 1 85 . 1 1 62 62 GLN C C 62 175.970 175.970 175.861 0.109 17919 34873 1 85 . 1 1 62 62 GLN CA C 62 53.660 53.660 54.068 -0.408 17919 34874 1 85 . 1 1 62 62 GLN CB C 62 31.650 31.650 30.267 1.383 17919 34875 1 85 . 1 1 62 62 GLN H H 62 7.610 7.610 8.088 -0.478 17919 34876 1 85 . 1 1 63 63 LYS N N 63 120.300 120.300 120.196 0.104 17919 34877 1 85 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.990 0.011 17919 34878 1 85 . 1 1 63 63 LYS C C 63 175.810 175.810 176.413 -0.603 17919 34879 1 85 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.738 0.052 17919 34880 1 85 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.453 1.197 17919 34881 1 85 . 1 1 63 63 LYS H H 63 8.490 8.490 8.443 0.047 17919 34882 1 85 . 1 1 64 64 GLU N N 64 113.950 113.950 119.245 -5.295 17919 34883 1 85 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.447 0.018 17919 34884 1 85 . 1 1 64 64 GLU C C 64 175.250 175.250 175.425 -0.175 17919 34885 1 85 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.697 0.193 17919 34886 1 85 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.813 -2.913 17919 34887 1 85 . 1 1 64 64 GLU H H 64 9.280 9.280 8.880 0.400 17919 34888 1 85 . 1 1 65 65 SER N N 65 114.730 114.730 114.652 0.078 17919 34889 1 85 . 1 1 65 65 SER HA H 65 4.640 4.640 4.515 0.125 17919 34890 1 85 . 1 1 65 65 SER C C 65 172.160 172.160 174.252 -2.092 17919 34891 1 85 . 1 1 65 65 SER CA C 65 60.890 60.890 59.847 1.043 17919 34892 1 85 . 1 1 65 65 SER CB C 65 64.910 64.910 64.177 0.733 17919 34893 1 85 . 1 1 65 65 SER H H 65 7.670 7.670 7.280 0.390 17919 34894 1 85 . 1 1 66 66 THR N N 66 117.110 117.110 120.883 -3.773 17919 34895 1 85 . 1 1 66 66 THR HA H 66 5.270 5.270 4.960 0.310 17919 34896 1 85 . 1 1 66 66 THR C C 66 173.950 173.950 174.503 -0.553 17919 34897 1 85 . 1 1 66 66 THR CA C 66 62.340 62.340 62.529 -0.189 17919 34898 1 85 . 1 1 66 66 THR CB C 66 70.080 70.080 69.453 0.627 17919 34899 1 85 . 1 1 66 66 THR H H 66 8.730 8.730 8.488 0.242 17919 34900 1 85 . 1 1 67 67 LEU N N 67 127.110 127.110 128.157 -1.047 17919 34901 1 85 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.728 0.332 17919 34902 1 85 . 1 1 67 67 LEU C C 67 175.770 175.770 175.711 0.059 17919 34903 1 85 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.148 -0.247 17919 34904 1 85 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.142 1.118 17919 34905 1 85 . 1 1 67 67 LEU H H 67 9.410 9.410 9.292 0.118 17919 34906 1 85 . 1 1 68 68 HIS N N 68 118.380 118.380 124.210 -5.830 17919 34907 1 85 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.168 0.072 17919 34908 1 85 . 1 1 68 68 HIS C C 68 173.150 173.150 174.677 -1.527 17919 34909 1 85 . 1 1 68 68 HIS CA C 68 55.000 55.000 53.467 1.533 17919 34910 1 85 . 1 1 68 68 HIS CB C 68 30.530 30.530 31.046 -0.516 17919 34911 1 85 . 1 1 68 68 HIS H H 68 9.230 9.230 9.024 0.206 17919 34912 1 85 . 1 1 69 69 LEU N N 69 124.460 124.460 130.109 -5.649 17919 34913 1 85 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.394 0.796 17919 34914 1 85 . 1 1 69 69 LEU C C 69 175.270 175.270 175.156 0.114 17919 34915 1 85 . 1 1 69 69 LEU CA C 69 53.890 53.890 55.526 -1.636 17919 34916 1 85 . 1 1 69 69 LEU CB C 69 44.380 44.380 42.448 1.932 17919 34917 1 85 . 1 1 69 69 LEU H H 69 8.340 8.340 7.955 0.385 17919 34918 1 85 . 1 1 70 70 VAL N N 70 126.940 126.940 127.365 -0.425 17919 34919 1 85 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.081 0.269 17919 34920 1 85 . 1 1 70 70 VAL C C 70 174.000 174.000 174.714 -0.714 17919 34921 1 85 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.955 -0.155 17919 34922 1 85 . 1 1 70 70 VAL CB C 70 34.910 34.910 33.498 1.412 17919 34923 1 85 . 1 1 70 70 VAL H H 70 9.200 9.200 8.993 0.207 17919 34924 1 85 . 1 1 71 71 LEU N N 71 123.130 123.130 125.947 -2.817 17919 34925 1 85 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.371 0.689 17919 34926 1 85 . 1 1 71 71 LEU C C 71 177.830 177.830 176.893 0.937 17919 34927 1 85 . 1 1 71 71 LEU CA C 71 53.940 53.940 54.435 -0.495 17919 34928 1 85 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.742 0.108 17919 34929 1 85 . 1 1 71 71 LEU H H 71 8.120 8.120 8.443 -0.323 17919 34930 1 85 . 1 1 72 72 ARG N N 72 123.490 123.490 123.551 -0.061 17919 34931 1 85 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.448 -0.147 17919 34932 1 85 . 1 1 72 72 ARG C C 72 175.350 175.350 175.048 0.302 17919 34933 1 85 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.281 -0.671 17919 34934 1 85 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.513 0.837 17919 34935 1 85 . 1 1 72 72 ARG H H 72 8.580 8.580 8.260 0.320 17919 34936 1 86 . 1 1 2 2 GLN N N 2 123.220 123.220 117.919 5.301 17919 34937 1 86 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.588 -0.339 17919 34938 1 86 . 1 1 2 2 GLN C C 2 175.920 175.920 174.856 1.064 17919 34939 1 86 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.526 0.554 17919 34940 1 86 . 1 1 2 2 GLN CB C 2 30.760 30.760 32.943 -2.183 17919 34941 1 86 . 1 1 2 2 GLN H H 2 8.900 8.900 8.183 0.717 17919 34942 1 86 . 1 1 3 3 ILE N N 3 115.340 115.340 115.548 -0.208 17919 34943 1 86 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.218 -0.005 17919 34944 1 86 . 1 1 3 3 ILE C C 3 172.450 172.450 173.754 -1.304 17919 34945 1 86 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.478 0.092 17919 34946 1 86 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.202 1.008 17919 34947 1 86 . 1 1 3 3 ILE H H 3 8.320 8.320 8.244 0.076 17919 34948 1 86 . 1 1 4 4 PHE N N 4 118.110 118.110 119.233 -1.123 17919 34949 1 86 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.116 0.514 17919 34950 1 86 . 1 1 4 4 PHE C C 4 175.320 175.320 175.084 0.236 17919 34951 1 86 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.479 -0.269 17919 34952 1 86 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.164 0.316 17919 34953 1 86 . 1 1 4 4 PHE H H 4 8.610 8.610 8.116 0.494 17919 34954 1 86 . 1 1 5 5 VAL N N 5 121.000 121.000 124.237 -3.237 17919 34955 1 86 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.591 0.134 17919 34956 1 86 . 1 1 5 5 VAL C C 5 174.870 174.870 175.430 -0.560 17919 34957 1 86 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.479 -0.859 17919 34958 1 86 . 1 1 5 5 VAL CB C 5 34.230 34.230 32.875 1.355 17919 34959 1 86 . 1 1 5 5 VAL H H 5 9.300 9.300 9.130 0.170 17919 34960 1 86 . 1 1 6 6 LYS N N 6 127.520 127.520 128.850 -1.330 17919 34961 1 86 . 1 1 6 6 LYS HA H 6 5.367 5.367 4.693 0.674 17919 34962 1 86 . 1 1 6 6 LYS C C 6 177.140 177.140 176.600 0.540 17919 34963 1 86 . 1 1 6 6 LYS CA C 6 54.520 54.520 55.307 -0.787 17919 34964 1 86 . 1 1 6 6 LYS CB C 6 35.050 35.050 33.784 1.266 17919 34965 1 86 . 1 1 6 6 LYS H H 6 8.820 8.820 9.016 -0.196 17919 34966 1 86 . 1 1 7 7 THR N N 7 115.400 115.400 115.090 0.310 17919 34967 1 86 . 1 1 7 7 THR HA H 7 4.970 4.970 5.012 -0.042 17919 34968 1 86 . 1 1 7 7 THR C C 7 176.910 176.910 176.233 0.677 17919 34969 1 86 . 1 1 7 7 THR CA C 7 60.470 60.470 60.118 0.352 17919 34970 1 86 . 1 1 7 7 THR CB C 7 70.630 70.630 71.233 -0.603 17919 34971 1 86 . 1 1 7 7 THR H H 7 8.730 8.730 8.022 0.708 17919 34972 1 86 . 1 1 8 8 LEU N N 8 121.330 121.330 123.142 -1.812 17919 34973 1 86 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.120 0.190 17919 34974 1 86 . 1 1 8 8 LEU C C 8 178.800 178.800 176.880 1.920 17919 34975 1 86 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.654 -0.074 17919 34976 1 86 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.303 -0.333 17919 34977 1 86 . 1 1 8 8 LEU H H 8 9.100 9.100 8.508 0.592 17919 34978 1 86 . 1 1 9 9 THR N N 9 105.590 105.590 107.655 -2.065 17919 34979 1 86 . 1 1 9 9 THR HA H 9 4.428 4.428 4.346 0.082 17919 34980 1 86 . 1 1 9 9 THR C C 9 175.520 175.520 176.181 -0.661 17919 34981 1 86 . 1 1 9 9 THR CA C 9 61.400 61.400 61.216 0.184 17919 34982 1 86 . 1 1 9 9 THR CB C 9 69.140 69.140 68.702 0.438 17919 34983 1 86 . 1 1 9 9 THR H H 9 7.630 7.630 7.608 0.022 17919 34984 1 86 . 1 1 10 10 GLY N N 10 108.890 108.890 111.964 -3.074 17919 34985 1 86 . 1 1 10 10 GLY C C 10 174.070 174.070 173.892 0.178 17919 34986 1 86 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.506 -0.046 17919 34987 1 86 . 1 1 10 10 GLY H H 10 7.810 7.810 8.477 -0.667 17919 34988 1 86 . 1 1 11 11 LYS N N 11 121.600 121.600 120.609 0.991 17919 34989 1 86 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.059 0.302 17919 34990 1 86 . 1 1 11 11 LYS C C 11 175.940 175.940 175.595 0.345 17919 34991 1 86 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.752 -0.472 17919 34992 1 86 . 1 1 11 11 LYS CB C 11 33.200 33.200 32.338 0.862 17919 34993 1 86 . 1 1 11 11 LYS H H 11 7.280 7.280 7.485 -0.205 17919 34994 1 86 . 1 1 12 12 THR N N 12 120.440 120.440 119.184 1.256 17919 34995 1 86 . 1 1 12 12 THR HA H 12 5.046 5.046 4.262 0.784 17919 34996 1 86 . 1 1 12 12 THR C C 12 174.320 174.320 173.886 0.434 17919 34997 1 86 . 1 1 12 12 THR CA C 12 62.390 62.390 62.239 0.151 17919 34998 1 86 . 1 1 12 12 THR CB C 12 69.910 69.910 69.489 0.421 17919 34999 1 86 . 1 1 12 12 THR H H 12 8.650 8.650 8.267 0.383 17919 35000 1 86 . 1 1 13 13 ILE N N 13 127.110 127.110 129.287 -2.177 17919 35001 1 86 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.391 0.153 17919 35002 1 86 . 1 1 13 13 ILE C C 13 175.220 175.220 175.008 0.212 17919 35003 1 86 . 1 1 13 13 ILE CA C 13 59.980 59.980 58.584 1.396 17919 35004 1 86 . 1 1 13 13 ILE CB C 13 40.950 40.950 36.854 4.096 17919 35005 1 86 . 1 1 13 13 ILE H H 13 9.450 9.450 8.506 0.944 17919 35006 1 86 . 1 1 14 14 THR N N 14 121.520 121.520 124.096 -2.576 17919 35007 1 86 . 1 1 14 14 THR HA H 14 4.964 4.964 5.043 -0.079 17919 35008 1 86 . 1 1 14 14 THR C C 14 173.790 173.790 174.115 -0.325 17919 35009 1 86 . 1 1 14 14 THR CA C 14 61.940 61.940 62.582 -0.642 17919 35010 1 86 . 1 1 14 14 THR CB C 14 69.650 69.650 69.580 0.070 17919 35011 1 86 . 1 1 14 14 THR H H 14 8.710 8.710 8.553 0.157 17919 35012 1 86 . 1 1 15 15 LEU N N 15 124.800 124.800 127.188 -2.388 17919 35013 1 86 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.723 0.057 17919 35014 1 86 . 1 1 15 15 LEU C C 15 174.670 174.670 175.613 -0.943 17919 35015 1 86 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.548 -0.718 17919 35016 1 86 . 1 1 15 15 LEU CB C 15 47.070 47.070 44.807 2.263 17919 35017 1 86 . 1 1 15 15 LEU H H 15 8.710 8.710 8.475 0.235 17919 35018 1 86 . 1 1 16 16 GLU N N 16 122.160 122.160 122.412 -0.252 17919 35019 1 86 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.105 -0.188 17919 35020 1 86 . 1 1 16 16 GLU C C 16 175.860 175.860 176.109 -0.249 17919 35021 1 86 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.899 -1.079 17919 35022 1 86 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.385 -0.935 17919 35023 1 86 . 1 1 16 16 GLU H H 16 8.140 8.140 8.716 -0.576 17919 35024 1 86 . 1 1 17 17 VAL N N 17 117.210 117.210 120.608 -3.398 17919 35025 1 86 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.631 0.083 17919 35026 1 86 . 1 1 17 17 VAL C C 17 174.160 174.160 174.511 -0.351 17919 35027 1 86 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.213 -0.783 17919 35028 1 86 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.546 0.854 17919 35029 1 86 . 1 1 17 17 VAL H H 17 8.900 8.900 8.736 0.164 17919 35030 1 86 . 1 1 18 18 GLU N N 18 118.990 118.990 120.894 -1.904 17919 35031 1 86 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.756 0.323 17919 35032 1 86 . 1 1 18 18 GLU C C 18 176.160 176.160 175.024 1.136 17919 35033 1 86 . 1 1 18 18 GLU CA C 18 52.720 52.720 54.178 -1.458 17919 35034 1 86 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.023 0.287 17919 35035 1 86 . 1 1 18 18 GLU H H 18 8.640 8.640 8.625 0.015 17919 35036 1 86 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.374 -0.233 17919 35037 1 86 . 1 1 19 19 PRO C C 19 175.310 175.310 178.199 -2.889 17919 35038 1 86 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.544 -0.074 17919 35039 1 86 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.117 -0.167 17919 35040 1 86 . 1 1 20 20 SER N N 20 103.400 103.400 110.754 -7.354 17919 35041 1 86 . 1 1 20 20 SER HA H 20 4.370 4.370 4.205 0.165 17919 35042 1 86 . 1 1 20 20 SER C C 20 174.660 174.660 173.977 0.683 17919 35043 1 86 . 1 1 20 20 SER CA C 20 57.400 57.400 58.981 -1.581 17919 35044 1 86 . 1 1 20 20 SER CB C 20 63.370 63.370 62.836 0.534 17919 35045 1 86 . 1 1 20 20 SER H H 20 7.040 7.040 8.103 -1.063 17919 35046 1 86 . 1 1 21 21 ASP N N 21 123.480 123.480 122.431 1.049 17919 35047 1 86 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.628 0.067 17919 35048 1 86 . 1 1 21 21 ASP C C 21 176.360 176.360 175.514 0.846 17919 35049 1 86 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.191 0.509 17919 35050 1 86 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.475 -0.675 17919 35051 1 86 . 1 1 21 21 ASP H H 21 8.030 8.030 7.507 0.523 17919 35052 1 86 . 1 1 22 22 THR N N 22 108.800 108.800 111.607 -2.807 17919 35053 1 86 . 1 1 22 22 THR HA H 22 4.920 4.920 4.524 0.396 17919 35054 1 86 . 1 1 22 22 THR C C 22 176.750 176.750 175.873 0.877 17919 35055 1 86 . 1 1 22 22 THR CA C 22 59.690 59.690 60.799 -1.109 17919 35056 1 86 . 1 1 22 22 THR CB C 22 71.200 71.200 70.757 0.443 17919 35057 1 86 . 1 1 22 22 THR H H 22 7.900 7.900 8.301 -0.401 17919 35058 1 86 . 1 1 23 23 ILE N N 23 121.190 121.190 122.385 -1.195 17919 35059 1 86 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.811 -0.154 17919 35060 1 86 . 1 1 23 23 ILE C C 23 179.040 179.040 177.432 1.608 17919 35061 1 86 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.686 -0.426 17919 35062 1 86 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.577 -2.227 17919 35063 1 86 . 1 1 23 23 ILE H H 23 8.560 8.560 8.685 -0.125 17919 35064 1 86 . 1 1 24 24 GLU N N 24 120.830 120.830 121.093 -0.263 17919 35065 1 86 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.953 -0.036 17919 35066 1 86 . 1 1 24 24 GLU C C 24 178.640 178.640 178.890 -0.250 17919 35067 1 86 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.018 0.202 17919 35068 1 86 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.567 -1.286 17919 35069 1 86 . 1 1 24 24 GLU H H 24 9.760 9.760 9.022 0.738 17919 35070 1 86 . 1 1 25 25 ASN N N 25 120.570 120.570 118.206 2.364 17919 35071 1 86 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.548 -0.023 17919 35072 1 86 . 1 1 25 25 ASN C C 25 178.380 178.380 177.941 0.439 17919 35073 1 86 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.152 -0.092 17919 35074 1 86 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.880 -0.430 17919 35075 1 86 . 1 1 25 25 ASN H H 25 7.920 7.920 7.819 0.101 17919 35076 1 86 . 1 1 26 26 VAL N N 26 121.710 121.710 121.710 0.000 17919 35077 1 86 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.805 -0.408 17919 35078 1 86 . 1 1 26 26 VAL C C 26 177.950 177.950 177.398 0.552 17919 35079 1 86 . 1 1 26 26 VAL CA C 26 67.660 67.660 64.655 3.005 17919 35080 1 86 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.531 -0.691 17919 35081 1 86 . 1 1 26 26 VAL H H 26 8.070 8.070 7.833 0.237 17919 35082 1 86 . 1 1 27 27 LYS N N 27 118.860 118.860 120.123 -1.263 17919 35083 1 86 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.143 0.437 17919 35084 1 86 . 1 1 27 27 LYS C C 27 180.550 180.550 179.056 1.494 17919 35085 1 86 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.857 -0.607 17919 35086 1 86 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.155 1.575 17919 35087 1 86 . 1 1 27 27 LYS H H 27 8.560 8.560 8.490 0.070 17919 35088 1 86 . 1 1 28 28 ALA N N 28 123.440 123.440 120.976 2.464 17919 35089 1 86 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.017 0.143 17919 35090 1 86 . 1 1 28 28 ALA C C 28 180.300 180.300 179.283 1.017 17919 35091 1 86 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.412 -0.042 17919 35092 1 86 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.448 -0.738 17919 35093 1 86 . 1 1 28 28 ALA H H 28 8.060 8.060 7.896 0.164 17919 35094 1 86 . 1 1 29 29 LYS N N 29 119.940 119.940 119.316 0.624 17919 35095 1 86 . 1 1 29 29 LYS HA H 29 4.207 4.207 3.981 0.226 17919 35096 1 86 . 1 1 29 29 LYS C C 29 180.320 180.320 179.153 1.167 17919 35097 1 86 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.575 0.075 17919 35098 1 86 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.128 1.162 17919 35099 1 86 . 1 1 29 29 LYS H H 29 7.850 7.850 7.339 0.511 17919 35100 1 86 . 1 1 30 30 ILE N N 30 121.080 121.080 119.975 1.105 17919 35101 1 86 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.589 -0.082 17919 35102 1 86 . 1 1 30 30 ILE C C 30 178.310 178.310 177.591 0.719 17919 35103 1 86 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.226 0.924 17919 35104 1 86 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.374 -0.574 17919 35105 1 86 . 1 1 30 30 ILE H H 30 8.280 8.280 8.141 0.139 17919 35106 1 86 . 1 1 31 31 GLN N N 31 123.490 123.490 119.451 4.039 17919 35107 1 86 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.109 -0.280 17919 35108 1 86 . 1 1 31 31 GLN C C 31 178.890 178.890 177.999 0.891 17919 35109 1 86 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.039 0.961 17919 35110 1 86 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.486 -0.766 17919 35111 1 86 . 1 1 31 31 GLN H H 31 8.580 8.580 7.913 0.667 17919 35112 1 86 . 1 1 32 32 ASP N N 32 119.360 119.360 118.881 0.479 17919 35113 1 86 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.459 -0.105 17919 35114 1 86 . 1 1 32 32 ASP C C 32 177.250 177.250 178.083 -0.833 17919 35115 1 86 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.643 0.547 17919 35116 1 86 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.835 -0.255 17919 35117 1 86 . 1 1 32 32 ASP H H 32 8.010 8.010 7.733 0.277 17919 35118 1 86 . 1 1 33 33 LYS N N 33 115.130 115.130 118.898 -3.768 17919 35119 1 86 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.361 -0.024 17919 35120 1 86 . 1 1 33 33 LYS C C 33 177.870 177.870 178.527 -0.657 17919 35121 1 86 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.709 0.341 17919 35122 1 86 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.097 1.073 17919 35123 1 86 . 1 1 33 33 LYS H H 33 7.430 7.430 7.619 -0.189 17919 35124 1 86 . 1 1 34 34 GLU N N 34 113.870 113.870 115.590 -1.720 17919 35125 1 86 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.430 0.195 17919 35126 1 86 . 1 1 34 34 GLU C C 34 177.840 177.840 177.534 0.306 17919 35127 1 86 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.061 -0.891 17919 35128 1 86 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.032 1.628 17919 35129 1 86 . 1 1 34 34 GLU H H 34 8.740 8.740 8.360 0.380 17919 35130 1 86 . 1 1 35 35 GLY N N 35 108.650 108.650 108.679 -0.029 17919 35131 1 86 . 1 1 35 35 GLY C C 35 173.960 173.960 174.121 -0.161 17919 35132 1 86 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.844 0.236 17919 35133 1 86 . 1 1 35 35 GLY H H 35 8.530 8.530 7.922 0.608 17919 35134 1 86 . 1 1 36 36 ILE N N 36 119.880 119.880 121.914 -2.034 17919 35135 1 86 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.407 0.038 17919 35136 1 86 . 1 1 36 36 ILE C C 36 173.590 173.590 174.331 -0.741 17919 35137 1 86 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.946 -0.196 17919 35138 1 86 . 1 1 36 36 ILE CB C 36 40.580 40.580 39.244 1.336 17919 35139 1 86 . 1 1 36 36 ILE H H 36 6.150 6.150 7.698 -1.548 17919 35140 1 86 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.932 -0.298 17919 35141 1 86 . 1 1 37 37 PRO C C 37 176.940 176.940 176.097 0.843 17919 35142 1 86 . 1 1 37 37 PRO CA C 37 61.660 61.660 60.623 1.037 17919 35143 1 86 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.282 0.568 17919 35144 1 86 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.096 0.021 17919 35145 1 86 . 1 1 38 38 PRO C C 38 178.320 178.320 178.893 -0.573 17919 35146 1 86 . 1 1 38 38 PRO CA C 38 66.260 66.260 66.307 -0.047 17919 35147 1 86 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.755 1.135 17919 35148 1 86 . 1 1 39 39 ASP N N 39 113.380 113.380 114.512 -1.132 17919 35149 1 86 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.404 0.026 17919 35150 1 86 . 1 1 39 39 ASP C C 39 177.090 177.090 177.250 -0.160 17919 35151 1 86 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.345 -0.705 17919 35152 1 86 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.319 -0.779 17919 35153 1 86 . 1 1 39 39 ASP H H 39 8.550 8.550 8.574 -0.024 17919 35154 1 86 . 1 1 40 40 GLN N N 40 116.780 116.780 115.565 1.215 17919 35155 1 86 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.440 0.024 17919 35156 1 86 . 1 1 40 40 GLN C C 40 175.380 175.380 175.160 0.220 17919 35157 1 86 . 1 1 40 40 GLN CA C 40 55.640 55.640 54.898 0.742 17919 35158 1 86 . 1 1 40 40 GLN CB C 40 30.140 30.140 28.554 1.586 17919 35159 1 86 . 1 1 40 40 GLN H H 40 7.820 7.820 7.970 -0.150 17919 35160 1 86 . 1 1 41 41 GLN N N 41 117.720 117.720 118.806 -1.086 17919 35161 1 86 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.688 -0.444 17919 35162 1 86 . 1 1 41 41 GLN C C 41 176.300 176.300 174.395 1.905 17919 35163 1 86 . 1 1 41 41 GLN CA C 41 56.470 56.470 54.889 1.581 17919 35164 1 86 . 1 1 41 41 GLN CB C 41 31.650 31.650 31.333 0.317 17919 35165 1 86 . 1 1 41 41 GLN H H 41 7.480 7.480 7.624 -0.144 17919 35166 1 86 . 1 1 42 42 ARG N N 42 122.680 122.680 124.114 -1.434 17919 35167 1 86 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.593 -0.093 17919 35168 1 86 . 1 1 42 42 ARG C C 42 174.050 174.050 174.266 -0.216 17919 35169 1 86 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.318 -0.268 17919 35170 1 86 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.502 -0.752 17919 35171 1 86 . 1 1 42 42 ARG H H 42 8.530 8.530 8.050 0.480 17919 35172 1 86 . 1 1 43 43 LEU N N 43 124.040 124.040 125.586 -1.546 17919 35173 1 86 . 1 1 43 43 LEU C C 43 175.290 175.290 175.590 -0.300 17919 35174 1 86 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.598 -0.618 17919 35175 1 86 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.848 1.942 17919 35176 1 86 . 1 1 43 43 LEU H H 43 8.820 8.820 8.731 0.089 17919 35177 1 86 . 1 1 44 44 ILE N N 44 121.920 121.920 118.178 3.742 17919 35178 1 86 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.078 -0.086 17919 35179 1 86 . 1 1 44 44 ILE C C 44 176.060 176.060 173.884 2.176 17919 35180 1 86 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.581 -0.601 17919 35181 1 86 . 1 1 44 44 ILE CB C 44 41.420 41.420 40.886 0.534 17919 35182 1 86 . 1 1 44 44 ILE H H 44 9.030 9.030 8.519 0.511 17919 35183 1 86 . 1 1 45 45 PHE N N 45 125.390 125.390 128.772 -3.382 17919 35184 1 86 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.064 -0.019 17919 35185 1 86 . 1 1 45 45 PHE C C 45 174.470 174.470 175.490 -1.020 17919 35186 1 86 . 1 1 45 45 PHE CA C 45 57.020 57.020 55.844 1.176 17919 35187 1 86 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.928 0.832 17919 35188 1 86 . 1 1 45 45 PHE H H 45 8.830 8.830 8.811 0.019 17919 35189 1 86 . 1 1 46 46 ALA N N 46 132.200 132.200 129.472 2.728 17919 35190 1 86 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.616 0.074 17919 35191 1 86 . 1 1 46 46 ALA C C 46 177.290 177.290 177.184 0.106 17919 35192 1 86 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.784 -0.244 17919 35193 1 86 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.251 0.319 17919 35194 1 86 . 1 1 46 46 ALA H H 46 8.810 8.810 8.896 -0.086 17919 35195 1 86 . 1 1 47 47 GLY N N 47 102.340 102.340 103.576 -1.236 17919 35196 1 86 . 1 1 47 47 GLY C C 47 173.810 173.810 174.658 -0.848 17919 35197 1 86 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.529 -0.179 17919 35198 1 86 . 1 1 47 47 GLY H H 47 8.130 8.130 8.645 -0.515 17919 35199 1 86 . 1 1 48 48 LYS N N 48 121.570 121.570 123.010 -1.440 17919 35200 1 86 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.557 0.065 17919 35201 1 86 . 1 1 48 48 LYS C C 48 174.700 174.700 175.809 -1.109 17919 35202 1 86 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.097 -0.547 17919 35203 1 86 . 1 1 48 48 LYS CB C 48 34.530 34.530 33.313 1.216 17919 35204 1 86 . 1 1 48 48 LYS H H 48 7.980 7.980 7.921 0.059 17919 35205 1 86 . 1 1 49 49 GLN N N 49 122.410 122.410 124.690 -2.280 17919 35206 1 86 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.589 -0.029 17919 35207 1 86 . 1 1 49 49 GLN C C 49 175.670 175.670 175.284 0.386 17919 35208 1 86 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.778 -0.038 17919 35209 1 86 . 1 1 49 49 GLN CB C 49 29.000 29.000 28.648 0.352 17919 35210 1 86 . 1 1 49 49 GLN H H 49 8.600 8.600 8.577 0.023 17919 35211 1 86 . 1 1 50 50 LEU N N 50 125.520 125.520 126.450 -0.930 17919 35212 1 86 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.467 -0.377 17919 35213 1 86 . 1 1 50 50 LEU C C 50 176.660 176.660 177.149 -0.489 17919 35214 1 86 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.253 -0.013 17919 35215 1 86 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.403 -0.833 17919 35216 1 86 . 1 1 50 50 LEU H H 50 8.530 8.530 8.233 0.297 17919 35217 1 86 . 1 1 51 51 GLU N N 51 122.940 122.940 122.311 0.629 17919 35218 1 86 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.568 -0.080 17919 35219 1 86 . 1 1 51 51 GLU C C 51 175.870 175.870 177.104 -1.234 17919 35220 1 86 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.627 0.333 17919 35221 1 86 . 1 1 51 51 GLU CB C 51 31.570 31.570 30.605 0.965 17919 35222 1 86 . 1 1 51 51 GLU H H 51 8.400 8.400 9.315 -0.915 17919 35223 1 86 . 1 1 52 52 ASP N N 52 120.030 120.030 125.622 -5.592 17919 35224 1 86 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.329 0.030 17919 35225 1 86 . 1 1 52 52 ASP C C 52 177.330 177.330 177.825 -0.495 17919 35226 1 86 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.598 -0.638 17919 35227 1 86 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.537 0.313 17919 35228 1 86 . 1 1 52 52 ASP H H 52 8.160 8.160 8.981 -0.821 17919 35229 1 86 . 1 1 53 53 GLY N N 53 106.660 106.660 104.233 2.427 17919 35230 1 86 . 1 1 53 53 GLY C C 53 174.870 174.870 174.527 0.343 17919 35231 1 86 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.919 0.251 17919 35232 1 86 . 1 1 53 53 GLY H H 53 9.390 9.390 8.090 1.300 17919 35233 1 86 . 1 1 54 54 ARG N N 54 119.050 119.050 122.234 -3.184 17919 35234 1 86 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.216 0.479 17919 35235 1 86 . 1 1 54 54 ARG C C 54 175.350 175.350 175.493 -0.143 17919 35236 1 86 . 1 1 54 54 ARG CA C 54 54.390 54.390 56.317 -1.927 17919 35237 1 86 . 1 1 54 54 ARG CB C 54 32.650 32.650 30.943 1.707 17919 35238 1 86 . 1 1 54 54 ARG H H 54 7.460 7.460 7.525 -0.065 17919 35239 1 86 . 1 1 55 55 THR N N 55 108.400 108.400 115.002 -6.602 17919 35240 1 86 . 1 1 55 55 THR HA H 55 5.240 5.240 4.583 0.657 17919 35241 1 86 . 1 1 55 55 THR C C 55 176.560 176.560 176.279 0.281 17919 35242 1 86 . 1 1 55 55 THR CA C 55 59.690 59.690 61.417 -1.727 17919 35243 1 86 . 1 1 55 55 THR CB C 55 72.260 72.260 70.011 2.249 17919 35244 1 86 . 1 1 55 55 THR H H 55 8.730 8.730 8.279 0.451 17919 35245 1 86 . 1 1 56 56 LEU N N 56 117.920 117.920 122.883 -4.963 17919 35246 1 86 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.888 0.172 17919 35247 1 86 . 1 1 56 56 LEU C C 56 180.810 180.810 178.789 2.021 17919 35248 1 86 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.783 -0.073 17919 35249 1 86 . 1 1 56 56 LEU CB C 56 40.370 40.370 40.723 -0.353 17919 35250 1 86 . 1 1 56 56 LEU H H 56 8.140 8.140 8.692 -0.552 17919 35251 1 86 . 1 1 57 57 SER N N 57 113.330 113.330 112.930 0.400 17919 35252 1 86 . 1 1 57 57 SER HA H 57 4.370 4.370 4.048 0.322 17919 35253 1 86 . 1 1 57 57 SER C C 57 178.310 178.310 176.513 1.797 17919 35254 1 86 . 1 1 57 57 SER CA C 57 61.080 61.080 61.317 -0.237 17919 35255 1 86 . 1 1 57 57 SER CB C 57 62.530 62.530 62.540 -0.010 17919 35256 1 86 . 1 1 57 57 SER H H 57 8.470 8.470 7.923 0.547 17919 35257 1 86 . 1 1 58 58 ASP N N 58 124.190 124.190 123.278 0.912 17919 35258 1 86 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.378 -0.082 17919 35259 1 86 . 1 1 58 58 ASP C C 58 177.400 177.400 177.280 0.120 17919 35260 1 86 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.520 0.660 17919 35261 1 86 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.808 -0.708 17919 35262 1 86 . 1 1 58 58 ASP H H 58 7.930 7.930 7.925 0.005 17919 35263 1 86 . 1 1 59 59 TYR N N 59 115.510 115.510 115.624 -0.114 17919 35264 1 86 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.650 0.020 17919 35265 1 86 . 1 1 59 59 TYR C C 59 174.700 174.700 174.563 0.137 17919 35266 1 86 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.772 0.478 17919 35267 1 86 . 1 1 59 59 TYR CB C 59 40.070 40.070 37.821 2.249 17919 35268 1 86 . 1 1 59 59 TYR H H 59 7.250 7.250 7.504 -0.254 17919 35269 1 86 . 1 1 60 60 ASN N N 60 115.900 115.900 114.319 1.581 17919 35270 1 86 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.394 -0.039 17919 35271 1 86 . 1 1 60 60 ASN C C 60 174.340 174.340 174.694 -0.354 17919 35272 1 86 . 1 1 60 60 ASN CA C 60 54.120 54.120 53.842 0.278 17919 35273 1 86 . 1 1 60 60 ASN CB C 60 37.410 37.410 36.684 0.726 17919 35274 1 86 . 1 1 60 60 ASN H H 60 8.150 8.150 7.740 0.410 17919 35275 1 86 . 1 1 61 61 ILE N N 61 118.600 118.600 120.049 -1.449 17919 35276 1 86 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.632 -0.239 17919 35277 1 86 . 1 1 61 61 ILE C C 61 174.610 174.610 175.432 -0.822 17919 35278 1 86 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.721 0.699 17919 35279 1 86 . 1 1 61 61 ILE CB C 61 36.740 36.740 35.564 1.176 17919 35280 1 86 . 1 1 61 61 ILE H H 61 7.250 7.250 8.256 -1.006 17919 35281 1 86 . 1 1 62 62 GLN N N 62 124.740 124.740 125.308 -0.568 17919 35282 1 86 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.604 -0.098 17919 35283 1 86 . 1 1 62 62 GLN C C 62 175.970 175.970 175.803 0.167 17919 35284 1 86 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.615 0.045 17919 35285 1 86 . 1 1 62 62 GLN CB C 62 31.650 31.650 30.730 0.920 17919 35286 1 86 . 1 1 62 62 GLN H H 62 7.610 7.610 7.704 -0.094 17919 35287 1 86 . 1 1 63 63 LYS N N 63 120.300 120.300 120.726 -0.426 17919 35288 1 86 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.168 -0.167 17919 35289 1 86 . 1 1 63 63 LYS C C 63 175.810 175.810 176.425 -0.615 17919 35290 1 86 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.035 0.755 17919 35291 1 86 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.950 0.701 17919 35292 1 86 . 1 1 63 63 LYS H H 63 8.490 8.490 8.464 0.026 17919 35293 1 86 . 1 1 64 64 GLU N N 64 113.950 113.950 118.657 -4.707 17919 35294 1 86 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.569 -0.104 17919 35295 1 86 . 1 1 64 64 GLU C C 64 175.250 175.250 174.946 0.304 17919 35296 1 86 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.058 0.832 17919 35297 1 86 . 1 1 64 64 GLU CB C 64 25.900 25.900 27.718 -1.818 17919 35298 1 86 . 1 1 64 64 GLU H H 64 9.280 9.280 8.658 0.622 17919 35299 1 86 . 1 1 65 65 SER N N 65 114.730 114.730 115.137 -0.407 17919 35300 1 86 . 1 1 65 65 SER HA H 65 4.640 4.640 4.639 0.001 17919 35301 1 86 . 1 1 65 65 SER C C 65 172.160 172.160 173.687 -1.527 17919 35302 1 86 . 1 1 65 65 SER CA C 65 60.890 60.890 59.471 1.419 17919 35303 1 86 . 1 1 65 65 SER CB C 65 64.910 64.910 64.435 0.475 17919 35304 1 86 . 1 1 65 65 SER H H 65 7.670 7.670 7.544 0.126 17919 35305 1 86 . 1 1 66 66 THR N N 66 117.110 117.110 121.257 -4.147 17919 35306 1 86 . 1 1 66 66 THR HA H 66 5.270 5.270 5.172 0.098 17919 35307 1 86 . 1 1 66 66 THR C C 66 173.950 173.950 173.914 0.036 17919 35308 1 86 . 1 1 66 66 THR CA C 66 62.340 62.340 61.707 0.633 17919 35309 1 86 . 1 1 66 66 THR CB C 66 70.080 70.080 70.663 -0.583 17919 35310 1 86 . 1 1 66 66 THR H H 66 8.730 8.730 8.593 0.137 17919 35311 1 86 . 1 1 67 67 LEU N N 67 127.110 127.110 126.840 0.270 17919 35312 1 86 . 1 1 67 67 LEU HA H 67 5.060 5.060 5.073 -0.013 17919 35313 1 86 . 1 1 67 67 LEU C C 67 175.770 175.770 175.663 0.107 17919 35314 1 86 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.351 0.549 17919 35315 1 86 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.663 -0.403 17919 35316 1 86 . 1 1 67 67 LEU H H 67 9.410 9.410 8.790 0.620 17919 35317 1 86 . 1 1 68 68 HIS N N 68 118.380 118.380 119.445 -1.065 17919 35318 1 86 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.333 -0.093 17919 35319 1 86 . 1 1 68 68 HIS C C 68 173.150 173.150 174.637 -1.487 17919 35320 1 86 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.423 0.577 17919 35321 1 86 . 1 1 68 68 HIS CB C 68 30.530 30.530 30.864 -0.334 17919 35322 1 86 . 1 1 68 68 HIS H H 68 9.230 9.230 8.508 0.722 17919 35323 1 86 . 1 1 69 69 LEU N N 69 124.460 124.460 128.669 -4.209 17919 35324 1 86 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.036 0.154 17919 35325 1 86 . 1 1 69 69 LEU C C 69 175.270 175.270 174.995 0.275 17919 35326 1 86 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.333 -0.443 17919 35327 1 86 . 1 1 69 69 LEU CB C 69 44.380 44.380 43.008 1.372 17919 35328 1 86 . 1 1 69 69 LEU H H 69 8.340 8.340 8.216 0.124 17919 35329 1 86 . 1 1 70 70 VAL N N 70 126.940 126.940 125.791 1.149 17919 35330 1 86 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.599 -0.249 17919 35331 1 86 . 1 1 70 70 VAL C C 70 174.000 174.000 173.797 0.203 17919 35332 1 86 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.959 0.841 17919 35333 1 86 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.362 -0.452 17919 35334 1 86 . 1 1 70 70 VAL H H 70 9.200 9.200 8.359 0.841 17919 35335 1 86 . 1 1 71 71 LEU N N 71 123.130 123.130 127.450 -4.320 17919 35336 1 86 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.544 0.516 17919 35337 1 86 . 1 1 71 71 LEU C C 71 177.830 177.830 177.189 0.641 17919 35338 1 86 . 1 1 71 71 LEU CA C 71 53.940 53.940 54.751 -0.811 17919 35339 1 86 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.217 0.633 17919 35340 1 86 . 1 1 71 71 LEU H H 71 8.120 8.120 8.331 -0.211 17919 35341 1 86 . 1 1 72 72 ARG N N 72 123.490 123.490 124.691 -1.201 17919 35342 1 86 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.346 -0.045 17919 35343 1 86 . 1 1 72 72 ARG C C 72 175.350 175.350 175.695 -0.345 17919 35344 1 86 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.056 -0.446 17919 35345 1 86 . 1 1 72 72 ARG CB C 72 31.350 31.350 31.127 0.223 17919 35346 1 86 . 1 1 72 72 ARG H H 72 8.580 8.580 8.120 0.460 17919 35347 1 87 . 1 1 2 2 GLN N N 2 123.220 123.220 122.698 0.522 17919 35348 1 87 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.233 0.016 17919 35349 1 87 . 1 1 2 2 GLN C C 2 175.920 175.920 174.771 1.149 17919 35350 1 87 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.844 0.236 17919 35351 1 87 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.639 0.121 17919 35352 1 87 . 1 1 2 2 GLN H H 2 8.900 8.900 8.459 0.441 17919 35353 1 87 . 1 1 3 3 ILE N N 3 115.340 115.340 119.507 -4.167 17919 35354 1 87 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.466 -0.253 17919 35355 1 87 . 1 1 3 3 ILE C C 3 172.450 172.450 173.679 -1.229 17919 35356 1 87 . 1 1 3 3 ILE CA C 3 59.570 59.570 58.885 0.686 17919 35357 1 87 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.275 0.935 17919 35358 1 87 . 1 1 3 3 ILE H H 3 8.320 8.320 8.791 -0.471 17919 35359 1 87 . 1 1 4 4 PHE N N 4 118.110 118.110 119.950 -1.840 17919 35360 1 87 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.234 0.396 17919 35361 1 87 . 1 1 4 4 PHE C C 4 175.320 175.320 175.702 -0.382 17919 35362 1 87 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.541 -0.331 17919 35363 1 87 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.086 0.394 17919 35364 1 87 . 1 1 4 4 PHE H H 4 8.610 8.610 8.562 0.048 17919 35365 1 87 . 1 1 5 5 VAL N N 5 121.000 121.000 121.724 -0.724 17919 35366 1 87 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.765 -0.040 17919 35367 1 87 . 1 1 5 5 VAL C C 5 174.870 174.870 174.710 0.160 17919 35368 1 87 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.470 -0.850 17919 35369 1 87 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.194 0.036 17919 35370 1 87 . 1 1 5 5 VAL H H 5 9.300 9.300 9.010 0.290 17919 35371 1 87 . 1 1 6 6 LYS N N 6 127.520 127.520 129.507 -1.987 17919 35372 1 87 . 1 1 6 6 LYS HA H 6 5.367 5.367 4.995 0.372 17919 35373 1 87 . 1 1 6 6 LYS C C 6 177.140 177.140 175.720 1.420 17919 35374 1 87 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.193 0.327 17919 35375 1 87 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.287 0.763 17919 35376 1 87 . 1 1 6 6 LYS H H 6 8.820 8.820 9.204 -0.384 17919 35377 1 87 . 1 1 7 7 THR N N 7 115.400 115.400 117.151 -1.751 17919 35378 1 87 . 1 1 7 7 THR HA H 7 4.970 4.970 4.537 0.433 17919 35379 1 87 . 1 1 7 7 THR C C 7 176.910 176.910 176.961 -0.051 17919 35380 1 87 . 1 1 7 7 THR CA C 7 60.470 60.470 60.464 0.006 17919 35381 1 87 . 1 1 7 7 THR CB C 7 70.630 70.630 70.551 0.079 17919 35382 1 87 . 1 1 7 7 THR H H 7 8.730 8.730 8.762 -0.032 17919 35383 1 87 . 1 1 8 8 LEU N N 8 121.330 121.330 119.984 1.346 17919 35384 1 87 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.267 0.043 17919 35385 1 87 . 1 1 8 8 LEU C C 8 178.800 178.800 177.584 1.216 17919 35386 1 87 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.648 -0.068 17919 35387 1 87 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.464 0.506 17919 35388 1 87 . 1 1 8 8 LEU H H 8 9.100 9.100 8.537 0.563 17919 35389 1 87 . 1 1 9 9 THR N N 9 105.590 105.590 109.929 -4.339 17919 35390 1 87 . 1 1 9 9 THR HA H 9 4.428 4.428 4.324 0.104 17919 35391 1 87 . 1 1 9 9 THR C C 9 175.520 175.520 175.777 -0.257 17919 35392 1 87 . 1 1 9 9 THR CA C 9 61.400 61.400 62.051 -0.651 17919 35393 1 87 . 1 1 9 9 THR CB C 9 69.140 69.140 69.667 -0.527 17919 35394 1 87 . 1 1 9 9 THR H H 9 7.630 7.630 7.665 -0.035 17919 35395 1 87 . 1 1 10 10 GLY N N 10 108.890 108.890 111.365 -2.475 17919 35396 1 87 . 1 1 10 10 GLY C C 10 174.070 174.070 173.941 0.129 17919 35397 1 87 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.801 0.659 17919 35398 1 87 . 1 1 10 10 GLY H H 10 7.810 7.810 7.776 0.034 17919 35399 1 87 . 1 1 11 11 LYS N N 11 121.600 121.600 122.128 -0.528 17919 35400 1 87 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.206 0.155 17919 35401 1 87 . 1 1 11 11 LYS C C 11 175.940 175.940 175.257 0.683 17919 35402 1 87 . 1 1 11 11 LYS CA C 11 56.280 56.280 57.062 -0.782 17919 35403 1 87 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.507 -0.307 17919 35404 1 87 . 1 1 11 11 LYS H H 11 7.280 7.280 7.548 -0.268 17919 35405 1 87 . 1 1 12 12 THR N N 12 120.440 120.440 117.499 2.941 17919 35406 1 87 . 1 1 12 12 THR HA H 12 5.046 5.046 5.261 -0.215 17919 35407 1 87 . 1 1 12 12 THR C C 12 174.320 174.320 174.445 -0.125 17919 35408 1 87 . 1 1 12 12 THR CA C 12 62.390 62.390 61.433 0.957 17919 35409 1 87 . 1 1 12 12 THR CB C 12 69.910 69.910 70.582 -0.672 17919 35410 1 87 . 1 1 12 12 THR H H 12 8.650 8.650 8.242 0.408 17919 35411 1 87 . 1 1 13 13 ILE N N 13 127.110 127.110 128.895 -1.785 17919 35412 1 87 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.373 0.171 17919 35413 1 87 . 1 1 13 13 ILE C C 13 175.220 175.220 175.027 0.193 17919 35414 1 87 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.449 -0.469 17919 35415 1 87 . 1 1 13 13 ILE CB C 13 40.950 40.950 38.828 2.122 17919 35416 1 87 . 1 1 13 13 ILE H H 13 9.450 9.450 9.231 0.219 17919 35417 1 87 . 1 1 14 14 THR N N 14 121.520 121.520 124.100 -2.580 17919 35418 1 87 . 1 1 14 14 THR HA H 14 4.964 4.964 4.884 0.080 17919 35419 1 87 . 1 1 14 14 THR C C 14 173.790 173.790 173.710 0.080 17919 35420 1 87 . 1 1 14 14 THR CA C 14 61.940 61.940 63.283 -1.343 17919 35421 1 87 . 1 1 14 14 THR CB C 14 69.650 69.650 69.689 -0.039 17919 35422 1 87 . 1 1 14 14 THR H H 14 8.710 8.710 8.798 -0.088 17919 35423 1 87 . 1 1 15 15 LEU N N 15 124.800 124.800 126.155 -1.355 17919 35424 1 87 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.754 0.026 17919 35425 1 87 . 1 1 15 15 LEU C C 15 174.670 174.670 174.732 -0.062 17919 35426 1 87 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.808 -0.978 17919 35427 1 87 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.995 1.075 17919 35428 1 87 . 1 1 15 15 LEU H H 15 8.710 8.710 8.600 0.110 17919 35429 1 87 . 1 1 16 16 GLU N N 16 122.160 122.160 122.649 -0.489 17919 35430 1 87 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.315 -0.398 17919 35431 1 87 . 1 1 16 16 GLU C C 16 175.860 175.860 175.752 0.108 17919 35432 1 87 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.080 -0.260 17919 35433 1 87 . 1 1 16 16 GLU CB C 16 29.450 29.450 31.455 -2.005 17919 35434 1 87 . 1 1 16 16 GLU H H 16 8.140 8.140 8.490 -0.350 17919 35435 1 87 . 1 1 17 17 VAL N N 17 117.210 117.210 118.275 -1.065 17919 35436 1 87 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.766 -0.052 17919 35437 1 87 . 1 1 17 17 VAL C C 17 174.160 174.160 174.431 -0.271 17919 35438 1 87 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.444 -1.014 17919 35439 1 87 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.560 0.840 17919 35440 1 87 . 1 1 17 17 VAL H H 17 8.900 8.900 8.818 0.082 17919 35441 1 87 . 1 1 18 18 GLU N N 18 118.990 118.990 118.734 0.256 17919 35442 1 87 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.881 0.198 17919 35443 1 87 . 1 1 18 18 GLU C C 18 176.160 176.160 174.790 1.370 17919 35444 1 87 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.903 -0.183 17919 35445 1 87 . 1 1 18 18 GLU CB C 18 30.310 30.310 32.538 -2.228 17919 35446 1 87 . 1 1 18 18 GLU H H 18 8.640 8.640 9.399 -0.759 17919 35447 1 87 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.484 -0.343 17919 35448 1 87 . 1 1 19 19 PRO C C 19 175.310 175.310 177.631 -2.321 17919 35449 1 87 . 1 1 19 19 PRO CA C 19 65.470 65.470 64.677 0.794 17919 35450 1 87 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.033 -0.083 17919 35451 1 87 . 1 1 20 20 SER N N 20 103.400 103.400 112.741 -9.341 17919 35452 1 87 . 1 1 20 20 SER HA H 20 4.370 4.370 4.283 0.087 17919 35453 1 87 . 1 1 20 20 SER C C 20 174.660 174.660 174.879 -0.219 17919 35454 1 87 . 1 1 20 20 SER CA C 20 57.400 57.400 59.705 -2.305 17919 35455 1 87 . 1 1 20 20 SER CB C 20 63.370 63.370 63.053 0.317 17919 35456 1 87 . 1 1 20 20 SER H H 20 7.040 7.040 7.975 -0.935 17919 35457 1 87 . 1 1 21 21 ASP N N 21 123.480 123.480 122.016 1.464 17919 35458 1 87 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.514 0.181 17919 35459 1 87 . 1 1 21 21 ASP C C 21 176.360 176.360 176.116 0.244 17919 35460 1 87 . 1 1 21 21 ASP CA C 21 55.700 55.700 56.319 -0.619 17919 35461 1 87 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.778 -0.978 17919 35462 1 87 . 1 1 21 21 ASP H H 21 8.030 8.030 8.064 -0.034 17919 35463 1 87 . 1 1 22 22 THR N N 22 108.800 108.800 111.903 -3.103 17919 35464 1 87 . 1 1 22 22 THR HA H 22 4.920 4.920 4.818 0.102 17919 35465 1 87 . 1 1 22 22 THR C C 22 176.750 176.750 176.355 0.395 17919 35466 1 87 . 1 1 22 22 THR CA C 22 59.690 59.690 61.340 -1.650 17919 35467 1 87 . 1 1 22 22 THR CB C 22 71.200 71.200 70.945 0.255 17919 35468 1 87 . 1 1 22 22 THR H H 22 7.900 7.900 8.110 -0.210 17919 35469 1 87 . 1 1 23 23 ILE N N 23 121.190 121.190 122.822 -1.632 17919 35470 1 87 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.724 -0.067 17919 35471 1 87 . 1 1 23 23 ILE C C 23 179.040 179.040 177.894 1.146 17919 35472 1 87 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.951 -0.691 17919 35473 1 87 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.513 -2.163 17919 35474 1 87 . 1 1 23 23 ILE H H 23 8.560 8.560 8.966 -0.406 17919 35475 1 87 . 1 1 24 24 GLU N N 24 120.830 120.830 120.745 0.085 17919 35476 1 87 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.894 0.023 17919 35477 1 87 . 1 1 24 24 GLU C C 24 178.640 178.640 178.204 0.436 17919 35478 1 87 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.185 0.035 17919 35479 1 87 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.423 -1.143 17919 35480 1 87 . 1 1 24 24 GLU H H 24 9.760 9.760 8.528 1.232 17919 35481 1 87 . 1 1 25 25 ASN N N 25 120.570 120.570 118.080 2.490 17919 35482 1 87 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.532 -0.007 17919 35483 1 87 . 1 1 25 25 ASN C C 25 178.380 178.380 178.112 0.268 17919 35484 1 87 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.521 0.539 17919 35485 1 87 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.687 -0.237 17919 35486 1 87 . 1 1 25 25 ASN H H 25 7.920 7.920 7.698 0.222 17919 35487 1 87 . 1 1 26 26 VAL N N 26 121.710 121.710 122.102 -0.392 17919 35488 1 87 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.438 -0.041 17919 35489 1 87 . 1 1 26 26 VAL C C 26 177.950 177.950 177.436 0.514 17919 35490 1 87 . 1 1 26 26 VAL CA C 26 67.660 67.660 67.379 0.281 17919 35491 1 87 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.387 -0.547 17919 35492 1 87 . 1 1 26 26 VAL H H 26 8.070 8.070 8.478 -0.408 17919 35493 1 87 . 1 1 27 27 LYS N N 27 118.860 118.860 119.360 -0.500 17919 35494 1 87 . 1 1 27 27 LYS HA H 27 4.580 4.580 3.992 0.588 17919 35495 1 87 . 1 1 27 27 LYS C C 27 180.550 180.550 178.935 1.615 17919 35496 1 87 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.674 -0.424 17919 35497 1 87 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.179 1.550 17919 35498 1 87 . 1 1 27 27 LYS H H 27 8.560 8.560 7.693 0.867 17919 35499 1 87 . 1 1 28 28 ALA N N 28 123.440 123.440 120.784 2.656 17919 35500 1 87 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.049 0.111 17919 35501 1 87 . 1 1 28 28 ALA C C 28 180.300 180.300 178.838 1.462 17919 35502 1 87 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.096 0.274 17919 35503 1 87 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.436 -0.726 17919 35504 1 87 . 1 1 28 28 ALA H H 28 8.060 8.060 8.393 -0.333 17919 35505 1 87 . 1 1 29 29 LYS N N 29 119.940 119.940 119.198 0.742 17919 35506 1 87 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.078 0.129 17919 35507 1 87 . 1 1 29 29 LYS C C 29 180.320 180.320 178.916 1.404 17919 35508 1 87 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.018 0.632 17919 35509 1 87 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.296 0.994 17919 35510 1 87 . 1 1 29 29 LYS H H 29 7.850 7.850 7.486 0.364 17919 35511 1 87 . 1 1 30 30 ILE N N 30 121.080 121.080 121.303 -0.223 17919 35512 1 87 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.490 0.017 17919 35513 1 87 . 1 1 30 30 ILE C C 30 178.310 178.310 177.620 0.690 17919 35514 1 87 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.729 0.421 17919 35515 1 87 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.333 -0.533 17919 35516 1 87 . 1 1 30 30 ILE H H 30 8.280 8.280 7.793 0.487 17919 35517 1 87 . 1 1 31 31 GLN N N 31 123.490 123.490 119.761 3.729 17919 35518 1 87 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.095 -0.266 17919 35519 1 87 . 1 1 31 31 GLN C C 31 178.890 178.890 178.501 0.389 17919 35520 1 87 . 1 1 31 31 GLN CA C 31 60.000 60.000 58.957 1.043 17919 35521 1 87 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.558 -0.838 17919 35522 1 87 . 1 1 31 31 GLN H H 31 8.580 8.580 8.085 0.495 17919 35523 1 87 . 1 1 32 32 ASP N N 32 119.360 119.360 119.418 -0.058 17919 35524 1 87 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.403 -0.049 17919 35525 1 87 . 1 1 32 32 ASP C C 32 177.250 177.250 178.051 -0.801 17919 35526 1 87 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.838 0.352 17919 35527 1 87 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.867 -0.287 17919 35528 1 87 . 1 1 32 32 ASP H H 32 8.010 8.010 7.981 0.029 17919 35529 1 87 . 1 1 33 33 LYS N N 33 115.130 115.130 118.914 -3.784 17919 35530 1 87 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.189 0.148 17919 35531 1 87 . 1 1 33 33 LYS C C 33 177.870 177.870 178.281 -0.411 17919 35532 1 87 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.233 -0.183 17919 35533 1 87 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.414 0.756 17919 35534 1 87 . 1 1 33 33 LYS H H 33 7.430 7.430 7.744 -0.314 17919 35535 1 87 . 1 1 34 34 GLU N N 34 113.870 113.870 114.671 -0.801 17919 35536 1 87 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.416 0.209 17919 35537 1 87 . 1 1 34 34 GLU C C 34 177.840 177.840 176.951 0.889 17919 35538 1 87 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.038 -0.868 17919 35539 1 87 . 1 1 34 34 GLU CB C 34 32.660 32.660 30.725 1.935 17919 35540 1 87 . 1 1 34 34 GLU H H 34 8.740 8.740 8.090 0.650 17919 35541 1 87 . 1 1 35 35 GLY N N 35 108.650 108.650 109.292 -0.642 17919 35542 1 87 . 1 1 35 35 GLY C C 35 173.960 173.960 174.488 -0.528 17919 35543 1 87 . 1 1 35 35 GLY CA C 35 46.080 46.080 46.031 0.049 17919 35544 1 87 . 1 1 35 35 GLY H H 35 8.530 8.530 7.993 0.537 17919 35545 1 87 . 1 1 36 36 ILE N N 36 119.880 119.880 120.674 -0.794 17919 35546 1 87 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.270 0.175 17919 35547 1 87 . 1 1 36 36 ILE C C 36 173.590 173.590 174.428 -0.838 17919 35548 1 87 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.083 -0.333 17919 35549 1 87 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.038 2.542 17919 35550 1 87 . 1 1 36 36 ILE H H 36 6.150 6.150 7.434 -1.284 17919 35551 1 87 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.739 -0.105 17919 35552 1 87 . 1 1 37 37 PRO C C 37 176.940 176.940 176.317 0.623 17919 35553 1 87 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.557 0.103 17919 35554 1 87 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.367 0.483 17919 35555 1 87 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.388 -0.271 17919 35556 1 87 . 1 1 38 38 PRO C C 38 178.320 178.320 177.524 0.796 17919 35557 1 87 . 1 1 38 38 PRO CA C 38 66.260 66.260 64.576 1.684 17919 35558 1 87 . 1 1 38 38 PRO CB C 38 32.890 32.890 32.170 0.720 17919 35559 1 87 . 1 1 39 39 ASP N N 39 113.380 113.380 117.092 -3.712 17919 35560 1 87 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.435 -0.005 17919 35561 1 87 . 1 1 39 39 ASP C C 39 177.090 177.090 175.516 1.574 17919 35562 1 87 . 1 1 39 39 ASP CA C 39 55.640 55.640 55.434 0.205 17919 35563 1 87 . 1 1 39 39 ASP CB C 39 39.540 39.540 39.392 0.147 17919 35564 1 87 . 1 1 39 39 ASP H H 39 8.550 8.550 8.882 -0.332 17919 35565 1 87 . 1 1 40 40 GLN N N 40 116.780 116.780 115.891 0.889 17919 35566 1 87 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.540 -0.076 17919 35567 1 87 . 1 1 40 40 GLN C C 40 175.380 175.380 175.775 -0.395 17919 35568 1 87 . 1 1 40 40 GLN CA C 40 55.640 55.640 54.913 0.727 17919 35569 1 87 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.709 0.430 17919 35570 1 87 . 1 1 40 40 GLN H H 40 7.820 7.820 7.698 0.122 17919 35571 1 87 . 1 1 41 41 GLN N N 41 117.720 117.720 121.357 -3.637 17919 35572 1 87 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.365 -0.121 17919 35573 1 87 . 1 1 41 41 GLN C C 41 176.300 176.300 175.083 1.217 17919 35574 1 87 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.860 0.610 17919 35575 1 87 . 1 1 41 41 GLN CB C 41 31.650 31.650 28.495 3.155 17919 35576 1 87 . 1 1 41 41 GLN H H 41 7.480 7.480 7.498 -0.018 17919 35577 1 87 . 1 1 42 42 ARG N N 42 122.680 122.680 124.479 -1.799 17919 35578 1 87 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.469 0.031 17919 35579 1 87 . 1 1 42 42 ARG C C 42 174.050 174.050 175.054 -1.004 17919 35580 1 87 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.724 -0.674 17919 35581 1 87 . 1 1 42 42 ARG CB C 42 31.750 31.750 31.922 -0.171 17919 35582 1 87 . 1 1 42 42 ARG H H 42 8.530 8.530 7.943 0.587 17919 35583 1 87 . 1 1 43 43 LEU N N 43 124.040 124.040 124.971 -0.931 17919 35584 1 87 . 1 1 43 43 LEU C C 43 175.290 175.290 176.004 -0.714 17919 35585 1 87 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.572 -0.592 17919 35586 1 87 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.710 2.080 17919 35587 1 87 . 1 1 43 43 LEU H H 43 8.820 8.820 8.737 0.083 17919 35588 1 87 . 1 1 44 44 ILE N N 44 121.920 121.920 121.444 0.476 17919 35589 1 87 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.271 -0.279 17919 35590 1 87 . 1 1 44 44 ILE C C 44 176.060 176.060 174.490 1.570 17919 35591 1 87 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.167 -1.187 17919 35592 1 87 . 1 1 44 44 ILE CB C 44 41.420 41.420 42.614 -1.194 17919 35593 1 87 . 1 1 44 44 ILE H H 44 9.030 9.030 8.090 0.940 17919 35594 1 87 . 1 1 45 45 PHE N N 45 125.390 125.390 126.113 -0.723 17919 35595 1 87 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.980 0.065 17919 35596 1 87 . 1 1 45 45 PHE C C 45 174.470 174.470 174.279 0.191 17919 35597 1 87 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.756 0.264 17919 35598 1 87 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.814 0.946 17919 35599 1 87 . 1 1 45 45 PHE H H 45 8.830 8.830 8.611 0.219 17919 35600 1 87 . 1 1 46 46 ALA N N 46 132.200 132.200 128.215 3.985 17919 35601 1 87 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.714 -0.024 17919 35602 1 87 . 1 1 46 46 ALA C C 46 177.290 177.290 177.926 -0.636 17919 35603 1 87 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.917 -0.377 17919 35604 1 87 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.621 -0.051 17919 35605 1 87 . 1 1 46 46 ALA H H 46 8.810 8.810 9.016 -0.206 17919 35606 1 87 . 1 1 47 47 GLY N N 47 102.340 102.340 104.233 -1.893 17919 35607 1 87 . 1 1 47 47 GLY C C 47 173.810 173.810 174.256 -0.446 17919 35608 1 87 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.995 0.355 17919 35609 1 87 . 1 1 47 47 GLY H H 47 8.130 8.130 8.582 -0.452 17919 35610 1 87 . 1 1 48 48 LYS N N 48 121.570 121.570 121.707 -0.137 17919 35611 1 87 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.594 0.028 17919 35612 1 87 . 1 1 48 48 LYS C C 48 174.700 174.700 175.513 -0.813 17919 35613 1 87 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.785 -0.235 17919 35614 1 87 . 1 1 48 48 LYS CB C 48 34.530 34.530 33.436 1.094 17919 35615 1 87 . 1 1 48 48 LYS H H 48 7.980 7.980 7.990 -0.010 17919 35616 1 87 . 1 1 49 49 GLN N N 49 122.410 122.410 125.233 -2.823 17919 35617 1 87 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.568 -0.008 17919 35618 1 87 . 1 1 49 49 GLN C C 49 175.670 175.670 175.315 0.355 17919 35619 1 87 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.969 -0.229 17919 35620 1 87 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.708 -0.708 17919 35621 1 87 . 1 1 49 49 GLN H H 49 8.600 8.600 8.545 0.055 17919 35622 1 87 . 1 1 50 50 LEU N N 50 125.520 125.520 124.555 0.965 17919 35623 1 87 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.291 -0.201 17919 35624 1 87 . 1 1 50 50 LEU C C 50 176.660 176.660 175.462 1.198 17919 35625 1 87 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.240 1.000 17919 35626 1 87 . 1 1 50 50 LEU CB C 50 41.570 41.570 43.015 -1.445 17919 35627 1 87 . 1 1 50 50 LEU H H 50 8.530 8.530 8.690 -0.160 17919 35628 1 87 . 1 1 51 51 GLU N N 51 122.940 122.940 122.916 0.024 17919 35629 1 87 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.455 0.033 17919 35630 1 87 . 1 1 51 51 GLU C C 51 175.870 175.870 176.692 -0.822 17919 35631 1 87 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.084 0.876 17919 35632 1 87 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.014 -0.444 17919 35633 1 87 . 1 1 51 51 GLU H H 51 8.400 8.400 7.981 0.419 17919 35634 1 87 . 1 1 52 52 ASP N N 52 120.030 120.030 126.523 -6.493 17919 35635 1 87 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.433 -0.074 17919 35636 1 87 . 1 1 52 52 ASP C C 52 177.330 177.330 177.352 -0.022 17919 35637 1 87 . 1 1 52 52 ASP CA C 52 56.960 56.960 56.504 0.456 17919 35638 1 87 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.613 0.237 17919 35639 1 87 . 1 1 52 52 ASP H H 52 8.160 8.160 8.720 -0.559 17919 35640 1 87 . 1 1 53 53 GLY N N 53 106.660 106.660 104.890 1.770 17919 35641 1 87 . 1 1 53 53 GLY C C 53 174.870 174.870 174.237 0.633 17919 35642 1 87 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.083 0.087 17919 35643 1 87 . 1 1 53 53 GLY H H 53 9.390 9.390 8.561 0.829 17919 35644 1 87 . 1 1 54 54 ARG N N 54 119.050 119.050 119.397 -0.347 17919 35645 1 87 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.715 -0.020 17919 35646 1 87 . 1 1 54 54 ARG C C 54 175.350 175.350 174.807 0.543 17919 35647 1 87 . 1 1 54 54 ARG CA C 54 54.390 54.390 53.622 0.768 17919 35648 1 87 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.433 -0.783 17919 35649 1 87 . 1 1 54 54 ARG H H 54 7.460 7.460 7.437 0.023 17919 35650 1 87 . 1 1 55 55 THR N N 55 108.400 108.400 112.941 -4.541 17919 35651 1 87 . 1 1 55 55 THR HA H 55 5.240 5.240 4.863 0.377 17919 35652 1 87 . 1 1 55 55 THR C C 55 176.560 176.560 176.614 -0.054 17919 35653 1 87 . 1 1 55 55 THR CA C 55 59.690 59.690 60.819 -1.129 17919 35654 1 87 . 1 1 55 55 THR CB C 55 72.260 72.260 70.251 2.009 17919 35655 1 87 . 1 1 55 55 THR H H 55 8.730 8.730 8.472 0.258 17919 35656 1 87 . 1 1 56 56 LEU N N 56 117.920 117.920 122.035 -4.115 17919 35657 1 87 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.885 0.175 17919 35658 1 87 . 1 1 56 56 LEU C C 56 180.810 180.810 178.895 1.915 17919 35659 1 87 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.692 0.018 17919 35660 1 87 . 1 1 56 56 LEU CB C 56 40.370 40.370 40.726 -0.356 17919 35661 1 87 . 1 1 56 56 LEU H H 56 8.140 8.140 8.397 -0.257 17919 35662 1 87 . 1 1 57 57 SER N N 57 113.330 113.330 114.294 -0.964 17919 35663 1 87 . 1 1 57 57 SER HA H 57 4.370 4.370 4.218 0.152 17919 35664 1 87 . 1 1 57 57 SER C C 57 178.310 178.310 176.809 1.501 17919 35665 1 87 . 1 1 57 57 SER CA C 57 61.080 61.080 61.595 -0.515 17919 35666 1 87 . 1 1 57 57 SER CB C 57 62.530 62.530 62.848 -0.318 17919 35667 1 87 . 1 1 57 57 SER H H 57 8.470 8.470 8.434 0.036 17919 35668 1 87 . 1 1 58 58 ASP N N 58 124.190 124.190 123.090 1.100 17919 35669 1 87 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.262 0.034 17919 35670 1 87 . 1 1 58 58 ASP C C 58 177.400 177.400 177.268 0.132 17919 35671 1 87 . 1 1 58 58 ASP CA C 58 57.180 57.180 57.392 -0.212 17919 35672 1 87 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.349 -0.249 17919 35673 1 87 . 1 1 58 58 ASP H H 58 7.930 7.930 7.787 0.143 17919 35674 1 87 . 1 1 59 59 TYR N N 59 115.510 115.510 113.735 1.775 17919 35675 1 87 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.717 -0.047 17919 35676 1 87 . 1 1 59 59 TYR C C 59 174.700 174.700 175.131 -0.431 17919 35677 1 87 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.038 1.212 17919 35678 1 87 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.445 1.625 17919 35679 1 87 . 1 1 59 59 TYR H H 59 7.250 7.250 7.267 -0.017 17919 35680 1 87 . 1 1 60 60 ASN N N 60 115.900 115.900 116.940 -1.040 17919 35681 1 87 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.409 -0.054 17919 35682 1 87 . 1 1 60 60 ASN C C 60 174.340 174.340 174.874 -0.534 17919 35683 1 87 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.091 0.029 17919 35684 1 87 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.646 -0.236 17919 35685 1 87 . 1 1 60 60 ASN H H 60 8.150 8.150 7.655 0.495 17919 35686 1 87 . 1 1 61 61 ILE N N 61 118.600 118.600 120.549 -1.949 17919 35687 1 87 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.841 -0.448 17919 35688 1 87 . 1 1 61 61 ILE C C 61 174.610 174.610 175.253 -0.643 17919 35689 1 87 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.624 -0.204 17919 35690 1 87 . 1 1 61 61 ILE CB C 61 36.740 36.740 36.968 -0.228 17919 35691 1 87 . 1 1 61 61 ILE H H 61 7.250 7.250 8.145 -0.895 17919 35692 1 87 . 1 1 62 62 GLN N N 62 124.740 124.740 125.884 -1.144 17919 35693 1 87 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.651 -0.145 17919 35694 1 87 . 1 1 62 62 GLN C C 62 175.970 175.970 175.900 0.070 17919 35695 1 87 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.858 -0.198 17919 35696 1 87 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.925 -0.275 17919 35697 1 87 . 1 1 62 62 GLN H H 62 7.610 7.610 8.065 -0.455 17919 35698 1 87 . 1 1 63 63 LYS N N 63 120.300 120.300 119.953 0.347 17919 35699 1 87 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.885 0.116 17919 35700 1 87 . 1 1 63 63 LYS C C 63 175.810 175.810 177.136 -1.326 17919 35701 1 87 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.020 -0.230 17919 35702 1 87 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.130 0.520 17919 35703 1 87 . 1 1 63 63 LYS H H 63 8.490 8.490 8.769 -0.279 17919 35704 1 87 . 1 1 64 64 GLU N N 64 113.950 113.950 117.897 -3.947 17919 35705 1 87 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.707 -0.242 17919 35706 1 87 . 1 1 64 64 GLU C C 64 175.250 175.250 175.753 -0.503 17919 35707 1 87 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.893 -0.003 17919 35708 1 87 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.432 -2.532 17919 35709 1 87 . 1 1 64 64 GLU H H 64 9.280 9.280 8.650 0.630 17919 35710 1 87 . 1 1 65 65 SER N N 65 114.730 114.730 114.469 0.261 17919 35711 1 87 . 1 1 65 65 SER HA H 65 4.640 4.640 4.547 0.093 17919 35712 1 87 . 1 1 65 65 SER C C 65 172.160 172.160 174.123 -1.963 17919 35713 1 87 . 1 1 65 65 SER CA C 65 60.890 60.890 59.541 1.349 17919 35714 1 87 . 1 1 65 65 SER CB C 65 64.910 64.910 63.945 0.965 17919 35715 1 87 . 1 1 65 65 SER H H 65 7.670 7.670 7.600 0.070 17919 35716 1 87 . 1 1 66 66 THR N N 66 117.110 117.110 119.179 -2.069 17919 35717 1 87 . 1 1 66 66 THR HA H 66 5.270 5.270 4.880 0.390 17919 35718 1 87 . 1 1 66 66 THR C C 66 173.950 173.950 174.294 -0.344 17919 35719 1 87 . 1 1 66 66 THR CA C 66 62.340 62.340 62.717 -0.377 17919 35720 1 87 . 1 1 66 66 THR CB C 66 70.080 70.080 69.551 0.529 17919 35721 1 87 . 1 1 66 66 THR H H 66 8.730 8.730 8.477 0.253 17919 35722 1 87 . 1 1 67 67 LEU N N 67 127.110 127.110 129.512 -2.402 17919 35723 1 87 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.492 0.568 17919 35724 1 87 . 1 1 67 67 LEU C C 67 175.770 175.770 175.528 0.242 17919 35725 1 87 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.751 0.149 17919 35726 1 87 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.990 0.270 17919 35727 1 87 . 1 1 67 67 LEU H H 67 9.410 9.410 9.029 0.381 17919 35728 1 87 . 1 1 68 68 HIS N N 68 118.380 118.380 123.985 -5.605 17919 35729 1 87 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.261 -0.021 17919 35730 1 87 . 1 1 68 68 HIS C C 68 173.150 173.150 173.709 -0.559 17919 35731 1 87 . 1 1 68 68 HIS CA C 68 55.000 55.000 55.484 -0.485 17919 35732 1 87 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.742 -2.212 17919 35733 1 87 . 1 1 68 68 HIS H H 68 9.230 9.230 9.043 0.187 17919 35734 1 87 . 1 1 69 69 LEU N N 69 124.460 124.460 123.443 1.017 17919 35735 1 87 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.845 0.345 17919 35736 1 87 . 1 1 69 69 LEU C C 69 175.270 175.270 173.791 1.479 17919 35737 1 87 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.745 -0.855 17919 35738 1 87 . 1 1 69 69 LEU CB C 69 44.380 44.380 45.221 -0.841 17919 35739 1 87 . 1 1 69 69 LEU H H 69 8.340 8.340 7.109 1.231 17919 35740 1 87 . 1 1 70 70 VAL N N 70 126.940 126.940 126.884 0.056 17919 35741 1 87 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.435 -0.085 17919 35742 1 87 . 1 1 70 70 VAL C C 70 174.000 174.000 174.015 -0.015 17919 35743 1 87 . 1 1 70 70 VAL CA C 70 60.800 60.800 61.245 -0.445 17919 35744 1 87 . 1 1 70 70 VAL CB C 70 34.910 34.910 34.082 0.828 17919 35745 1 87 . 1 1 70 70 VAL H H 70 9.200 9.200 8.075 1.125 17919 35746 1 87 . 1 1 71 71 LEU N N 71 123.130 123.130 128.383 -5.253 17919 35747 1 87 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.018 0.042 17919 35748 1 87 . 1 1 71 71 LEU C C 71 177.830 177.830 176.305 1.525 17919 35749 1 87 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.584 0.356 17919 35750 1 87 . 1 1 71 71 LEU CB C 71 42.850 42.850 44.822 -1.972 17919 35751 1 87 . 1 1 71 71 LEU H H 71 8.120 8.120 8.437 -0.317 17919 35752 1 87 . 1 1 72 72 ARG N N 72 123.490 123.490 120.637 2.853 17919 35753 1 87 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.586 -0.285 17919 35754 1 87 . 1 1 72 72 ARG C C 72 175.350 175.350 174.316 1.034 17919 35755 1 87 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.380 0.230 17919 35756 1 87 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.779 0.571 17919 35757 1 87 . 1 1 72 72 ARG H H 72 8.580 8.580 7.986 0.594 17919 35758 1 88 . 1 1 2 2 GLN N N 2 123.220 123.220 126.622 -3.402 17919 35759 1 88 . 1 1 2 2 GLN HA H 2 5.249 5.249 4.528 0.721 17919 35760 1 88 . 1 1 2 2 GLN C C 2 175.920 175.920 174.720 1.200 17919 35761 1 88 . 1 1 2 2 GLN CA C 2 55.080 55.080 56.528 -1.448 17919 35762 1 88 . 1 1 2 2 GLN CB C 2 30.760 30.760 29.644 1.116 17919 35763 1 88 . 1 1 2 2 GLN H H 2 8.900 8.900 8.387 0.513 17919 35764 1 88 . 1 1 3 3 ILE N N 3 115.340 115.340 117.865 -2.525 17919 35765 1 88 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.405 -0.192 17919 35766 1 88 . 1 1 3 3 ILE C C 3 172.450 172.450 173.948 -1.498 17919 35767 1 88 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.054 0.516 17919 35768 1 88 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.053 1.157 17919 35769 1 88 . 1 1 3 3 ILE H H 3 8.320 8.320 8.604 -0.284 17919 35770 1 88 . 1 1 4 4 PHE N N 4 118.110 118.110 122.024 -3.914 17919 35771 1 88 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.132 0.498 17919 35772 1 88 . 1 1 4 4 PHE C C 4 175.320 175.320 175.421 -0.101 17919 35773 1 88 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.841 -0.631 17919 35774 1 88 . 1 1 4 4 PHE CB C 4 41.480 41.480 40.504 0.976 17919 35775 1 88 . 1 1 4 4 PHE H H 4 8.610 8.610 8.836 -0.226 17919 35776 1 88 . 1 1 5 5 VAL N N 5 121.000 121.000 122.721 -1.721 17919 35777 1 88 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.822 -0.097 17919 35778 1 88 . 1 1 5 5 VAL C C 5 174.870 174.870 174.797 0.073 17919 35779 1 88 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.173 -0.553 17919 35780 1 88 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.597 0.633 17919 35781 1 88 . 1 1 5 5 VAL H H 5 9.300 9.300 9.312 -0.012 17919 35782 1 88 . 1 1 6 6 LYS N N 6 127.520 127.520 129.705 -2.185 17919 35783 1 88 . 1 1 6 6 LYS HA H 6 5.367 5.367 4.919 0.448 17919 35784 1 88 . 1 1 6 6 LYS C C 6 177.140 177.140 175.757 1.383 17919 35785 1 88 . 1 1 6 6 LYS CA C 6 54.520 54.520 55.389 -0.869 17919 35786 1 88 . 1 1 6 6 LYS CB C 6 35.050 35.050 33.605 1.445 17919 35787 1 88 . 1 1 6 6 LYS H H 6 8.820 8.820 8.764 0.056 17919 35788 1 88 . 1 1 7 7 THR N N 7 115.400 115.400 123.931 -8.531 17919 35789 1 88 . 1 1 7 7 THR HA H 7 4.970 4.970 4.721 0.249 17919 35790 1 88 . 1 1 7 7 THR C C 7 176.910 176.910 174.744 2.166 17919 35791 1 88 . 1 1 7 7 THR CA C 7 60.470 60.470 62.214 -1.744 17919 35792 1 88 . 1 1 7 7 THR CB C 7 70.630 70.630 68.903 1.727 17919 35793 1 88 . 1 1 7 7 THR H H 7 8.730 8.730 9.288 -0.558 17919 35794 1 88 . 1 1 8 8 LEU N N 8 121.330 121.330 127.990 -6.660 17919 35795 1 88 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.013 0.297 17919 35796 1 88 . 1 1 8 8 LEU C C 8 178.800 178.800 177.749 1.051 17919 35797 1 88 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.655 -0.075 17919 35798 1 88 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.948 0.022 17919 35799 1 88 . 1 1 8 8 LEU H H 8 9.100 9.100 7.975 1.125 17919 35800 1 88 . 1 1 9 9 THR N N 9 105.590 105.590 107.753 -2.163 17919 35801 1 88 . 1 1 9 9 THR HA H 9 4.428 4.428 4.206 0.222 17919 35802 1 88 . 1 1 9 9 THR C C 9 175.520 175.520 175.551 -0.031 17919 35803 1 88 . 1 1 9 9 THR CA C 9 61.400 61.400 63.038 -1.638 17919 35804 1 88 . 1 1 9 9 THR CB C 9 69.140 69.140 68.334 0.806 17919 35805 1 88 . 1 1 9 9 THR H H 9 7.630 7.630 7.987 -0.357 17919 35806 1 88 . 1 1 10 10 GLY N N 10 108.890 108.890 110.716 -1.826 17919 35807 1 88 . 1 1 10 10 GLY C C 10 174.070 174.070 173.418 0.652 17919 35808 1 88 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.068 0.392 17919 35809 1 88 . 1 1 10 10 GLY H H 10 7.810 7.810 7.921 -0.111 17919 35810 1 88 . 1 1 11 11 LYS N N 11 121.600 121.600 122.796 -1.196 17919 35811 1 88 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.669 -0.308 17919 35812 1 88 . 1 1 11 11 LYS C C 11 175.940 175.940 175.727 0.213 17919 35813 1 88 . 1 1 11 11 LYS CA C 11 56.280 56.280 54.799 1.481 17919 35814 1 88 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.724 -0.524 17919 35815 1 88 . 1 1 11 11 LYS H H 11 7.280 7.280 7.953 -0.673 17919 35816 1 88 . 1 1 12 12 THR N N 12 120.440 120.440 120.774 -0.334 17919 35817 1 88 . 1 1 12 12 THR HA H 12 5.046 5.046 4.479 0.567 17919 35818 1 88 . 1 1 12 12 THR C C 12 174.320 174.320 174.354 -0.034 17919 35819 1 88 . 1 1 12 12 THR CA C 12 62.390 62.390 62.763 -0.373 17919 35820 1 88 . 1 1 12 12 THR CB C 12 69.910 69.910 68.855 1.055 17919 35821 1 88 . 1 1 12 12 THR H H 12 8.650 8.650 8.551 0.099 17919 35822 1 88 . 1 1 13 13 ILE N N 13 127.110 127.110 128.225 -1.115 17919 35823 1 88 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.650 -0.106 17919 35824 1 88 . 1 1 13 13 ILE C C 13 175.220 175.220 175.426 -0.206 17919 35825 1 88 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.227 0.753 17919 35826 1 88 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.229 0.721 17919 35827 1 88 . 1 1 13 13 ILE H H 13 9.450 9.450 9.149 0.301 17919 35828 1 88 . 1 1 14 14 THR N N 14 121.520 121.520 119.016 2.504 17919 35829 1 88 . 1 1 14 14 THR HA H 14 4.964 4.964 5.326 -0.362 17919 35830 1 88 . 1 1 14 14 THR C C 14 173.790 173.790 173.323 0.467 17919 35831 1 88 . 1 1 14 14 THR CA C 14 61.940 61.940 60.237 1.703 17919 35832 1 88 . 1 1 14 14 THR CB C 14 69.650 69.650 70.381 -0.731 17919 35833 1 88 . 1 1 14 14 THR H H 14 8.710 8.710 8.277 0.433 17919 35834 1 88 . 1 1 15 15 LEU N N 15 124.800 124.800 127.021 -2.221 17919 35835 1 88 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.791 -0.011 17919 35836 1 88 . 1 1 15 15 LEU C C 15 174.670 174.670 174.990 -0.320 17919 35837 1 88 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.581 -0.751 17919 35838 1 88 . 1 1 15 15 LEU CB C 15 47.070 47.070 46.350 0.720 17919 35839 1 88 . 1 1 15 15 LEU H H 15 8.710 8.710 8.537 0.173 17919 35840 1 88 . 1 1 16 16 GLU N N 16 122.160 122.160 123.528 -1.368 17919 35841 1 88 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.460 0.457 17919 35842 1 88 . 1 1 16 16 GLU C C 16 175.860 175.860 175.221 0.639 17919 35843 1 88 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.510 -0.690 17919 35844 1 88 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.025 -0.575 17919 35845 1 88 . 1 1 16 16 GLU H H 16 8.140 8.140 8.487 -0.347 17919 35846 1 88 . 1 1 17 17 VAL N N 17 117.210 117.210 120.756 -3.546 17919 35847 1 88 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.567 0.147 17919 35848 1 88 . 1 1 17 17 VAL C C 17 174.160 174.160 174.817 -0.657 17919 35849 1 88 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.709 -1.279 17919 35850 1 88 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.776 0.624 17919 35851 1 88 . 1 1 17 17 VAL H H 17 8.900 8.900 8.507 0.393 17919 35852 1 88 . 1 1 18 18 GLU N N 18 118.990 118.990 121.656 -2.666 17919 35853 1 88 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.916 0.163 17919 35854 1 88 . 1 1 18 18 GLU C C 18 176.160 176.160 176.058 0.102 17919 35855 1 88 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.727 -0.007 17919 35856 1 88 . 1 1 18 18 GLU CB C 18 30.310 30.310 31.102 -0.793 17919 35857 1 88 . 1 1 18 18 GLU H H 18 8.640 8.640 9.458 -0.818 17919 35858 1 88 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.262 -0.121 17919 35859 1 88 . 1 1 19 19 PRO C C 19 175.310 175.310 177.221 -1.911 17919 35860 1 88 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.051 0.419 17919 35861 1 88 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.736 0.214 17919 35862 1 88 . 1 1 20 20 SER N N 20 103.400 103.400 109.938 -6.538 17919 35863 1 88 . 1 1 20 20 SER HA H 20 4.370 4.370 4.323 0.047 17919 35864 1 88 . 1 1 20 20 SER C C 20 174.660 174.660 174.407 0.253 17919 35865 1 88 . 1 1 20 20 SER CA C 20 57.400 57.400 58.347 -0.947 17919 35866 1 88 . 1 1 20 20 SER CB C 20 63.370 63.370 62.919 0.451 17919 35867 1 88 . 1 1 20 20 SER H H 20 7.040 7.040 8.304 -1.264 17919 35868 1 88 . 1 1 21 21 ASP N N 21 123.480 123.480 124.201 -0.721 17919 35869 1 88 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.751 -0.056 17919 35870 1 88 . 1 1 21 21 ASP C C 21 176.360 176.360 175.734 0.626 17919 35871 1 88 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.923 0.777 17919 35872 1 88 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.957 -1.157 17919 35873 1 88 . 1 1 21 21 ASP H H 21 8.030 8.030 7.694 0.336 17919 35874 1 88 . 1 1 22 22 THR N N 22 108.800 108.800 112.943 -4.143 17919 35875 1 88 . 1 1 22 22 THR HA H 22 4.920 4.920 4.347 0.573 17919 35876 1 88 . 1 1 22 22 THR C C 22 176.750 176.750 175.939 0.811 17919 35877 1 88 . 1 1 22 22 THR CA C 22 59.690 59.690 61.506 -1.816 17919 35878 1 88 . 1 1 22 22 THR CB C 22 71.200 71.200 69.810 1.390 17919 35879 1 88 . 1 1 22 22 THR H H 22 7.900 7.900 8.451 -0.551 17919 35880 1 88 . 1 1 23 23 ILE N N 23 121.190 121.190 124.494 -3.304 17919 35881 1 88 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.680 -0.023 17919 35882 1 88 . 1 1 23 23 ILE C C 23 179.040 179.040 177.398 1.642 17919 35883 1 88 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.359 -1.099 17919 35884 1 88 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.619 -2.269 17919 35885 1 88 . 1 1 23 23 ILE H H 23 8.560 8.560 8.537 0.023 17919 35886 1 88 . 1 1 24 24 GLU N N 24 120.830 120.830 120.714 0.116 17919 35887 1 88 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.913 0.004 17919 35888 1 88 . 1 1 24 24 GLU C C 24 178.640 178.640 179.183 -0.543 17919 35889 1 88 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.962 0.258 17919 35890 1 88 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.399 -1.119 17919 35891 1 88 . 1 1 24 24 GLU H H 24 9.760 9.760 8.344 1.416 17919 35892 1 88 . 1 1 25 25 ASN N N 25 120.570 120.570 118.020 2.550 17919 35893 1 88 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.490 0.035 17919 35894 1 88 . 1 1 25 25 ASN C C 25 178.380 178.380 177.831 0.549 17919 35895 1 88 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.325 -0.265 17919 35896 1 88 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.736 -0.286 17919 35897 1 88 . 1 1 25 25 ASN H H 25 7.920 7.920 7.911 0.009 17919 35898 1 88 . 1 1 26 26 VAL N N 26 121.710 121.710 121.362 0.348 17919 35899 1 88 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.774 -0.377 17919 35900 1 88 . 1 1 26 26 VAL C C 26 177.950 177.950 177.055 0.895 17919 35901 1 88 . 1 1 26 26 VAL CA C 26 67.660 67.660 65.094 2.567 17919 35902 1 88 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.472 -0.632 17919 35903 1 88 . 1 1 26 26 VAL H H 26 8.070 8.070 7.835 0.235 17919 35904 1 88 . 1 1 27 27 LYS N N 27 118.860 118.860 120.178 -1.318 17919 35905 1 88 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.191 0.389 17919 35906 1 88 . 1 1 27 27 LYS C C 27 180.550 180.550 178.934 1.616 17919 35907 1 88 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.873 -0.623 17919 35908 1 88 . 1 1 27 27 LYS CB C 27 33.730 33.730 31.984 1.746 17919 35909 1 88 . 1 1 27 27 LYS H H 27 8.560 8.560 8.258 0.302 17919 35910 1 88 . 1 1 28 28 ALA N N 28 123.440 123.440 121.780 1.660 17919 35911 1 88 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.056 0.104 17919 35912 1 88 . 1 1 28 28 ALA C C 28 180.300 180.300 179.539 0.761 17919 35913 1 88 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.983 0.387 17919 35914 1 88 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.166 -0.456 17919 35915 1 88 . 1 1 28 28 ALA H H 28 8.060 8.060 7.769 0.291 17919 35916 1 88 . 1 1 29 29 LYS N N 29 119.940 119.940 119.935 0.005 17919 35917 1 88 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.094 0.113 17919 35918 1 88 . 1 1 29 29 LYS C C 29 180.320 180.320 178.916 1.404 17919 35919 1 88 . 1 1 29 29 LYS CA C 29 59.650 59.650 58.213 1.437 17919 35920 1 88 . 1 1 29 29 LYS CB C 29 33.290 33.290 31.819 1.471 17919 35921 1 88 . 1 1 29 29 LYS H H 29 7.850 7.850 7.640 0.210 17919 35922 1 88 . 1 1 30 30 ILE N N 30 121.080 121.080 120.370 0.710 17919 35923 1 88 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.588 -0.081 17919 35924 1 88 . 1 1 30 30 ILE C C 30 178.310 178.310 178.067 0.243 17919 35925 1 88 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.938 0.212 17919 35926 1 88 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.068 -0.268 17919 35927 1 88 . 1 1 30 30 ILE H H 30 8.280 8.280 8.362 -0.082 17919 35928 1 88 . 1 1 31 31 GLN N N 31 123.490 123.490 119.258 4.232 17919 35929 1 88 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.084 -0.255 17919 35930 1 88 . 1 1 31 31 GLN C C 31 178.890 178.890 178.557 0.333 17919 35931 1 88 . 1 1 31 31 GLN CA C 31 60.000 60.000 58.868 1.132 17919 35932 1 88 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.585 -0.865 17919 35933 1 88 . 1 1 31 31 GLN H H 31 8.580 8.580 8.557 0.023 17919 35934 1 88 . 1 1 32 32 ASP N N 32 119.360 119.360 120.341 -0.981 17919 35935 1 88 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.376 -0.022 17919 35936 1 88 . 1 1 32 32 ASP C C 32 177.250 177.250 178.099 -0.849 17919 35937 1 88 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.711 0.479 17919 35938 1 88 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.668 -0.088 17919 35939 1 88 . 1 1 32 32 ASP H H 32 8.010 8.010 7.991 0.019 17919 35940 1 88 . 1 1 33 33 LYS N N 33 115.130 115.130 118.713 -3.583 17919 35941 1 88 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.174 0.163 17919 35942 1 88 . 1 1 33 33 LYS C C 33 177.870 177.870 178.045 -0.175 17919 35943 1 88 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.641 0.409 17919 35944 1 88 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.098 1.072 17919 35945 1 88 . 1 1 33 33 LYS H H 33 7.430 7.430 8.176 -0.746 17919 35946 1 88 . 1 1 34 34 GLU N N 34 113.870 113.870 115.358 -1.488 17919 35947 1 88 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.536 0.089 17919 35948 1 88 . 1 1 34 34 GLU C C 34 177.840 177.840 176.505 1.335 17919 35949 1 88 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.324 -1.154 17919 35950 1 88 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.836 0.824 17919 35951 1 88 . 1 1 34 34 GLU H H 34 8.740 8.740 7.747 0.993 17919 35952 1 88 . 1 1 35 35 GLY N N 35 108.650 108.650 109.153 -0.503 17919 35953 1 88 . 1 1 35 35 GLY C C 35 173.960 173.960 174.577 -0.617 17919 35954 1 88 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.608 0.472 17919 35955 1 88 . 1 1 35 35 GLY H H 35 8.530 8.530 7.884 0.646 17919 35956 1 88 . 1 1 36 36 ILE N N 36 119.880 119.880 122.576 -2.696 17919 35957 1 88 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.384 0.061 17919 35958 1 88 . 1 1 36 36 ILE C C 36 173.590 173.590 174.480 -0.890 17919 35959 1 88 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.329 -0.579 17919 35960 1 88 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.172 2.408 17919 35961 1 88 . 1 1 36 36 ILE H H 36 6.150 6.150 7.808 -1.658 17919 35962 1 88 . 1 1 37 37 PRO HA H 37 4.634 4.634 5.126 -0.492 17919 35963 1 88 . 1 1 37 37 PRO C C 37 176.940 176.940 176.035 0.905 17919 35964 1 88 . 1 1 37 37 PRO CA C 37 61.660 61.660 60.896 0.764 17919 35965 1 88 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.221 0.629 17919 35966 1 88 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.357 -0.240 17919 35967 1 88 . 1 1 38 38 PRO C C 38 178.320 178.320 176.942 1.378 17919 35968 1 88 . 1 1 38 38 PRO CA C 38 66.260 66.260 64.879 1.381 17919 35969 1 88 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.769 1.121 17919 35970 1 88 . 1 1 39 39 ASP N N 39 113.380 113.380 117.553 -4.173 17919 35971 1 88 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.343 0.087 17919 35972 1 88 . 1 1 39 39 ASP C C 39 177.090 177.090 178.840 -1.750 17919 35973 1 88 . 1 1 39 39 ASP CA C 39 55.640 55.640 57.119 -1.479 17919 35974 1 88 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.625 -1.085 17919 35975 1 88 . 1 1 39 39 ASP H H 39 8.550 8.550 8.209 0.341 17919 35976 1 88 . 1 1 40 40 GLN N N 40 116.780 116.780 118.382 -1.602 17919 35977 1 88 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.113 0.351 17919 35978 1 88 . 1 1 40 40 GLN C C 40 175.380 175.380 176.744 -1.364 17919 35979 1 88 . 1 1 40 40 GLN CA C 40 55.640 55.640 57.996 -2.356 17919 35980 1 88 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.461 0.679 17919 35981 1 88 . 1 1 40 40 GLN H H 40 7.820 7.820 7.886 -0.066 17919 35982 1 88 . 1 1 41 41 GLN N N 41 117.720 117.720 118.252 -0.532 17919 35983 1 88 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.306 -0.062 17919 35984 1 88 . 1 1 41 41 GLN C C 41 176.300 176.300 175.777 0.523 17919 35985 1 88 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.770 -0.300 17919 35986 1 88 . 1 1 41 41 GLN CB C 41 31.650 31.650 28.433 3.217 17919 35987 1 88 . 1 1 41 41 GLN H H 41 7.480 7.480 7.597 -0.117 17919 35988 1 88 . 1 1 42 42 ARG N N 42 122.680 122.680 124.212 -1.532 17919 35989 1 88 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.654 -0.154 17919 35990 1 88 . 1 1 42 42 ARG C C 42 174.050 174.050 174.420 -0.370 17919 35991 1 88 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.136 0.913 17919 35992 1 88 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.302 -1.552 17919 35993 1 88 . 1 1 42 42 ARG H H 42 8.530 8.530 8.064 0.466 17919 35994 1 88 . 1 1 43 43 LEU N N 43 124.040 124.040 125.825 -1.785 17919 35995 1 88 . 1 1 43 43 LEU C C 43 175.290 175.290 176.047 -0.757 17919 35996 1 88 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.497 -1.517 17919 35997 1 88 . 1 1 43 43 LEU CB C 43 45.790 45.790 42.752 3.038 17919 35998 1 88 . 1 1 43 43 LEU H H 43 8.820 8.820 8.844 -0.024 17919 35999 1 88 . 1 1 44 44 ILE N N 44 121.920 121.920 123.056 -1.136 17919 36000 1 88 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.815 0.177 17919 36001 1 88 . 1 1 44 44 ILE C C 44 176.060 176.060 174.450 1.610 17919 36002 1 88 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.270 -1.290 17919 36003 1 88 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.273 0.147 17919 36004 1 88 . 1 1 44 44 ILE H H 44 9.030 9.030 8.965 0.065 17919 36005 1 88 . 1 1 45 45 PHE N N 45 125.390 125.390 127.622 -2.232 17919 36006 1 88 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.058 -0.013 17919 36007 1 88 . 1 1 45 45 PHE C C 45 174.470 174.470 174.684 -0.214 17919 36008 1 88 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.365 0.655 17919 36009 1 88 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.066 0.694 17919 36010 1 88 . 1 1 45 45 PHE H H 45 8.830 8.830 8.481 0.349 17919 36011 1 88 . 1 1 46 46 ALA N N 46 132.200 132.200 129.691 2.509 17919 36012 1 88 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.741 -0.051 17919 36013 1 88 . 1 1 46 46 ALA C C 46 177.290 177.290 177.197 0.093 17919 36014 1 88 . 1 1 46 46 ALA CA C 46 52.540 52.540 53.161 -0.621 17919 36015 1 88 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.706 -0.136 17919 36016 1 88 . 1 1 46 46 ALA H H 46 8.810 8.810 9.028 -0.218 17919 36017 1 88 . 1 1 47 47 GLY N N 47 102.340 102.340 104.185 -1.845 17919 36018 1 88 . 1 1 47 47 GLY C C 47 173.810 173.810 174.668 -0.858 17919 36019 1 88 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.370 -0.020 17919 36020 1 88 . 1 1 47 47 GLY H H 47 8.130 8.130 8.509 -0.379 17919 36021 1 88 . 1 1 48 48 LYS N N 48 121.570 121.570 123.295 -1.725 17919 36022 1 88 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.541 0.081 17919 36023 1 88 . 1 1 48 48 LYS C C 48 174.700 174.700 175.989 -1.289 17919 36024 1 88 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.803 -0.254 17919 36025 1 88 . 1 1 48 48 LYS CB C 48 34.530 34.530 33.068 1.462 17919 36026 1 88 . 1 1 48 48 LYS H H 48 7.980 7.980 8.206 -0.226 17919 36027 1 88 . 1 1 49 49 GLN N N 49 122.410 122.410 124.534 -2.124 17919 36028 1 88 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.356 0.204 17919 36029 1 88 . 1 1 49 49 GLN C C 49 175.670 175.670 176.184 -0.514 17919 36030 1 88 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.357 -0.617 17919 36031 1 88 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.102 -0.102 17919 36032 1 88 . 1 1 49 49 GLN H H 49 8.600 8.600 8.712 -0.112 17919 36033 1 88 . 1 1 50 50 LEU N N 50 125.520 125.520 126.051 -0.531 17919 36034 1 88 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.078 0.012 17919 36035 1 88 . 1 1 50 50 LEU C C 50 176.660 176.660 176.561 0.099 17919 36036 1 88 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.531 -0.291 17919 36037 1 88 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.124 -0.554 17919 36038 1 88 . 1 1 50 50 LEU H H 50 8.530 8.530 8.623 -0.093 17919 36039 1 88 . 1 1 51 51 GLU N N 51 122.940 122.940 121.758 1.182 17919 36040 1 88 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.513 -0.025 17919 36041 1 88 . 1 1 51 51 GLU C C 51 175.870 175.870 176.688 -0.818 17919 36042 1 88 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.043 0.917 17919 36043 1 88 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.644 -1.074 17919 36044 1 88 . 1 1 51 51 GLU H H 51 8.400 8.400 8.336 0.064 17919 36045 1 88 . 1 1 52 52 ASP N N 52 120.030 120.030 124.586 -4.556 17919 36046 1 88 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.529 -0.170 17919 36047 1 88 . 1 1 52 52 ASP C C 52 177.330 177.330 177.723 -0.393 17919 36048 1 88 . 1 1 52 52 ASP CA C 52 56.960 56.960 56.567 0.393 17919 36049 1 88 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.749 0.101 17919 36050 1 88 . 1 1 52 52 ASP H H 52 8.160 8.160 8.834 -0.674 17919 36051 1 88 . 1 1 53 53 GLY N N 53 106.660 106.660 105.665 0.995 17919 36052 1 88 . 1 1 53 53 GLY C C 53 174.870 174.870 174.700 0.170 17919 36053 1 88 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.258 -0.088 17919 36054 1 88 . 1 1 53 53 GLY H H 53 9.390 9.390 8.477 0.913 17919 36055 1 88 . 1 1 54 54 ARG N N 54 119.050 119.050 121.150 -2.100 17919 36056 1 88 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.549 0.146 17919 36057 1 88 . 1 1 54 54 ARG C C 54 175.350 175.350 176.032 -0.682 17919 36058 1 88 . 1 1 54 54 ARG CA C 54 54.390 54.390 55.060 -0.670 17919 36059 1 88 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.080 0.570 17919 36060 1 88 . 1 1 54 54 ARG H H 54 7.460 7.460 7.446 0.014 17919 36061 1 88 . 1 1 55 55 THR N N 55 108.400 108.400 115.462 -7.062 17919 36062 1 88 . 1 1 55 55 THR HA H 55 5.240 5.240 4.581 0.659 17919 36063 1 88 . 1 1 55 55 THR C C 55 176.560 176.560 176.356 0.204 17919 36064 1 88 . 1 1 55 55 THR CA C 55 59.690 59.690 61.553 -1.863 17919 36065 1 88 . 1 1 55 55 THR CB C 55 72.260 72.260 69.900 2.360 17919 36066 1 88 . 1 1 55 55 THR H H 55 8.730 8.730 8.928 -0.198 17919 36067 1 88 . 1 1 56 56 LEU N N 56 117.920 117.920 123.760 -5.840 17919 36068 1 88 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.866 0.194 17919 36069 1 88 . 1 1 56 56 LEU C C 56 180.810 180.810 178.761 2.049 17919 36070 1 88 . 1 1 56 56 LEU CA C 56 58.710 58.710 59.687 -0.977 17919 36071 1 88 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.245 -0.875 17919 36072 1 88 . 1 1 56 56 LEU H H 56 8.140 8.140 8.303 -0.163 17919 36073 1 88 . 1 1 57 57 SER N N 57 113.330 113.330 112.755 0.575 17919 36074 1 88 . 1 1 57 57 SER HA H 57 4.370 4.370 4.167 0.203 17919 36075 1 88 . 1 1 57 57 SER C C 57 178.310 178.310 176.428 1.882 17919 36076 1 88 . 1 1 57 57 SER CA C 57 61.080 61.080 61.581 -0.501 17919 36077 1 88 . 1 1 57 57 SER CB C 57 62.530 62.530 62.734 -0.205 17919 36078 1 88 . 1 1 57 57 SER H H 57 8.470 8.470 8.108 0.362 17919 36079 1 88 . 1 1 58 58 ASP N N 58 124.190 124.190 121.130 3.060 17919 36080 1 88 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.390 -0.094 17919 36081 1 88 . 1 1 58 58 ASP C C 58 177.400 177.400 176.561 0.839 17919 36082 1 88 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.008 1.171 17919 36083 1 88 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.392 -0.292 17919 36084 1 88 . 1 1 58 58 ASP H H 58 7.930 7.930 7.891 0.039 17919 36085 1 88 . 1 1 59 59 TYR N N 59 115.510 115.510 115.424 0.086 17919 36086 1 88 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.631 0.039 17919 36087 1 88 . 1 1 59 59 TYR C C 59 174.700 174.700 175.280 -0.580 17919 36088 1 88 . 1 1 59 59 TYR CA C 59 58.250 58.250 56.891 1.359 17919 36089 1 88 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.572 1.498 17919 36090 1 88 . 1 1 59 59 TYR H H 59 7.250 7.250 7.139 0.111 17919 36091 1 88 . 1 1 60 60 ASN N N 60 115.900 115.900 117.745 -1.845 17919 36092 1 88 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.377 -0.022 17919 36093 1 88 . 1 1 60 60 ASN C C 60 174.340 174.340 174.939 -0.599 17919 36094 1 88 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.257 -0.137 17919 36095 1 88 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.253 0.157 17919 36096 1 88 . 1 1 60 60 ASN H H 60 8.150 8.150 7.730 0.420 17919 36097 1 88 . 1 1 61 61 ILE N N 61 118.600 118.600 118.819 -0.219 17919 36098 1 88 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.735 -0.342 17919 36099 1 88 . 1 1 61 61 ILE C C 61 174.610 174.610 175.347 -0.737 17919 36100 1 88 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.188 0.232 17919 36101 1 88 . 1 1 61 61 ILE CB C 61 36.740 36.740 38.416 -1.676 17919 36102 1 88 . 1 1 61 61 ILE H H 61 7.250 7.250 7.609 -0.359 17919 36103 1 88 . 1 1 62 62 GLN N N 62 124.740 124.740 122.898 1.842 17919 36104 1 88 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.720 -0.214 17919 36105 1 88 . 1 1 62 62 GLN C C 62 175.970 175.970 174.914 1.056 17919 36106 1 88 . 1 1 62 62 GLN CA C 62 53.660 53.660 54.004 -0.344 17919 36107 1 88 . 1 1 62 62 GLN CB C 62 31.650 31.650 33.263 -1.613 17919 36108 1 88 . 1 1 62 62 GLN H H 62 7.610 7.610 8.131 -0.521 17919 36109 1 88 . 1 1 63 63 LYS N N 63 120.300 120.300 124.118 -3.818 17919 36110 1 88 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.984 0.017 17919 36111 1 88 . 1 1 63 63 LYS C C 63 175.810 175.810 176.945 -1.135 17919 36112 1 88 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.901 -0.111 17919 36113 1 88 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.187 0.463 17919 36114 1 88 . 1 1 63 63 LYS H H 63 8.490 8.490 8.849 -0.359 17919 36115 1 88 . 1 1 64 64 GLU N N 64 113.950 113.950 122.433 -8.483 17919 36116 1 88 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.618 -0.153 17919 36117 1 88 . 1 1 64 64 GLU C C 64 175.250 175.250 175.670 -0.420 17919 36118 1 88 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.862 0.028 17919 36119 1 88 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.937 -3.037 17919 36120 1 88 . 1 1 64 64 GLU H H 64 9.280 9.280 8.585 0.695 17919 36121 1 88 . 1 1 65 65 SER N N 65 114.730 114.730 113.514 1.216 17919 36122 1 88 . 1 1 65 65 SER HA H 65 4.640 4.640 4.848 -0.208 17919 36123 1 88 . 1 1 65 65 SER C C 65 172.160 172.160 173.667 -1.507 17919 36124 1 88 . 1 1 65 65 SER CA C 65 60.890 60.890 58.651 2.239 17919 36125 1 88 . 1 1 65 65 SER CB C 65 64.910 64.910 65.600 -0.690 17919 36126 1 88 . 1 1 65 65 SER H H 65 7.670 7.670 7.780 -0.110 17919 36127 1 88 . 1 1 66 66 THR N N 66 117.110 117.110 116.032 1.078 17919 36128 1 88 . 1 1 66 66 THR HA H 66 5.270 5.270 5.146 0.124 17919 36129 1 88 . 1 1 66 66 THR C C 66 173.950 173.950 173.388 0.562 17919 36130 1 88 . 1 1 66 66 THR CA C 66 62.340 62.340 62.355 -0.015 17919 36131 1 88 . 1 1 66 66 THR CB C 66 70.080 70.080 70.396 -0.316 17919 36132 1 88 . 1 1 66 66 THR H H 66 8.730 8.730 8.332 0.398 17919 36133 1 88 . 1 1 67 67 LEU N N 67 127.110 127.110 127.762 -0.652 17919 36134 1 88 . 1 1 67 67 LEU HA H 67 5.060 5.060 5.154 -0.094 17919 36135 1 88 . 1 1 67 67 LEU C C 67 175.770 175.770 176.374 -0.604 17919 36136 1 88 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.947 -0.047 17919 36137 1 88 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.553 0.707 17919 36138 1 88 . 1 1 67 67 LEU H H 67 9.410 9.410 9.208 0.202 17919 36139 1 88 . 1 1 68 68 HIS N N 68 118.380 118.380 121.005 -2.625 17919 36140 1 88 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.077 0.163 17919 36141 1 88 . 1 1 68 68 HIS C C 68 173.150 173.150 174.575 -1.425 17919 36142 1 88 . 1 1 68 68 HIS CA C 68 55.000 55.000 56.144 -1.144 17919 36143 1 88 . 1 1 68 68 HIS CB C 68 30.530 30.530 31.482 -0.952 17919 36144 1 88 . 1 1 68 68 HIS H H 68 9.230 9.230 9.427 -0.197 17919 36145 1 88 . 1 1 69 69 LEU N N 69 124.460 124.460 121.633 2.827 17919 36146 1 88 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.940 0.250 17919 36147 1 88 . 1 1 69 69 LEU C C 69 175.270 175.270 174.643 0.627 17919 36148 1 88 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.501 -0.611 17919 36149 1 88 . 1 1 69 69 LEU CB C 69 44.380 44.380 45.434 -1.054 17919 36150 1 88 . 1 1 69 69 LEU H H 69 8.340 8.340 8.779 -0.439 17919 36151 1 88 . 1 1 70 70 VAL N N 70 126.940 126.940 127.209 -0.269 17919 36152 1 88 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.517 -0.167 17919 36153 1 88 . 1 1 70 70 VAL C C 70 174.000 174.000 174.451 -0.451 17919 36154 1 88 . 1 1 70 70 VAL CA C 70 60.800 60.800 61.551 -0.751 17919 36155 1 88 . 1 1 70 70 VAL CB C 70 34.910 34.910 32.901 2.009 17919 36156 1 88 . 1 1 70 70 VAL H H 70 9.200 9.200 8.724 0.476 17919 36157 1 88 . 1 1 71 71 LEU N N 71 123.130 123.130 127.387 -4.257 17919 36158 1 88 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.935 0.125 17919 36159 1 88 . 1 1 71 71 LEU C C 71 177.830 177.830 176.504 1.326 17919 36160 1 88 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.671 0.269 17919 36161 1 88 . 1 1 71 71 LEU CB C 71 42.850 42.850 44.386 -1.536 17919 36162 1 88 . 1 1 71 71 LEU H H 71 8.120 8.120 8.593 -0.473 17919 36163 1 88 . 1 1 72 72 ARG N N 72 123.490 123.490 123.793 -0.303 17919 36164 1 88 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.645 -0.344 17919 36165 1 88 . 1 1 72 72 ARG C C 72 175.350 175.350 175.145 0.205 17919 36166 1 88 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.187 0.423 17919 36167 1 88 . 1 1 72 72 ARG CB C 72 31.350 31.350 32.347 -0.997 17919 36168 1 88 . 1 1 72 72 ARG H H 72 8.580 8.580 8.434 0.146 17919 36169 1 89 . 1 1 2 2 GLN N N 2 123.220 123.220 122.320 0.900 17919 36170 1 89 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.291 -0.042 17919 36171 1 89 . 1 1 2 2 GLN C C 2 175.920 175.920 175.490 0.430 17919 36172 1 89 . 1 1 2 2 GLN CA C 2 55.080 55.080 55.214 -0.134 17919 36173 1 89 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.076 0.684 17919 36174 1 89 . 1 1 2 2 GLN H H 2 8.900 8.900 8.441 0.459 17919 36175 1 89 . 1 1 3 3 ILE N N 3 115.340 115.340 117.358 -2.018 17919 36176 1 89 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.353 -0.140 17919 36177 1 89 . 1 1 3 3 ILE C C 3 172.450 172.450 173.791 -1.341 17919 36178 1 89 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.087 0.483 17919 36179 1 89 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.179 1.031 17919 36180 1 89 . 1 1 3 3 ILE H H 3 8.320 8.320 7.798 0.522 17919 36181 1 89 . 1 1 4 4 PHE N N 4 118.110 118.110 120.200 -2.090 17919 36182 1 89 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.043 0.587 17919 36183 1 89 . 1 1 4 4 PHE C C 4 175.320 175.320 174.896 0.424 17919 36184 1 89 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.883 -0.673 17919 36185 1 89 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.287 0.193 17919 36186 1 89 . 1 1 4 4 PHE H H 4 8.610 8.610 8.437 0.173 17919 36187 1 89 . 1 1 5 5 VAL N N 5 121.000 121.000 122.391 -1.391 17919 36188 1 89 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.910 -0.185 17919 36189 1 89 . 1 1 5 5 VAL C C 5 174.870 174.870 174.899 -0.029 17919 36190 1 89 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.175 -0.555 17919 36191 1 89 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.049 0.181 17919 36192 1 89 . 1 1 5 5 VAL H H 5 9.300 9.300 8.521 0.779 17919 36193 1 89 . 1 1 6 6 LYS N N 6 127.520 127.520 129.453 -1.933 17919 36194 1 89 . 1 1 6 6 LYS HA H 6 5.367 5.367 4.879 0.488 17919 36195 1 89 . 1 1 6 6 LYS C C 6 177.140 177.140 176.463 0.677 17919 36196 1 89 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.637 -0.117 17919 36197 1 89 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.911 0.139 17919 36198 1 89 . 1 1 6 6 LYS H H 6 8.820 8.820 8.817 0.003 17919 36199 1 89 . 1 1 7 7 THR N N 7 115.400 115.400 118.709 -3.309 17919 36200 1 89 . 1 1 7 7 THR HA H 7 4.970 4.970 4.376 0.594 17919 36201 1 89 . 1 1 7 7 THR C C 7 176.910 176.910 176.638 0.272 17919 36202 1 89 . 1 1 7 7 THR CA C 7 60.470 60.470 61.868 -1.398 17919 36203 1 89 . 1 1 7 7 THR CB C 7 70.630 70.630 69.909 0.721 17919 36204 1 89 . 1 1 7 7 THR H H 7 8.730 8.730 8.237 0.493 17919 36205 1 89 . 1 1 8 8 LEU N N 8 121.330 121.330 120.659 0.671 17919 36206 1 89 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.163 0.147 17919 36207 1 89 . 1 1 8 8 LEU C C 8 178.800 178.800 178.145 0.655 17919 36208 1 89 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.799 -0.219 17919 36209 1 89 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.585 0.385 17919 36210 1 89 . 1 1 8 8 LEU H H 8 9.100 9.100 8.794 0.306 17919 36211 1 89 . 1 1 9 9 THR N N 9 105.590 105.590 107.507 -1.917 17919 36212 1 89 . 1 1 9 9 THR HA H 9 4.428 4.428 4.343 0.085 17919 36213 1 89 . 1 1 9 9 THR C C 9 175.520 175.520 176.093 -0.573 17919 36214 1 89 . 1 1 9 9 THR CA C 9 61.400 61.400 61.598 -0.198 17919 36215 1 89 . 1 1 9 9 THR CB C 9 69.140 69.140 68.448 0.692 17919 36216 1 89 . 1 1 9 9 THR H H 9 7.630 7.630 7.888 -0.258 17919 36217 1 89 . 1 1 10 10 GLY N N 10 108.890 108.890 110.593 -1.703 17919 36218 1 89 . 1 1 10 10 GLY C C 10 174.070 174.070 173.807 0.263 17919 36219 1 89 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.246 0.214 17919 36220 1 89 . 1 1 10 10 GLY H H 10 7.810 7.810 7.822 -0.012 17919 36221 1 89 . 1 1 11 11 LYS N N 11 121.600 121.600 123.401 -1.801 17919 36222 1 89 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.233 0.128 17919 36223 1 89 . 1 1 11 11 LYS C C 11 175.940 175.940 175.886 0.054 17919 36224 1 89 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.794 -0.514 17919 36225 1 89 . 1 1 11 11 LYS CB C 11 33.200 33.200 32.946 0.254 17919 36226 1 89 . 1 1 11 11 LYS H H 11 7.280 7.280 7.636 -0.356 17919 36227 1 89 . 1 1 12 12 THR N N 12 120.440 120.440 120.869 -0.429 17919 36228 1 89 . 1 1 12 12 THR HA H 12 5.046 5.046 4.667 0.379 17919 36229 1 89 . 1 1 12 12 THR C C 12 174.320 174.320 174.874 -0.554 17919 36230 1 89 . 1 1 12 12 THR CA C 12 62.390 62.390 62.959 -0.569 17919 36231 1 89 . 1 1 12 12 THR CB C 12 69.910 69.910 69.881 0.029 17919 36232 1 89 . 1 1 12 12 THR H H 12 8.650 8.650 8.204 0.446 17919 36233 1 89 . 1 1 13 13 ILE N N 13 127.110 127.110 124.609 2.501 17919 36234 1 89 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.455 0.089 17919 36235 1 89 . 1 1 13 13 ILE C C 13 175.220 175.220 175.056 0.164 17919 36236 1 89 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.464 -0.484 17919 36237 1 89 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.602 0.347 17919 36238 1 89 . 1 1 13 13 ILE H H 13 9.450 9.450 8.844 0.606 17919 36239 1 89 . 1 1 14 14 THR N N 14 121.520 121.520 120.186 1.334 17919 36240 1 89 . 1 1 14 14 THR HA H 14 4.964 4.964 4.792 0.172 17919 36241 1 89 . 1 1 14 14 THR C C 14 173.790 173.790 173.396 0.394 17919 36242 1 89 . 1 1 14 14 THR CA C 14 61.940 61.940 61.930 0.010 17919 36243 1 89 . 1 1 14 14 THR CB C 14 69.650 69.650 69.882 -0.232 17919 36244 1 89 . 1 1 14 14 THR H H 14 8.710 8.710 8.430 0.280 17919 36245 1 89 . 1 1 15 15 LEU N N 15 124.800 124.800 128.213 -3.413 17919 36246 1 89 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.607 0.173 17919 36247 1 89 . 1 1 15 15 LEU C C 15 174.670 174.670 175.739 -1.069 17919 36248 1 89 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.809 -0.979 17919 36249 1 89 . 1 1 15 15 LEU CB C 15 47.070 47.070 43.323 3.747 17919 36250 1 89 . 1 1 15 15 LEU H H 15 8.710 8.710 8.151 0.559 17919 36251 1 89 . 1 1 16 16 GLU N N 16 122.160 122.160 124.102 -1.942 17919 36252 1 89 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.566 0.351 17919 36253 1 89 . 1 1 16 16 GLU C C 16 175.860 175.860 176.324 -0.464 17919 36254 1 89 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.158 -0.339 17919 36255 1 89 . 1 1 16 16 GLU CB C 16 29.450 29.450 29.549 -0.099 17919 36256 1 89 . 1 1 16 16 GLU H H 16 8.140 8.140 8.761 -0.621 17919 36257 1 89 . 1 1 17 17 VAL N N 17 117.210 117.210 121.530 -4.320 17919 36258 1 89 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.508 0.206 17919 36259 1 89 . 1 1 17 17 VAL C C 17 174.160 174.160 175.060 -0.900 17919 36260 1 89 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.329 -0.899 17919 36261 1 89 . 1 1 17 17 VAL CB C 17 36.400 36.400 34.491 1.909 17919 36262 1 89 . 1 1 17 17 VAL H H 17 8.900 8.900 8.398 0.502 17919 36263 1 89 . 1 1 18 18 GLU N N 18 118.990 118.990 116.900 2.090 17919 36264 1 89 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.697 0.382 17919 36265 1 89 . 1 1 18 18 GLU C C 18 176.160 176.160 174.278 1.882 17919 36266 1 89 . 1 1 18 18 GLU CA C 18 52.720 52.720 54.656 -1.936 17919 36267 1 89 . 1 1 18 18 GLU CB C 18 30.310 30.310 31.403 -1.093 17919 36268 1 89 . 1 1 18 18 GLU H H 18 8.640 8.640 8.336 0.304 17919 36269 1 89 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.432 -0.291 17919 36270 1 89 . 1 1 19 19 PRO C C 19 175.310 175.310 177.444 -2.134 17919 36271 1 89 . 1 1 19 19 PRO CA C 19 65.470 65.470 64.734 0.736 17919 36272 1 89 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.195 -0.245 17919 36273 1 89 . 1 1 20 20 SER N N 20 103.400 103.400 109.519 -6.119 17919 36274 1 89 . 1 1 20 20 SER HA H 20 4.370 4.370 4.367 0.003 17919 36275 1 89 . 1 1 20 20 SER C C 20 174.660 174.660 174.143 0.517 17919 36276 1 89 . 1 1 20 20 SER CA C 20 57.400 57.400 57.809 -0.409 17919 36277 1 89 . 1 1 20 20 SER CB C 20 63.370 63.370 62.828 0.542 17919 36278 1 89 . 1 1 20 20 SER H H 20 7.040 7.040 7.986 -0.946 17919 36279 1 89 . 1 1 21 21 ASP N N 21 123.480 123.480 124.130 -0.650 17919 36280 1 89 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.810 -0.115 17919 36281 1 89 . 1 1 21 21 ASP C C 21 176.360 176.360 175.418 0.942 17919 36282 1 89 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.558 1.142 17919 36283 1 89 . 1 1 21 21 ASP CB C 21 40.800 40.800 42.547 -1.747 17919 36284 1 89 . 1 1 21 21 ASP H H 21 8.030 8.030 7.970 0.060 17919 36285 1 89 . 1 1 22 22 THR N N 22 108.800 108.800 111.973 -3.173 17919 36286 1 89 . 1 1 22 22 THR HA H 22 4.920 4.920 4.810 0.110 17919 36287 1 89 . 1 1 22 22 THR C C 22 176.750 176.750 175.534 1.216 17919 36288 1 89 . 1 1 22 22 THR CA C 22 59.690 59.690 60.283 -0.593 17919 36289 1 89 . 1 1 22 22 THR CB C 22 71.200 71.200 70.699 0.501 17919 36290 1 89 . 1 1 22 22 THR H H 22 7.900 7.900 8.435 -0.535 17919 36291 1 89 . 1 1 23 23 ILE N N 23 121.190 121.190 121.926 -0.736 17919 36292 1 89 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.874 -0.217 17919 36293 1 89 . 1 1 23 23 ILE C C 23 179.040 179.040 177.543 1.497 17919 36294 1 89 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.275 -0.015 17919 36295 1 89 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.729 -2.379 17919 36296 1 89 . 1 1 23 23 ILE H H 23 8.560 8.560 8.441 0.119 17919 36297 1 89 . 1 1 24 24 GLU N N 24 120.830 120.830 121.096 -0.266 17919 36298 1 89 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.803 0.114 17919 36299 1 89 . 1 1 24 24 GLU C C 24 178.640 178.640 178.731 -0.091 17919 36300 1 89 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.294 -0.074 17919 36301 1 89 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.338 -1.058 17919 36302 1 89 . 1 1 24 24 GLU H H 24 9.760 9.760 8.362 1.398 17919 36303 1 89 . 1 1 25 25 ASN N N 25 120.570 120.570 116.804 3.766 17919 36304 1 89 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.491 0.034 17919 36305 1 89 . 1 1 25 25 ASN C C 25 178.380 178.380 177.620 0.760 17919 36306 1 89 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.941 0.119 17919 36307 1 89 . 1 1 25 25 ASN CB C 25 38.450 38.450 37.856 0.594 17919 36308 1 89 . 1 1 25 25 ASN H H 25 7.920 7.920 8.367 -0.447 17919 36309 1 89 . 1 1 26 26 VAL N N 26 121.710 121.710 120.771 0.939 17919 36310 1 89 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.502 -0.105 17919 36311 1 89 . 1 1 26 26 VAL C C 26 177.950 177.950 178.093 -0.143 17919 36312 1 89 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.584 1.076 17919 36313 1 89 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.302 -0.462 17919 36314 1 89 . 1 1 26 26 VAL H H 26 8.070 8.070 7.906 0.164 17919 36315 1 89 . 1 1 27 27 LYS N N 27 118.860 118.860 120.202 -1.342 17919 36316 1 89 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.042 0.538 17919 36317 1 89 . 1 1 27 27 LYS C C 27 180.550 180.550 179.241 1.309 17919 36318 1 89 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.700 -0.450 17919 36319 1 89 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.112 1.617 17919 36320 1 89 . 1 1 27 27 LYS H H 27 8.560 8.560 7.982 0.578 17919 36321 1 89 . 1 1 28 28 ALA N N 28 123.440 123.440 120.895 2.545 17919 36322 1 89 . 1 1 28 28 ALA HA H 28 4.160 4.160 3.922 0.238 17919 36323 1 89 . 1 1 28 28 ALA C C 28 180.300 180.300 178.914 1.386 17919 36324 1 89 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.441 -0.071 17919 36325 1 89 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.292 -0.582 17919 36326 1 89 . 1 1 28 28 ALA H H 28 8.060 8.060 8.243 -0.183 17919 36327 1 89 . 1 1 29 29 LYS N N 29 119.940 119.940 120.638 -0.698 17919 36328 1 89 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.145 0.062 17919 36329 1 89 . 1 1 29 29 LYS C C 29 180.320 180.320 179.239 1.081 17919 36330 1 89 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.244 0.406 17919 36331 1 89 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.260 1.030 17919 36332 1 89 . 1 1 29 29 LYS H H 29 7.850 7.850 7.561 0.289 17919 36333 1 89 . 1 1 30 30 ILE N N 30 121.080 121.080 119.494 1.586 17919 36334 1 89 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.634 -0.127 17919 36335 1 89 . 1 1 30 30 ILE C C 30 178.310 178.310 177.632 0.678 17919 36336 1 89 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.248 0.902 17919 36337 1 89 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.861 -1.062 17919 36338 1 89 . 1 1 30 30 ILE H H 30 8.280 8.280 8.332 -0.052 17919 36339 1 89 . 1 1 31 31 GLN N N 31 123.490 123.490 119.338 4.152 17919 36340 1 89 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.081 -0.252 17919 36341 1 89 . 1 1 31 31 GLN C C 31 178.890 178.890 178.379 0.511 17919 36342 1 89 . 1 1 31 31 GLN CA C 31 60.000 60.000 58.591 1.409 17919 36343 1 89 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.078 -0.358 17919 36344 1 89 . 1 1 31 31 GLN H H 31 8.580 8.580 8.150 0.430 17919 36345 1 89 . 1 1 32 32 ASP N N 32 119.360 119.360 120.916 -1.556 17919 36346 1 89 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.390 -0.036 17919 36347 1 89 . 1 1 32 32 ASP C C 32 177.250 177.250 177.509 -0.259 17919 36348 1 89 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.632 0.558 17919 36349 1 89 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.555 0.025 17919 36350 1 89 . 1 1 32 32 ASP H H 32 8.010 8.010 8.775 -0.765 17919 36351 1 89 . 1 1 33 33 LYS N N 33 115.130 115.130 118.147 -3.017 17919 36352 1 89 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.310 0.027 17919 36353 1 89 . 1 1 33 33 LYS C C 33 177.870 177.870 178.064 -0.194 17919 36354 1 89 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.852 0.198 17919 36355 1 89 . 1 1 33 33 LYS CB C 33 34.170 34.170 32.906 1.264 17919 36356 1 89 . 1 1 33 33 LYS H H 33 7.430 7.430 7.363 0.067 17919 36357 1 89 . 1 1 34 34 GLU N N 34 113.870 113.870 115.382 -1.512 17919 36358 1 89 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.444 0.181 17919 36359 1 89 . 1 1 34 34 GLU C C 34 177.840 177.840 177.473 0.367 17919 36360 1 89 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.050 -0.880 17919 36361 1 89 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.175 1.485 17919 36362 1 89 . 1 1 34 34 GLU H H 34 8.740 8.740 8.227 0.513 17919 36363 1 89 . 1 1 35 35 GLY N N 35 108.650 108.650 108.467 0.183 17919 36364 1 89 . 1 1 35 35 GLY C C 35 173.960 173.960 174.193 -0.233 17919 36365 1 89 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.087 0.993 17919 36366 1 89 . 1 1 35 35 GLY H H 35 8.530 8.530 7.714 0.816 17919 36367 1 89 . 1 1 36 36 ILE N N 36 119.880 119.880 119.949 -0.069 17919 36368 1 89 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.305 0.140 17919 36369 1 89 . 1 1 36 36 ILE C C 36 173.590 173.590 173.807 -0.217 17919 36370 1 89 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.836 -0.086 17919 36371 1 89 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.001 2.579 17919 36372 1 89 . 1 1 36 36 ILE H H 36 6.150 6.150 7.506 -1.356 17919 36373 1 89 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.706 -0.072 17919 36374 1 89 . 1 1 37 37 PRO C C 37 176.940 176.940 176.028 0.912 17919 36375 1 89 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.465 0.195 17919 36376 1 89 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.398 0.452 17919 36377 1 89 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.149 -0.032 17919 36378 1 89 . 1 1 38 38 PRO C C 38 178.320 178.320 178.213 0.107 17919 36379 1 89 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.813 0.447 17919 36380 1 89 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.935 0.955 17919 36381 1 89 . 1 1 39 39 ASP N N 39 113.380 113.380 114.121 -0.741 17919 36382 1 89 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.577 -0.147 17919 36383 1 89 . 1 1 39 39 ASP C C 39 177.090 177.090 176.503 0.587 17919 36384 1 89 . 1 1 39 39 ASP CA C 39 55.640 55.640 54.926 0.714 17919 36385 1 89 . 1 1 39 39 ASP CB C 39 39.540 39.540 39.749 -0.209 17919 36386 1 89 . 1 1 39 39 ASP H H 39 8.550 8.550 8.699 -0.149 17919 36387 1 89 . 1 1 40 40 GLN N N 40 116.780 116.780 116.497 0.283 17919 36388 1 89 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.630 -0.166 17919 36389 1 89 . 1 1 40 40 GLN C C 40 175.380 175.380 175.309 0.071 17919 36390 1 89 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.634 0.006 17919 36391 1 89 . 1 1 40 40 GLN CB C 40 30.140 30.140 31.745 -1.605 17919 36392 1 89 . 1 1 40 40 GLN H H 40 7.820 7.820 7.694 0.126 17919 36393 1 89 . 1 1 41 41 GLN N N 41 117.720 117.720 120.236 -2.516 17919 36394 1 89 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.704 -0.460 17919 36395 1 89 . 1 1 41 41 GLN C C 41 176.300 176.300 175.441 0.859 17919 36396 1 89 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.405 0.065 17919 36397 1 89 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.874 1.776 17919 36398 1 89 . 1 1 41 41 GLN H H 41 7.480 7.480 7.421 0.059 17919 36399 1 89 . 1 1 42 42 ARG N N 42 122.680 122.680 121.281 1.399 17919 36400 1 89 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.749 -0.249 17919 36401 1 89 . 1 1 42 42 ARG C C 42 174.050 174.050 174.324 -0.274 17919 36402 1 89 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.225 0.825 17919 36403 1 89 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.238 -1.488 17919 36404 1 89 . 1 1 42 42 ARG H H 42 8.530 8.530 8.392 0.138 17919 36405 1 89 . 1 1 43 43 LEU N N 43 124.040 124.040 125.567 -1.527 17919 36406 1 89 . 1 1 43 43 LEU C C 43 175.290 175.290 176.062 -0.772 17919 36407 1 89 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.839 -1.859 17919 36408 1 89 . 1 1 43 43 LEU CB C 43 45.790 45.790 41.959 3.831 17919 36409 1 89 . 1 1 43 43 LEU H H 43 8.820 8.820 9.033 -0.213 17919 36410 1 89 . 1 1 44 44 ILE N N 44 121.920 121.920 119.228 2.692 17919 36411 1 89 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.280 -0.288 17919 36412 1 89 . 1 1 44 44 ILE C C 44 176.060 176.060 173.774 2.286 17919 36413 1 89 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.337 -0.357 17919 36414 1 89 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.570 -0.150 17919 36415 1 89 . 1 1 44 44 ILE H H 44 9.030 9.030 8.913 0.117 17919 36416 1 89 . 1 1 45 45 PHE N N 45 125.390 125.390 127.921 -2.531 17919 36417 1 89 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.037 0.008 17919 36418 1 89 . 1 1 45 45 PHE C C 45 174.470 174.470 174.610 -0.140 17919 36419 1 89 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.801 0.219 17919 36420 1 89 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.163 0.597 17919 36421 1 89 . 1 1 45 45 PHE H H 45 8.830 8.830 8.771 0.059 17919 36422 1 89 . 1 1 46 46 ALA N N 46 132.200 132.200 127.849 4.351 17919 36423 1 89 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.502 0.188 17919 36424 1 89 . 1 1 46 46 ALA C C 46 177.290 177.290 177.449 -0.159 17919 36425 1 89 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.519 0.021 17919 36426 1 89 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.456 0.114 17919 36427 1 89 . 1 1 46 46 ALA H H 46 8.810 8.810 8.447 0.363 17919 36428 1 89 . 1 1 47 47 GLY N N 47 102.340 102.340 103.301 -0.961 17919 36429 1 89 . 1 1 47 47 GLY C C 47 173.810 173.810 173.975 -0.165 17919 36430 1 89 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.995 0.355 17919 36431 1 89 . 1 1 47 47 GLY H H 47 8.130 8.130 8.337 -0.207 17919 36432 1 89 . 1 1 48 48 LYS N N 48 121.570 121.570 118.763 2.807 17919 36433 1 89 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.536 0.086 17919 36434 1 89 . 1 1 48 48 LYS C C 48 174.700 174.700 175.075 -0.375 17919 36435 1 89 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.145 0.405 17919 36436 1 89 . 1 1 48 48 LYS CB C 48 34.530 34.530 35.372 -0.842 17919 36437 1 89 . 1 1 48 48 LYS H H 48 7.980 7.980 7.947 0.033 17919 36438 1 89 . 1 1 49 49 GLN N N 49 122.410 122.410 121.064 1.346 17919 36439 1 89 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.307 0.253 17919 36440 1 89 . 1 1 49 49 GLN C C 49 175.670 175.670 176.076 -0.406 17919 36441 1 89 . 1 1 49 49 GLN CA C 49 55.740 55.740 57.347 -1.607 17919 36442 1 89 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.387 -0.387 17919 36443 1 89 . 1 1 49 49 GLN H H 49 8.600 8.600 8.592 0.008 17919 36444 1 89 . 1 1 50 50 LEU N N 50 125.520 125.520 123.987 1.533 17919 36445 1 89 . 1 1 50 50 LEU HA H 50 4.090 4.090 3.912 0.178 17919 36446 1 89 . 1 1 50 50 LEU C C 50 176.660 176.660 175.622 1.038 17919 36447 1 89 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.093 1.147 17919 36448 1 89 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.123 0.447 17919 36449 1 89 . 1 1 50 50 LEU H H 50 8.530 8.530 8.675 -0.145 17919 36450 1 89 . 1 1 51 51 GLU N N 51 122.940 122.940 123.936 -0.996 17919 36451 1 89 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.039 0.449 17919 36452 1 89 . 1 1 51 51 GLU C C 51 175.870 175.870 177.218 -1.348 17919 36453 1 89 . 1 1 51 51 GLU CA C 51 55.960 55.960 56.931 -0.971 17919 36454 1 89 . 1 1 51 51 GLU CB C 51 31.570 31.570 30.999 0.571 17919 36455 1 89 . 1 1 51 51 GLU H H 51 8.400 8.400 8.191 0.209 17919 36456 1 89 . 1 1 52 52 ASP N N 52 120.030 120.030 124.328 -4.298 17919 36457 1 89 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.527 -0.168 17919 36458 1 89 . 1 1 52 52 ASP C C 52 177.330 177.330 177.235 0.095 17919 36459 1 89 . 1 1 52 52 ASP CA C 52 56.960 56.960 56.953 0.007 17919 36460 1 89 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.759 0.091 17919 36461 1 89 . 1 1 52 52 ASP H H 52 8.160 8.160 8.783 -0.623 17919 36462 1 89 . 1 1 53 53 GLY N N 53 106.660 106.660 105.228 1.432 17919 36463 1 89 . 1 1 53 53 GLY C C 53 174.870 174.870 173.626 1.244 17919 36464 1 89 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.954 0.216 17919 36465 1 89 . 1 1 53 53 GLY H H 53 9.390 9.390 8.667 0.723 17919 36466 1 89 . 1 1 54 54 ARG N N 54 119.050 119.050 120.209 -1.159 17919 36467 1 89 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.596 0.099 17919 36468 1 89 . 1 1 54 54 ARG C C 54 175.350 175.350 175.202 0.148 17919 36469 1 89 . 1 1 54 54 ARG CA C 54 54.390 54.390 53.998 0.392 17919 36470 1 89 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.812 -0.162 17919 36471 1 89 . 1 1 54 54 ARG H H 54 7.460 7.460 7.254 0.206 17919 36472 1 89 . 1 1 55 55 THR N N 55 108.400 108.400 112.693 -4.293 17919 36473 1 89 . 1 1 55 55 THR HA H 55 5.240 5.240 4.747 0.493 17919 36474 1 89 . 1 1 55 55 THR C C 55 176.560 176.560 176.220 0.340 17919 36475 1 89 . 1 1 55 55 THR CA C 55 59.690 59.690 60.597 -0.907 17919 36476 1 89 . 1 1 55 55 THR CB C 55 72.260 72.260 71.026 1.234 17919 36477 1 89 . 1 1 55 55 THR H H 55 8.730 8.730 8.623 0.107 17919 36478 1 89 . 1 1 56 56 LEU N N 56 117.920 117.920 120.525 -2.605 17919 36479 1 89 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.035 0.025 17919 36480 1 89 . 1 1 56 56 LEU C C 56 180.810 180.810 179.023 1.787 17919 36481 1 89 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.122 0.588 17919 36482 1 89 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.537 -1.167 17919 36483 1 89 . 1 1 56 56 LEU H H 56 8.140 8.140 8.414 -0.274 17919 36484 1 89 . 1 1 57 57 SER N N 57 113.330 113.330 115.434 -2.104 17919 36485 1 89 . 1 1 57 57 SER HA H 57 4.370 4.370 4.229 0.141 17919 36486 1 89 . 1 1 57 57 SER C C 57 178.310 178.310 177.027 1.283 17919 36487 1 89 . 1 1 57 57 SER CA C 57 61.080 61.080 61.658 -0.578 17919 36488 1 89 . 1 1 57 57 SER CB C 57 62.530 62.530 62.340 0.190 17919 36489 1 89 . 1 1 57 57 SER H H 57 8.470 8.470 8.128 0.342 17919 36490 1 89 . 1 1 58 58 ASP N N 58 124.190 124.190 122.873 1.317 17919 36491 1 89 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.321 -0.025 17919 36492 1 89 . 1 1 58 58 ASP C C 58 177.400 177.400 177.316 0.084 17919 36493 1 89 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.899 0.281 17919 36494 1 89 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.345 -0.245 17919 36495 1 89 . 1 1 58 58 ASP H H 58 7.930 7.930 7.666 0.264 17919 36496 1 89 . 1 1 59 59 TYR N N 59 115.510 115.510 115.457 0.053 17919 36497 1 89 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.750 -0.080 17919 36498 1 89 . 1 1 59 59 TYR C C 59 174.700 174.700 174.972 -0.272 17919 36499 1 89 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.065 1.185 17919 36500 1 89 . 1 1 59 59 TYR CB C 59 40.070 40.070 37.611 2.459 17919 36501 1 89 . 1 1 59 59 TYR H H 59 7.250 7.250 7.241 0.009 17919 36502 1 89 . 1 1 60 60 ASN N N 60 115.900 115.900 118.089 -2.189 17919 36503 1 89 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.351 0.004 17919 36504 1 89 . 1 1 60 60 ASN C C 60 174.340 174.340 174.739 -0.399 17919 36505 1 89 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.261 -0.141 17919 36506 1 89 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.292 0.118 17919 36507 1 89 . 1 1 60 60 ASN H H 60 8.150 8.150 7.843 0.307 17919 36508 1 89 . 1 1 61 61 ILE N N 61 118.600 118.600 119.825 -1.225 17919 36509 1 89 . 1 1 61 61 ILE HA H 61 3.393 3.393 4.020 -0.627 17919 36510 1 89 . 1 1 61 61 ILE C C 61 174.610 174.610 175.434 -0.824 17919 36511 1 89 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.464 0.956 17919 36512 1 89 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.513 -0.773 17919 36513 1 89 . 1 1 61 61 ILE H H 61 7.250 7.250 8.257 -1.007 17919 36514 1 89 . 1 1 62 62 GLN N N 62 124.740 124.740 127.031 -2.291 17919 36515 1 89 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.592 -0.086 17919 36516 1 89 . 1 1 62 62 GLN C C 62 175.970 175.970 175.758 0.212 17919 36517 1 89 . 1 1 62 62 GLN CA C 62 53.660 53.660 54.107 -0.447 17919 36518 1 89 . 1 1 62 62 GLN CB C 62 31.650 31.650 30.537 1.113 17919 36519 1 89 . 1 1 62 62 GLN H H 62 7.610 7.610 7.879 -0.269 17919 36520 1 89 . 1 1 63 63 LYS N N 63 120.300 120.300 120.095 0.205 17919 36521 1 89 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.922 0.079 17919 36522 1 89 . 1 1 63 63 LYS C C 63 175.810 175.810 176.491 -0.681 17919 36523 1 89 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.751 0.040 17919 36524 1 89 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.672 0.978 17919 36525 1 89 . 1 1 63 63 LYS H H 63 8.490 8.490 8.477 0.013 17919 36526 1 89 . 1 1 64 64 GLU N N 64 113.950 113.950 118.010 -4.060 17919 36527 1 89 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.583 -0.118 17919 36528 1 89 . 1 1 64 64 GLU C C 64 175.250 175.250 175.880 -0.630 17919 36529 1 89 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.752 0.138 17919 36530 1 89 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.425 -2.525 17919 36531 1 89 . 1 1 64 64 GLU H H 64 9.280 9.280 8.865 0.415 17919 36532 1 89 . 1 1 65 65 SER N N 65 114.730 114.730 115.394 -0.664 17919 36533 1 89 . 1 1 65 65 SER HA H 65 4.640 4.640 4.355 0.285 17919 36534 1 89 . 1 1 65 65 SER C C 65 172.160 172.160 174.253 -2.093 17919 36535 1 89 . 1 1 65 65 SER CA C 65 60.890 60.890 60.017 0.873 17919 36536 1 89 . 1 1 65 65 SER CB C 65 64.910 64.910 63.621 1.289 17919 36537 1 89 . 1 1 65 65 SER H H 65 7.670 7.670 7.282 0.388 17919 36538 1 89 . 1 1 66 66 THR N N 66 117.110 117.110 118.979 -1.869 17919 36539 1 89 . 1 1 66 66 THR HA H 66 5.270 5.270 5.239 0.031 17919 36540 1 89 . 1 1 66 66 THR C C 66 173.950 173.950 173.873 0.077 17919 36541 1 89 . 1 1 66 66 THR CA C 66 62.340 62.340 61.819 0.521 17919 36542 1 89 . 1 1 66 66 THR CB C 66 70.080 70.080 70.255 -0.175 17919 36543 1 89 . 1 1 66 66 THR H H 66 8.730 8.730 8.296 0.434 17919 36544 1 89 . 1 1 67 67 LEU N N 67 127.110 127.110 127.696 -0.586 17919 36545 1 89 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.794 0.266 17919 36546 1 89 . 1 1 67 67 LEU C C 67 175.770 175.770 175.174 0.596 17919 36547 1 89 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.132 -0.232 17919 36548 1 89 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.761 0.499 17919 36549 1 89 . 1 1 67 67 LEU H H 67 9.410 9.410 8.762 0.648 17919 36550 1 89 . 1 1 68 68 HIS N N 68 118.380 118.380 123.130 -4.750 17919 36551 1 89 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.262 -0.022 17919 36552 1 89 . 1 1 68 68 HIS C C 68 173.150 173.150 173.459 -0.309 17919 36553 1 89 . 1 1 68 68 HIS CA C 68 55.000 55.000 53.818 1.183 17919 36554 1 89 . 1 1 68 68 HIS CB C 68 30.530 30.530 33.269 -2.739 17919 36555 1 89 . 1 1 68 68 HIS H H 68 9.230 9.230 9.235 -0.005 17919 36556 1 89 . 1 1 69 69 LEU N N 69 124.460 124.460 129.183 -4.723 17919 36557 1 89 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.927 0.263 17919 36558 1 89 . 1 1 69 69 LEU C C 69 175.270 175.270 173.966 1.304 17919 36559 1 89 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.621 0.269 17919 36560 1 89 . 1 1 69 69 LEU CB C 69 44.380 44.380 43.075 1.305 17919 36561 1 89 . 1 1 69 69 LEU H H 69 8.340 8.340 8.004 0.336 17919 36562 1 89 . 1 1 70 70 VAL N N 70 126.940 126.940 124.957 1.983 17919 36563 1 89 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.201 0.149 17919 36564 1 89 . 1 1 70 70 VAL C C 70 174.000 174.000 174.435 -0.435 17919 36565 1 89 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.063 0.737 17919 36566 1 89 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.144 -0.234 17919 36567 1 89 . 1 1 70 70 VAL H H 70 9.200 9.200 8.656 0.544 17919 36568 1 89 . 1 1 71 71 LEU N N 71 123.130 123.130 123.208 -0.078 17919 36569 1 89 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.048 0.012 17919 36570 1 89 . 1 1 71 71 LEU C C 71 177.830 177.830 176.258 1.572 17919 36571 1 89 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.859 0.081 17919 36572 1 89 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.700 -0.850 17919 36573 1 89 . 1 1 71 71 LEU H H 71 8.120 8.120 8.281 -0.161 17919 36574 1 89 . 1 1 72 72 ARG N N 72 123.490 123.490 124.362 -0.872 17919 36575 1 89 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.664 -0.363 17919 36576 1 89 . 1 1 72 72 ARG C C 72 175.350 175.350 176.071 -0.721 17919 36577 1 89 . 1 1 72 72 ARG CA C 72 55.610 55.610 53.707 1.903 17919 36578 1 89 . 1 1 72 72 ARG CB C 72 31.350 31.350 32.745 -1.395 17919 36579 1 89 . 1 1 72 72 ARG H H 72 8.580 8.580 8.497 0.083 17919 36580 1 90 . 1 1 2 2 GLN N N 2 123.220 123.220 120.407 2.813 17919 36581 1 90 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.248 0.001 17919 36582 1 90 . 1 1 2 2 GLN C C 2 175.920 175.920 175.450 0.470 17919 36583 1 90 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.757 0.323 17919 36584 1 90 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.362 0.398 17919 36585 1 90 . 1 1 2 2 GLN H H 2 8.900 8.900 8.364 0.536 17919 36586 1 90 . 1 1 3 3 ILE N N 3 115.340 115.340 116.433 -1.093 17919 36587 1 90 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.143 0.070 17919 36588 1 90 . 1 1 3 3 ILE C C 3 172.450 172.450 173.620 -1.170 17919 36589 1 90 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.952 -0.382 17919 36590 1 90 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.137 1.073 17919 36591 1 90 . 1 1 3 3 ILE H H 3 8.320 8.320 8.510 -0.190 17919 36592 1 90 . 1 1 4 4 PHE N N 4 118.110 118.110 118.773 -0.663 17919 36593 1 90 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.578 0.052 17919 36594 1 90 . 1 1 4 4 PHE C C 4 175.320 175.320 175.800 -0.480 17919 36595 1 90 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.554 -0.344 17919 36596 1 90 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.157 -0.677 17919 36597 1 90 . 1 1 4 4 PHE H H 4 8.610 8.610 7.869 0.741 17919 36598 1 90 . 1 1 5 5 VAL N N 5 121.000 121.000 119.399 1.601 17919 36599 1 90 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.967 -0.242 17919 36600 1 90 . 1 1 5 5 VAL C C 5 174.870 174.870 175.110 -0.240 17919 36601 1 90 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.059 -0.439 17919 36602 1 90 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.689 -0.459 17919 36603 1 90 . 1 1 5 5 VAL H H 5 9.300 9.300 9.042 0.258 17919 36604 1 90 . 1 1 6 6 LYS N N 6 127.520 127.520 128.883 -1.363 17919 36605 1 90 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.234 0.133 17919 36606 1 90 . 1 1 6 6 LYS C C 6 177.140 177.140 176.538 0.602 17919 36607 1 90 . 1 1 6 6 LYS CA C 6 54.520 54.520 55.089 -0.569 17919 36608 1 90 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.648 0.402 17919 36609 1 90 . 1 1 6 6 LYS H H 6 8.820 8.820 8.878 -0.058 17919 36610 1 90 . 1 1 7 7 THR N N 7 115.400 115.400 118.165 -2.765 17919 36611 1 90 . 1 1 7 7 THR HA H 7 4.970 4.970 4.631 0.339 17919 36612 1 90 . 1 1 7 7 THR C C 7 176.910 176.910 175.639 1.271 17919 36613 1 90 . 1 1 7 7 THR CA C 7 60.470 60.470 60.559 -0.089 17919 36614 1 90 . 1 1 7 7 THR CB C 7 70.630 70.630 70.720 -0.090 17919 36615 1 90 . 1 1 7 7 THR H H 7 8.730 8.730 8.592 0.138 17919 36616 1 90 . 1 1 8 8 LEU N N 8 121.330 121.330 123.914 -2.584 17919 36617 1 90 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.338 -0.028 17919 36618 1 90 . 1 1 8 8 LEU C C 8 178.800 178.800 176.850 1.950 17919 36619 1 90 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.169 0.411 17919 36620 1 90 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.060 -0.090 17919 36621 1 90 . 1 1 8 8 LEU H H 8 9.100 9.100 8.495 0.605 17919 36622 1 90 . 1 1 9 9 THR N N 9 105.590 105.590 109.623 -4.033 17919 36623 1 90 . 1 1 9 9 THR HA H 9 4.428 4.428 4.376 0.052 17919 36624 1 90 . 1 1 9 9 THR C C 9 175.520 175.520 175.627 -0.107 17919 36625 1 90 . 1 1 9 9 THR CA C 9 61.400 61.400 61.652 -0.252 17919 36626 1 90 . 1 1 9 9 THR CB C 9 69.140 69.140 69.506 -0.366 17919 36627 1 90 . 1 1 9 9 THR H H 9 7.630 7.630 7.654 -0.024 17919 36628 1 90 . 1 1 10 10 GLY N N 10 108.890 108.890 111.556 -2.666 17919 36629 1 90 . 1 1 10 10 GLY C C 10 174.070 174.070 174.208 -0.138 17919 36630 1 90 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.825 0.635 17919 36631 1 90 . 1 1 10 10 GLY H H 10 7.810 7.810 8.361 -0.551 17919 36632 1 90 . 1 1 11 11 LYS N N 11 121.600 121.600 121.363 0.237 17919 36633 1 90 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.355 0.006 17919 36634 1 90 . 1 1 11 11 LYS C C 11 175.940 175.940 175.358 0.582 17919 36635 1 90 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.827 -0.547 17919 36636 1 90 . 1 1 11 11 LYS CB C 11 33.200 33.200 32.971 0.229 17919 36637 1 90 . 1 1 11 11 LYS H H 11 7.280 7.280 8.047 -0.767 17919 36638 1 90 . 1 1 12 12 THR N N 12 120.440 120.440 118.258 2.182 17919 36639 1 90 . 1 1 12 12 THR HA H 12 5.046 5.046 5.341 -0.295 17919 36640 1 90 . 1 1 12 12 THR C C 12 174.320 174.320 173.947 0.373 17919 36641 1 90 . 1 1 12 12 THR CA C 12 62.390 62.390 61.299 1.091 17919 36642 1 90 . 1 1 12 12 THR CB C 12 69.910 69.910 70.740 -0.830 17919 36643 1 90 . 1 1 12 12 THR H H 12 8.650 8.650 8.219 0.431 17919 36644 1 90 . 1 1 13 13 ILE N N 13 127.110 127.110 125.811 1.299 17919 36645 1 90 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.463 0.081 17919 36646 1 90 . 1 1 13 13 ILE C C 13 175.220 175.220 174.844 0.376 17919 36647 1 90 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.730 -0.750 17919 36648 1 90 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.895 -0.945 17919 36649 1 90 . 1 1 13 13 ILE H H 13 9.450 9.450 8.437 1.013 17919 36650 1 90 . 1 1 14 14 THR N N 14 121.520 121.520 124.380 -2.860 17919 36651 1 90 . 1 1 14 14 THR HA H 14 4.964 4.964 4.927 0.037 17919 36652 1 90 . 1 1 14 14 THR C C 14 173.790 173.790 173.935 -0.145 17919 36653 1 90 . 1 1 14 14 THR CA C 14 61.940 61.940 61.875 0.065 17919 36654 1 90 . 1 1 14 14 THR CB C 14 69.650 69.650 69.557 0.093 17919 36655 1 90 . 1 1 14 14 THR H H 14 8.710 8.710 8.600 0.110 17919 36656 1 90 . 1 1 15 15 LEU N N 15 124.800 124.800 128.542 -3.742 17919 36657 1 90 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.580 0.200 17919 36658 1 90 . 1 1 15 15 LEU C C 15 174.670 174.670 175.868 -1.198 17919 36659 1 90 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.002 -0.172 17919 36660 1 90 . 1 1 15 15 LEU CB C 15 47.070 47.070 42.144 4.926 17919 36661 1 90 . 1 1 15 15 LEU H H 15 8.710 8.710 8.741 -0.031 17919 36662 1 90 . 1 1 16 16 GLU N N 16 122.160 122.160 123.929 -1.769 17919 36663 1 90 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.053 -0.136 17919 36664 1 90 . 1 1 16 16 GLU C C 16 175.860 175.860 175.943 -0.083 17919 36665 1 90 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.625 -0.805 17919 36666 1 90 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.424 -0.974 17919 36667 1 90 . 1 1 16 16 GLU H H 16 8.140 8.140 8.783 -0.643 17919 36668 1 90 . 1 1 17 17 VAL N N 17 117.210 117.210 119.728 -2.518 17919 36669 1 90 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.852 -0.138 17919 36670 1 90 . 1 1 17 17 VAL C C 17 174.160 174.160 174.763 -0.603 17919 36671 1 90 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.574 -0.144 17919 36672 1 90 . 1 1 17 17 VAL CB C 17 36.400 36.400 34.719 1.681 17919 36673 1 90 . 1 1 17 17 VAL H H 17 8.900 8.900 8.371 0.529 17919 36674 1 90 . 1 1 18 18 GLU N N 18 118.990 118.990 119.811 -0.821 17919 36675 1 90 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.883 0.196 17919 36676 1 90 . 1 1 18 18 GLU C C 18 176.160 176.160 175.179 0.981 17919 36677 1 90 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.442 0.278 17919 36678 1 90 . 1 1 18 18 GLU CB C 18 30.310 30.310 32.293 -1.983 17919 36679 1 90 . 1 1 18 18 GLU H H 18 8.640 8.640 8.959 -0.319 17919 36680 1 90 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.257 -0.116 17919 36681 1 90 . 1 1 19 19 PRO C C 19 175.310 175.310 178.254 -2.944 17919 36682 1 90 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.433 0.037 17919 36683 1 90 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.859 0.091 17919 36684 1 90 . 1 1 20 20 SER N N 20 103.400 103.400 112.659 -9.259 17919 36685 1 90 . 1 1 20 20 SER HA H 20 4.370 4.370 4.102 0.268 17919 36686 1 90 . 1 1 20 20 SER C C 20 174.660 174.660 174.915 -0.255 17919 36687 1 90 . 1 1 20 20 SER CA C 20 57.400 57.400 60.342 -2.942 17919 36688 1 90 . 1 1 20 20 SER CB C 20 63.370 63.370 62.879 0.491 17919 36689 1 90 . 1 1 20 20 SER H H 20 7.040 7.040 8.176 -1.136 17919 36690 1 90 . 1 1 21 21 ASP N N 21 123.480 123.480 122.180 1.300 17919 36691 1 90 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.735 -0.040 17919 36692 1 90 . 1 1 21 21 ASP C C 21 176.360 176.360 175.887 0.473 17919 36693 1 90 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.410 0.290 17919 36694 1 90 . 1 1 21 21 ASP CB C 21 40.800 40.800 42.013 -1.213 17919 36695 1 90 . 1 1 21 21 ASP H H 21 8.030 8.030 7.925 0.105 17919 36696 1 90 . 1 1 22 22 THR N N 22 108.800 108.800 113.335 -4.535 17919 36697 1 90 . 1 1 22 22 THR HA H 22 4.920 4.920 4.492 0.428 17919 36698 1 90 . 1 1 22 22 THR C C 22 176.750 176.750 176.364 0.386 17919 36699 1 90 . 1 1 22 22 THR CA C 22 59.690 59.690 62.338 -2.648 17919 36700 1 90 . 1 1 22 22 THR CB C 22 71.200 71.200 69.934 1.266 17919 36701 1 90 . 1 1 22 22 THR H H 22 7.900 7.900 8.227 -0.327 17919 36702 1 90 . 1 1 23 23 ILE N N 23 121.190 121.190 123.879 -2.689 17919 36703 1 90 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.616 0.041 17919 36704 1 90 . 1 1 23 23 ILE C C 23 179.040 179.040 177.640 1.400 17919 36705 1 90 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.574 -1.314 17919 36706 1 90 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.252 -1.902 17919 36707 1 90 . 1 1 23 23 ILE H H 23 8.560 8.560 9.118 -0.558 17919 36708 1 90 . 1 1 24 24 GLU N N 24 120.830 120.830 120.584 0.246 17919 36709 1 90 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.892 0.025 17919 36710 1 90 . 1 1 24 24 GLU C C 24 178.640 178.640 178.926 -0.286 17919 36711 1 90 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.859 0.361 17919 36712 1 90 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.341 -1.061 17919 36713 1 90 . 1 1 24 24 GLU H H 24 9.760 9.760 7.888 1.872 17919 36714 1 90 . 1 1 25 25 ASN N N 25 120.570 120.570 116.849 3.721 17919 36715 1 90 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.521 0.004 17919 36716 1 90 . 1 1 25 25 ASN C C 25 178.380 178.380 177.713 0.667 17919 36717 1 90 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.122 -0.062 17919 36718 1 90 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.660 -0.210 17919 36719 1 90 . 1 1 25 25 ASN H H 25 7.920 7.920 7.806 0.114 17919 36720 1 90 . 1 1 26 26 VAL N N 26 121.710 121.710 120.381 1.329 17919 36721 1 90 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.639 -0.242 17919 36722 1 90 . 1 1 26 26 VAL C C 26 177.950 177.950 177.730 0.220 17919 36723 1 90 . 1 1 26 26 VAL CA C 26 67.660 67.660 65.966 1.694 17919 36724 1 90 . 1 1 26 26 VAL CB C 26 30.840 30.840 30.904 -0.064 17919 36725 1 90 . 1 1 26 26 VAL H H 26 8.070 8.070 7.704 0.366 17919 36726 1 90 . 1 1 27 27 LYS N N 27 118.860 118.860 120.176 -1.316 17919 36727 1 90 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.167 0.413 17919 36728 1 90 . 1 1 27 27 LYS C C 27 180.550 180.550 179.255 1.295 17919 36729 1 90 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.716 -0.466 17919 36730 1 90 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.080 1.650 17919 36731 1 90 . 1 1 27 27 LYS H H 27 8.560 8.560 8.124 0.436 17919 36732 1 90 . 1 1 28 28 ALA N N 28 123.440 123.440 121.738 1.702 17919 36733 1 90 . 1 1 28 28 ALA HA H 28 4.160 4.160 3.946 0.214 17919 36734 1 90 . 1 1 28 28 ALA C C 28 180.300 180.300 179.383 0.917 17919 36735 1 90 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.330 0.041 17919 36736 1 90 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.303 -0.593 17919 36737 1 90 . 1 1 28 28 ALA H H 28 8.060 8.060 7.857 0.203 17919 36738 1 90 . 1 1 29 29 LYS N N 29 119.940 119.940 118.689 1.251 17919 36739 1 90 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.037 0.170 17919 36740 1 90 . 1 1 29 29 LYS C C 29 180.320 180.320 179.000 1.320 17919 36741 1 90 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.187 0.464 17919 36742 1 90 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.453 0.837 17919 36743 1 90 . 1 1 29 29 LYS H H 29 7.850 7.850 7.412 0.438 17919 36744 1 90 . 1 1 30 30 ILE N N 30 121.080 121.080 119.839 1.241 17919 36745 1 90 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.628 -0.121 17919 36746 1 90 . 1 1 30 30 ILE C C 30 178.310 178.310 177.249 1.061 17919 36747 1 90 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.252 0.898 17919 36748 1 90 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.816 -1.016 17919 36749 1 90 . 1 1 30 30 ILE H H 30 8.280 8.280 8.008 0.272 17919 36750 1 90 . 1 1 31 31 GLN N N 31 123.490 123.490 119.814 3.676 17919 36751 1 90 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.952 -0.123 17919 36752 1 90 . 1 1 31 31 GLN C C 31 178.890 178.890 177.613 1.277 17919 36753 1 90 . 1 1 31 31 GLN CA C 31 60.000 60.000 58.784 1.216 17919 36754 1 90 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.549 -0.829 17919 36755 1 90 . 1 1 31 31 GLN H H 31 8.580 8.580 7.959 0.621 17919 36756 1 90 . 1 1 32 32 ASP N N 32 119.360 119.360 118.892 0.468 17919 36757 1 90 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.408 -0.054 17919 36758 1 90 . 1 1 32 32 ASP C C 32 177.250 177.250 177.570 -0.320 17919 36759 1 90 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.699 0.491 17919 36760 1 90 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.925 -0.345 17919 36761 1 90 . 1 1 32 32 ASP H H 32 8.010 8.010 7.774 0.236 17919 36762 1 90 . 1 1 33 33 LYS N N 33 115.130 115.130 117.719 -2.589 17919 36763 1 90 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.394 -0.057 17919 36764 1 90 . 1 1 33 33 LYS C C 33 177.870 177.870 177.485 0.385 17919 36765 1 90 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.069 0.981 17919 36766 1 90 . 1 1 33 33 LYS CB C 33 34.170 34.170 34.995 -0.825 17919 36767 1 90 . 1 1 33 33 LYS H H 33 7.430 7.430 7.608 -0.178 17919 36768 1 90 . 1 1 34 34 GLU N N 34 113.870 113.870 117.797 -3.927 17919 36769 1 90 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.516 0.109 17919 36770 1 90 . 1 1 34 34 GLU C C 34 177.840 177.840 176.576 1.264 17919 36771 1 90 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.640 -0.470 17919 36772 1 90 . 1 1 34 34 GLU CB C 34 32.660 32.660 30.615 2.045 17919 36773 1 90 . 1 1 34 34 GLU H H 34 8.740 8.740 7.796 0.944 17919 36774 1 90 . 1 1 35 35 GLY N N 35 108.650 108.650 108.475 0.175 17919 36775 1 90 . 1 1 35 35 GLY C C 35 173.960 173.960 174.617 -0.657 17919 36776 1 90 . 1 1 35 35 GLY CA C 35 46.080 46.080 46.225 -0.145 17919 36777 1 90 . 1 1 35 35 GLY H H 35 8.530 8.530 7.991 0.539 17919 36778 1 90 . 1 1 36 36 ILE N N 36 119.880 119.880 118.657 1.223 17919 36779 1 90 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.456 -0.011 17919 36780 1 90 . 1 1 36 36 ILE C C 36 173.590 173.590 174.028 -0.438 17919 36781 1 90 . 1 1 36 36 ILE CA C 36 57.750 57.750 56.779 0.972 17919 36782 1 90 . 1 1 36 36 ILE CB C 36 40.580 40.580 36.863 3.717 17919 36783 1 90 . 1 1 36 36 ILE H H 36 6.150 6.150 7.616 -1.466 17919 36784 1 90 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.690 -0.056 17919 36785 1 90 . 1 1 37 37 PRO C C 37 176.940 176.940 176.847 0.093 17919 36786 1 90 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.627 0.033 17919 36787 1 90 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.407 0.443 17919 36788 1 90 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.081 0.036 17919 36789 1 90 . 1 1 38 38 PRO C C 38 178.320 178.320 178.432 -0.112 17919 36790 1 90 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.987 0.273 17919 36791 1 90 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.554 1.336 17919 36792 1 90 . 1 1 39 39 ASP N N 39 113.380 113.380 116.827 -3.447 17919 36793 1 90 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.304 0.126 17919 36794 1 90 . 1 1 39 39 ASP C C 39 177.090 177.090 177.001 0.089 17919 36795 1 90 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.525 -0.885 17919 36796 1 90 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.315 -0.775 17919 36797 1 90 . 1 1 39 39 ASP H H 39 8.550 8.550 8.587 -0.037 17919 36798 1 90 . 1 1 40 40 GLN N N 40 116.780 116.780 115.830 0.950 17919 36799 1 90 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.326 0.138 17919 36800 1 90 . 1 1 40 40 GLN C C 40 175.380 175.380 176.798 -1.418 17919 36801 1 90 . 1 1 40 40 GLN CA C 40 55.640 55.640 57.228 -1.589 17919 36802 1 90 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.551 0.589 17919 36803 1 90 . 1 1 40 40 GLN H H 40 7.820 7.820 7.795 0.025 17919 36804 1 90 . 1 1 41 41 GLN N N 41 117.720 117.720 119.224 -1.504 17919 36805 1 90 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.274 -0.030 17919 36806 1 90 . 1 1 41 41 GLN C C 41 176.300 176.300 175.663 0.637 17919 36807 1 90 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.967 0.503 17919 36808 1 90 . 1 1 41 41 GLN CB C 41 31.650 31.650 28.688 2.962 17919 36809 1 90 . 1 1 41 41 GLN H H 41 7.480 7.480 7.310 0.170 17919 36810 1 90 . 1 1 42 42 ARG N N 42 122.680 122.680 126.258 -3.578 17919 36811 1 90 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.392 0.108 17919 36812 1 90 . 1 1 42 42 ARG C C 42 174.050 174.050 174.730 -0.680 17919 36813 1 90 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.155 -0.105 17919 36814 1 90 . 1 1 42 42 ARG CB C 42 31.750 31.750 30.348 1.402 17919 36815 1 90 . 1 1 42 42 ARG H H 42 8.530 8.530 8.228 0.302 17919 36816 1 90 . 1 1 43 43 LEU N N 43 124.040 124.040 126.807 -2.767 17919 36817 1 90 . 1 1 43 43 LEU C C 43 175.290 175.290 175.116 0.174 17919 36818 1 90 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.993 -1.013 17919 36819 1 90 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.545 2.245 17919 36820 1 90 . 1 1 43 43 LEU H H 43 8.820 8.820 8.456 0.364 17919 36821 1 90 . 1 1 44 44 ILE N N 44 121.920 121.920 125.272 -3.352 17919 36822 1 90 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.142 -0.150 17919 36823 1 90 . 1 1 44 44 ILE C C 44 176.060 176.060 174.528 1.532 17919 36824 1 90 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.948 -0.968 17919 36825 1 90 . 1 1 44 44 ILE CB C 44 41.420 41.420 42.062 -0.642 17919 36826 1 90 . 1 1 44 44 ILE H H 44 9.030 9.030 8.297 0.733 17919 36827 1 90 . 1 1 45 45 PHE N N 45 125.390 125.390 126.033 -0.643 17919 36828 1 90 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.986 0.059 17919 36829 1 90 . 1 1 45 45 PHE C C 45 174.470 174.470 174.375 0.095 17919 36830 1 90 . 1 1 45 45 PHE CA C 45 57.020 57.020 57.045 -0.025 17919 36831 1 90 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.907 0.853 17919 36832 1 90 . 1 1 45 45 PHE H H 45 8.830 8.830 9.032 -0.202 17919 36833 1 90 . 1 1 46 46 ALA N N 46 132.200 132.200 129.703 2.497 17919 36834 1 90 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.714 -0.024 17919 36835 1 90 . 1 1 46 46 ALA C C 46 177.290 177.290 177.632 -0.342 17919 36836 1 90 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.882 -0.342 17919 36837 1 90 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.697 -0.127 17919 36838 1 90 . 1 1 46 46 ALA H H 46 8.810 8.810 8.798 0.012 17919 36839 1 90 . 1 1 47 47 GLY N N 47 102.340 102.340 102.302 0.038 17919 36840 1 90 . 1 1 47 47 GLY C C 47 173.810 173.810 174.202 -0.392 17919 36841 1 90 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.902 0.448 17919 36842 1 90 . 1 1 47 47 GLY H H 47 8.130 8.130 8.410 -0.280 17919 36843 1 90 . 1 1 48 48 LYS N N 48 121.570 121.570 120.007 1.563 17919 36844 1 90 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.663 -0.041 17919 36845 1 90 . 1 1 48 48 LYS C C 48 174.700 174.700 175.466 -0.766 17919 36846 1 90 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.294 0.256 17919 36847 1 90 . 1 1 48 48 LYS CB C 48 34.530 34.530 35.086 -0.556 17919 36848 1 90 . 1 1 48 48 LYS H H 48 7.980 7.980 8.039 -0.059 17919 36849 1 90 . 1 1 49 49 GLN N N 49 122.410 122.410 121.103 1.307 17919 36850 1 90 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.664 -0.104 17919 36851 1 90 . 1 1 49 49 GLN C C 49 175.670 175.670 176.149 -0.479 17919 36852 1 90 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.040 -0.300 17919 36853 1 90 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.766 -0.766 17919 36854 1 90 . 1 1 49 49 GLN H H 49 8.600 8.600 8.526 0.074 17919 36855 1 90 . 1 1 50 50 LEU N N 50 125.520 125.520 124.321 1.199 17919 36856 1 90 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.077 0.013 17919 36857 1 90 . 1 1 50 50 LEU C C 50 176.660 176.660 176.004 0.656 17919 36858 1 90 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.394 0.847 17919 36859 1 90 . 1 1 50 50 LEU CB C 50 41.570 41.570 40.912 0.658 17919 36860 1 90 . 1 1 50 50 LEU H H 50 8.530 8.530 8.488 0.042 17919 36861 1 90 . 1 1 51 51 GLU N N 51 122.940 122.940 124.950 -2.010 17919 36862 1 90 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.141 0.347 17919 36863 1 90 . 1 1 51 51 GLU C C 51 175.870 175.870 177.107 -1.237 17919 36864 1 90 . 1 1 51 51 GLU CA C 51 55.960 55.960 56.900 -0.940 17919 36865 1 90 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.233 0.337 17919 36866 1 90 . 1 1 51 51 GLU H H 51 8.400 8.400 8.023 0.377 17919 36867 1 90 . 1 1 52 52 ASP N N 52 120.030 120.030 124.764 -4.734 17919 36868 1 90 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.539 -0.180 17919 36869 1 90 . 1 1 52 52 ASP C C 52 177.330 177.330 177.609 -0.279 17919 36870 1 90 . 1 1 52 52 ASP CA C 52 56.960 56.960 56.643 0.317 17919 36871 1 90 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.747 0.103 17919 36872 1 90 . 1 1 52 52 ASP H H 52 8.160 8.160 8.729 -0.569 17919 36873 1 90 . 1 1 53 53 GLY N N 53 106.660 106.660 106.723 -0.063 17919 36874 1 90 . 1 1 53 53 GLY C C 53 174.870 174.870 173.840 1.030 17919 36875 1 90 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.763 0.407 17919 36876 1 90 . 1 1 53 53 GLY H H 53 9.390 9.390 8.638 0.752 17919 36877 1 90 . 1 1 54 54 ARG N N 54 119.050 119.050 120.545 -1.495 17919 36878 1 90 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.643 0.052 17919 36879 1 90 . 1 1 54 54 ARG C C 54 175.350 175.350 175.224 0.126 17919 36880 1 90 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.244 0.146 17919 36881 1 90 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.144 -0.494 17919 36882 1 90 . 1 1 54 54 ARG H H 54 7.460 7.460 7.453 0.007 17919 36883 1 90 . 1 1 55 55 THR N N 55 108.400 108.400 111.510 -3.110 17919 36884 1 90 . 1 1 55 55 THR HA H 55 5.240 5.240 5.083 0.157 17919 36885 1 90 . 1 1 55 55 THR C C 55 176.560 176.560 176.046 0.514 17919 36886 1 90 . 1 1 55 55 THR CA C 55 59.690 59.690 60.169 -0.479 17919 36887 1 90 . 1 1 55 55 THR CB C 55 72.260 72.260 71.486 0.774 17919 36888 1 90 . 1 1 55 55 THR H H 55 8.730 8.730 8.343 0.387 17919 36889 1 90 . 1 1 56 56 LEU N N 56 117.920 117.920 121.068 -3.148 17919 36890 1 90 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.029 0.030 17919 36891 1 90 . 1 1 56 56 LEU C C 56 180.810 180.810 178.939 1.871 17919 36892 1 90 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.201 0.509 17919 36893 1 90 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.681 -1.311 17919 36894 1 90 . 1 1 56 56 LEU H H 56 8.140 8.140 8.287 -0.147 17919 36895 1 90 . 1 1 57 57 SER N N 57 113.330 113.330 115.522 -2.192 17919 36896 1 90 . 1 1 57 57 SER HA H 57 4.370 4.370 4.148 0.222 17919 36897 1 90 . 1 1 57 57 SER C C 57 178.310 178.310 176.849 1.461 17919 36898 1 90 . 1 1 57 57 SER CA C 57 61.080 61.080 61.754 -0.674 17919 36899 1 90 . 1 1 57 57 SER CB C 57 62.530 62.530 62.397 0.133 17919 36900 1 90 . 1 1 57 57 SER H H 57 8.470 8.470 8.068 0.402 17919 36901 1 90 . 1 1 58 58 ASP N N 58 124.190 124.190 122.305 1.885 17919 36902 1 90 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.346 -0.050 17919 36903 1 90 . 1 1 58 58 ASP C C 58 177.400 177.400 177.804 -0.404 17919 36904 1 90 . 1 1 58 58 ASP CA C 58 57.180 57.180 57.109 0.071 17919 36905 1 90 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.483 -0.383 17919 36906 1 90 . 1 1 58 58 ASP H H 58 7.930 7.930 7.669 0.261 17919 36907 1 90 . 1 1 59 59 TYR N N 59 115.510 115.510 114.767 0.743 17919 36908 1 90 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.717 -0.047 17919 36909 1 90 . 1 1 59 59 TYR C C 59 174.700 174.700 175.574 -0.874 17919 36910 1 90 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.735 0.515 17919 36911 1 90 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.527 1.543 17919 36912 1 90 . 1 1 59 59 TYR H H 59 7.250 7.250 7.421 -0.171 17919 36913 1 90 . 1 1 60 60 ASN N N 60 115.900 115.900 115.545 0.355 17919 36914 1 90 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.422 -0.067 17919 36915 1 90 . 1 1 60 60 ASN C C 60 174.340 174.340 174.151 0.189 17919 36916 1 90 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.136 -0.016 17919 36917 1 90 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.383 0.027 17919 36918 1 90 . 1 1 60 60 ASN H H 60 8.150 8.150 8.011 0.139 17919 36919 1 90 . 1 1 61 61 ILE N N 61 118.600 118.600 121.347 -2.747 17919 36920 1 90 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.837 -0.444 17919 36921 1 90 . 1 1 61 61 ILE C C 61 174.610 174.610 175.258 -0.648 17919 36922 1 90 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.566 0.854 17919 36923 1 90 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.830 -1.090 17919 36924 1 90 . 1 1 61 61 ILE H H 61 7.250 7.250 8.328 -1.078 17919 36925 1 90 . 1 1 62 62 GLN N N 62 124.740 124.740 125.417 -0.677 17919 36926 1 90 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.679 -0.173 17919 36927 1 90 . 1 1 62 62 GLN C C 62 175.970 175.970 175.512 0.458 17919 36928 1 90 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.346 0.314 17919 36929 1 90 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.144 0.506 17919 36930 1 90 . 1 1 62 62 GLN H H 62 7.610 7.610 8.191 -0.581 17919 36931 1 90 . 1 1 63 63 LYS N N 63 120.300 120.300 120.471 -0.171 17919 36932 1 90 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.931 0.070 17919 36933 1 90 . 1 1 63 63 LYS C C 63 175.810 175.810 177.564 -1.754 17919 36934 1 90 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.023 -0.233 17919 36935 1 90 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.108 0.541 17919 36936 1 90 . 1 1 63 63 LYS H H 63 8.490 8.490 8.654 -0.164 17919 36937 1 90 . 1 1 64 64 GLU N N 64 113.950 113.950 118.209 -4.259 17919 36938 1 90 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.627 -0.162 17919 36939 1 90 . 1 1 64 64 GLU C C 64 175.250 175.250 175.590 -0.340 17919 36940 1 90 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.820 0.070 17919 36941 1 90 . 1 1 64 64 GLU CB C 64 25.900 25.900 27.371 -1.471 17919 36942 1 90 . 1 1 64 64 GLU H H 64 9.280 9.280 8.615 0.665 17919 36943 1 90 . 1 1 65 65 SER N N 65 114.730 114.730 116.908 -2.178 17919 36944 1 90 . 1 1 65 65 SER HA H 65 4.640 4.640 4.466 0.174 17919 36945 1 90 . 1 1 65 65 SER C C 65 172.160 172.160 174.953 -2.793 17919 36946 1 90 . 1 1 65 65 SER CA C 65 60.890 60.890 59.919 0.971 17919 36947 1 90 . 1 1 65 65 SER CB C 65 64.910 64.910 63.327 1.583 17919 36948 1 90 . 1 1 65 65 SER H H 65 7.670 7.670 7.667 0.003 17919 36949 1 90 . 1 1 66 66 THR N N 66 117.110 117.110 123.020 -5.910 17919 36950 1 90 . 1 1 66 66 THR HA H 66 5.270 5.270 4.518 0.752 17919 36951 1 90 . 1 1 66 66 THR C C 66 173.950 173.950 174.343 -0.393 17919 36952 1 90 . 1 1 66 66 THR CA C 66 62.340 62.340 63.557 -1.217 17919 36953 1 90 . 1 1 66 66 THR CB C 66 70.080 70.080 69.397 0.683 17919 36954 1 90 . 1 1 66 66 THR H H 66 8.730 8.730 8.565 0.165 17919 36955 1 90 . 1 1 67 67 LEU N N 67 127.110 127.110 127.724 -0.614 17919 36956 1 90 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.914 0.146 17919 36957 1 90 . 1 1 67 67 LEU C C 67 175.770 175.770 175.325 0.445 17919 36958 1 90 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.821 0.079 17919 36959 1 90 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.537 -0.277 17919 36960 1 90 . 1 1 67 67 LEU H H 67 9.410 9.410 8.825 0.585 17919 36961 1 90 . 1 1 68 68 HIS N N 68 118.380 118.380 118.340 0.040 17919 36962 1 90 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.800 -0.560 17919 36963 1 90 . 1 1 68 68 HIS C C 68 173.150 173.150 174.286 -1.136 17919 36964 1 90 . 1 1 68 68 HIS CA C 68 55.000 55.000 53.761 1.238 17919 36965 1 90 . 1 1 68 68 HIS CB C 68 30.530 30.530 34.259 -3.729 17919 36966 1 90 . 1 1 68 68 HIS H H 68 9.230 9.230 8.864 0.366 17919 36967 1 90 . 1 1 69 69 LEU N N 69 124.460 124.460 122.054 2.406 17919 36968 1 90 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.707 0.483 17919 36969 1 90 . 1 1 69 69 LEU C C 69 175.270 175.270 173.748 1.522 17919 36970 1 90 . 1 1 69 69 LEU CA C 69 53.890 53.890 55.748 -1.858 17919 36971 1 90 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.529 -0.149 17919 36972 1 90 . 1 1 69 69 LEU H H 69 8.340 8.340 7.496 0.844 17919 36973 1 90 . 1 1 70 70 VAL N N 70 126.940 126.940 123.771 3.169 17919 36974 1 90 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.479 -0.129 17919 36975 1 90 . 1 1 70 70 VAL C C 70 174.000 174.000 173.706 0.294 17919 36976 1 90 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.647 0.153 17919 36977 1 90 . 1 1 70 70 VAL CB C 70 34.910 34.910 36.398 -1.488 17919 36978 1 90 . 1 1 70 70 VAL H H 70 9.200 9.200 7.931 1.269 17919 36979 1 90 . 1 1 71 71 LEU N N 71 123.130 123.130 122.383 0.747 17919 36980 1 90 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.256 -0.196 17919 36981 1 90 . 1 1 71 71 LEU C C 71 177.830 177.830 176.099 1.731 17919 36982 1 90 . 1 1 71 71 LEU CA C 71 53.940 53.940 52.707 1.233 17919 36983 1 90 . 1 1 71 71 LEU CB C 71 42.850 42.850 44.711 -1.861 17919 36984 1 90 . 1 1 71 71 LEU H H 71 8.120 8.120 8.176 -0.056 17919 36985 1 90 . 1 1 72 72 ARG N N 72 123.490 123.490 124.479 -0.989 17919 36986 1 90 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.493 -0.192 17919 36987 1 90 . 1 1 72 72 ARG C C 72 175.350 175.350 175.031 0.319 17919 36988 1 90 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.935 -0.325 17919 36989 1 90 . 1 1 72 72 ARG CB C 72 31.350 31.350 31.008 0.342 17919 36990 1 90 . 1 1 72 72 ARG H H 72 8.580 8.580 8.350 0.230 17919 36991 1 91 . 1 1 2 2 GLN N N 2 123.220 123.220 123.283 -0.063 17919 36992 1 91 . 1 1 2 2 GLN HA H 2 5.249 5.249 4.858 0.391 17919 36993 1 91 . 1 1 2 2 GLN C C 2 175.920 175.920 174.808 1.112 17919 36994 1 91 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.852 0.228 17919 36995 1 91 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.402 0.358 17919 36996 1 91 . 1 1 2 2 GLN H H 2 8.900 8.900 8.520 0.380 17919 36997 1 91 . 1 1 3 3 ILE N N 3 115.340 115.340 118.186 -2.846 17919 36998 1 91 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.078 0.135 17919 36999 1 91 . 1 1 3 3 ILE C C 3 172.450 172.450 173.776 -1.326 17919 37000 1 91 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.672 -0.102 17919 37001 1 91 . 1 1 3 3 ILE CB C 3 42.210 42.210 40.413 1.797 17919 37002 1 91 . 1 1 3 3 ILE H H 3 8.320 8.320 7.455 0.865 17919 37003 1 91 . 1 1 4 4 PHE N N 4 118.110 118.110 119.565 -1.455 17919 37004 1 91 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.274 0.356 17919 37005 1 91 . 1 1 4 4 PHE C C 4 175.320 175.320 174.795 0.525 17919 37006 1 91 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.360 -0.150 17919 37007 1 91 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.685 -0.205 17919 37008 1 91 . 1 1 4 4 PHE H H 4 8.610 8.610 7.758 0.852 17919 37009 1 91 . 1 1 5 5 VAL N N 5 121.000 121.000 119.420 1.580 17919 37010 1 91 . 1 1 5 5 VAL HA H 5 4.725 4.725 5.020 -0.295 17919 37011 1 91 . 1 1 5 5 VAL C C 5 174.870 174.870 174.504 0.366 17919 37012 1 91 . 1 1 5 5 VAL CA C 5 60.620 60.620 60.216 0.404 17919 37013 1 91 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.676 0.554 17919 37014 1 91 . 1 1 5 5 VAL H H 5 9.300 9.300 8.910 0.390 17919 37015 1 91 . 1 1 6 6 LYS N N 6 127.520 127.520 129.724 -2.204 17919 37016 1 91 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.137 0.230 17919 37017 1 91 . 1 1 6 6 LYS C C 6 177.140 177.140 176.482 0.658 17919 37018 1 91 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.777 -0.257 17919 37019 1 91 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.810 -0.760 17919 37020 1 91 . 1 1 6 6 LYS H H 6 8.820 8.820 9.272 -0.452 17919 37021 1 91 . 1 1 7 7 THR N N 7 115.400 115.400 118.257 -2.857 17919 37022 1 91 . 1 1 7 7 THR HA H 7 4.970 4.970 4.784 0.186 17919 37023 1 91 . 1 1 7 7 THR C C 7 176.910 176.910 176.343 0.567 17919 37024 1 91 . 1 1 7 7 THR CA C 7 60.470 60.470 60.372 0.098 17919 37025 1 91 . 1 1 7 7 THR CB C 7 70.630 70.630 70.629 0.001 17919 37026 1 91 . 1 1 7 7 THR H H 7 8.730 8.730 8.686 0.044 17919 37027 1 91 . 1 1 8 8 LEU N N 8 121.330 121.330 122.555 -1.225 17919 37028 1 91 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.117 0.193 17919 37029 1 91 . 1 1 8 8 LEU C C 8 178.800 178.800 176.851 1.949 17919 37030 1 91 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.580 0.000 17919 37031 1 91 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.643 0.327 17919 37032 1 91 . 1 1 8 8 LEU H H 8 9.100 9.100 8.657 0.443 17919 37033 1 91 . 1 1 9 9 THR N N 9 105.590 105.590 105.406 0.184 17919 37034 1 91 . 1 1 9 9 THR HA H 9 4.428 4.428 4.343 0.085 17919 37035 1 91 . 1 1 9 9 THR C C 9 175.520 175.520 175.270 0.250 17919 37036 1 91 . 1 1 9 9 THR CA C 9 61.400 61.400 61.867 -0.467 17919 37037 1 91 . 1 1 9 9 THR CB C 9 69.140 69.140 68.734 0.406 17919 37038 1 91 . 1 1 9 9 THR H H 9 7.630 7.630 7.568 0.062 17919 37039 1 91 . 1 1 10 10 GLY N N 10 108.890 108.890 110.106 -1.216 17919 37040 1 91 . 1 1 10 10 GLY C C 10 174.070 174.070 174.467 -0.397 17919 37041 1 91 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.038 0.421 17919 37042 1 91 . 1 1 10 10 GLY H H 10 7.810 7.810 7.716 0.094 17919 37043 1 91 . 1 1 11 11 LYS N N 11 121.600 121.600 121.963 -0.363 17919 37044 1 91 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.410 -0.049 17919 37045 1 91 . 1 1 11 11 LYS C C 11 175.940 175.940 175.481 0.459 17919 37046 1 91 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.030 0.250 17919 37047 1 91 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.646 -0.446 17919 37048 1 91 . 1 1 11 11 LYS H H 11 7.280 7.280 7.586 -0.306 17919 37049 1 91 . 1 1 12 12 THR N N 12 120.440 120.440 116.278 4.162 17919 37050 1 91 . 1 1 12 12 THR HA H 12 5.046 5.046 4.524 0.522 17919 37051 1 91 . 1 1 12 12 THR C C 12 174.320 174.320 173.679 0.641 17919 37052 1 91 . 1 1 12 12 THR CA C 12 62.390 62.390 61.144 1.246 17919 37053 1 91 . 1 1 12 12 THR CB C 12 69.910 69.910 70.647 -0.736 17919 37054 1 91 . 1 1 12 12 THR H H 12 8.650 8.650 8.283 0.367 17919 37055 1 91 . 1 1 13 13 ILE N N 13 127.110 127.110 127.730 -0.620 17919 37056 1 91 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.351 0.193 17919 37057 1 91 . 1 1 13 13 ILE C C 13 175.220 175.220 175.788 -0.568 17919 37058 1 91 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.570 -0.590 17919 37059 1 91 . 1 1 13 13 ILE CB C 13 40.950 40.950 39.373 1.577 17919 37060 1 91 . 1 1 13 13 ILE H H 13 9.450 9.450 8.381 1.069 17919 37061 1 91 . 1 1 14 14 THR N N 14 121.520 121.520 122.459 -0.939 17919 37062 1 91 . 1 1 14 14 THR HA H 14 4.964 4.964 4.858 0.106 17919 37063 1 91 . 1 1 14 14 THR C C 14 173.790 173.790 173.451 0.339 17919 37064 1 91 . 1 1 14 14 THR CA C 14 61.940 61.940 61.127 0.813 17919 37065 1 91 . 1 1 14 14 THR CB C 14 69.650 69.650 69.644 0.006 17919 37066 1 91 . 1 1 14 14 THR H H 14 8.710 8.710 8.656 0.054 17919 37067 1 91 . 1 1 15 15 LEU N N 15 124.800 124.800 126.590 -1.790 17919 37068 1 91 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.737 0.043 17919 37069 1 91 . 1 1 15 15 LEU C C 15 174.670 174.670 174.693 -0.023 17919 37070 1 91 . 1 1 15 15 LEU CA C 15 52.830 52.830 54.123 -1.293 17919 37071 1 91 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.910 1.160 17919 37072 1 91 . 1 1 15 15 LEU H H 15 8.710 8.710 7.962 0.748 17919 37073 1 91 . 1 1 16 16 GLU N N 16 122.160 122.160 122.437 -0.277 17919 37074 1 91 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.530 0.387 17919 37075 1 91 . 1 1 16 16 GLU C C 16 175.860 175.860 175.488 0.372 17919 37076 1 91 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.041 -0.222 17919 37077 1 91 . 1 1 16 16 GLU CB C 16 29.450 29.450 29.670 -0.220 17919 37078 1 91 . 1 1 16 16 GLU H H 16 8.140 8.140 8.564 -0.424 17919 37079 1 91 . 1 1 17 17 VAL N N 17 117.210 117.210 119.664 -2.454 17919 37080 1 91 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.593 0.121 17919 37081 1 91 . 1 1 17 17 VAL C C 17 174.160 174.160 174.389 -0.229 17919 37082 1 91 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.905 -0.475 17919 37083 1 91 . 1 1 17 17 VAL CB C 17 36.400 36.400 34.934 1.466 17919 37084 1 91 . 1 1 17 17 VAL H H 17 8.900 8.900 8.028 0.872 17919 37085 1 91 . 1 1 18 18 GLU N N 18 118.990 118.990 118.973 0.017 17919 37086 1 91 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.673 0.406 17919 37087 1 91 . 1 1 18 18 GLU C C 18 176.160 176.160 174.757 1.403 17919 37088 1 91 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.371 -0.651 17919 37089 1 91 . 1 1 18 18 GLU CB C 18 30.310 30.310 31.365 -1.055 17919 37090 1 91 . 1 1 18 18 GLU H H 18 8.640 8.640 8.085 0.555 17919 37091 1 91 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.227 -0.086 17919 37092 1 91 . 1 1 19 19 PRO C C 19 175.310 175.310 177.920 -2.610 17919 37093 1 91 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.769 -0.299 17919 37094 1 91 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.090 -0.140 17919 37095 1 91 . 1 1 20 20 SER N N 20 103.400 103.400 110.991 -7.591 17919 37096 1 91 . 1 1 20 20 SER HA H 20 4.370 4.370 4.281 0.089 17919 37097 1 91 . 1 1 20 20 SER C C 20 174.660 174.660 174.571 0.089 17919 37098 1 91 . 1 1 20 20 SER CA C 20 57.400 57.400 58.835 -1.435 17919 37099 1 91 . 1 1 20 20 SER CB C 20 63.370 63.370 63.078 0.292 17919 37100 1 91 . 1 1 20 20 SER H H 20 7.040 7.040 8.196 -1.156 17919 37101 1 91 . 1 1 21 21 ASP N N 21 123.480 123.480 124.761 -1.281 17919 37102 1 91 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.546 0.149 17919 37103 1 91 . 1 1 21 21 ASP C C 21 176.360 176.360 175.508 0.852 17919 37104 1 91 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.676 0.024 17919 37105 1 91 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.052 -0.252 17919 37106 1 91 . 1 1 21 21 ASP H H 21 8.030 8.030 7.675 0.355 17919 37107 1 91 . 1 1 22 22 THR N N 22 108.800 108.800 113.237 -4.437 17919 37108 1 91 . 1 1 22 22 THR HA H 22 4.920 4.920 4.578 0.342 17919 37109 1 91 . 1 1 22 22 THR C C 22 176.750 176.750 175.820 0.930 17919 37110 1 91 . 1 1 22 22 THR CA C 22 59.690 59.690 61.452 -1.762 17919 37111 1 91 . 1 1 22 22 THR CB C 22 71.200 71.200 70.547 0.653 17919 37112 1 91 . 1 1 22 22 THR H H 22 7.900 7.900 8.155 -0.255 17919 37113 1 91 . 1 1 23 23 ILE N N 23 121.190 121.190 123.985 -2.795 17919 37114 1 91 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.703 -0.046 17919 37115 1 91 . 1 1 23 23 ILE C C 23 179.040 179.040 177.741 1.299 17919 37116 1 91 . 1 1 23 23 ILE CA C 23 62.260 62.260 61.659 0.601 17919 37117 1 91 . 1 1 23 23 ILE CB C 23 34.350 34.350 35.845 -1.495 17919 37118 1 91 . 1 1 23 23 ILE H H 23 8.560 8.560 8.902 -0.342 17919 37119 1 91 . 1 1 24 24 GLU N N 24 120.830 120.830 119.991 0.839 17919 37120 1 91 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.826 0.091 17919 37121 1 91 . 1 1 24 24 GLU C C 24 178.640 178.640 178.572 0.068 17919 37122 1 91 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.065 0.155 17919 37123 1 91 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.427 -1.147 17919 37124 1 91 . 1 1 24 24 GLU H H 24 9.760 9.760 8.198 1.562 17919 37125 1 91 . 1 1 25 25 ASN N N 25 120.570 120.570 117.584 2.986 17919 37126 1 91 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.490 0.035 17919 37127 1 91 . 1 1 25 25 ASN C C 25 178.380 178.380 177.875 0.505 17919 37128 1 91 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.128 -0.068 17919 37129 1 91 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.595 -0.145 17919 37130 1 91 . 1 1 25 25 ASN H H 25 7.920 7.920 7.620 0.300 17919 37131 1 91 . 1 1 26 26 VAL N N 26 121.710 121.710 119.764 1.946 17919 37132 1 91 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.692 -0.295 17919 37133 1 91 . 1 1 26 26 VAL C C 26 177.950 177.950 178.125 -0.175 17919 37134 1 91 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.416 1.244 17919 37135 1 91 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.183 -0.343 17919 37136 1 91 . 1 1 26 26 VAL H H 26 8.070 8.070 7.994 0.076 17919 37137 1 91 . 1 1 27 27 LYS N N 27 118.860 118.860 118.993 -0.133 17919 37138 1 91 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.277 0.303 17919 37139 1 91 . 1 1 27 27 LYS C C 27 180.550 180.550 178.933 1.617 17919 37140 1 91 . 1 1 27 27 LYS CA C 27 59.250 59.250 58.963 0.287 17919 37141 1 91 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.068 1.662 17919 37142 1 91 . 1 1 27 27 LYS H H 27 8.560 8.560 8.086 0.474 17919 37143 1 91 . 1 1 28 28 ALA N N 28 123.440 123.440 124.150 -0.710 17919 37144 1 91 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.074 0.086 17919 37145 1 91 . 1 1 28 28 ALA C C 28 180.300 180.300 178.787 1.513 17919 37146 1 91 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.035 0.335 17919 37147 1 91 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.470 -0.760 17919 37148 1 91 . 1 1 28 28 ALA H H 28 8.060 8.060 8.227 -0.167 17919 37149 1 91 . 1 1 29 29 LYS N N 29 119.940 119.940 119.314 0.626 17919 37150 1 91 . 1 1 29 29 LYS HA H 29 4.207 4.207 3.893 0.314 17919 37151 1 91 . 1 1 29 29 LYS C C 29 180.320 180.320 179.259 1.061 17919 37152 1 91 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.396 0.254 17919 37153 1 91 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.242 1.048 17919 37154 1 91 . 1 1 29 29 LYS H H 29 7.850 7.850 7.681 0.169 17919 37155 1 91 . 1 1 30 30 ILE N N 30 121.080 121.080 119.691 1.389 17919 37156 1 91 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.555 -0.048 17919 37157 1 91 . 1 1 30 30 ILE C C 30 178.310 178.310 177.200 1.110 17919 37158 1 91 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.547 0.603 17919 37159 1 91 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.831 -1.032 17919 37160 1 91 . 1 1 30 30 ILE H H 30 8.280 8.280 7.938 0.342 17919 37161 1 91 . 1 1 31 31 GLN N N 31 123.490 123.490 119.316 4.174 17919 37162 1 91 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.094 -0.265 17919 37163 1 91 . 1 1 31 31 GLN C C 31 178.890 178.890 178.531 0.359 17919 37164 1 91 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.161 0.839 17919 37165 1 91 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.234 -0.514 17919 37166 1 91 . 1 1 31 31 GLN H H 31 8.580 8.580 7.631 0.949 17919 37167 1 91 . 1 1 32 32 ASP N N 32 119.360 119.360 119.260 0.100 17919 37168 1 91 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.460 -0.106 17919 37169 1 91 . 1 1 32 32 ASP C C 32 177.250 177.250 177.848 -0.598 17919 37170 1 91 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.683 0.507 17919 37171 1 91 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.971 -0.391 17919 37172 1 91 . 1 1 32 32 ASP H H 32 8.010 8.010 8.116 -0.106 17919 37173 1 91 . 1 1 33 33 LYS N N 33 115.130 115.130 118.805 -3.675 17919 37174 1 91 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.303 0.034 17919 37175 1 91 . 1 1 33 33 LYS C C 33 177.870 177.870 177.659 0.211 17919 37176 1 91 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.883 0.167 17919 37177 1 91 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.515 0.655 17919 37178 1 91 . 1 1 33 33 LYS H H 33 7.430 7.430 7.489 -0.059 17919 37179 1 91 . 1 1 34 34 GLU N N 34 113.870 113.870 114.852 -0.982 17919 37180 1 91 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.551 0.074 17919 37181 1 91 . 1 1 34 34 GLU C C 34 177.840 177.840 175.644 2.196 17919 37182 1 91 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.452 -0.282 17919 37183 1 91 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.327 1.333 17919 37184 1 91 . 1 1 34 34 GLU H H 34 8.740 8.740 8.214 0.526 17919 37185 1 91 . 1 1 35 35 GLY N N 35 108.650 108.650 108.481 0.169 17919 37186 1 91 . 1 1 35 35 GLY C C 35 173.960 173.960 174.837 -0.877 17919 37187 1 91 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.502 0.578 17919 37188 1 91 . 1 1 35 35 GLY H H 35 8.530 8.530 7.752 0.778 17919 37189 1 91 . 1 1 36 36 ILE N N 36 119.880 119.880 120.482 -0.602 17919 37190 1 91 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.190 0.255 17919 37191 1 91 . 1 1 36 36 ILE C C 36 173.590 173.590 174.146 -0.556 17919 37192 1 91 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.529 0.221 17919 37193 1 91 . 1 1 36 36 ILE CB C 36 40.580 40.580 36.404 4.176 17919 37194 1 91 . 1 1 36 36 ILE H H 36 6.150 6.150 7.707 -1.557 17919 37195 1 91 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.626 0.008 17919 37196 1 91 . 1 1 37 37 PRO C C 37 176.940 176.940 176.185 0.755 17919 37197 1 91 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.923 -0.263 17919 37198 1 91 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.513 0.337 17919 37199 1 91 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.223 -0.106 17919 37200 1 91 . 1 1 38 38 PRO C C 38 178.320 178.320 178.377 -0.057 17919 37201 1 91 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.250 1.010 17919 37202 1 91 . 1 1 38 38 PRO CB C 38 32.890 32.890 32.055 0.835 17919 37203 1 91 . 1 1 39 39 ASP N N 39 113.380 113.380 117.448 -4.068 17919 37204 1 91 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.350 0.080 17919 37205 1 91 . 1 1 39 39 ASP C C 39 177.090 177.090 178.023 -0.933 17919 37206 1 91 . 1 1 39 39 ASP CA C 39 55.640 55.640 57.165 -1.525 17919 37207 1 91 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.482 -0.942 17919 37208 1 91 . 1 1 39 39 ASP H H 39 8.550 8.550 8.732 -0.182 17919 37209 1 91 . 1 1 40 40 GLN N N 40 116.780 116.780 117.066 -0.286 17919 37210 1 91 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.244 0.220 17919 37211 1 91 . 1 1 40 40 GLN C C 40 175.380 175.380 175.143 0.237 17919 37212 1 91 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.531 -0.891 17919 37213 1 91 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.389 0.751 17919 37214 1 91 . 1 1 40 40 GLN H H 40 7.820 7.820 7.755 0.065 17919 37215 1 91 . 1 1 41 41 GLN N N 41 117.720 117.720 117.853 -0.133 17919 37216 1 91 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.939 -0.695 17919 37217 1 91 . 1 1 41 41 GLN C C 41 176.300 176.300 174.912 1.388 17919 37218 1 91 . 1 1 41 41 GLN CA C 41 56.470 56.470 54.274 2.196 17919 37219 1 91 . 1 1 41 41 GLN CB C 41 31.650 31.650 30.159 1.491 17919 37220 1 91 . 1 1 41 41 GLN H H 41 7.480 7.480 7.320 0.160 17919 37221 1 91 . 1 1 42 42 ARG N N 42 122.680 122.680 123.119 -0.439 17919 37222 1 91 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.639 -0.139 17919 37223 1 91 . 1 1 42 42 ARG C C 42 174.050 174.050 174.682 -0.632 17919 37224 1 91 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.753 0.297 17919 37225 1 91 . 1 1 42 42 ARG CB C 42 31.750 31.750 31.977 -0.227 17919 37226 1 91 . 1 1 42 42 ARG H H 42 8.530 8.530 8.177 0.353 17919 37227 1 91 . 1 1 43 43 LEU N N 43 124.040 124.040 123.592 0.448 17919 37228 1 91 . 1 1 43 43 LEU C C 43 175.290 175.290 175.318 -0.028 17919 37229 1 91 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.787 -0.807 17919 37230 1 91 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.123 1.667 17919 37231 1 91 . 1 1 43 43 LEU H H 43 8.820 8.820 8.737 0.083 17919 37232 1 91 . 1 1 44 44 ILE N N 44 121.920 121.920 121.036 0.884 17919 37233 1 91 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.586 0.406 17919 37234 1 91 . 1 1 44 44 ILE C C 44 176.060 176.060 174.601 1.459 17919 37235 1 91 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.090 -1.110 17919 37236 1 91 . 1 1 44 44 ILE CB C 44 41.420 41.420 40.869 0.551 17919 37237 1 91 . 1 1 44 44 ILE H H 44 9.030 9.030 8.551 0.479 17919 37238 1 91 . 1 1 45 45 PHE N N 45 125.390 125.390 128.039 -2.649 17919 37239 1 91 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.995 0.050 17919 37240 1 91 . 1 1 45 45 PHE C C 45 174.470 174.470 174.623 -0.153 17919 37241 1 91 . 1 1 45 45 PHE CA C 45 57.020 57.020 55.815 1.205 17919 37242 1 91 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.104 0.656 17919 37243 1 91 . 1 1 45 45 PHE H H 45 8.830 8.830 8.143 0.687 17919 37244 1 91 . 1 1 46 46 ALA N N 46 132.200 132.200 128.129 4.071 17919 37245 1 91 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.625 0.065 17919 37246 1 91 . 1 1 46 46 ALA C C 46 177.290 177.290 177.826 -0.536 17919 37247 1 91 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.757 -0.217 17919 37248 1 91 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.514 0.056 17919 37249 1 91 . 1 1 46 46 ALA H H 46 8.810 8.810 8.803 0.008 17919 37250 1 91 . 1 1 47 47 GLY N N 47 102.340 102.340 104.143 -1.803 17919 37251 1 91 . 1 1 47 47 GLY C C 47 173.810 173.810 174.449 -0.639 17919 37252 1 91 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.964 0.386 17919 37253 1 91 . 1 1 47 47 GLY H H 47 8.130 8.130 8.361 -0.231 17919 37254 1 91 . 1 1 48 48 LYS N N 48 121.570 121.570 123.106 -1.536 17919 37255 1 91 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.586 0.036 17919 37256 1 91 . 1 1 48 48 LYS C C 48 174.700 174.700 175.723 -1.023 17919 37257 1 91 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.713 -0.163 17919 37258 1 91 . 1 1 48 48 LYS CB C 48 34.530 34.530 33.714 0.816 17919 37259 1 91 . 1 1 48 48 LYS H H 48 7.980 7.980 7.921 0.059 17919 37260 1 91 . 1 1 49 49 GLN N N 49 122.410 122.410 124.381 -1.971 17919 37261 1 91 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.488 0.072 17919 37262 1 91 . 1 1 49 49 GLN C C 49 175.670 175.670 175.557 0.113 17919 37263 1 91 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.496 -0.756 17919 37264 1 91 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.214 -0.214 17919 37265 1 91 . 1 1 49 49 GLN H H 49 8.600 8.600 8.643 -0.043 17919 37266 1 91 . 1 1 50 50 LEU N N 50 125.520 125.520 125.229 0.291 17919 37267 1 91 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.155 -0.065 17919 37268 1 91 . 1 1 50 50 LEU C C 50 176.660 176.660 176.554 0.106 17919 37269 1 91 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.002 0.238 17919 37270 1 91 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.593 -0.023 17919 37271 1 91 . 1 1 50 50 LEU H H 50 8.530 8.530 8.581 -0.051 17919 37272 1 91 . 1 1 51 51 GLU N N 51 122.940 122.940 125.358 -2.418 17919 37273 1 91 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.248 0.240 17919 37274 1 91 . 1 1 51 51 GLU C C 51 175.870 175.870 177.130 -1.260 17919 37275 1 91 . 1 1 51 51 GLU CA C 51 55.960 55.960 56.973 -1.013 17919 37276 1 91 . 1 1 51 51 GLU CB C 51 31.570 31.570 30.462 1.108 17919 37277 1 91 . 1 1 51 51 GLU H H 51 8.400 8.400 8.147 0.253 17919 37278 1 91 . 1 1 52 52 ASP N N 52 120.030 120.030 124.204 -4.174 17919 37279 1 91 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.402 -0.043 17919 37280 1 91 . 1 1 52 52 ASP C C 52 177.330 177.330 178.225 -0.895 17919 37281 1 91 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.956 -0.996 17919 37282 1 91 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.812 0.038 17919 37283 1 91 . 1 1 52 52 ASP H H 52 8.160 8.160 8.779 -0.619 17919 37284 1 91 . 1 1 53 53 GLY N N 53 106.660 106.660 104.808 1.852 17919 37285 1 91 . 1 1 53 53 GLY C C 53 174.870 174.870 174.343 0.527 17919 37286 1 91 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.774 0.396 17919 37287 1 91 . 1 1 53 53 GLY H H 53 9.390 9.390 8.389 1.001 17919 37288 1 91 . 1 1 54 54 ARG N N 54 119.050 119.050 121.653 -2.603 17919 37289 1 91 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.567 0.128 17919 37290 1 91 . 1 1 54 54 ARG C C 54 175.350 175.350 175.341 0.009 17919 37291 1 91 . 1 1 54 54 ARG CA C 54 54.390 54.390 55.215 -0.825 17919 37292 1 91 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.340 0.310 17919 37293 1 91 . 1 1 54 54 ARG H H 54 7.460 7.460 7.472 -0.012 17919 37294 1 91 . 1 1 55 55 THR N N 55 108.400 108.400 112.746 -4.346 17919 37295 1 91 . 1 1 55 55 THR HA H 55 5.240 5.240 4.903 0.337 17919 37296 1 91 . 1 1 55 55 THR C C 55 176.560 176.560 176.182 0.378 17919 37297 1 91 . 1 1 55 55 THR CA C 55 59.690 59.690 60.753 -1.063 17919 37298 1 91 . 1 1 55 55 THR CB C 55 72.260 72.260 70.606 1.654 17919 37299 1 91 . 1 1 55 55 THR H H 55 8.730 8.730 8.415 0.315 17919 37300 1 91 . 1 1 56 56 LEU N N 56 117.920 117.920 122.040 -4.120 17919 37301 1 91 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.899 0.161 17919 37302 1 91 . 1 1 56 56 LEU C C 56 180.810 180.810 178.854 1.956 17919 37303 1 91 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.766 -0.056 17919 37304 1 91 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.453 -1.083 17919 37305 1 91 . 1 1 56 56 LEU H H 56 8.140 8.140 8.439 -0.299 17919 37306 1 91 . 1 1 57 57 SER N N 57 113.330 113.330 114.611 -1.281 17919 37307 1 91 . 1 1 57 57 SER HA H 57 4.370 4.370 4.043 0.327 17919 37308 1 91 . 1 1 57 57 SER C C 57 178.310 178.310 176.715 1.595 17919 37309 1 91 . 1 1 57 57 SER CA C 57 61.080 61.080 61.886 -0.806 17919 37310 1 91 . 1 1 57 57 SER CB C 57 62.530 62.530 62.693 -0.163 17919 37311 1 91 . 1 1 57 57 SER H H 57 8.470 8.470 8.004 0.466 17919 37312 1 91 . 1 1 58 58 ASP N N 58 124.190 124.190 121.581 2.609 17919 37313 1 91 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.245 0.051 17919 37314 1 91 . 1 1 58 58 ASP C C 58 177.400 177.400 176.503 0.897 17919 37315 1 91 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.694 0.486 17919 37316 1 91 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.480 -0.380 17919 37317 1 91 . 1 1 58 58 ASP H H 58 7.930 7.930 7.793 0.137 17919 37318 1 91 . 1 1 59 59 TYR N N 59 115.510 115.510 114.700 0.810 17919 37319 1 91 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.686 -0.016 17919 37320 1 91 . 1 1 59 59 TYR C C 59 174.700 174.700 175.031 -0.331 17919 37321 1 91 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.282 0.968 17919 37322 1 91 . 1 1 59 59 TYR CB C 59 40.070 40.070 37.777 2.293 17919 37323 1 91 . 1 1 59 59 TYR H H 59 7.250 7.250 7.418 -0.168 17919 37324 1 91 . 1 1 60 60 ASN N N 60 115.900 115.900 115.137 0.763 17919 37325 1 91 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.299 0.056 17919 37326 1 91 . 1 1 60 60 ASN C C 60 174.340 174.340 174.606 -0.266 17919 37327 1 91 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.100 0.020 17919 37328 1 91 . 1 1 60 60 ASN CB C 60 37.410 37.410 36.859 0.551 17919 37329 1 91 . 1 1 60 60 ASN H H 60 8.150 8.150 7.778 0.372 17919 37330 1 91 . 1 1 61 61 ILE N N 61 118.600 118.600 119.659 -1.059 17919 37331 1 91 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.797 -0.404 17919 37332 1 91 . 1 1 61 61 ILE C C 61 174.610 174.610 175.230 -0.620 17919 37333 1 91 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.779 -0.360 17919 37334 1 91 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.225 -0.485 17919 37335 1 91 . 1 1 61 61 ILE H H 61 7.250 7.250 7.820 -0.570 17919 37336 1 91 . 1 1 62 62 GLN N N 62 124.740 124.740 125.921 -1.181 17919 37337 1 91 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.833 -0.327 17919 37338 1 91 . 1 1 62 62 GLN C C 62 175.970 175.970 175.346 0.624 17919 37339 1 91 . 1 1 62 62 GLN CA C 62 53.660 53.660 52.914 0.746 17919 37340 1 91 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.210 0.440 17919 37341 1 91 . 1 1 62 62 GLN H H 62 7.610 7.610 8.043 -0.433 17919 37342 1 91 . 1 1 63 63 LYS N N 63 120.300 120.300 121.118 -0.818 17919 37343 1 91 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.927 0.074 17919 37344 1 91 . 1 1 63 63 LYS C C 63 175.810 175.810 176.627 -0.817 17919 37345 1 91 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.779 0.011 17919 37346 1 91 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.608 1.042 17919 37347 1 91 . 1 1 63 63 LYS H H 63 8.490 8.490 8.534 -0.044 17919 37348 1 91 . 1 1 64 64 GLU N N 64 113.950 113.950 116.930 -2.980 17919 37349 1 91 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.680 -0.215 17919 37350 1 91 . 1 1 64 64 GLU C C 64 175.250 175.250 175.546 -0.296 17919 37351 1 91 . 1 1 64 64 GLU CA C 64 57.890 57.890 58.244 -0.354 17919 37352 1 91 . 1 1 64 64 GLU CB C 64 25.900 25.900 27.911 -2.011 17919 37353 1 91 . 1 1 64 64 GLU H H 64 9.280 9.280 8.656 0.624 17919 37354 1 91 . 1 1 65 65 SER N N 65 114.730 114.730 116.582 -1.852 17919 37355 1 91 . 1 1 65 65 SER HA H 65 4.640 4.640 4.397 0.243 17919 37356 1 91 . 1 1 65 65 SER C C 65 172.160 172.160 174.220 -2.060 17919 37357 1 91 . 1 1 65 65 SER CA C 65 60.890 60.890 60.062 0.828 17919 37358 1 91 . 1 1 65 65 SER CB C 65 64.910 64.910 63.513 1.397 17919 37359 1 91 . 1 1 65 65 SER H H 65 7.670 7.670 7.642 0.028 17919 37360 1 91 . 1 1 66 66 THR N N 66 117.110 117.110 122.052 -4.942 17919 37361 1 91 . 1 1 66 66 THR HA H 66 5.270 5.270 4.830 0.440 17919 37362 1 91 . 1 1 66 66 THR C C 66 173.950 173.950 174.458 -0.508 17919 37363 1 91 . 1 1 66 66 THR CA C 66 62.340 62.340 63.107 -0.767 17919 37364 1 91 . 1 1 66 66 THR CB C 66 70.080 70.080 69.558 0.522 17919 37365 1 91 . 1 1 66 66 THR H H 66 8.730 8.730 8.231 0.499 17919 37366 1 91 . 1 1 67 67 LEU N N 67 127.110 127.110 126.353 0.757 17919 37367 1 91 . 1 1 67 67 LEU HA H 67 5.060 5.060 5.141 -0.081 17919 37368 1 91 . 1 1 67 67 LEU C C 67 175.770 175.770 175.276 0.494 17919 37369 1 91 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.999 -0.099 17919 37370 1 91 . 1 1 67 67 LEU CB C 67 44.260 44.260 46.090 -1.830 17919 37371 1 91 . 1 1 67 67 LEU H H 67 9.410 9.410 8.944 0.466 17919 37372 1 91 . 1 1 68 68 HIS N N 68 118.380 118.380 123.069 -4.689 17919 37373 1 91 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.035 0.205 17919 37374 1 91 . 1 1 68 68 HIS C C 68 173.150 173.150 174.599 -1.449 17919 37375 1 91 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.248 0.752 17919 37376 1 91 . 1 1 68 68 HIS CB C 68 30.530 30.530 29.513 1.017 17919 37377 1 91 . 1 1 68 68 HIS H H 68 9.230 9.230 8.386 0.844 17919 37378 1 91 . 1 1 69 69 LEU N N 69 124.460 124.460 127.827 -3.367 17919 37379 1 91 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.362 0.828 17919 37380 1 91 . 1 1 69 69 LEU C C 69 175.270 175.270 174.841 0.429 17919 37381 1 91 . 1 1 69 69 LEU CA C 69 53.890 53.890 55.829 -1.939 17919 37382 1 91 . 1 1 69 69 LEU CB C 69 44.380 44.380 42.510 1.870 17919 37383 1 91 . 1 1 69 69 LEU H H 69 8.340 8.340 8.329 0.011 17919 37384 1 91 . 1 1 70 70 VAL N N 70 126.940 126.940 127.816 -0.876 17919 37385 1 91 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.325 0.025 17919 37386 1 91 . 1 1 70 70 VAL C C 70 174.000 174.000 174.310 -0.310 17919 37387 1 91 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.805 -0.005 17919 37388 1 91 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.409 -0.499 17919 37389 1 91 . 1 1 70 70 VAL H H 70 9.200 9.200 8.182 1.018 17919 37390 1 91 . 1 1 71 71 LEU N N 71 123.130 123.130 125.005 -1.875 17919 37391 1 91 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.067 -0.007 17919 37392 1 91 . 1 1 71 71 LEU C C 71 177.830 177.830 178.332 -0.502 17919 37393 1 91 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.318 0.622 17919 37394 1 91 . 1 1 71 71 LEU CB C 71 42.850 42.850 41.649 1.201 17919 37395 1 91 . 1 1 71 71 LEU H H 71 8.120 8.120 8.652 -0.532 17919 37396 1 91 . 1 1 72 72 ARG N N 72 123.490 123.490 124.928 -1.438 17919 37397 1 91 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.383 -0.082 17919 37398 1 91 . 1 1 72 72 ARG C C 72 175.350 175.350 176.236 -0.886 17919 37399 1 91 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.994 -0.384 17919 37400 1 91 . 1 1 72 72 ARG CB C 72 31.350 31.350 28.183 3.167 17919 37401 1 91 . 1 1 72 72 ARG H H 72 8.580 8.580 8.769 -0.189 17919 37402 1 92 . 1 1 2 2 GLN N N 2 123.220 123.220 120.561 2.659 17919 37403 1 92 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.009 0.240 17919 37404 1 92 . 1 1 2 2 GLN C C 2 175.920 175.920 174.902 1.018 17919 37405 1 92 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.532 0.548 17919 37406 1 92 . 1 1 2 2 GLN CB C 2 30.760 30.760 31.430 -0.670 17919 37407 1 92 . 1 1 2 2 GLN H H 2 8.900 8.900 8.277 0.623 17919 37408 1 92 . 1 1 3 3 ILE N N 3 115.340 115.340 116.445 -1.105 17919 37409 1 92 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.187 0.026 17919 37410 1 92 . 1 1 3 3 ILE C C 3 172.450 172.450 173.071 -0.621 17919 37411 1 92 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.322 0.248 17919 37412 1 92 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.329 0.881 17919 37413 1 92 . 1 1 3 3 ILE H H 3 8.320 8.320 7.872 0.448 17919 37414 1 92 . 1 1 4 4 PHE N N 4 118.110 118.110 118.429 -0.319 17919 37415 1 92 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.347 0.283 17919 37416 1 92 . 1 1 4 4 PHE C C 4 175.320 175.320 175.275 0.045 17919 37417 1 92 . 1 1 4 4 PHE CA C 4 55.210 55.210 56.101 -0.891 17919 37418 1 92 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.516 -0.035 17919 37419 1 92 . 1 1 4 4 PHE H H 4 8.610 8.610 8.228 0.382 17919 37420 1 92 . 1 1 5 5 VAL N N 5 121.000 121.000 121.945 -0.945 17919 37421 1 92 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.574 0.151 17919 37422 1 92 . 1 1 5 5 VAL C C 5 174.870 174.870 175.217 -0.347 17919 37423 1 92 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.042 -0.422 17919 37424 1 92 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.130 0.100 17919 37425 1 92 . 1 1 5 5 VAL H H 5 9.300 9.300 8.382 0.918 17919 37426 1 92 . 1 1 6 6 LYS N N 6 127.520 127.520 127.638 -0.118 17919 37427 1 92 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.004 0.363 17919 37428 1 92 . 1 1 6 6 LYS C C 6 177.140 177.140 176.445 0.695 17919 37429 1 92 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.692 -0.172 17919 37430 1 92 . 1 1 6 6 LYS CB C 6 35.050 35.050 33.827 1.223 17919 37431 1 92 . 1 1 6 6 LYS H H 6 8.820 8.820 8.558 0.262 17919 37432 1 92 . 1 1 7 7 THR N N 7 115.400 115.400 117.046 -1.646 17919 37433 1 92 . 1 1 7 7 THR HA H 7 4.970 4.970 4.227 0.743 17919 37434 1 92 . 1 1 7 7 THR C C 7 176.910 176.910 176.117 0.793 17919 37435 1 92 . 1 1 7 7 THR CA C 7 60.470 60.470 60.791 -0.320 17919 37436 1 92 . 1 1 7 7 THR CB C 7 70.630 70.630 69.608 1.022 17919 37437 1 92 . 1 1 7 7 THR H H 7 8.730 8.730 8.295 0.435 17919 37438 1 92 . 1 1 8 8 LEU N N 8 121.330 121.330 120.763 0.567 17919 37439 1 92 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.276 0.034 17919 37440 1 92 . 1 1 8 8 LEU C C 8 178.800 178.800 177.633 1.167 17919 37441 1 92 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.450 0.130 17919 37442 1 92 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.926 0.044 17919 37443 1 92 . 1 1 8 8 LEU H H 8 9.100 9.100 8.737 0.363 17919 37444 1 92 . 1 1 9 9 THR N N 9 105.590 105.590 107.698 -2.108 17919 37445 1 92 . 1 1 9 9 THR HA H 9 4.428 4.428 4.344 0.084 17919 37446 1 92 . 1 1 9 9 THR C C 9 175.520 175.520 175.529 -0.009 17919 37447 1 92 . 1 1 9 9 THR CA C 9 61.400 61.400 61.590 -0.190 17919 37448 1 92 . 1 1 9 9 THR CB C 9 69.140 69.140 68.989 0.151 17919 37449 1 92 . 1 1 9 9 THR H H 9 7.630 7.630 7.519 0.111 17919 37450 1 92 . 1 1 10 10 GLY N N 10 108.890 108.890 111.764 -2.874 17919 37451 1 92 . 1 1 10 10 GLY C C 10 174.070 174.070 173.552 0.518 17919 37452 1 92 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.865 0.595 17919 37453 1 92 . 1 1 10 10 GLY H H 10 7.810 7.810 7.824 -0.014 17919 37454 1 92 . 1 1 11 11 LYS N N 11 121.600 121.600 122.083 -0.483 17919 37455 1 92 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.311 0.050 17919 37456 1 92 . 1 1 11 11 LYS C C 11 175.940 175.940 175.941 -0.001 17919 37457 1 92 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.138 0.142 17919 37458 1 92 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.013 0.187 17919 37459 1 92 . 1 1 11 11 LYS H H 11 7.280 7.280 7.755 -0.475 17919 37460 1 92 . 1 1 12 12 THR N N 12 120.440 120.440 119.679 0.761 17919 37461 1 92 . 1 1 12 12 THR HA H 12 5.046 5.046 5.137 -0.091 17919 37462 1 92 . 1 1 12 12 THR C C 12 174.320 174.320 174.499 -0.179 17919 37463 1 92 . 1 1 12 12 THR CA C 12 62.390 62.390 61.237 1.153 17919 37464 1 92 . 1 1 12 12 THR CB C 12 69.910 69.910 70.064 -0.153 17919 37465 1 92 . 1 1 12 12 THR H H 12 8.650 8.650 8.270 0.380 17919 37466 1 92 . 1 1 13 13 ILE N N 13 127.110 127.110 118.921 8.189 17919 37467 1 92 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.477 0.067 17919 37468 1 92 . 1 1 13 13 ILE C C 13 175.220 175.220 173.958 1.262 17919 37469 1 92 . 1 1 13 13 ILE CA C 13 59.980 59.980 61.103 -1.123 17919 37470 1 92 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.579 -0.629 17919 37471 1 92 . 1 1 13 13 ILE H H 13 9.450 9.450 8.138 1.312 17919 37472 1 92 . 1 1 14 14 THR N N 14 121.520 121.520 121.335 0.185 17919 37473 1 92 . 1 1 14 14 THR HA H 14 4.964 4.964 4.868 0.096 17919 37474 1 92 . 1 1 14 14 THR C C 14 173.790 173.790 173.801 -0.011 17919 37475 1 92 . 1 1 14 14 THR CA C 14 61.940 61.940 62.162 -0.222 17919 37476 1 92 . 1 1 14 14 THR CB C 14 69.650 69.650 69.602 0.049 17919 37477 1 92 . 1 1 14 14 THR H H 14 8.710 8.710 8.473 0.237 17919 37478 1 92 . 1 1 15 15 LEU N N 15 124.800 124.800 127.306 -2.506 17919 37479 1 92 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.711 0.069 17919 37480 1 92 . 1 1 15 15 LEU C C 15 174.670 174.670 174.775 -0.105 17919 37481 1 92 . 1 1 15 15 LEU CA C 15 52.830 52.830 54.124 -1.294 17919 37482 1 92 . 1 1 15 15 LEU CB C 15 47.070 47.070 43.511 3.559 17919 37483 1 92 . 1 1 15 15 LEU H H 15 8.710 8.710 8.058 0.652 17919 37484 1 92 . 1 1 16 16 GLU N N 16 122.160 122.160 123.695 -1.535 17919 37485 1 92 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.013 -0.096 17919 37486 1 92 . 1 1 16 16 GLU C C 16 175.860 175.860 175.927 -0.067 17919 37487 1 92 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.295 -0.475 17919 37488 1 92 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.963 -1.513 17919 37489 1 92 . 1 1 16 16 GLU H H 16 8.140 8.140 8.520 -0.380 17919 37490 1 92 . 1 1 17 17 VAL N N 17 117.210 117.210 121.367 -4.157 17919 37491 1 92 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.793 -0.079 17919 37492 1 92 . 1 1 17 17 VAL C C 17 174.160 174.160 174.892 -0.732 17919 37493 1 92 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.386 -0.957 17919 37494 1 92 . 1 1 17 17 VAL CB C 17 36.400 36.400 34.659 1.741 17919 37495 1 92 . 1 1 17 17 VAL H H 17 8.900 8.900 7.868 1.032 17919 37496 1 92 . 1 1 18 18 GLU N N 18 118.990 118.990 121.570 -2.580 17919 37497 1 92 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.860 0.219 17919 37498 1 92 . 1 1 18 18 GLU C C 18 176.160 176.160 176.032 0.128 17919 37499 1 92 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.268 -0.548 17919 37500 1 92 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.200 0.110 17919 37501 1 92 . 1 1 18 18 GLU H H 18 8.640 8.640 8.486 0.154 17919 37502 1 92 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.288 -0.147 17919 37503 1 92 . 1 1 19 19 PRO C C 19 175.310 175.310 177.897 -2.587 17919 37504 1 92 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.817 -0.346 17919 37505 1 92 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.942 0.008 17919 37506 1 92 . 1 1 20 20 SER N N 20 103.400 103.400 109.173 -5.773 17919 37507 1 92 . 1 1 20 20 SER HA H 20 4.370 4.370 4.360 0.010 17919 37508 1 92 . 1 1 20 20 SER C C 20 174.660 174.660 174.489 0.171 17919 37509 1 92 . 1 1 20 20 SER CA C 20 57.400 57.400 58.371 -0.971 17919 37510 1 92 . 1 1 20 20 SER CB C 20 63.370 63.370 62.460 0.910 17919 37511 1 92 . 1 1 20 20 SER H H 20 7.040 7.040 7.979 -0.939 17919 37512 1 92 . 1 1 21 21 ASP N N 21 123.480 123.480 125.216 -1.736 17919 37513 1 92 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.485 0.210 17919 37514 1 92 . 1 1 21 21 ASP C C 21 176.360 176.360 175.930 0.430 17919 37515 1 92 . 1 1 21 21 ASP CA C 21 55.700 55.700 56.113 -0.413 17919 37516 1 92 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.559 -0.759 17919 37517 1 92 . 1 1 21 21 ASP H H 21 8.030 8.030 7.842 0.188 17919 37518 1 92 . 1 1 22 22 THR N N 22 108.800 108.800 115.739 -6.939 17919 37519 1 92 . 1 1 22 22 THR HA H 22 4.920 4.920 4.587 0.333 17919 37520 1 92 . 1 1 22 22 THR C C 22 176.750 176.750 175.966 0.784 17919 37521 1 92 . 1 1 22 22 THR CA C 22 59.690 59.690 61.927 -2.237 17919 37522 1 92 . 1 1 22 22 THR CB C 22 71.200 71.200 69.897 1.303 17919 37523 1 92 . 1 1 22 22 THR H H 22 7.900 7.900 8.239 -0.339 17919 37524 1 92 . 1 1 23 23 ILE N N 23 121.190 121.190 122.773 -1.583 17919 37525 1 92 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.754 -0.097 17919 37526 1 92 . 1 1 23 23 ILE C C 23 179.040 179.040 177.839 1.201 17919 37527 1 92 . 1 1 23 23 ILE CA C 23 62.260 62.260 61.593 0.667 17919 37528 1 92 . 1 1 23 23 ILE CB C 23 34.350 34.350 35.874 -1.524 17919 37529 1 92 . 1 1 23 23 ILE H H 23 8.560 8.560 9.076 -0.516 17919 37530 1 92 . 1 1 24 24 GLU N N 24 120.830 120.830 120.706 0.124 17919 37531 1 92 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.876 0.041 17919 37532 1 92 . 1 1 24 24 GLU C C 24 178.640 178.640 178.375 0.265 17919 37533 1 92 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.093 0.127 17919 37534 1 92 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.326 -1.046 17919 37535 1 92 . 1 1 24 24 GLU H H 24 9.760 9.760 8.056 1.704 17919 37536 1 92 . 1 1 25 25 ASN N N 25 120.570 120.570 117.873 2.697 17919 37537 1 92 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.424 0.101 17919 37538 1 92 . 1 1 25 25 ASN C C 25 178.380 178.380 177.990 0.390 17919 37539 1 92 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.258 -0.198 17919 37540 1 92 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.641 -0.191 17919 37541 1 92 . 1 1 25 25 ASN H H 25 7.920 7.920 7.591 0.329 17919 37542 1 92 . 1 1 26 26 VAL N N 26 121.710 121.710 120.035 1.675 17919 37543 1 92 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.551 -0.154 17919 37544 1 92 . 1 1 26 26 VAL C C 26 177.950 177.950 177.939 0.011 17919 37545 1 92 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.539 1.121 17919 37546 1 92 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.022 -0.182 17919 37547 1 92 . 1 1 26 26 VAL H H 26 8.070 8.070 8.395 -0.325 17919 37548 1 92 . 1 1 27 27 LYS N N 27 118.860 118.860 119.577 -0.717 17919 37549 1 92 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.160 0.420 17919 37550 1 92 . 1 1 27 27 LYS C C 27 180.550 180.550 179.132 1.418 17919 37551 1 92 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.432 -0.182 17919 37552 1 92 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.119 1.611 17919 37553 1 92 . 1 1 27 27 LYS H H 27 8.560 8.560 7.988 0.572 17919 37554 1 92 . 1 1 28 28 ALA N N 28 123.440 123.440 120.867 2.573 17919 37555 1 92 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.142 0.018 17919 37556 1 92 . 1 1 28 28 ALA C C 28 180.300 180.300 178.761 1.539 17919 37557 1 92 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.589 0.781 17919 37558 1 92 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.464 -0.754 17919 37559 1 92 . 1 1 28 28 ALA H H 28 8.060 8.060 8.043 0.017 17919 37560 1 92 . 1 1 29 29 LYS N N 29 119.940 119.940 119.980 -0.040 17919 37561 1 92 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.029 0.178 17919 37562 1 92 . 1 1 29 29 LYS C C 29 180.320 180.320 179.080 1.240 17919 37563 1 92 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.205 0.445 17919 37564 1 92 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.322 0.968 17919 37565 1 92 . 1 1 29 29 LYS H H 29 7.850 7.850 7.445 0.405 17919 37566 1 92 . 1 1 30 30 ILE N N 30 121.080 121.080 120.133 0.947 17919 37567 1 92 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.559 -0.052 17919 37568 1 92 . 1 1 30 30 ILE C C 30 178.310 178.310 177.567 0.743 17919 37569 1 92 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.283 0.867 17919 37570 1 92 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.158 -0.358 17919 37571 1 92 . 1 1 30 30 ILE H H 30 8.280 8.280 8.554 -0.274 17919 37572 1 92 . 1 1 31 31 GLN N N 31 123.490 123.490 118.878 4.612 17919 37573 1 92 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.928 -0.099 17919 37574 1 92 . 1 1 31 31 GLN C C 31 178.890 178.890 178.617 0.273 17919 37575 1 92 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.132 0.868 17919 37576 1 92 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.297 -0.577 17919 37577 1 92 . 1 1 31 31 GLN H H 31 8.580 8.580 7.843 0.737 17919 37578 1 92 . 1 1 32 32 ASP N N 32 119.360 119.360 119.884 -0.524 17919 37579 1 92 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.456 -0.102 17919 37580 1 92 . 1 1 32 32 ASP C C 32 177.250 177.250 177.665 -0.415 17919 37581 1 92 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.762 0.428 17919 37582 1 92 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.784 -0.204 17919 37583 1 92 . 1 1 32 32 ASP H H 32 8.010 8.010 7.998 0.012 17919 37584 1 92 . 1 1 33 33 LYS N N 33 115.130 115.130 117.565 -2.435 17919 37585 1 92 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.342 -0.005 17919 37586 1 92 . 1 1 33 33 LYS C C 33 177.870 177.870 177.931 -0.061 17919 37587 1 92 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.178 -0.128 17919 37588 1 92 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.680 0.490 17919 37589 1 92 . 1 1 33 33 LYS H H 33 7.430 7.430 7.554 -0.124 17919 37590 1 92 . 1 1 34 34 GLU N N 34 113.870 113.870 114.242 -0.372 17919 37591 1 92 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.484 0.141 17919 37592 1 92 . 1 1 34 34 GLU C C 34 177.840 177.840 177.037 0.803 17919 37593 1 92 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.576 -0.406 17919 37594 1 92 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.448 1.212 17919 37595 1 92 . 1 1 34 34 GLU H H 34 8.740 8.740 7.714 1.026 17919 37596 1 92 . 1 1 35 35 GLY N N 35 108.650 108.650 110.303 -1.653 17919 37597 1 92 . 1 1 35 35 GLY C C 35 173.960 173.960 174.538 -0.578 17919 37598 1 92 . 1 1 35 35 GLY CA C 35 46.080 46.080 46.112 -0.032 17919 37599 1 92 . 1 1 35 35 GLY H H 35 8.530 8.530 8.106 0.424 17919 37600 1 92 . 1 1 36 36 ILE N N 36 119.880 119.880 120.821 -0.941 17919 37601 1 92 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.181 0.264 17919 37602 1 92 . 1 1 36 36 ILE C C 36 173.590 173.590 174.014 -0.424 17919 37603 1 92 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.315 -0.565 17919 37604 1 92 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.201 2.379 17919 37605 1 92 . 1 1 36 36 ILE H H 36 6.150 6.150 7.677 -1.527 17919 37606 1 92 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.610 0.024 17919 37607 1 92 . 1 1 37 37 PRO C C 37 176.940 176.940 176.366 0.574 17919 37608 1 92 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.875 -0.215 17919 37609 1 92 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.685 0.165 17919 37610 1 92 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.269 -0.152 17919 37611 1 92 . 1 1 38 38 PRO C C 38 178.320 178.320 177.869 0.451 17919 37612 1 92 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.325 0.935 17919 37613 1 92 . 1 1 38 38 PRO CB C 38 32.890 32.890 32.094 0.796 17919 37614 1 92 . 1 1 39 39 ASP N N 39 113.380 113.380 116.780 -3.400 17919 37615 1 92 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.479 -0.049 17919 37616 1 92 . 1 1 39 39 ASP C C 39 177.090 177.090 177.063 0.027 17919 37617 1 92 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.410 -0.770 17919 37618 1 92 . 1 1 39 39 ASP CB C 39 39.540 39.540 41.011 -1.471 17919 37619 1 92 . 1 1 39 39 ASP H H 39 8.550 8.550 8.548 0.002 17919 37620 1 92 . 1 1 40 40 GLN N N 40 116.780 116.780 116.151 0.629 17919 37621 1 92 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.405 0.059 17919 37622 1 92 . 1 1 40 40 GLN C C 40 175.380 175.380 175.618 -0.238 17919 37623 1 92 . 1 1 40 40 GLN CA C 40 55.640 55.640 54.879 0.761 17919 37624 1 92 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.440 0.700 17919 37625 1 92 . 1 1 40 40 GLN H H 40 7.820 7.820 7.511 0.309 17919 37626 1 92 . 1 1 41 41 GLN N N 41 117.720 117.720 119.944 -2.224 17919 37627 1 92 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.268 -0.024 17919 37628 1 92 . 1 1 41 41 GLN C C 41 176.300 176.300 175.335 0.965 17919 37629 1 92 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.544 -0.074 17919 37630 1 92 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.125 2.525 17919 37631 1 92 . 1 1 41 41 GLN H H 41 7.480 7.480 7.312 0.168 17919 37632 1 92 . 1 1 42 42 ARG N N 42 122.680 122.680 125.989 -3.309 17919 37633 1 92 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.491 0.009 17919 37634 1 92 . 1 1 42 42 ARG C C 42 174.050 174.050 174.427 -0.377 17919 37635 1 92 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.390 -0.340 17919 37636 1 92 . 1 1 42 42 ARG CB C 42 31.750 31.750 31.664 0.086 17919 37637 1 92 . 1 1 42 42 ARG H H 42 8.530 8.530 8.240 0.290 17919 37638 1 92 . 1 1 43 43 LEU N N 43 124.040 124.040 127.883 -3.843 17919 37639 1 92 . 1 1 43 43 LEU C C 43 175.290 175.290 175.812 -0.522 17919 37640 1 92 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.090 -1.110 17919 37641 1 92 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.567 2.223 17919 37642 1 92 . 1 1 43 43 LEU H H 43 8.820 8.820 8.806 0.014 17919 37643 1 92 . 1 1 44 44 ILE N N 44 121.920 121.920 123.729 -1.809 17919 37644 1 92 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.121 -0.129 17919 37645 1 92 . 1 1 44 44 ILE C C 44 176.060 176.060 174.417 1.643 17919 37646 1 92 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.840 -0.860 17919 37647 1 92 . 1 1 44 44 ILE CB C 44 41.420 41.420 42.694 -1.274 17919 37648 1 92 . 1 1 44 44 ILE H H 44 9.030 9.030 9.189 -0.159 17919 37649 1 92 . 1 1 45 45 PHE N N 45 125.390 125.390 125.159 0.231 17919 37650 1 92 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.970 0.075 17919 37651 1 92 . 1 1 45 45 PHE C C 45 174.470 174.470 174.398 0.072 17919 37652 1 92 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.787 0.233 17919 37653 1 92 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.163 1.597 17919 37654 1 92 . 1 1 45 45 PHE H H 45 8.830 8.830 9.050 -0.220 17919 37655 1 92 . 1 1 46 46 ALA N N 46 132.200 132.200 131.150 1.050 17919 37656 1 92 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.759 -0.069 17919 37657 1 92 . 1 1 46 46 ALA C C 46 177.290 177.290 177.308 -0.018 17919 37658 1 92 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.739 -0.199 17919 37659 1 92 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.286 0.284 17919 37660 1 92 . 1 1 46 46 ALA H H 46 8.810 8.810 9.059 -0.249 17919 37661 1 92 . 1 1 47 47 GLY N N 47 102.340 102.340 104.248 -1.908 17919 37662 1 92 . 1 1 47 47 GLY C C 47 173.810 173.810 174.002 -0.192 17919 37663 1 92 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.112 0.238 17919 37664 1 92 . 1 1 47 47 GLY H H 47 8.130 8.130 8.470 -0.340 17919 37665 1 92 . 1 1 48 48 LYS N N 48 121.570 121.570 121.006 0.564 17919 37666 1 92 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.540 0.082 17919 37667 1 92 . 1 1 48 48 LYS C C 48 174.700 174.700 175.403 -0.703 17919 37668 1 92 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.563 -0.013 17919 37669 1 92 . 1 1 48 48 LYS CB C 48 34.530 34.530 33.852 0.678 17919 37670 1 92 . 1 1 48 48 LYS H H 48 7.980 7.980 7.927 0.053 17919 37671 1 92 . 1 1 49 49 GLN N N 49 122.410 122.410 126.051 -3.641 17919 37672 1 92 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.294 0.266 17919 37673 1 92 . 1 1 49 49 GLN C C 49 175.670 175.670 175.357 0.313 17919 37674 1 92 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.382 -0.641 17919 37675 1 92 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.288 -0.288 17919 37676 1 92 . 1 1 49 49 GLN H H 49 8.600 8.600 8.710 -0.110 17919 37677 1 92 . 1 1 50 50 LEU N N 50 125.520 125.520 128.401 -2.881 17919 37678 1 92 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.131 -0.041 17919 37679 1 92 . 1 1 50 50 LEU C C 50 176.660 176.660 175.893 0.767 17919 37680 1 92 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.044 0.196 17919 37681 1 92 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.414 -0.844 17919 37682 1 92 . 1 1 50 50 LEU H H 50 8.530 8.530 8.773 -0.243 17919 37683 1 92 . 1 1 51 51 GLU N N 51 122.940 122.940 123.725 -0.785 17919 37684 1 92 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.496 -0.008 17919 37685 1 92 . 1 1 51 51 GLU C C 51 175.870 175.870 176.639 -0.769 17919 37686 1 92 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.224 0.736 17919 37687 1 92 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.926 -0.356 17919 37688 1 92 . 1 1 51 51 GLU H H 51 8.400 8.400 8.076 0.324 17919 37689 1 92 . 1 1 52 52 ASP N N 52 120.030 120.030 125.896 -5.866 17919 37690 1 92 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.499 -0.140 17919 37691 1 92 . 1 1 52 52 ASP C C 52 177.330 177.330 177.680 -0.350 17919 37692 1 92 . 1 1 52 52 ASP CA C 52 56.960 56.960 56.727 0.233 17919 37693 1 92 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.788 0.061 17919 37694 1 92 . 1 1 52 52 ASP H H 52 8.160 8.160 8.819 -0.659 17919 37695 1 92 . 1 1 53 53 GLY N N 53 106.660 106.660 105.552 1.108 17919 37696 1 92 . 1 1 53 53 GLY C C 53 174.870 174.870 174.328 0.542 17919 37697 1 92 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.991 0.179 17919 37698 1 92 . 1 1 53 53 GLY H H 53 9.390 9.390 8.361 1.029 17919 37699 1 92 . 1 1 54 54 ARG N N 54 119.050 119.050 120.103 -1.053 17919 37700 1 92 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.737 -0.042 17919 37701 1 92 . 1 1 54 54 ARG C C 54 175.350 175.350 174.932 0.418 17919 37702 1 92 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.105 0.285 17919 37703 1 92 . 1 1 54 54 ARG CB C 54 32.650 32.650 34.253 -1.603 17919 37704 1 92 . 1 1 54 54 ARG H H 54 7.460 7.460 7.602 -0.142 17919 37705 1 92 . 1 1 55 55 THR N N 55 108.400 108.400 112.536 -4.136 17919 37706 1 92 . 1 1 55 55 THR HA H 55 5.240 5.240 4.979 0.261 17919 37707 1 92 . 1 1 55 55 THR C C 55 176.560 176.560 175.977 0.583 17919 37708 1 92 . 1 1 55 55 THR CA C 55 59.690 59.690 60.559 -0.869 17919 37709 1 92 . 1 1 55 55 THR CB C 55 72.260 72.260 70.661 1.599 17919 37710 1 92 . 1 1 55 55 THR H H 55 8.730 8.730 9.091 -0.361 17919 37711 1 92 . 1 1 56 56 LEU N N 56 117.920 117.920 121.601 -3.681 17919 37712 1 92 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.014 0.046 17919 37713 1 92 . 1 1 56 56 LEU C C 56 180.810 180.810 178.813 1.997 17919 37714 1 92 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.419 0.291 17919 37715 1 92 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.548 -1.178 17919 37716 1 92 . 1 1 56 56 LEU H H 56 8.140 8.140 8.095 0.045 17919 37717 1 92 . 1 1 57 57 SER N N 57 113.330 113.330 114.919 -1.589 17919 37718 1 92 . 1 1 57 57 SER HA H 57 4.370 4.370 4.038 0.332 17919 37719 1 92 . 1 1 57 57 SER C C 57 178.310 178.310 176.814 1.496 17919 37720 1 92 . 1 1 57 57 SER CA C 57 61.080 61.080 62.106 -1.026 17919 37721 1 92 . 1 1 57 57 SER CB C 57 62.530 62.530 62.530 0.000 17919 37722 1 92 . 1 1 57 57 SER H H 57 8.470 8.470 8.017 0.453 17919 37723 1 92 . 1 1 58 58 ASP N N 58 124.190 124.190 121.033 3.157 17919 37724 1 92 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.346 -0.050 17919 37725 1 92 . 1 1 58 58 ASP C C 58 177.400 177.400 176.755 0.645 17919 37726 1 92 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.272 0.908 17919 37727 1 92 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.477 -0.377 17919 37728 1 92 . 1 1 58 58 ASP H H 58 7.930 7.930 7.914 0.016 17919 37729 1 92 . 1 1 59 59 TYR N N 59 115.510 115.510 114.926 0.584 17919 37730 1 92 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.646 0.024 17919 37731 1 92 . 1 1 59 59 TYR C C 59 174.700 174.700 175.433 -0.733 17919 37732 1 92 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.435 0.814 17919 37733 1 92 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.767 1.303 17919 37734 1 92 . 1 1 59 59 TYR H H 59 7.250 7.250 7.354 -0.104 17919 37735 1 92 . 1 1 60 60 ASN N N 60 115.900 115.900 117.857 -1.957 17919 37736 1 92 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.432 -0.077 17919 37737 1 92 . 1 1 60 60 ASN C C 60 174.340 174.340 174.300 0.040 17919 37738 1 92 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.141 -0.021 17919 37739 1 92 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.033 0.377 17919 37740 1 92 . 1 1 60 60 ASN H H 60 8.150 8.150 8.109 0.041 17919 37741 1 92 . 1 1 61 61 ILE N N 61 118.600 118.600 119.986 -1.386 17919 37742 1 92 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.642 -0.249 17919 37743 1 92 . 1 1 61 61 ILE C C 61 174.610 174.610 175.050 -0.440 17919 37744 1 92 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.671 0.749 17919 37745 1 92 . 1 1 61 61 ILE CB C 61 36.740 36.740 36.771 -0.031 17919 37746 1 92 . 1 1 61 61 ILE H H 61 7.250 7.250 8.017 -0.767 17919 37747 1 92 . 1 1 62 62 GLN N N 62 124.740 124.740 126.425 -1.685 17919 37748 1 92 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.515 -0.009 17919 37749 1 92 . 1 1 62 62 GLN C C 62 175.970 175.970 176.451 -0.481 17919 37750 1 92 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.407 0.253 17919 37751 1 92 . 1 1 62 62 GLN CB C 62 31.650 31.650 30.627 1.023 17919 37752 1 92 . 1 1 62 62 GLN H H 62 7.610 7.610 8.300 -0.690 17919 37753 1 92 . 1 1 63 63 LYS N N 63 120.300 120.300 121.292 -0.992 17919 37754 1 92 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.817 0.184 17919 37755 1 92 . 1 1 63 63 LYS C C 63 175.810 175.810 177.527 -1.717 17919 37756 1 92 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.426 -0.636 17919 37757 1 92 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.199 0.451 17919 37758 1 92 . 1 1 63 63 LYS H H 63 8.490 8.490 8.801 -0.311 17919 37759 1 92 . 1 1 64 64 GLU N N 64 113.950 113.950 120.417 -6.467 17919 37760 1 92 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.825 -0.360 17919 37761 1 92 . 1 1 64 64 GLU C C 64 175.250 175.250 175.215 0.035 17919 37762 1 92 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.824 0.066 17919 37763 1 92 . 1 1 64 64 GLU CB C 64 25.900 25.900 27.864 -1.964 17919 37764 1 92 . 1 1 64 64 GLU H H 64 9.280 9.280 8.841 0.439 17919 37765 1 92 . 1 1 65 65 SER N N 65 114.730 114.730 116.185 -1.455 17919 37766 1 92 . 1 1 65 65 SER HA H 65 4.640 4.640 4.429 0.211 17919 37767 1 92 . 1 1 65 65 SER C C 65 172.160 172.160 174.581 -2.421 17919 37768 1 92 . 1 1 65 65 SER CA C 65 60.890 60.890 59.913 0.977 17919 37769 1 92 . 1 1 65 65 SER CB C 65 64.910 64.910 63.236 1.673 17919 37770 1 92 . 1 1 65 65 SER H H 65 7.670 7.670 7.852 -0.182 17919 37771 1 92 . 1 1 66 66 THR N N 66 117.110 117.110 121.361 -4.251 17919 37772 1 92 . 1 1 66 66 THR HA H 66 5.270 5.270 4.586 0.684 17919 37773 1 92 . 1 1 66 66 THR C C 66 173.950 173.950 174.272 -0.322 17919 37774 1 92 . 1 1 66 66 THR CA C 66 62.340 62.340 62.917 -0.577 17919 37775 1 92 . 1 1 66 66 THR CB C 66 70.080 70.080 69.921 0.159 17919 37776 1 92 . 1 1 66 66 THR H H 66 8.730 8.730 8.210 0.520 17919 37777 1 92 . 1 1 67 67 LEU N N 67 127.110 127.110 126.487 0.623 17919 37778 1 92 . 1 1 67 67 LEU HA H 67 5.060 5.060 5.114 -0.054 17919 37779 1 92 . 1 1 67 67 LEU C C 67 175.770 175.770 175.585 0.185 17919 37780 1 92 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.468 0.432 17919 37781 1 92 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.651 -0.391 17919 37782 1 92 . 1 1 67 67 LEU H H 67 9.410 9.410 9.079 0.331 17919 37783 1 92 . 1 1 68 68 HIS N N 68 118.380 118.380 119.214 -0.834 17919 37784 1 92 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.447 -0.206 17919 37785 1 92 . 1 1 68 68 HIS C C 68 173.150 173.150 173.311 -0.161 17919 37786 1 92 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.750 0.250 17919 37787 1 92 . 1 1 68 68 HIS CB C 68 30.530 30.530 34.617 -4.087 17919 37788 1 92 . 1 1 68 68 HIS H H 68 9.230 9.230 9.061 0.169 17919 37789 1 92 . 1 1 69 69 LEU N N 69 124.460 124.460 123.757 0.703 17919 37790 1 92 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.243 -0.053 17919 37791 1 92 . 1 1 69 69 LEU C C 69 175.270 175.270 173.963 1.307 17919 37792 1 92 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.245 -0.355 17919 37793 1 92 . 1 1 69 69 LEU CB C 69 44.380 44.380 45.261 -0.881 17919 37794 1 92 . 1 1 69 69 LEU H H 69 8.340 8.340 7.188 1.152 17919 37795 1 92 . 1 1 70 70 VAL N N 70 126.940 126.940 123.161 3.779 17919 37796 1 92 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.479 -0.129 17919 37797 1 92 . 1 1 70 70 VAL C C 70 174.000 174.000 174.685 -0.685 17919 37798 1 92 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.579 1.221 17919 37799 1 92 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.072 -0.162 17919 37800 1 92 . 1 1 70 70 VAL H H 70 9.200 9.200 8.214 0.986 17919 37801 1 92 . 1 1 71 71 LEU N N 71 123.130 123.130 121.337 1.793 17919 37802 1 92 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.138 -0.078 17919 37803 1 92 . 1 1 71 71 LEU C C 71 177.830 177.830 177.556 0.274 17919 37804 1 92 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.108 0.832 17919 37805 1 92 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.233 -0.383 17919 37806 1 92 . 1 1 71 71 LEU H H 71 8.120 8.120 8.127 -0.007 17919 37807 1 92 . 1 1 72 72 ARG N N 72 123.490 123.490 122.346 1.144 17919 37808 1 92 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.251 0.050 17919 37809 1 92 . 1 1 72 72 ARG C C 72 175.350 175.350 176.242 -0.892 17919 37810 1 92 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.917 -1.307 17919 37811 1 92 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.874 0.476 17919 37812 1 92 . 1 1 72 72 ARG H H 72 8.580 8.580 7.946 0.634 17919 37813 1 93 . 1 1 2 2 GLN N N 2 123.220 123.220 124.023 -0.803 17919 37814 1 93 . 1 1 2 2 GLN HA H 2 5.249 5.249 4.836 0.413 17919 37815 1 93 . 1 1 2 2 GLN C C 2 175.920 175.920 174.287 1.633 17919 37816 1 93 . 1 1 2 2 GLN CA C 2 55.080 55.080 55.020 0.060 17919 37817 1 93 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.605 0.155 17919 37818 1 93 . 1 1 2 2 GLN H H 2 8.900 8.900 8.515 0.385 17919 37819 1 93 . 1 1 3 3 ILE N N 3 115.340 115.340 118.430 -3.090 17919 37820 1 93 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.644 -0.431 17919 37821 1 93 . 1 1 3 3 ILE C C 3 172.450 172.450 173.689 -1.239 17919 37822 1 93 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.453 0.117 17919 37823 1 93 . 1 1 3 3 ILE CB C 3 42.210 42.210 40.998 1.212 17919 37824 1 93 . 1 1 3 3 ILE H H 3 8.320 8.320 7.613 0.707 17919 37825 1 93 . 1 1 4 4 PHE N N 4 118.110 118.110 123.848 -5.738 17919 37826 1 93 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.189 0.441 17919 37827 1 93 . 1 1 4 4 PHE C C 4 175.320 175.320 175.084 0.236 17919 37828 1 93 . 1 1 4 4 PHE CA C 4 55.210 55.210 54.907 0.303 17919 37829 1 93 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.537 -0.057 17919 37830 1 93 . 1 1 4 4 PHE H H 4 8.610 8.610 9.167 -0.557 17919 37831 1 93 . 1 1 5 5 VAL N N 5 121.000 121.000 121.841 -0.841 17919 37832 1 93 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.647 0.078 17919 37833 1 93 . 1 1 5 5 VAL C C 5 174.870 174.870 175.046 -0.176 17919 37834 1 93 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.409 -0.789 17919 37835 1 93 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.633 0.597 17919 37836 1 93 . 1 1 5 5 VAL H H 5 9.300 9.300 8.432 0.868 17919 37837 1 93 . 1 1 6 6 LYS N N 6 127.520 127.520 128.095 -0.575 17919 37838 1 93 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.470 -0.103 17919 37839 1 93 . 1 1 6 6 LYS C C 6 177.140 177.140 176.456 0.684 17919 37840 1 93 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.673 -0.153 17919 37841 1 93 . 1 1 6 6 LYS CB C 6 35.050 35.050 36.170 -1.120 17919 37842 1 93 . 1 1 6 6 LYS H H 6 8.820 8.820 8.779 0.041 17919 37843 1 93 . 1 1 7 7 THR N N 7 115.400 115.400 112.310 3.090 17919 37844 1 93 . 1 1 7 7 THR HA H 7 4.970 4.970 4.846 0.124 17919 37845 1 93 . 1 1 7 7 THR C C 7 176.910 176.910 175.823 1.087 17919 37846 1 93 . 1 1 7 7 THR CA C 7 60.470 60.470 59.973 0.497 17919 37847 1 93 . 1 1 7 7 THR CB C 7 70.630 70.630 71.286 -0.656 17919 37848 1 93 . 1 1 7 7 THR H H 7 8.730 8.730 8.599 0.131 17919 37849 1 93 . 1 1 8 8 LEU N N 8 121.330 121.330 121.496 -0.166 17919 37850 1 93 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.525 -0.215 17919 37851 1 93 . 1 1 8 8 LEU C C 8 178.800 178.800 177.819 0.981 17919 37852 1 93 . 1 1 8 8 LEU CA C 8 57.580 57.580 56.474 1.106 17919 37853 1 93 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.090 -0.120 17919 37854 1 93 . 1 1 8 8 LEU H H 8 9.100 9.100 9.012 0.088 17919 37855 1 93 . 1 1 9 9 THR N N 9 105.590 105.590 109.589 -3.999 17919 37856 1 93 . 1 1 9 9 THR HA H 9 4.428 4.428 4.424 0.004 17919 37857 1 93 . 1 1 9 9 THR C C 9 175.520 175.520 175.744 -0.224 17919 37858 1 93 . 1 1 9 9 THR CA C 9 61.400 61.400 61.345 0.055 17919 37859 1 93 . 1 1 9 9 THR CB C 9 69.140 69.140 70.357 -1.217 17919 37860 1 93 . 1 1 9 9 THR H H 9 7.630 7.630 7.615 0.015 17919 37861 1 93 . 1 1 10 10 GLY N N 10 108.890 108.890 111.281 -2.391 17919 37862 1 93 . 1 1 10 10 GLY C C 10 174.070 174.070 174.518 -0.448 17919 37863 1 93 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.315 0.145 17919 37864 1 93 . 1 1 10 10 GLY H H 10 7.810 7.810 8.034 -0.224 17919 37865 1 93 . 1 1 11 11 LYS N N 11 121.600 121.600 121.504 0.096 17919 37866 1 93 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.559 -0.198 17919 37867 1 93 . 1 1 11 11 LYS C C 11 175.940 175.940 175.608 0.332 17919 37868 1 93 . 1 1 11 11 LYS CA C 11 56.280 56.280 54.908 1.372 17919 37869 1 93 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.272 -0.072 17919 37870 1 93 . 1 1 11 11 LYS H H 11 7.280 7.280 7.848 -0.568 17919 37871 1 93 . 1 1 12 12 THR N N 12 120.440 120.440 116.499 3.941 17919 37872 1 93 . 1 1 12 12 THR HA H 12 5.046 5.046 4.565 0.481 17919 37873 1 93 . 1 1 12 12 THR C C 12 174.320 174.320 174.352 -0.032 17919 37874 1 93 . 1 1 12 12 THR CA C 12 62.390 62.390 61.438 0.952 17919 37875 1 93 . 1 1 12 12 THR CB C 12 69.910 69.910 69.591 0.319 17919 37876 1 93 . 1 1 12 12 THR H H 12 8.650 8.650 8.317 0.333 17919 37877 1 93 . 1 1 13 13 ILE N N 13 127.110 127.110 127.219 -0.109 17919 37878 1 93 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.394 0.150 17919 37879 1 93 . 1 1 13 13 ILE C C 13 175.220 175.220 176.021 -0.801 17919 37880 1 93 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.751 -0.770 17919 37881 1 93 . 1 1 13 13 ILE CB C 13 40.950 40.950 39.400 1.550 17919 37882 1 93 . 1 1 13 13 ILE H H 13 9.450 9.450 8.737 0.713 17919 37883 1 93 . 1 1 14 14 THR N N 14 121.520 121.520 121.381 0.139 17919 37884 1 93 . 1 1 14 14 THR HA H 14 4.964 4.964 4.977 -0.013 17919 37885 1 93 . 1 1 14 14 THR C C 14 173.790 173.790 174.047 -0.257 17919 37886 1 93 . 1 1 14 14 THR CA C 14 61.940 61.940 61.771 0.169 17919 37887 1 93 . 1 1 14 14 THR CB C 14 69.650 69.650 70.221 -0.571 17919 37888 1 93 . 1 1 14 14 THR H H 14 8.710 8.710 8.219 0.491 17919 37889 1 93 . 1 1 15 15 LEU N N 15 124.800 124.800 126.812 -2.012 17919 37890 1 93 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.656 0.124 17919 37891 1 93 . 1 1 15 15 LEU C C 15 174.670 174.670 175.625 -0.955 17919 37892 1 93 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.736 -0.906 17919 37893 1 93 . 1 1 15 15 LEU CB C 15 47.070 47.070 44.331 2.739 17919 37894 1 93 . 1 1 15 15 LEU H H 15 8.710 8.710 8.286 0.424 17919 37895 1 93 . 1 1 16 16 GLU N N 16 122.160 122.160 121.531 0.629 17919 37896 1 93 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.665 0.252 17919 37897 1 93 . 1 1 16 16 GLU C C 16 175.860 175.860 175.997 -0.137 17919 37898 1 93 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.352 -0.532 17919 37899 1 93 . 1 1 16 16 GLU CB C 16 29.450 29.450 31.028 -1.578 17919 37900 1 93 . 1 1 16 16 GLU H H 16 8.140 8.140 8.532 -0.392 17919 37901 1 93 . 1 1 17 17 VAL N N 17 117.210 117.210 119.583 -2.373 17919 37902 1 93 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.795 -0.081 17919 37903 1 93 . 1 1 17 17 VAL C C 17 174.160 174.160 175.134 -0.974 17919 37904 1 93 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.308 -0.878 17919 37905 1 93 . 1 1 17 17 VAL CB C 17 36.400 36.400 34.715 1.685 17919 37906 1 93 . 1 1 17 17 VAL H H 17 8.900 8.900 7.779 1.121 17919 37907 1 93 . 1 1 18 18 GLU N N 18 118.990 118.990 121.180 -2.190 17919 37908 1 93 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.867 0.212 17919 37909 1 93 . 1 1 18 18 GLU C C 18 176.160 176.160 175.717 0.443 17919 37910 1 93 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.014 -0.294 17919 37911 1 93 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.586 -0.276 17919 37912 1 93 . 1 1 18 18 GLU H H 18 8.640 8.640 8.597 0.043 17919 37913 1 93 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.227 -0.086 17919 37914 1 93 . 1 1 19 19 PRO C C 19 175.310 175.310 177.683 -2.373 17919 37915 1 93 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.475 -0.005 17919 37916 1 93 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.946 0.004 17919 37917 1 93 . 1 1 20 20 SER N N 20 103.400 103.400 110.360 -6.960 17919 37918 1 93 . 1 1 20 20 SER HA H 20 4.370 4.370 4.218 0.152 17919 37919 1 93 . 1 1 20 20 SER C C 20 174.660 174.660 173.504 1.156 17919 37920 1 93 . 1 1 20 20 SER CA C 20 57.400 57.400 58.703 -1.302 17919 37921 1 93 . 1 1 20 20 SER CB C 20 63.370 63.370 62.542 0.828 17919 37922 1 93 . 1 1 20 20 SER H H 20 7.040 7.040 8.060 -1.020 17919 37923 1 93 . 1 1 21 21 ASP N N 21 123.480 123.480 122.583 0.897 17919 37924 1 93 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.744 -0.049 17919 37925 1 93 . 1 1 21 21 ASP C C 21 176.360 176.360 175.176 1.184 17919 37926 1 93 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.379 1.321 17919 37927 1 93 . 1 1 21 21 ASP CB C 21 40.800 40.800 42.562 -1.762 17919 37928 1 93 . 1 1 21 21 ASP H H 21 8.030 8.030 7.467 0.563 17919 37929 1 93 . 1 1 22 22 THR N N 22 108.800 108.800 113.749 -4.949 17919 37930 1 93 . 1 1 22 22 THR HA H 22 4.920 4.920 4.465 0.455 17919 37931 1 93 . 1 1 22 22 THR C C 22 176.750 176.750 175.738 1.012 17919 37932 1 93 . 1 1 22 22 THR CA C 22 59.690 59.690 60.863 -1.173 17919 37933 1 93 . 1 1 22 22 THR CB C 22 71.200 71.200 70.508 0.692 17919 37934 1 93 . 1 1 22 22 THR H H 22 7.900 7.900 8.389 -0.489 17919 37935 1 93 . 1 1 23 23 ILE N N 23 121.190 121.190 124.561 -3.371 17919 37936 1 93 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.707 -0.050 17919 37937 1 93 . 1 1 23 23 ILE C C 23 179.040 179.040 177.334 1.706 17919 37938 1 93 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.532 -0.272 17919 37939 1 93 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.681 -2.331 17919 37940 1 93 . 1 1 23 23 ILE H H 23 8.560 8.560 8.605 -0.045 17919 37941 1 93 . 1 1 24 24 GLU N N 24 120.830 120.830 119.928 0.902 17919 37942 1 93 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.864 0.053 17919 37943 1 93 . 1 1 24 24 GLU C C 24 178.640 178.640 178.549 0.091 17919 37944 1 93 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.897 0.323 17919 37945 1 93 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.497 -1.217 17919 37946 1 93 . 1 1 24 24 GLU H H 24 9.760 9.760 8.129 1.631 17919 37947 1 93 . 1 1 25 25 ASN N N 25 120.570 120.570 118.384 2.186 17919 37948 1 93 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.488 0.037 17919 37949 1 93 . 1 1 25 25 ASN C C 25 178.380 178.380 177.806 0.574 17919 37950 1 93 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.883 0.178 17919 37951 1 93 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.142 0.308 17919 37952 1 93 . 1 1 25 25 ASN H H 25 7.920 7.920 7.546 0.374 17919 37953 1 93 . 1 1 26 26 VAL N N 26 121.710 121.710 119.809 1.901 17919 37954 1 93 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.530 -0.133 17919 37955 1 93 . 1 1 26 26 VAL C C 26 177.950 177.950 178.109 -0.159 17919 37956 1 93 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.776 0.884 17919 37957 1 93 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.109 -0.269 17919 37958 1 93 . 1 1 26 26 VAL H H 26 8.070 8.070 7.945 0.125 17919 37959 1 93 . 1 1 27 27 LYS N N 27 118.860 118.860 118.615 0.245 17919 37960 1 93 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.201 0.379 17919 37961 1 93 . 1 1 27 27 LYS C C 27 180.550 180.550 179.388 1.162 17919 37962 1 93 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.371 -0.121 17919 37963 1 93 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.096 1.634 17919 37964 1 93 . 1 1 27 27 LYS H H 27 8.560 8.560 7.716 0.844 17919 37965 1 93 . 1 1 28 28 ALA N N 28 123.440 123.440 122.988 0.452 17919 37966 1 93 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.067 0.093 17919 37967 1 93 . 1 1 28 28 ALA C C 28 180.300 180.300 179.449 0.851 17919 37968 1 93 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.157 0.213 17919 37969 1 93 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.300 -0.590 17919 37970 1 93 . 1 1 28 28 ALA H H 28 8.060 8.060 7.984 0.076 17919 37971 1 93 . 1 1 29 29 LYS N N 29 119.940 119.940 119.060 0.880 17919 37972 1 93 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.013 0.194 17919 37973 1 93 . 1 1 29 29 LYS C C 29 180.320 180.320 179.310 1.010 17919 37974 1 93 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.453 0.197 17919 37975 1 93 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.235 1.055 17919 37976 1 93 . 1 1 29 29 LYS H H 29 7.850 7.850 7.689 0.161 17919 37977 1 93 . 1 1 30 30 ILE N N 30 121.080 121.080 119.957 1.123 17919 37978 1 93 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.697 -0.190 17919 37979 1 93 . 1 1 30 30 ILE C C 30 178.310 178.310 177.344 0.966 17919 37980 1 93 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.015 1.135 17919 37981 1 93 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.852 -1.052 17919 37982 1 93 . 1 1 30 30 ILE H H 30 8.280 8.280 7.714 0.566 17919 37983 1 93 . 1 1 31 31 GLN N N 31 123.490 123.490 121.181 2.309 17919 37984 1 93 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.046 -0.217 17919 37985 1 93 . 1 1 31 31 GLN C C 31 178.890 178.890 178.644 0.246 17919 37986 1 93 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.160 0.840 17919 37987 1 93 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.517 -0.797 17919 37988 1 93 . 1 1 31 31 GLN H H 31 8.580 8.580 8.387 0.193 17919 37989 1 93 . 1 1 32 32 ASP N N 32 119.360 119.360 118.252 1.108 17919 37990 1 93 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.432 -0.078 17919 37991 1 93 . 1 1 32 32 ASP C C 32 177.250 177.250 177.462 -0.212 17919 37992 1 93 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.688 0.502 17919 37993 1 93 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.852 -0.272 17919 37994 1 93 . 1 1 32 32 ASP H H 32 8.010 8.010 8.299 -0.289 17919 37995 1 93 . 1 1 33 33 LYS N N 33 115.130 115.130 118.710 -3.580 17919 37996 1 93 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.353 -0.016 17919 37997 1 93 . 1 1 33 33 LYS C C 33 177.870 177.870 178.287 -0.417 17919 37998 1 93 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.665 0.385 17919 37999 1 93 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.641 0.529 17919 38000 1 93 . 1 1 33 33 LYS H H 33 7.430 7.430 7.471 -0.041 17919 38001 1 93 . 1 1 34 34 GLU N N 34 113.870 113.870 116.264 -2.394 17919 38002 1 93 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.431 0.194 17919 38003 1 93 . 1 1 34 34 GLU C C 34 177.840 177.840 177.176 0.664 17919 38004 1 93 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.682 -1.512 17919 38005 1 93 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.160 1.500 17919 38006 1 93 . 1 1 34 34 GLU H H 34 8.740 8.740 8.491 0.249 17919 38007 1 93 . 1 1 35 35 GLY N N 35 108.650 108.650 107.392 1.258 17919 38008 1 93 . 1 1 35 35 GLY C C 35 173.960 173.960 174.561 -0.601 17919 38009 1 93 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.122 0.958 17919 38010 1 93 . 1 1 35 35 GLY H H 35 8.530 8.530 7.749 0.781 17919 38011 1 93 . 1 1 36 36 ILE N N 36 119.880 119.880 123.268 -3.388 17919 38012 1 93 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.324 0.121 17919 38013 1 93 . 1 1 36 36 ILE C C 36 173.590 173.590 174.358 -0.768 17919 38014 1 93 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.350 -0.600 17919 38015 1 93 . 1 1 36 36 ILE CB C 36 40.580 40.580 37.880 2.700 17919 38016 1 93 . 1 1 36 36 ILE H H 36 6.150 6.150 7.808 -1.658 17919 38017 1 93 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.494 0.140 17919 38018 1 93 . 1 1 37 37 PRO C C 37 176.940 176.940 176.625 0.315 17919 38019 1 93 . 1 1 37 37 PRO CA C 37 61.660 61.660 62.073 -0.413 17919 38020 1 93 . 1 1 37 37 PRO CB C 37 31.850 31.850 30.993 0.857 17919 38021 1 93 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.149 -0.032 17919 38022 1 93 . 1 1 38 38 PRO C C 38 178.320 178.320 178.094 0.226 17919 38023 1 93 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.761 0.499 17919 38024 1 93 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.627 1.263 17919 38025 1 93 . 1 1 39 39 ASP N N 39 113.380 113.380 117.015 -3.635 17919 38026 1 93 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.399 0.031 17919 38027 1 93 . 1 1 39 39 ASP C C 39 177.090 177.090 178.064 -0.974 17919 38028 1 93 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.799 -1.159 17919 38029 1 93 . 1 1 39 39 ASP CB C 39 39.540 39.540 39.546 -0.006 17919 38030 1 93 . 1 1 39 39 ASP H H 39 8.550 8.550 8.832 -0.282 17919 38031 1 93 . 1 1 40 40 GLN N N 40 116.780 116.780 118.056 -1.276 17919 38032 1 93 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.242 0.222 17919 38033 1 93 . 1 1 40 40 GLN C C 40 175.380 175.380 175.755 -0.375 17919 38034 1 93 . 1 1 40 40 GLN CA C 40 55.640 55.640 57.014 -1.374 17919 38035 1 93 . 1 1 40 40 GLN CB C 40 30.140 30.140 30.128 0.012 17919 38036 1 93 . 1 1 40 40 GLN H H 40 7.820 7.820 7.883 -0.063 17919 38037 1 93 . 1 1 41 41 GLN N N 41 117.720 117.720 118.099 -0.379 17919 38038 1 93 . 1 1 41 41 GLN HA H 41 4.244 4.244 5.029 -0.785 17919 38039 1 93 . 1 1 41 41 GLN C C 41 176.300 176.300 175.661 0.639 17919 38040 1 93 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.647 0.823 17919 38041 1 93 . 1 1 41 41 GLN CB C 41 31.650 31.650 30.850 0.800 17919 38042 1 93 . 1 1 41 41 GLN H H 41 7.480 7.480 7.407 0.073 17919 38043 1 93 . 1 1 42 42 ARG N N 42 122.680 122.680 120.716 1.964 17919 38044 1 93 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.669 -0.169 17919 38045 1 93 . 1 1 42 42 ARG C C 42 174.050 174.050 174.214 -0.164 17919 38046 1 93 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.531 0.519 17919 38047 1 93 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.968 -2.219 17919 38048 1 93 . 1 1 42 42 ARG H H 42 8.530 8.530 8.569 -0.039 17919 38049 1 93 . 1 1 43 43 LEU N N 43 124.040 124.040 122.107 1.933 17919 38050 1 93 . 1 1 43 43 LEU C C 43 175.290 175.290 175.784 -0.494 17919 38051 1 93 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.658 -0.678 17919 38052 1 93 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.198 1.592 17919 38053 1 93 . 1 1 43 43 LEU H H 43 8.820 8.820 8.752 0.068 17919 38054 1 93 . 1 1 44 44 ILE N N 44 121.920 121.920 123.125 -1.205 17919 38055 1 93 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.622 0.370 17919 38056 1 93 . 1 1 44 44 ILE C C 44 176.060 176.060 174.139 1.921 17919 38057 1 93 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.454 -1.474 17919 38058 1 93 . 1 1 44 44 ILE CB C 44 41.420 41.420 39.712 1.708 17919 38059 1 93 . 1 1 44 44 ILE H H 44 9.030 9.030 8.621 0.409 17919 38060 1 93 . 1 1 45 45 PHE N N 45 125.390 125.390 128.448 -3.058 17919 38061 1 93 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.032 0.013 17919 38062 1 93 . 1 1 45 45 PHE C C 45 174.470 174.470 174.776 -0.306 17919 38063 1 93 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.005 1.014 17919 38064 1 93 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.096 0.664 17919 38065 1 93 . 1 1 45 45 PHE H H 45 8.830 8.830 8.318 0.512 17919 38066 1 93 . 1 1 46 46 ALA N N 46 132.200 132.200 129.258 2.942 17919 38067 1 93 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.585 0.105 17919 38068 1 93 . 1 1 46 46 ALA C C 46 177.290 177.290 177.388 -0.098 17919 38069 1 93 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.993 -0.453 17919 38070 1 93 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.347 0.223 17919 38071 1 93 . 1 1 46 46 ALA H H 46 8.810 8.810 8.830 -0.020 17919 38072 1 93 . 1 1 47 47 GLY N N 47 102.340 102.340 103.572 -1.232 17919 38073 1 93 . 1 1 47 47 GLY C C 47 173.810 173.810 174.202 -0.392 17919 38074 1 93 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.263 0.087 17919 38075 1 93 . 1 1 47 47 GLY H H 47 8.130 8.130 8.535 -0.405 17919 38076 1 93 . 1 1 48 48 LYS N N 48 121.570 121.570 122.747 -1.177 17919 38077 1 93 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.542 0.080 17919 38078 1 93 . 1 1 48 48 LYS C C 48 174.700 174.700 175.038 -0.338 17919 38079 1 93 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.297 0.253 17919 38080 1 93 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.255 0.275 17919 38081 1 93 . 1 1 48 48 LYS H H 48 7.980 7.980 7.802 0.178 17919 38082 1 93 . 1 1 49 49 GLN N N 49 122.410 122.410 127.668 -5.258 17919 38083 1 93 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.521 0.039 17919 38084 1 93 . 1 1 49 49 GLN C C 49 175.670 175.670 175.759 -0.089 17919 38085 1 93 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.032 -0.292 17919 38086 1 93 . 1 1 49 49 GLN CB C 49 29.000 29.000 28.704 0.296 17919 38087 1 93 . 1 1 49 49 GLN H H 49 8.600 8.600 8.660 -0.060 17919 38088 1 93 . 1 1 50 50 LEU N N 50 125.520 125.520 128.806 -3.286 17919 38089 1 93 . 1 1 50 50 LEU HA H 50 4.090 4.090 3.726 0.364 17919 38090 1 93 . 1 1 50 50 LEU C C 50 176.660 176.660 176.401 0.259 17919 38091 1 93 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.362 -0.122 17919 38092 1 93 . 1 1 50 50 LEU CB C 50 41.570 41.570 40.541 1.030 17919 38093 1 93 . 1 1 50 50 LEU H H 50 8.530 8.530 8.177 0.353 17919 38094 1 93 . 1 1 51 51 GLU N N 51 122.940 122.940 125.825 -2.885 17919 38095 1 93 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.280 0.208 17919 38096 1 93 . 1 1 51 51 GLU C C 51 175.870 175.870 176.862 -0.992 17919 38097 1 93 . 1 1 51 51 GLU CA C 51 55.960 55.960 56.769 -0.809 17919 38098 1 93 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.134 0.436 17919 38099 1 93 . 1 1 51 51 GLU H H 51 8.400 8.400 8.026 0.374 17919 38100 1 93 . 1 1 52 52 ASP N N 52 120.030 120.030 125.765 -5.735 17919 38101 1 93 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.668 -0.308 17919 38102 1 93 . 1 1 52 52 ASP C C 52 177.330 177.330 176.996 0.334 17919 38103 1 93 . 1 1 52 52 ASP CA C 52 56.960 56.960 56.767 0.193 17919 38104 1 93 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.830 0.020 17919 38105 1 93 . 1 1 52 52 ASP H H 52 8.160 8.160 8.726 -0.566 17919 38106 1 93 . 1 1 53 53 GLY N N 53 106.660 106.660 105.864 0.796 17919 38107 1 93 . 1 1 53 53 GLY C C 53 174.870 174.870 174.196 0.674 17919 38108 1 93 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.155 0.015 17919 38109 1 93 . 1 1 53 53 GLY H H 53 9.390 9.390 8.641 0.749 17919 38110 1 93 . 1 1 54 54 ARG N N 54 119.050 119.050 119.371 -0.321 17919 38111 1 93 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.708 -0.013 17919 38112 1 93 . 1 1 54 54 ARG C C 54 175.350 175.350 174.999 0.351 17919 38113 1 93 . 1 1 54 54 ARG CA C 54 54.390 54.390 52.751 1.639 17919 38114 1 93 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.370 0.280 17919 38115 1 93 . 1 1 54 54 ARG H H 54 7.460 7.460 7.388 0.072 17919 38116 1 93 . 1 1 55 55 THR N N 55 108.400 108.400 112.160 -3.760 17919 38117 1 93 . 1 1 55 55 THR HA H 55 5.240 5.240 4.988 0.252 17919 38118 1 93 . 1 1 55 55 THR C C 55 176.560 176.560 176.226 0.334 17919 38119 1 93 . 1 1 55 55 THR CA C 55 59.690 59.690 60.049 -0.359 17919 38120 1 93 . 1 1 55 55 THR CB C 55 72.260 72.260 71.390 0.870 17919 38121 1 93 . 1 1 55 55 THR H H 55 8.730 8.730 8.859 -0.129 17919 38122 1 93 . 1 1 56 56 LEU N N 56 117.920 117.920 122.843 -4.923 17919 38123 1 93 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.871 0.189 17919 38124 1 93 . 1 1 56 56 LEU C C 56 180.810 180.810 179.025 1.785 17919 38125 1 93 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.853 -0.143 17919 38126 1 93 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.029 -0.659 17919 38127 1 93 . 1 1 56 56 LEU H H 56 8.140 8.140 8.447 -0.307 17919 38128 1 93 . 1 1 57 57 SER N N 57 113.330 113.330 114.155 -0.825 17919 38129 1 93 . 1 1 57 57 SER HA H 57 4.370 4.370 4.075 0.295 17919 38130 1 93 . 1 1 57 57 SER C C 57 178.310 178.310 177.123 1.187 17919 38131 1 93 . 1 1 57 57 SER CA C 57 61.080 61.080 61.377 -0.297 17919 38132 1 93 . 1 1 57 57 SER CB C 57 62.530 62.530 62.280 0.250 17919 38133 1 93 . 1 1 57 57 SER H H 57 8.470 8.470 7.731 0.739 17919 38134 1 93 . 1 1 58 58 ASP N N 58 124.190 124.190 124.118 0.072 17919 38135 1 93 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.263 0.033 17919 38136 1 93 . 1 1 58 58 ASP C C 58 177.400 177.400 177.798 -0.398 17919 38137 1 93 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.974 0.206 17919 38138 1 93 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.416 -0.316 17919 38139 1 93 . 1 1 58 58 ASP H H 58 7.930 7.930 7.625 0.305 17919 38140 1 93 . 1 1 59 59 TYR N N 59 115.510 115.510 115.609 -0.099 17919 38141 1 93 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.539 0.131 17919 38142 1 93 . 1 1 59 59 TYR C C 59 174.700 174.700 174.750 -0.050 17919 38143 1 93 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.307 0.943 17919 38144 1 93 . 1 1 59 59 TYR CB C 59 40.070 40.070 37.453 2.617 17919 38145 1 93 . 1 1 59 59 TYR H H 59 7.250 7.250 7.344 -0.094 17919 38146 1 93 . 1 1 60 60 ASN N N 60 115.900 115.900 114.341 1.559 17919 38147 1 93 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.343 0.012 17919 38148 1 93 . 1 1 60 60 ASN C C 60 174.340 174.340 174.015 0.325 17919 38149 1 93 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.050 0.070 17919 38150 1 93 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.089 0.321 17919 38151 1 93 . 1 1 60 60 ASN H H 60 8.150 8.150 7.769 0.381 17919 38152 1 93 . 1 1 61 61 ILE N N 61 118.600 118.600 119.776 -1.176 17919 38153 1 93 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.796 -0.403 17919 38154 1 93 . 1 1 61 61 ILE C C 61 174.610 174.610 175.078 -0.468 17919 38155 1 93 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.446 0.974 17919 38156 1 93 . 1 1 61 61 ILE CB C 61 36.740 36.740 38.017 -1.277 17919 38157 1 93 . 1 1 61 61 ILE H H 61 7.250 7.250 7.981 -0.731 17919 38158 1 93 . 1 1 62 62 GLN N N 62 124.740 124.740 124.727 0.013 17919 38159 1 93 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.763 -0.257 17919 38160 1 93 . 1 1 62 62 GLN C C 62 175.970 175.970 176.198 -0.228 17919 38161 1 93 . 1 1 62 62 GLN CA C 62 53.660 53.660 52.605 1.055 17919 38162 1 93 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.074 0.576 17919 38163 1 93 . 1 1 62 62 GLN H H 62 7.610 7.610 7.990 -0.380 17919 38164 1 93 . 1 1 63 63 LYS N N 63 120.300 120.300 122.017 -1.717 17919 38165 1 93 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.230 -0.229 17919 38166 1 93 . 1 1 63 63 LYS C C 63 175.810 175.810 176.510 -0.700 17919 38167 1 93 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.343 0.447 17919 38168 1 93 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.801 0.849 17919 38169 1 93 . 1 1 63 63 LYS H H 63 8.490 8.490 8.632 -0.142 17919 38170 1 93 . 1 1 64 64 GLU N N 64 113.950 113.950 117.021 -3.071 17919 38171 1 93 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.513 -0.048 17919 38172 1 93 . 1 1 64 64 GLU C C 64 175.250 175.250 175.916 -0.666 17919 38173 1 93 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.259 0.631 17919 38174 1 93 . 1 1 64 64 GLU CB C 64 25.900 25.900 26.687 -0.787 17919 38175 1 93 . 1 1 64 64 GLU H H 64 9.280 9.280 8.827 0.453 17919 38176 1 93 . 1 1 65 65 SER N N 65 114.730 114.730 116.468 -1.738 17919 38177 1 93 . 1 1 65 65 SER HA H 65 4.640 4.640 4.402 0.238 17919 38178 1 93 . 1 1 65 65 SER C C 65 172.160 172.160 173.711 -1.551 17919 38179 1 93 . 1 1 65 65 SER CA C 65 60.890 60.890 60.419 0.471 17919 38180 1 93 . 1 1 65 65 SER CB C 65 64.910 64.910 64.070 0.840 17919 38181 1 93 . 1 1 65 65 SER H H 65 7.670 7.670 7.642 0.028 17919 38182 1 93 . 1 1 66 66 THR N N 66 117.110 117.110 118.176 -1.066 17919 38183 1 93 . 1 1 66 66 THR HA H 66 5.270 5.270 5.229 0.041 17919 38184 1 93 . 1 1 66 66 THR C C 66 173.950 173.950 173.631 0.319 17919 38185 1 93 . 1 1 66 66 THR CA C 66 62.340 62.340 61.680 0.660 17919 38186 1 93 . 1 1 66 66 THR CB C 66 70.080 70.080 71.065 -0.985 17919 38187 1 93 . 1 1 66 66 THR H H 66 8.730 8.730 8.371 0.359 17919 38188 1 93 . 1 1 67 67 LEU N N 67 127.110 127.110 125.768 1.342 17919 38189 1 93 . 1 1 67 67 LEU HA H 67 5.060 5.060 5.069 -0.009 17919 38190 1 93 . 1 1 67 67 LEU C C 67 175.770 175.770 175.146 0.624 17919 38191 1 93 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.085 0.815 17919 38192 1 93 . 1 1 67 67 LEU CB C 67 44.260 44.260 45.079 -0.819 17919 38193 1 93 . 1 1 67 67 LEU H H 67 9.410 9.410 9.083 0.327 17919 38194 1 93 . 1 1 68 68 HIS N N 68 118.380 118.380 117.410 0.970 17919 38195 1 93 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.382 -0.142 17919 38196 1 93 . 1 1 68 68 HIS C C 68 173.150 173.150 174.002 -0.852 17919 38197 1 93 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.896 0.104 17919 38198 1 93 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.640 -2.110 17919 38199 1 93 . 1 1 68 68 HIS H H 68 9.230 9.230 8.573 0.657 17919 38200 1 93 . 1 1 69 69 LEU N N 69 124.460 124.460 126.295 -1.835 17919 38201 1 93 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.090 0.100 17919 38202 1 93 . 1 1 69 69 LEU C C 69 175.270 175.270 174.460 0.810 17919 38203 1 93 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.653 0.237 17919 38204 1 93 . 1 1 69 69 LEU CB C 69 44.380 44.380 43.968 0.412 17919 38205 1 93 . 1 1 69 69 LEU H H 69 8.340 8.340 8.644 -0.304 17919 38206 1 93 . 1 1 70 70 VAL N N 70 126.940 126.940 125.434 1.506 17919 38207 1 93 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.582 -0.232 17919 38208 1 93 . 1 1 70 70 VAL C C 70 174.000 174.000 173.537 0.463 17919 38209 1 93 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.711 1.089 17919 38210 1 93 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.560 -0.650 17919 38211 1 93 . 1 1 70 70 VAL H H 70 9.200 9.200 8.424 0.776 17919 38212 1 93 . 1 1 71 71 LEU N N 71 123.130 123.130 128.510 -5.380 17919 38213 1 93 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.994 0.066 17919 38214 1 93 . 1 1 71 71 LEU C C 71 177.830 177.830 177.804 0.026 17919 38215 1 93 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.551 0.389 17919 38216 1 93 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.473 0.377 17919 38217 1 93 . 1 1 71 71 LEU H H 71 8.120 8.120 8.525 -0.405 17919 38218 1 93 . 1 1 72 72 ARG N N 72 123.490 123.490 124.738 -1.248 17919 38219 1 93 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.132 0.169 17919 38220 1 93 . 1 1 72 72 ARG C C 72 175.350 175.350 177.329 -1.979 17919 38221 1 93 . 1 1 72 72 ARG CA C 72 55.610 55.610 57.125 -1.515 17919 38222 1 93 . 1 1 72 72 ARG CB C 72 31.350 31.350 27.841 3.509 17919 38223 1 93 . 1 1 72 72 ARG H H 72 8.580 8.580 9.230 -0.650 17919 38224 1 94 . 1 1 2 2 GLN N N 2 123.220 123.220 122.475 0.745 17919 38225 1 94 . 1 1 2 2 GLN HA H 2 5.249 5.249 4.863 0.386 17919 38226 1 94 . 1 1 2 2 GLN C C 2 175.920 175.920 174.886 1.034 17919 38227 1 94 . 1 1 2 2 GLN CA C 2 55.080 55.080 55.800 -0.720 17919 38228 1 94 . 1 1 2 2 GLN CB C 2 30.760 30.760 29.231 1.529 17919 38229 1 94 . 1 1 2 2 GLN H H 2 8.900 8.900 8.524 0.376 17919 38230 1 94 . 1 1 3 3 ILE N N 3 115.340 115.340 115.651 -0.311 17919 38231 1 94 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.681 -0.468 17919 38232 1 94 . 1 1 3 3 ILE C C 3 172.450 172.450 173.507 -1.057 17919 38233 1 94 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.501 0.070 17919 38234 1 94 . 1 1 3 3 ILE CB C 3 42.210 42.210 42.016 0.194 17919 38235 1 94 . 1 1 3 3 ILE H H 3 8.320 8.320 7.684 0.636 17919 38236 1 94 . 1 1 4 4 PHE N N 4 118.110 118.110 119.640 -1.530 17919 38237 1 94 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.096 0.534 17919 38238 1 94 . 1 1 4 4 PHE C C 4 175.320 175.320 175.475 -0.155 17919 38239 1 94 . 1 1 4 4 PHE CA C 4 55.210 55.210 56.121 -0.911 17919 38240 1 94 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.136 -0.656 17919 38241 1 94 . 1 1 4 4 PHE H H 4 8.610 8.610 8.254 0.356 17919 38242 1 94 . 1 1 5 5 VAL N N 5 121.000 121.000 120.930 0.070 17919 38243 1 94 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.887 -0.162 17919 38244 1 94 . 1 1 5 5 VAL C C 5 174.870 174.870 175.608 -0.738 17919 38245 1 94 . 1 1 5 5 VAL CA C 5 60.620 60.620 60.625 -0.005 17919 38246 1 94 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.460 -0.230 17919 38247 1 94 . 1 1 5 5 VAL H H 5 9.300 9.300 8.441 0.859 17919 38248 1 94 . 1 1 6 6 LYS N N 6 127.520 127.520 129.712 -2.192 17919 38249 1 94 . 1 1 6 6 LYS HA H 6 5.367 5.367 4.616 0.751 17919 38250 1 94 . 1 1 6 6 LYS C C 6 177.140 177.140 176.339 0.801 17919 38251 1 94 . 1 1 6 6 LYS CA C 6 54.520 54.520 55.076 -0.556 17919 38252 1 94 . 1 1 6 6 LYS CB C 6 35.050 35.050 31.585 3.465 17919 38253 1 94 . 1 1 6 6 LYS H H 6 8.820 8.820 9.114 -0.294 17919 38254 1 94 . 1 1 7 7 THR N N 7 115.400 115.400 119.300 -3.900 17919 38255 1 94 . 1 1 7 7 THR HA H 7 4.970 4.970 4.242 0.728 17919 38256 1 94 . 1 1 7 7 THR C C 7 176.910 176.910 176.000 0.910 17919 38257 1 94 . 1 1 7 7 THR CA C 7 60.470 60.470 61.170 -0.700 17919 38258 1 94 . 1 1 7 7 THR CB C 7 70.630 70.630 69.582 1.048 17919 38259 1 94 . 1 1 7 7 THR H H 7 8.730 8.730 8.031 0.699 17919 38260 1 94 . 1 1 8 8 LEU N N 8 121.330 121.330 120.634 0.696 17919 38261 1 94 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.025 0.285 17919 38262 1 94 . 1 1 8 8 LEU C C 8 178.800 178.800 178.283 0.517 17919 38263 1 94 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.727 -0.147 17919 38264 1 94 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.038 0.932 17919 38265 1 94 . 1 1 8 8 LEU H H 8 9.100 9.100 8.913 0.187 17919 38266 1 94 . 1 1 9 9 THR N N 9 105.590 105.590 106.925 -1.335 17919 38267 1 94 . 1 1 9 9 THR HA H 9 4.428 4.428 4.312 0.116 17919 38268 1 94 . 1 1 9 9 THR C C 9 175.520 175.520 176.430 -0.910 17919 38269 1 94 . 1 1 9 9 THR CA C 9 61.400 61.400 61.926 -0.526 17919 38270 1 94 . 1 1 9 9 THR CB C 9 69.140 69.140 68.803 0.337 17919 38271 1 94 . 1 1 9 9 THR H H 9 7.630 7.630 7.747 -0.117 17919 38272 1 94 . 1 1 10 10 GLY N N 10 108.890 108.890 111.215 -2.325 17919 38273 1 94 . 1 1 10 10 GLY C C 10 174.070 174.070 173.644 0.426 17919 38274 1 94 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.429 0.031 17919 38275 1 94 . 1 1 10 10 GLY H H 10 7.810 7.810 8.437 -0.627 17919 38276 1 94 . 1 1 11 11 LYS N N 11 121.600 121.600 121.841 -0.241 17919 38277 1 94 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.145 0.216 17919 38278 1 94 . 1 1 11 11 LYS C C 11 175.940 175.940 175.309 0.631 17919 38279 1 94 . 1 1 11 11 LYS CA C 11 56.280 56.280 57.360 -1.080 17919 38280 1 94 . 1 1 11 11 LYS CB C 11 33.200 33.200 32.699 0.501 17919 38281 1 94 . 1 1 11 11 LYS H H 11 7.280 7.280 7.623 -0.343 17919 38282 1 94 . 1 1 12 12 THR N N 12 120.440 120.440 118.874 1.566 17919 38283 1 94 . 1 1 12 12 THR HA H 12 5.046 5.046 5.188 -0.142 17919 38284 1 94 . 1 1 12 12 THR C C 12 174.320 174.320 174.225 0.095 17919 38285 1 94 . 1 1 12 12 THR CA C 12 62.390 62.390 61.188 1.202 17919 38286 1 94 . 1 1 12 12 THR CB C 12 69.910 69.910 69.697 0.213 17919 38287 1 94 . 1 1 12 12 THR H H 12 8.650 8.650 8.403 0.247 17919 38288 1 94 . 1 1 13 13 ILE N N 13 127.110 127.110 125.682 1.428 17919 38289 1 94 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.751 -0.207 17919 38290 1 94 . 1 1 13 13 ILE C C 13 175.220 175.220 175.093 0.127 17919 38291 1 94 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.385 0.595 17919 38292 1 94 . 1 1 13 13 ILE CB C 13 40.950 40.950 39.448 1.502 17919 38293 1 94 . 1 1 13 13 ILE H H 13 9.450 9.450 8.324 1.126 17919 38294 1 94 . 1 1 14 14 THR N N 14 121.520 121.520 123.184 -1.664 17919 38295 1 94 . 1 1 14 14 THR HA H 14 4.964 4.964 4.497 0.467 17919 38296 1 94 . 1 1 14 14 THR C C 14 173.790 173.790 174.122 -0.332 17919 38297 1 94 . 1 1 14 14 THR CA C 14 61.940 61.940 62.166 -0.226 17919 38298 1 94 . 1 1 14 14 THR CB C 14 69.650 69.650 69.466 0.184 17919 38299 1 94 . 1 1 14 14 THR H H 14 8.710 8.710 8.244 0.466 17919 38300 1 94 . 1 1 15 15 LEU N N 15 124.800 124.800 127.098 -2.298 17919 38301 1 94 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.714 0.066 17919 38302 1 94 . 1 1 15 15 LEU C C 15 174.670 174.670 175.551 -0.881 17919 38303 1 94 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.576 -0.746 17919 38304 1 94 . 1 1 15 15 LEU CB C 15 47.070 47.070 44.538 2.533 17919 38305 1 94 . 1 1 15 15 LEU H H 15 8.710 8.710 7.976 0.734 17919 38306 1 94 . 1 1 16 16 GLU N N 16 122.160 122.160 122.985 -0.825 17919 38307 1 94 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.357 0.560 17919 38308 1 94 . 1 1 16 16 GLU C C 16 175.860 175.860 175.712 0.148 17919 38309 1 94 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.844 -1.024 17919 38310 1 94 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.455 -1.005 17919 38311 1 94 . 1 1 16 16 GLU H H 16 8.140 8.140 8.611 -0.471 17919 38312 1 94 . 1 1 17 17 VAL N N 17 117.210 117.210 118.745 -1.535 17919 38313 1 94 . 1 1 17 17 VAL HA H 17 4.714 4.714 5.057 -0.343 17919 38314 1 94 . 1 1 17 17 VAL C C 17 174.160 174.160 175.146 -0.986 17919 38315 1 94 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.876 -0.446 17919 38316 1 94 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.746 0.654 17919 38317 1 94 . 1 1 17 17 VAL H H 17 8.900 8.900 8.145 0.755 17919 38318 1 94 . 1 1 18 18 GLU N N 18 118.990 118.990 120.769 -1.779 17919 38319 1 94 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.943 0.136 17919 38320 1 94 . 1 1 18 18 GLU C C 18 176.160 176.160 176.147 0.013 17919 38321 1 94 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.714 0.007 17919 38322 1 94 . 1 1 18 18 GLU CB C 18 30.310 30.310 31.133 -0.823 17919 38323 1 94 . 1 1 18 18 GLU H H 18 8.640 8.640 9.269 -0.629 17919 38324 1 94 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.317 -0.176 17919 38325 1 94 . 1 1 19 19 PRO C C 19 175.310 175.310 177.176 -1.866 17919 38326 1 94 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.188 0.282 17919 38327 1 94 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.978 -0.028 17919 38328 1 94 . 1 1 20 20 SER N N 20 103.400 103.400 111.627 -8.227 17919 38329 1 94 . 1 1 20 20 SER HA H 20 4.370 4.370 4.450 -0.080 17919 38330 1 94 . 1 1 20 20 SER C C 20 174.660 174.660 173.860 0.800 17919 38331 1 94 . 1 1 20 20 SER CA C 20 57.400 57.400 58.255 -0.855 17919 38332 1 94 . 1 1 20 20 SER CB C 20 63.370 63.370 62.503 0.867 17919 38333 1 94 . 1 1 20 20 SER H H 20 7.040 7.040 8.101 -1.061 17919 38334 1 94 . 1 1 21 21 ASP N N 21 123.480 123.480 123.875 -0.395 17919 38335 1 94 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.338 0.357 17919 38336 1 94 . 1 1 21 21 ASP C C 21 176.360 176.360 176.316 0.044 17919 38337 1 94 . 1 1 21 21 ASP CA C 21 55.700 55.700 56.735 -1.035 17919 38338 1 94 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.465 -0.665 17919 38339 1 94 . 1 1 21 21 ASP H H 21 8.030 8.030 7.642 0.388 17919 38340 1 94 . 1 1 22 22 THR N N 22 108.800 108.800 114.514 -5.714 17919 38341 1 94 . 1 1 22 22 THR HA H 22 4.920 4.920 4.737 0.183 17919 38342 1 94 . 1 1 22 22 THR C C 22 176.750 176.750 175.938 0.812 17919 38343 1 94 . 1 1 22 22 THR CA C 22 59.690 59.690 61.045 -1.355 17919 38344 1 94 . 1 1 22 22 THR CB C 22 71.200 71.200 70.777 0.423 17919 38345 1 94 . 1 1 22 22 THR H H 22 7.900 7.900 8.076 -0.176 17919 38346 1 94 . 1 1 23 23 ILE N N 23 121.190 121.190 122.858 -1.668 17919 38347 1 94 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.747 -0.090 17919 38348 1 94 . 1 1 23 23 ILE C C 23 179.040 179.040 177.989 1.051 17919 38349 1 94 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.971 -0.711 17919 38350 1 94 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.146 -1.796 17919 38351 1 94 . 1 1 23 23 ILE H H 23 8.560 8.560 8.853 -0.293 17919 38352 1 94 . 1 1 24 24 GLU N N 24 120.830 120.830 120.786 0.044 17919 38353 1 94 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.952 -0.035 17919 38354 1 94 . 1 1 24 24 GLU C C 24 178.640 178.640 178.443 0.197 17919 38355 1 94 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.720 0.500 17919 38356 1 94 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.553 -1.273 17919 38357 1 94 . 1 1 24 24 GLU H H 24 9.760 9.760 8.475 1.285 17919 38358 1 94 . 1 1 25 25 ASN N N 25 120.570 120.570 118.163 2.407 17919 38359 1 94 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.448 0.077 17919 38360 1 94 . 1 1 25 25 ASN C C 25 178.380 178.380 177.897 0.483 17919 38361 1 94 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.542 0.518 17919 38362 1 94 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.647 -0.197 17919 38363 1 94 . 1 1 25 25 ASN H H 25 7.920 7.920 7.793 0.127 17919 38364 1 94 . 1 1 26 26 VAL N N 26 121.710 121.710 121.397 0.313 17919 38365 1 94 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.478 -0.081 17919 38366 1 94 . 1 1 26 26 VAL C C 26 177.950 177.950 177.247 0.703 17919 38367 1 94 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.906 0.754 17919 38368 1 94 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.615 -0.775 17919 38369 1 94 . 1 1 26 26 VAL H H 26 8.070 8.070 8.363 -0.293 17919 38370 1 94 . 1 1 27 27 LYS N N 27 118.860 118.860 117.694 1.166 17919 38371 1 94 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.233 0.347 17919 38372 1 94 . 1 1 27 27 LYS C C 27 180.550 180.550 178.745 1.805 17919 38373 1 94 . 1 1 27 27 LYS CA C 27 59.250 59.250 58.898 0.352 17919 38374 1 94 . 1 1 27 27 LYS CB C 27 33.730 33.730 31.872 1.857 17919 38375 1 94 . 1 1 27 27 LYS H H 27 8.560 8.560 7.928 0.632 17919 38376 1 94 . 1 1 28 28 ALA N N 28 123.440 123.440 122.616 0.824 17919 38377 1 94 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.130 0.030 17919 38378 1 94 . 1 1 28 28 ALA C C 28 180.300 180.300 178.781 1.519 17919 38379 1 94 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.908 0.462 17919 38380 1 94 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.481 -0.771 17919 38381 1 94 . 1 1 28 28 ALA H H 28 8.060 8.060 7.814 0.246 17919 38382 1 94 . 1 1 29 29 LYS N N 29 119.940 119.940 119.757 0.183 17919 38383 1 94 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.000 0.207 17919 38384 1 94 . 1 1 29 29 LYS C C 29 180.320 180.320 179.401 0.919 17919 38385 1 94 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.325 0.325 17919 38386 1 94 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.205 1.085 17919 38387 1 94 . 1 1 29 29 LYS H H 29 7.850 7.850 7.586 0.264 17919 38388 1 94 . 1 1 30 30 ILE N N 30 121.080 121.080 119.608 1.472 17919 38389 1 94 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.650 -0.143 17919 38390 1 94 . 1 1 30 30 ILE C C 30 178.310 178.310 177.257 1.053 17919 38391 1 94 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.149 1.001 17919 38392 1 94 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.419 -0.619 17919 38393 1 94 . 1 1 30 30 ILE H H 30 8.280 8.280 7.735 0.545 17919 38394 1 94 . 1 1 31 31 GLN N N 31 123.490 123.490 120.783 2.707 17919 38395 1 94 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.033 -0.204 17919 38396 1 94 . 1 1 31 31 GLN C C 31 178.890 178.890 178.470 0.420 17919 38397 1 94 . 1 1 31 31 GLN CA C 31 60.000 60.000 58.984 1.016 17919 38398 1 94 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.116 -0.397 17919 38399 1 94 . 1 1 31 31 GLN H H 31 8.580 8.580 7.635 0.945 17919 38400 1 94 . 1 1 32 32 ASP N N 32 119.360 119.360 118.642 0.718 17919 38401 1 94 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.345 0.009 17919 38402 1 94 . 1 1 32 32 ASP C C 32 177.250 177.250 177.326 -0.076 17919 38403 1 94 . 1 1 32 32 ASP CA C 32 57.190 57.190 57.077 0.113 17919 38404 1 94 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.747 -0.167 17919 38405 1 94 . 1 1 32 32 ASP H H 32 8.010 8.010 8.566 -0.556 17919 38406 1 94 . 1 1 33 33 LYS N N 33 115.130 115.130 117.504 -2.374 17919 38407 1 94 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.324 0.013 17919 38408 1 94 . 1 1 33 33 LYS C C 33 177.870 177.870 178.245 -0.375 17919 38409 1 94 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.675 0.375 17919 38410 1 94 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.425 0.745 17919 38411 1 94 . 1 1 33 33 LYS H H 33 7.430 7.430 7.673 -0.243 17919 38412 1 94 . 1 1 34 34 GLU N N 34 113.870 113.870 116.024 -2.154 17919 38413 1 94 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.434 0.191 17919 38414 1 94 . 1 1 34 34 GLU C C 34 177.840 177.840 177.442 0.398 17919 38415 1 94 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.400 -1.230 17919 38416 1 94 . 1 1 34 34 GLU CB C 34 32.660 32.660 30.815 1.845 17919 38417 1 94 . 1 1 34 34 GLU H H 34 8.740 8.740 8.226 0.514 17919 38418 1 94 . 1 1 35 35 GLY N N 35 108.650 108.650 109.563 -0.913 17919 38419 1 94 . 1 1 35 35 GLY C C 35 173.960 173.960 174.439 -0.479 17919 38420 1 94 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.870 0.210 17919 38421 1 94 . 1 1 35 35 GLY H H 35 8.530 8.530 7.981 0.549 17919 38422 1 94 . 1 1 36 36 ILE N N 36 119.880 119.880 118.901 0.979 17919 38423 1 94 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.466 -0.021 17919 38424 1 94 . 1 1 36 36 ILE C C 36 173.590 173.590 174.230 -0.640 17919 38425 1 94 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.886 -0.136 17919 38426 1 94 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.234 2.346 17919 38427 1 94 . 1 1 36 36 ILE H H 36 6.150 6.150 7.639 -1.489 17919 38428 1 94 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.741 -0.107 17919 38429 1 94 . 1 1 37 37 PRO C C 37 176.940 176.940 176.106 0.834 17919 38430 1 94 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.125 0.535 17919 38431 1 94 . 1 1 37 37 PRO CB C 37 31.850 31.850 30.979 0.871 17919 38432 1 94 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.150 -0.033 17919 38433 1 94 . 1 1 38 38 PRO C C 38 178.320 178.320 178.819 -0.499 17919 38434 1 94 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.819 0.441 17919 38435 1 94 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.799 1.091 17919 38436 1 94 . 1 1 39 39 ASP N N 39 113.380 113.380 115.139 -1.759 17919 38437 1 94 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.363 0.067 17919 38438 1 94 . 1 1 39 39 ASP C C 39 177.090 177.090 177.299 -0.209 17919 38439 1 94 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.430 -0.790 17919 38440 1 94 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.352 -0.812 17919 38441 1 94 . 1 1 39 39 ASP H H 39 8.550 8.550 8.590 -0.040 17919 38442 1 94 . 1 1 40 40 GLN N N 40 116.780 116.780 115.432 1.348 17919 38443 1 94 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.390 0.074 17919 38444 1 94 . 1 1 40 40 GLN C C 40 175.380 175.380 175.923 -0.543 17919 38445 1 94 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.929 -0.289 17919 38446 1 94 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.721 0.419 17919 38447 1 94 . 1 1 40 40 GLN H H 40 7.820 7.820 7.606 0.214 17919 38448 1 94 . 1 1 41 41 GLN N N 41 117.720 117.720 119.925 -2.205 17919 38449 1 94 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.244 0.000 17919 38450 1 94 . 1 1 41 41 GLN C C 41 176.300 176.300 175.228 1.072 17919 38451 1 94 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.767 -0.298 17919 38452 1 94 . 1 1 41 41 GLN CB C 41 31.650 31.650 28.963 2.687 17919 38453 1 94 . 1 1 41 41 GLN H H 41 7.480 7.480 7.479 0.001 17919 38454 1 94 . 1 1 42 42 ARG N N 42 122.680 122.680 122.819 -0.139 17919 38455 1 94 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.658 -0.158 17919 38456 1 94 . 1 1 42 42 ARG C C 42 174.050 174.050 174.934 -0.884 17919 38457 1 94 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.820 0.230 17919 38458 1 94 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.627 -1.877 17919 38459 1 94 . 1 1 42 42 ARG H H 42 8.530 8.530 8.562 -0.032 17919 38460 1 94 . 1 1 43 43 LEU N N 43 124.040 124.040 123.085 0.955 17919 38461 1 94 . 1 1 43 43 LEU C C 43 175.290 175.290 175.456 -0.166 17919 38462 1 94 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.154 -1.174 17919 38463 1 94 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.351 1.439 17919 38464 1 94 . 1 1 43 43 LEU H H 43 8.820 8.820 8.772 0.048 17919 38465 1 94 . 1 1 44 44 ILE N N 44 121.920 121.920 120.311 1.609 17919 38466 1 94 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.813 0.179 17919 38467 1 94 . 1 1 44 44 ILE C C 44 176.060 176.060 174.346 1.714 17919 38468 1 94 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.299 -0.319 17919 38469 1 94 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.499 -0.079 17919 38470 1 94 . 1 1 44 44 ILE H H 44 9.030 9.030 8.752 0.278 17919 38471 1 94 . 1 1 45 45 PHE N N 45 125.390 125.390 126.939 -1.549 17919 38472 1 94 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.966 0.079 17919 38473 1 94 . 1 1 45 45 PHE C C 45 174.470 174.470 174.553 -0.083 17919 38474 1 94 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.257 0.763 17919 38475 1 94 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.014 0.745 17919 38476 1 94 . 1 1 45 45 PHE H H 45 8.830 8.830 8.442 0.388 17919 38477 1 94 . 1 1 46 46 ALA N N 46 132.200 132.200 128.323 3.877 17919 38478 1 94 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.697 -0.007 17919 38479 1 94 . 1 1 46 46 ALA C C 46 177.290 177.290 177.852 -0.562 17919 38480 1 94 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.910 -0.370 17919 38481 1 94 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.663 -0.093 17919 38482 1 94 . 1 1 46 46 ALA H H 46 8.810 8.810 8.758 0.052 17919 38483 1 94 . 1 1 47 47 GLY N N 47 102.340 102.340 103.527 -1.187 17919 38484 1 94 . 1 1 47 47 GLY C C 47 173.810 173.810 174.448 -0.638 17919 38485 1 94 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.862 0.488 17919 38486 1 94 . 1 1 47 47 GLY H H 47 8.130 8.130 8.307 -0.177 17919 38487 1 94 . 1 1 48 48 LYS N N 48 121.570 121.570 122.724 -1.154 17919 38488 1 94 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.571 0.051 17919 38489 1 94 . 1 1 48 48 LYS C C 48 174.700 174.700 175.344 -0.644 17919 38490 1 94 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.259 -0.709 17919 38491 1 94 . 1 1 48 48 LYS CB C 48 34.530 34.530 33.942 0.588 17919 38492 1 94 . 1 1 48 48 LYS H H 48 7.980 7.980 7.975 0.005 17919 38493 1 94 . 1 1 49 49 GLN N N 49 122.410 122.410 125.075 -2.665 17919 38494 1 94 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.496 0.064 17919 38495 1 94 . 1 1 49 49 GLN C C 49 175.670 175.670 174.969 0.701 17919 38496 1 94 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.804 -0.064 17919 38497 1 94 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.611 -0.611 17919 38498 1 94 . 1 1 49 49 GLN H H 49 8.600 8.600 8.657 -0.057 17919 38499 1 94 . 1 1 50 50 LEU N N 50 125.520 125.520 125.791 -0.271 17919 38500 1 94 . 1 1 50 50 LEU HA H 50 4.090 4.090 3.097 0.993 17919 38501 1 94 . 1 1 50 50 LEU C C 50 176.660 176.660 175.864 0.796 17919 38502 1 94 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.945 0.295 17919 38503 1 94 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.682 -0.112 17919 38504 1 94 . 1 1 50 50 LEU H H 50 8.530 8.530 7.879 0.651 17919 38505 1 94 . 1 1 51 51 GLU N N 51 122.940 122.940 123.139 -0.199 17919 38506 1 94 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.541 -0.053 17919 38507 1 94 . 1 1 51 51 GLU C C 51 175.870 175.870 176.395 -0.525 17919 38508 1 94 . 1 1 51 51 GLU CA C 51 55.960 55.960 54.902 1.058 17919 38509 1 94 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.246 -0.676 17919 38510 1 94 . 1 1 51 51 GLU H H 51 8.400 8.400 8.142 0.258 17919 38511 1 94 . 1 1 52 52 ASP N N 52 120.030 120.030 125.659 -5.629 17919 38512 1 94 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.398 -0.039 17919 38513 1 94 . 1 1 52 52 ASP C C 52 177.330 177.330 177.422 -0.092 17919 38514 1 94 . 1 1 52 52 ASP CA C 52 56.960 56.960 56.857 0.103 17919 38515 1 94 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.742 0.108 17919 38516 1 94 . 1 1 52 52 ASP H H 52 8.160 8.160 8.783 -0.623 17919 38517 1 94 . 1 1 53 53 GLY N N 53 106.660 106.660 105.893 0.767 17919 38518 1 94 . 1 1 53 53 GLY C C 53 174.870 174.870 174.699 0.171 17919 38519 1 94 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.972 0.198 17919 38520 1 94 . 1 1 53 53 GLY H H 53 9.390 9.390 8.427 0.963 17919 38521 1 94 . 1 1 54 54 ARG N N 54 119.050 119.050 121.195 -2.145 17919 38522 1 94 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.393 0.302 17919 38523 1 94 . 1 1 54 54 ARG C C 54 175.350 175.350 175.545 -0.195 17919 38524 1 94 . 1 1 54 54 ARG CA C 54 54.390 54.390 55.755 -1.365 17919 38525 1 94 . 1 1 54 54 ARG CB C 54 32.650 32.650 31.167 1.483 17919 38526 1 94 . 1 1 54 54 ARG H H 54 7.460 7.460 7.795 -0.335 17919 38527 1 94 . 1 1 55 55 THR N N 55 108.400 108.400 111.797 -3.397 17919 38528 1 94 . 1 1 55 55 THR HA H 55 5.240 5.240 4.812 0.428 17919 38529 1 94 . 1 1 55 55 THR C C 55 176.560 176.560 176.672 -0.112 17919 38530 1 94 . 1 1 55 55 THR CA C 55 59.690 59.690 60.263 -0.573 17919 38531 1 94 . 1 1 55 55 THR CB C 55 72.260 72.260 70.876 1.384 17919 38532 1 94 . 1 1 55 55 THR H H 55 8.730 8.730 8.733 -0.003 17919 38533 1 94 . 1 1 56 56 LEU N N 56 117.920 117.920 124.426 -6.506 17919 38534 1 94 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.864 0.196 17919 38535 1 94 . 1 1 56 56 LEU C C 56 180.810 180.810 178.465 2.345 17919 38536 1 94 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.610 0.100 17919 38537 1 94 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.235 -0.865 17919 38538 1 94 . 1 1 56 56 LEU H H 56 8.140 8.140 8.358 -0.218 17919 38539 1 94 . 1 1 57 57 SER N N 57 113.330 113.330 114.147 -0.817 17919 38540 1 94 . 1 1 57 57 SER HA H 57 4.370 4.370 4.133 0.237 17919 38541 1 94 . 1 1 57 57 SER C C 57 178.310 178.310 176.550 1.760 17919 38542 1 94 . 1 1 57 57 SER CA C 57 61.080 61.080 61.702 -0.622 17919 38543 1 94 . 1 1 57 57 SER CB C 57 62.530 62.530 62.512 0.018 17919 38544 1 94 . 1 1 57 57 SER H H 57 8.470 8.470 8.386 0.084 17919 38545 1 94 . 1 1 58 58 ASP N N 58 124.190 124.190 122.492 1.698 17919 38546 1 94 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.489 -0.193 17919 38547 1 94 . 1 1 58 58 ASP C C 58 177.400 177.400 177.532 -0.132 17919 38548 1 94 . 1 1 58 58 ASP CA C 58 57.180 57.180 57.048 0.132 17919 38549 1 94 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.766 -0.666 17919 38550 1 94 . 1 1 58 58 ASP H H 58 7.930 7.930 8.339 -0.409 17919 38551 1 94 . 1 1 59 59 TYR N N 59 115.510 115.510 116.501 -0.991 17919 38552 1 94 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.498 0.172 17919 38553 1 94 . 1 1 59 59 TYR C C 59 174.700 174.700 175.131 -0.431 17919 38554 1 94 . 1 1 59 59 TYR CA C 59 58.250 58.250 58.391 -0.141 17919 38555 1 94 . 1 1 59 59 TYR CB C 59 40.070 40.070 37.828 2.241 17919 38556 1 94 . 1 1 59 59 TYR H H 59 7.250 7.250 7.363 -0.113 17919 38557 1 94 . 1 1 60 60 ASN N N 60 115.900 115.900 117.659 -1.759 17919 38558 1 94 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.364 -0.009 17919 38559 1 94 . 1 1 60 60 ASN C C 60 174.340 174.340 174.472 -0.132 17919 38560 1 94 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.281 -0.161 17919 38561 1 94 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.500 -0.090 17919 38562 1 94 . 1 1 60 60 ASN H H 60 8.150 8.150 7.519 0.631 17919 38563 1 94 . 1 1 61 61 ILE N N 61 118.600 118.600 120.488 -1.888 17919 38564 1 94 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.733 -0.340 17919 38565 1 94 . 1 1 61 61 ILE C C 61 174.610 174.610 175.007 -0.397 17919 38566 1 94 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.032 1.388 17919 38567 1 94 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.160 -0.420 17919 38568 1 94 . 1 1 61 61 ILE H H 61 7.250 7.250 8.287 -1.037 17919 38569 1 94 . 1 1 62 62 GLN N N 62 124.740 124.740 126.868 -2.128 17919 38570 1 94 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.612 -0.106 17919 38571 1 94 . 1 1 62 62 GLN C C 62 175.970 175.970 175.412 0.558 17919 38572 1 94 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.747 -0.087 17919 38573 1 94 . 1 1 62 62 GLN CB C 62 31.650 31.650 29.800 1.850 17919 38574 1 94 . 1 1 62 62 GLN H H 62 7.610 7.610 8.214 -0.604 17919 38575 1 94 . 1 1 63 63 LYS N N 63 120.300 120.300 120.055 0.245 17919 38576 1 94 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.900 0.101 17919 38577 1 94 . 1 1 63 63 LYS C C 63 175.810 175.810 177.229 -1.419 17919 38578 1 94 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.917 -0.127 17919 38579 1 94 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.632 1.018 17919 38580 1 94 . 1 1 63 63 LYS H H 63 8.490 8.490 8.462 0.028 17919 38581 1 94 . 1 1 64 64 GLU N N 64 113.950 113.950 119.747 -5.797 17919 38582 1 94 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.950 -0.485 17919 38583 1 94 . 1 1 64 64 GLU C C 64 175.250 175.250 175.487 -0.237 17919 38584 1 94 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.706 0.184 17919 38585 1 94 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.827 -2.927 17919 38586 1 94 . 1 1 64 64 GLU H H 64 9.280 9.280 9.051 0.229 17919 38587 1 94 . 1 1 65 65 SER N N 65 114.730 114.730 115.177 -0.447 17919 38588 1 94 . 1 1 65 65 SER HA H 65 4.640 4.640 4.668 -0.028 17919 38589 1 94 . 1 1 65 65 SER C C 65 172.160 172.160 174.137 -1.977 17919 38590 1 94 . 1 1 65 65 SER CA C 65 60.890 60.890 59.973 0.917 17919 38591 1 94 . 1 1 65 65 SER CB C 65 64.910 64.910 63.987 0.923 17919 38592 1 94 . 1 1 65 65 SER H H 65 7.670 7.670 7.594 0.076 17919 38593 1 94 . 1 1 66 66 THR N N 66 117.110 117.110 122.592 -5.482 17919 38594 1 94 . 1 1 66 66 THR HA H 66 5.270 5.270 4.800 0.470 17919 38595 1 94 . 1 1 66 66 THR C C 66 173.950 173.950 173.877 0.073 17919 38596 1 94 . 1 1 66 66 THR CA C 66 62.340 62.340 62.701 -0.361 17919 38597 1 94 . 1 1 66 66 THR CB C 66 70.080 70.080 70.017 0.063 17919 38598 1 94 . 1 1 66 66 THR H H 66 8.730 8.730 8.617 0.113 17919 38599 1 94 . 1 1 67 67 LEU N N 67 127.110 127.110 126.345 0.765 17919 38600 1 94 . 1 1 67 67 LEU HA H 67 5.060 5.060 5.174 -0.114 17919 38601 1 94 . 1 1 67 67 LEU C C 67 175.770 175.770 175.063 0.707 17919 38602 1 94 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.040 -0.140 17919 38603 1 94 . 1 1 67 67 LEU CB C 67 44.260 44.260 46.158 -1.898 17919 38604 1 94 . 1 1 67 67 LEU H H 67 9.410 9.410 8.449 0.961 17919 38605 1 94 . 1 1 68 68 HIS N N 68 118.380 118.380 123.014 -4.634 17919 38606 1 94 . 1 1 68 68 HIS HA H 68 5.240 5.240 4.863 0.377 17919 38607 1 94 . 1 1 68 68 HIS C C 68 173.150 173.150 174.579 -1.429 17919 38608 1 94 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.158 0.842 17919 38609 1 94 . 1 1 68 68 HIS CB C 68 30.530 30.530 30.228 0.302 17919 38610 1 94 . 1 1 68 68 HIS H H 68 9.230 9.230 8.860 0.370 17919 38611 1 94 . 1 1 69 69 LEU N N 69 124.460 124.460 129.726 -5.266 17919 38612 1 94 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.692 0.498 17919 38613 1 94 . 1 1 69 69 LEU C C 69 175.270 175.270 175.333 -0.063 17919 38614 1 94 . 1 1 69 69 LEU CA C 69 53.890 53.890 56.094 -2.204 17919 38615 1 94 . 1 1 69 69 LEU CB C 69 44.380 44.380 42.603 1.776 17919 38616 1 94 . 1 1 69 69 LEU H H 69 8.340 8.340 7.849 0.491 17919 38617 1 94 . 1 1 70 70 VAL N N 70 126.940 126.940 125.574 1.366 17919 38618 1 94 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.386 -0.036 17919 38619 1 94 . 1 1 70 70 VAL C C 70 174.000 174.000 173.902 0.098 17919 38620 1 94 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.698 1.102 17919 38621 1 94 . 1 1 70 70 VAL CB C 70 34.910 34.910 36.174 -1.264 17919 38622 1 94 . 1 1 70 70 VAL H H 70 9.200 9.200 8.908 0.292 17919 38623 1 94 . 1 1 71 71 LEU N N 71 123.130 123.130 127.151 -4.021 17919 38624 1 94 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.472 0.588 17919 38625 1 94 . 1 1 71 71 LEU C C 71 177.830 177.830 176.230 1.600 17919 38626 1 94 . 1 1 71 71 LEU CA C 71 53.940 53.940 54.526 -0.586 17919 38627 1 94 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.174 -0.324 17919 38628 1 94 . 1 1 71 71 LEU H H 71 8.120 8.120 8.646 -0.526 17919 38629 1 94 . 1 1 72 72 ARG N N 72 123.490 123.490 124.278 -0.788 17919 38630 1 94 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.307 -0.006 17919 38631 1 94 . 1 1 72 72 ARG C C 72 175.350 175.350 174.987 0.363 17919 38632 1 94 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.998 -0.388 17919 38633 1 94 . 1 1 72 72 ARG CB C 72 31.350 31.350 31.265 0.085 17919 38634 1 94 . 1 1 72 72 ARG H H 72 8.580 8.580 8.107 0.473 17919 38635 1 95 . 1 1 2 2 GLN N N 2 123.220 123.220 119.346 3.874 17919 38636 1 95 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.144 0.105 17919 38637 1 95 . 1 1 2 2 GLN C C 2 175.920 175.920 174.591 1.329 17919 38638 1 95 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.184 0.896 17919 38639 1 95 . 1 1 2 2 GLN CB C 2 30.760 30.760 31.953 -1.193 17919 38640 1 95 . 1 1 2 2 GLN H H 2 8.900 8.900 8.132 0.768 17919 38641 1 95 . 1 1 3 3 ILE N N 3 115.340 115.340 117.158 -1.818 17919 38642 1 95 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.174 0.039 17919 38643 1 95 . 1 1 3 3 ILE C C 3 172.450 172.450 173.572 -1.122 17919 38644 1 95 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.484 0.086 17919 38645 1 95 . 1 1 3 3 ILE CB C 3 42.210 42.210 40.765 1.445 17919 38646 1 95 . 1 1 3 3 ILE H H 3 8.320 8.320 7.734 0.586 17919 38647 1 95 . 1 1 4 4 PHE N N 4 118.110 118.110 121.822 -3.712 17919 38648 1 95 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.204 0.426 17919 38649 1 95 . 1 1 4 4 PHE C C 4 175.320 175.320 175.145 0.175 17919 38650 1 95 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.637 -0.427 17919 38651 1 95 . 1 1 4 4 PHE CB C 4 41.480 41.480 40.372 1.108 17919 38652 1 95 . 1 1 4 4 PHE H H 4 8.610 8.610 8.006 0.604 17919 38653 1 95 . 1 1 5 5 VAL N N 5 121.000 121.000 119.000 2.000 17919 38654 1 95 . 1 1 5 5 VAL HA H 5 4.725 4.725 5.104 -0.379 17919 38655 1 95 . 1 1 5 5 VAL C C 5 174.870 174.870 174.393 0.477 17919 38656 1 95 . 1 1 5 5 VAL CA C 5 60.620 60.620 60.027 0.593 17919 38657 1 95 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.629 0.601 17919 38658 1 95 . 1 1 5 5 VAL H H 5 9.300 9.300 8.192 1.108 17919 38659 1 95 . 1 1 6 6 LYS N N 6 127.520 127.520 127.899 -0.379 17919 38660 1 95 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.144 0.223 17919 38661 1 95 . 1 1 6 6 LYS C C 6 177.140 177.140 176.721 0.419 17919 38662 1 95 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.268 0.252 17919 38663 1 95 . 1 1 6 6 LYS CB C 6 35.050 35.050 36.331 -1.281 17919 38664 1 95 . 1 1 6 6 LYS H H 6 8.820 8.820 9.180 -0.360 17919 38665 1 95 . 1 1 7 7 THR N N 7 115.400 115.400 116.879 -1.479 17919 38666 1 95 . 1 1 7 7 THR HA H 7 4.970 4.970 4.709 0.261 17919 38667 1 95 . 1 1 7 7 THR C C 7 176.910 176.910 176.184 0.726 17919 38668 1 95 . 1 1 7 7 THR CA C 7 60.470 60.470 61.331 -0.861 17919 38669 1 95 . 1 1 7 7 THR CB C 7 70.630 70.630 70.425 0.205 17919 38670 1 95 . 1 1 7 7 THR H H 7 8.730 8.730 8.583 0.147 17919 38671 1 95 . 1 1 8 8 LEU N N 8 121.330 121.330 120.900 0.430 17919 38672 1 95 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.029 0.281 17919 38673 1 95 . 1 1 8 8 LEU C C 8 178.800 178.800 177.706 1.094 17919 38674 1 95 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.808 -0.228 17919 38675 1 95 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.777 0.193 17919 38676 1 95 . 1 1 8 8 LEU H H 8 9.100 9.100 8.877 0.223 17919 38677 1 95 . 1 1 9 9 THR N N 9 105.590 105.590 106.498 -0.908 17919 38678 1 95 . 1 1 9 9 THR HA H 9 4.428 4.428 4.265 0.163 17919 38679 1 95 . 1 1 9 9 THR C C 9 175.520 175.520 175.395 0.125 17919 38680 1 95 . 1 1 9 9 THR CA C 9 61.400 61.400 62.346 -0.945 17919 38681 1 95 . 1 1 9 9 THR CB C 9 69.140 69.140 68.126 1.014 17919 38682 1 95 . 1 1 9 9 THR H H 9 7.630 7.630 7.760 -0.130 17919 38683 1 95 . 1 1 10 10 GLY N N 10 108.890 108.890 110.718 -1.828 17919 38684 1 95 . 1 1 10 10 GLY C C 10 174.070 174.070 173.970 0.100 17919 38685 1 95 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.054 0.406 17919 38686 1 95 . 1 1 10 10 GLY H H 10 7.810 7.810 7.612 0.198 17919 38687 1 95 . 1 1 11 11 LYS N N 11 121.600 121.600 122.388 -0.788 17919 38688 1 95 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.305 0.056 17919 38689 1 95 . 1 1 11 11 LYS C C 11 175.940 175.940 175.464 0.476 17919 38690 1 95 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.760 -0.480 17919 38691 1 95 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.497 -0.297 17919 38692 1 95 . 1 1 11 11 LYS H H 11 7.280 7.280 7.850 -0.570 17919 38693 1 95 . 1 1 12 12 THR N N 12 120.440 120.440 118.395 2.045 17919 38694 1 95 . 1 1 12 12 THR HA H 12 5.046 5.046 5.023 0.023 17919 38695 1 95 . 1 1 12 12 THR C C 12 174.320 174.320 173.911 0.409 17919 38696 1 95 . 1 1 12 12 THR CA C 12 62.390 62.390 60.758 1.633 17919 38697 1 95 . 1 1 12 12 THR CB C 12 69.910 69.910 71.058 -1.148 17919 38698 1 95 . 1 1 12 12 THR H H 12 8.650 8.650 8.154 0.496 17919 38699 1 95 . 1 1 13 13 ILE N N 13 127.110 127.110 121.018 6.092 17919 38700 1 95 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.631 -0.087 17919 38701 1 95 . 1 1 13 13 ILE C C 13 175.220 175.220 174.568 0.652 17919 38702 1 95 . 1 1 13 13 ILE CA C 13 59.980 59.980 58.585 1.395 17919 38703 1 95 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.161 0.789 17919 38704 1 95 . 1 1 13 13 ILE H H 13 9.450 9.450 8.697 0.753 17919 38705 1 95 . 1 1 14 14 THR N N 14 121.520 121.520 116.843 4.677 17919 38706 1 95 . 1 1 14 14 THR HA H 14 4.964 4.964 4.802 0.162 17919 38707 1 95 . 1 1 14 14 THR C C 14 173.790 173.790 174.161 -0.371 17919 38708 1 95 . 1 1 14 14 THR CA C 14 61.940 61.940 62.035 -0.095 17919 38709 1 95 . 1 1 14 14 THR CB C 14 69.650 69.650 69.928 -0.278 17919 38710 1 95 . 1 1 14 14 THR H H 14 8.710 8.710 8.222 0.488 17919 38711 1 95 . 1 1 15 15 LEU N N 15 124.800 124.800 126.828 -2.028 17919 38712 1 95 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.695 0.085 17919 38713 1 95 . 1 1 15 15 LEU C C 15 174.670 174.670 175.506 -0.836 17919 38714 1 95 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.889 -1.059 17919 38715 1 95 . 1 1 15 15 LEU CB C 15 47.070 47.070 43.834 3.236 17919 38716 1 95 . 1 1 15 15 LEU H H 15 8.710 8.710 8.420 0.290 17919 38717 1 95 . 1 1 16 16 GLU N N 16 122.160 122.160 122.065 0.095 17919 38718 1 95 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.964 -0.047 17919 38719 1 95 . 1 1 16 16 GLU C C 16 175.860 175.860 176.277 -0.417 17919 38720 1 95 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.730 -0.909 17919 38721 1 95 . 1 1 16 16 GLU CB C 16 29.450 29.450 31.040 -1.590 17919 38722 1 95 . 1 1 16 16 GLU H H 16 8.140 8.140 8.593 -0.453 17919 38723 1 95 . 1 1 17 17 VAL N N 17 117.210 117.210 119.905 -2.695 17919 38724 1 95 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.691 0.023 17919 38725 1 95 . 1 1 17 17 VAL C C 17 174.160 174.160 174.831 -0.671 17919 38726 1 95 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.390 -0.960 17919 38727 1 95 . 1 1 17 17 VAL CB C 17 36.400 36.400 34.990 1.410 17919 38728 1 95 . 1 1 17 17 VAL H H 17 8.900 8.900 7.973 0.927 17919 38729 1 95 . 1 1 18 18 GLU N N 18 118.990 118.990 120.526 -1.536 17919 38730 1 95 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.977 0.102 17919 38731 1 95 . 1 1 18 18 GLU C C 18 176.160 176.160 175.371 0.789 17919 38732 1 95 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.045 0.675 17919 38733 1 95 . 1 1 18 18 GLU CB C 18 30.310 30.310 32.083 -1.773 17919 38734 1 95 . 1 1 18 18 GLU H H 18 8.640 8.640 8.416 0.224 17919 38735 1 95 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.347 -0.206 17919 38736 1 95 . 1 1 19 19 PRO C C 19 175.310 175.310 177.705 -2.395 17919 38737 1 95 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.022 0.448 17919 38738 1 95 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.056 -0.106 17919 38739 1 95 . 1 1 20 20 SER N N 20 103.400 103.400 111.641 -8.241 17919 38740 1 95 . 1 1 20 20 SER HA H 20 4.370 4.370 4.349 0.021 17919 38741 1 95 . 1 1 20 20 SER C C 20 174.660 174.660 174.340 0.320 17919 38742 1 95 . 1 1 20 20 SER CA C 20 57.400 57.400 58.371 -0.971 17919 38743 1 95 . 1 1 20 20 SER CB C 20 63.370 63.370 63.020 0.349 17919 38744 1 95 . 1 1 20 20 SER H H 20 7.040 7.040 8.004 -0.964 17919 38745 1 95 . 1 1 21 21 ASP N N 21 123.480 123.480 123.567 -0.087 17919 38746 1 95 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.686 0.009 17919 38747 1 95 . 1 1 21 21 ASP C C 21 176.360 176.360 175.920 0.440 17919 38748 1 95 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.236 0.464 17919 38749 1 95 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.286 -0.486 17919 38750 1 95 . 1 1 21 21 ASP H H 21 8.030 8.030 7.909 0.121 17919 38751 1 95 . 1 1 22 22 THR N N 22 108.800 108.800 114.602 -5.802 17919 38752 1 95 . 1 1 22 22 THR HA H 22 4.920 4.920 4.515 0.405 17919 38753 1 95 . 1 1 22 22 THR C C 22 176.750 176.750 176.390 0.360 17919 38754 1 95 . 1 1 22 22 THR CA C 22 59.690 59.690 61.920 -2.230 17919 38755 1 95 . 1 1 22 22 THR CB C 22 71.200 71.200 70.052 1.148 17919 38756 1 95 . 1 1 22 22 THR H H 22 7.900 7.900 8.144 -0.244 17919 38757 1 95 . 1 1 23 23 ILE N N 23 121.190 121.190 124.034 -2.844 17919 38758 1 95 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.674 -0.017 17919 38759 1 95 . 1 1 23 23 ILE C C 23 179.040 179.040 177.517 1.523 17919 38760 1 95 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.427 -0.167 17919 38761 1 95 . 1 1 23 23 ILE CB C 23 34.350 34.350 35.894 -1.544 17919 38762 1 95 . 1 1 23 23 ILE H H 23 8.560 8.560 9.255 -0.695 17919 38763 1 95 . 1 1 24 24 GLU N N 24 120.830 120.830 119.873 0.957 17919 38764 1 95 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.914 0.003 17919 38765 1 95 . 1 1 24 24 GLU C C 24 178.640 178.640 178.763 -0.123 17919 38766 1 95 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.568 0.652 17919 38767 1 95 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.465 -1.185 17919 38768 1 95 . 1 1 24 24 GLU H H 24 9.760 9.760 8.224 1.536 17919 38769 1 95 . 1 1 25 25 ASN N N 25 120.570 120.570 117.614 2.956 17919 38770 1 95 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.509 0.016 17919 38771 1 95 . 1 1 25 25 ASN C C 25 178.380 178.380 177.726 0.654 17919 38772 1 95 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.003 0.057 17919 38773 1 95 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.468 -0.017 17919 38774 1 95 . 1 1 25 25 ASN H H 25 7.920 7.920 7.955 -0.035 17919 38775 1 95 . 1 1 26 26 VAL N N 26 121.710 121.710 119.643 2.067 17919 38776 1 95 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.445 -0.048 17919 38777 1 95 . 1 1 26 26 VAL C C 26 177.950 177.950 177.861 0.089 17919 38778 1 95 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.517 1.143 17919 38779 1 95 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.238 -0.398 17919 38780 1 95 . 1 1 26 26 VAL H H 26 8.070 8.070 7.580 0.490 17919 38781 1 95 . 1 1 27 27 LYS N N 27 118.860 118.860 119.681 -0.821 17919 38782 1 95 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.120 0.460 17919 38783 1 95 . 1 1 27 27 LYS C C 27 180.550 180.550 179.397 1.153 17919 38784 1 95 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.541 -0.291 17919 38785 1 95 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.124 1.606 17919 38786 1 95 . 1 1 27 27 LYS H H 27 8.560 8.560 7.696 0.864 17919 38787 1 95 . 1 1 28 28 ALA N N 28 123.440 123.440 120.595 2.845 17919 38788 1 95 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.046 0.114 17919 38789 1 95 . 1 1 28 28 ALA C C 28 180.300 180.300 179.233 1.067 17919 38790 1 95 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.040 0.330 17919 38791 1 95 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.369 -0.659 17919 38792 1 95 . 1 1 28 28 ALA H H 28 8.060 8.060 8.077 -0.017 17919 38793 1 95 . 1 1 29 29 LYS N N 29 119.940 119.940 119.953 -0.013 17919 38794 1 95 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.235 -0.028 17919 38795 1 95 . 1 1 29 29 LYS C C 29 180.320 180.320 179.082 1.238 17919 38796 1 95 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.359 0.291 17919 38797 1 95 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.108 1.182 17919 38798 1 95 . 1 1 29 29 LYS H H 29 7.850 7.850 7.621 0.229 17919 38799 1 95 . 1 1 30 30 ILE N N 30 121.080 121.080 119.433 1.647 17919 38800 1 95 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.526 -0.019 17919 38801 1 95 . 1 1 30 30 ILE C C 30 178.310 178.310 177.810 0.500 17919 38802 1 95 . 1 1 30 30 ILE CA C 30 66.150 66.150 64.718 1.432 17919 38803 1 95 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.518 -0.718 17919 38804 1 95 . 1 1 30 30 ILE H H 30 8.280 8.280 8.012 0.268 17919 38805 1 95 . 1 1 31 31 GLN N N 31 123.490 123.490 119.643 3.847 17919 38806 1 95 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.970 -0.141 17919 38807 1 95 . 1 1 31 31 GLN C C 31 178.890 178.890 178.308 0.582 17919 38808 1 95 . 1 1 31 31 GLN CA C 31 60.000 60.000 58.625 1.375 17919 38809 1 95 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.043 -0.323 17919 38810 1 95 . 1 1 31 31 GLN H H 31 8.580 8.580 8.047 0.533 17919 38811 1 95 . 1 1 32 32 ASP N N 32 119.360 119.360 119.541 -0.181 17919 38812 1 95 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.434 -0.080 17919 38813 1 95 . 1 1 32 32 ASP C C 32 177.250 177.250 178.216 -0.966 17919 38814 1 95 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.689 0.501 17919 38815 1 95 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.472 0.108 17919 38816 1 95 . 1 1 32 32 ASP H H 32 8.010 8.010 8.353 -0.343 17919 38817 1 95 . 1 1 33 33 LYS N N 33 115.130 115.130 118.076 -2.946 17919 38818 1 95 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.261 0.076 17919 38819 1 95 . 1 1 33 33 LYS C C 33 177.870 177.870 177.941 -0.071 17919 38820 1 95 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.484 -0.434 17919 38821 1 95 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.543 0.627 17919 38822 1 95 . 1 1 33 33 LYS H H 33 7.430 7.430 7.505 -0.075 17919 38823 1 95 . 1 1 34 34 GLU N N 34 113.870 113.870 114.667 -0.797 17919 38824 1 95 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.486 0.139 17919 38825 1 95 . 1 1 34 34 GLU C C 34 177.840 177.840 177.342 0.498 17919 38826 1 95 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.012 -0.842 17919 38827 1 95 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.688 0.972 17919 38828 1 95 . 1 1 34 34 GLU H H 34 8.740 8.740 7.893 0.847 17919 38829 1 95 . 1 1 35 35 GLY N N 35 108.650 108.650 109.300 -0.650 17919 38830 1 95 . 1 1 35 35 GLY C C 35 173.960 173.960 174.119 -0.159 17919 38831 1 95 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.564 0.516 17919 38832 1 95 . 1 1 35 35 GLY H H 35 8.530 8.530 8.186 0.344 17919 38833 1 95 . 1 1 36 36 ILE N N 36 119.880 119.880 120.898 -1.018 17919 38834 1 95 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.322 0.123 17919 38835 1 95 . 1 1 36 36 ILE C C 36 173.590 173.590 173.919 -0.329 17919 38836 1 95 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.709 0.041 17919 38837 1 95 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.874 1.706 17919 38838 1 95 . 1 1 36 36 ILE H H 36 6.150 6.150 7.602 -1.452 17919 38839 1 95 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.990 -0.356 17919 38840 1 95 . 1 1 37 37 PRO C C 37 176.940 176.940 176.391 0.549 17919 38841 1 95 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.438 0.222 17919 38842 1 95 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.169 0.680 17919 38843 1 95 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.025 0.092 17919 38844 1 95 . 1 1 38 38 PRO C C 38 178.320 178.320 178.340 -0.020 17919 38845 1 95 . 1 1 38 38 PRO CA C 38 66.260 66.260 66.206 0.054 17919 38846 1 95 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.711 1.179 17919 38847 1 95 . 1 1 39 39 ASP N N 39 113.380 113.380 116.746 -3.366 17919 38848 1 95 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.265 0.165 17919 38849 1 95 . 1 1 39 39 ASP C C 39 177.090 177.090 177.501 -0.411 17919 38850 1 95 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.714 -1.074 17919 38851 1 95 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.312 -0.772 17919 38852 1 95 . 1 1 39 39 ASP H H 39 8.550 8.550 8.744 -0.194 17919 38853 1 95 . 1 1 40 40 GLN N N 40 116.780 116.780 116.376 0.404 17919 38854 1 95 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.112 0.352 17919 38855 1 95 . 1 1 40 40 GLN C C 40 175.380 175.380 175.763 -0.383 17919 38856 1 95 . 1 1 40 40 GLN CA C 40 55.640 55.640 57.146 -1.506 17919 38857 1 95 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.234 0.906 17919 38858 1 95 . 1 1 40 40 GLN H H 40 7.820 7.820 7.592 0.228 17919 38859 1 95 . 1 1 41 41 GLN N N 41 117.720 117.720 118.001 -0.281 17919 38860 1 95 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.598 -0.354 17919 38861 1 95 . 1 1 41 41 GLN C C 41 176.300 176.300 174.594 1.706 17919 38862 1 95 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.110 1.360 17919 38863 1 95 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.900 1.750 17919 38864 1 95 . 1 1 41 41 GLN H H 41 7.480 7.480 7.304 0.176 17919 38865 1 95 . 1 1 42 42 ARG N N 42 122.680 122.680 123.535 -0.855 17919 38866 1 95 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.532 -0.032 17919 38867 1 95 . 1 1 42 42 ARG C C 42 174.050 174.050 174.939 -0.889 17919 38868 1 95 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.141 -0.091 17919 38869 1 95 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.438 -0.688 17919 38870 1 95 . 1 1 42 42 ARG H H 42 8.530 8.530 8.339 0.191 17919 38871 1 95 . 1 1 43 43 LEU N N 43 124.040 124.040 123.896 0.144 17919 38872 1 95 . 1 1 43 43 LEU C C 43 175.290 175.290 175.342 -0.052 17919 38873 1 95 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.733 -0.753 17919 38874 1 95 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.272 2.518 17919 38875 1 95 . 1 1 43 43 LEU H H 43 8.820 8.820 8.797 0.023 17919 38876 1 95 . 1 1 44 44 ILE N N 44 121.920 121.920 118.797 3.123 17919 38877 1 95 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.321 -0.329 17919 38878 1 95 . 1 1 44 44 ILE C C 44 176.060 176.060 174.244 1.816 17919 38879 1 95 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.138 -0.158 17919 38880 1 95 . 1 1 44 44 ILE CB C 44 41.420 41.420 42.101 -0.681 17919 38881 1 95 . 1 1 44 44 ILE H H 44 9.030 9.030 7.847 1.183 17919 38882 1 95 . 1 1 45 45 PHE N N 45 125.390 125.390 126.500 -1.110 17919 38883 1 95 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.106 -0.061 17919 38884 1 95 . 1 1 45 45 PHE C C 45 174.470 174.470 174.553 -0.083 17919 38885 1 95 . 1 1 45 45 PHE CA C 45 57.020 57.020 57.525 -0.505 17919 38886 1 95 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.745 1.015 17919 38887 1 95 . 1 1 45 45 PHE H H 45 8.830 8.830 8.223 0.607 17919 38888 1 95 . 1 1 46 46 ALA N N 46 132.200 132.200 129.286 2.914 17919 38889 1 95 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.716 -0.026 17919 38890 1 95 . 1 1 46 46 ALA C C 46 177.290 177.290 177.229 0.061 17919 38891 1 95 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.773 -0.233 17919 38892 1 95 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.605 -0.035 17919 38893 1 95 . 1 1 46 46 ALA H H 46 8.810 8.810 8.625 0.185 17919 38894 1 95 . 1 1 47 47 GLY N N 47 102.340 102.340 104.387 -2.047 17919 38895 1 95 . 1 1 47 47 GLY C C 47 173.810 173.810 174.321 -0.511 17919 38896 1 95 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.349 0.001 17919 38897 1 95 . 1 1 47 47 GLY H H 47 8.130 8.130 8.486 -0.356 17919 38898 1 95 . 1 1 48 48 LYS N N 48 121.570 121.570 120.956 0.614 17919 38899 1 95 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.618 0.004 17919 38900 1 95 . 1 1 48 48 LYS C C 48 174.700 174.700 175.859 -1.159 17919 38901 1 95 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.986 -0.436 17919 38902 1 95 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.182 0.348 17919 38903 1 95 . 1 1 48 48 LYS H H 48 7.980 7.980 7.940 0.040 17919 38904 1 95 . 1 1 49 49 GLN N N 49 122.410 122.410 123.735 -1.325 17919 38905 1 95 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.681 -0.121 17919 38906 1 95 . 1 1 49 49 GLN C C 49 175.670 175.670 175.401 0.269 17919 38907 1 95 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.702 0.038 17919 38908 1 95 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.697 -0.697 17919 38909 1 95 . 1 1 49 49 GLN H H 49 8.600 8.600 8.528 0.072 17919 38910 1 95 . 1 1 50 50 LEU N N 50 125.520 125.520 128.618 -3.098 17919 38911 1 95 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.071 0.019 17919 38912 1 95 . 1 1 50 50 LEU C C 50 176.660 176.660 175.489 1.171 17919 38913 1 95 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.845 0.395 17919 38914 1 95 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.318 -0.748 17919 38915 1 95 . 1 1 50 50 LEU H H 50 8.530 8.530 8.100 0.430 17919 38916 1 95 . 1 1 51 51 GLU N N 51 122.940 122.940 123.359 -0.419 17919 38917 1 95 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.651 -0.163 17919 38918 1 95 . 1 1 51 51 GLU C C 51 175.870 175.870 176.396 -0.526 17919 38919 1 95 . 1 1 51 51 GLU CA C 51 55.960 55.960 54.984 0.976 17919 38920 1 95 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.879 -1.309 17919 38921 1 95 . 1 1 51 51 GLU H H 51 8.400 8.400 8.702 -0.302 17919 38922 1 95 . 1 1 52 52 ASP N N 52 120.030 120.030 123.753 -3.723 17919 38923 1 95 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.411 -0.052 17919 38924 1 95 . 1 1 52 52 ASP C C 52 177.330 177.330 178.255 -0.925 17919 38925 1 95 . 1 1 52 52 ASP CA C 52 56.960 56.960 58.098 -1.138 17919 38926 1 95 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.833 0.017 17919 38927 1 95 . 1 1 52 52 ASP H H 52 8.160 8.160 8.810 -0.650 17919 38928 1 95 . 1 1 53 53 GLY N N 53 106.660 106.660 104.478 2.182 17919 38929 1 95 . 1 1 53 53 GLY C C 53 174.870 174.870 174.803 0.067 17919 38930 1 95 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.965 0.205 17919 38931 1 95 . 1 1 53 53 GLY H H 53 9.390 9.390 8.290 1.100 17919 38932 1 95 . 1 1 54 54 ARG N N 54 119.050 119.050 120.640 -1.590 17919 38933 1 95 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.554 0.141 17919 38934 1 95 . 1 1 54 54 ARG C C 54 175.350 175.350 175.799 -0.449 17919 38935 1 95 . 1 1 54 54 ARG CA C 54 54.390 54.390 55.441 -1.051 17919 38936 1 95 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.324 0.326 17919 38937 1 95 . 1 1 54 54 ARG H H 54 7.460 7.460 7.659 -0.199 17919 38938 1 95 . 1 1 55 55 THR N N 55 108.400 108.400 111.805 -3.405 17919 38939 1 95 . 1 1 55 55 THR HA H 55 5.240 5.240 5.022 0.218 17919 38940 1 95 . 1 1 55 55 THR C C 55 176.560 176.560 176.546 0.014 17919 38941 1 95 . 1 1 55 55 THR CA C 55 59.690 59.690 60.180 -0.490 17919 38942 1 95 . 1 1 55 55 THR CB C 55 72.260 72.260 71.272 0.988 17919 38943 1 95 . 1 1 55 55 THR H H 55 8.730 8.730 8.332 0.397 17919 38944 1 95 . 1 1 56 56 LEU N N 56 117.920 117.920 123.326 -5.406 17919 38945 1 95 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.968 0.092 17919 38946 1 95 . 1 1 56 56 LEU C C 56 180.810 180.810 178.947 1.863 17919 38947 1 95 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.608 0.102 17919 38948 1 95 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.621 -1.251 17919 38949 1 95 . 1 1 56 56 LEU H H 56 8.140 8.140 8.449 -0.309 17919 38950 1 95 . 1 1 57 57 SER N N 57 113.330 113.330 113.924 -0.594 17919 38951 1 95 . 1 1 57 57 SER HA H 57 4.370 4.370 4.137 0.233 17919 38952 1 95 . 1 1 57 57 SER C C 57 178.310 178.310 176.792 1.518 17919 38953 1 95 . 1 1 57 57 SER CA C 57 61.080 61.080 62.029 -0.949 17919 38954 1 95 . 1 1 57 57 SER CB C 57 62.530 62.530 62.697 -0.167 17919 38955 1 95 . 1 1 57 57 SER H H 57 8.470 8.470 7.950 0.520 17919 38956 1 95 . 1 1 58 58 ASP N N 58 124.190 124.190 121.249 2.941 17919 38957 1 95 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.376 -0.080 17919 38958 1 95 . 1 1 58 58 ASP C C 58 177.400 177.400 176.848 0.552 17919 38959 1 95 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.283 0.897 17919 38960 1 95 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.396 -0.296 17919 38961 1 95 . 1 1 58 58 ASP H H 58 7.930 7.930 7.912 0.018 17919 38962 1 95 . 1 1 59 59 TYR N N 59 115.510 115.510 116.251 -0.741 17919 38963 1 95 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.555 0.115 17919 38964 1 95 . 1 1 59 59 TYR C C 59 174.700 174.700 175.681 -0.981 17919 38965 1 95 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.559 0.691 17919 38966 1 95 . 1 1 59 59 TYR CB C 59 40.070 40.070 37.971 2.099 17919 38967 1 95 . 1 1 59 59 TYR H H 59 7.250 7.250 7.267 -0.017 17919 38968 1 95 . 1 1 60 60 ASN N N 60 115.900 115.900 117.401 -1.501 17919 38969 1 95 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.426 -0.071 17919 38970 1 95 . 1 1 60 60 ASN C C 60 174.340 174.340 174.258 0.082 17919 38971 1 95 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.465 -0.345 17919 38972 1 95 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.612 -0.202 17919 38973 1 95 . 1 1 60 60 ASN H H 60 8.150 8.150 7.933 0.217 17919 38974 1 95 . 1 1 61 61 ILE N N 61 118.600 118.600 119.725 -1.125 17919 38975 1 95 . 1 1 61 61 ILE HA H 61 3.393 3.393 4.025 -0.632 17919 38976 1 95 . 1 1 61 61 ILE C C 61 174.610 174.610 174.665 -0.055 17919 38977 1 95 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.525 0.895 17919 38978 1 95 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.916 -1.176 17919 38979 1 95 . 1 1 61 61 ILE H H 61 7.250 7.250 8.001 -0.751 17919 38980 1 95 . 1 1 62 62 GLN N N 62 124.740 124.740 127.265 -2.525 17919 38981 1 95 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.659 -0.153 17919 38982 1 95 . 1 1 62 62 GLN C C 62 175.970 175.970 174.912 1.058 17919 38983 1 95 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.547 0.113 17919 38984 1 95 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.063 0.587 17919 38985 1 95 . 1 1 62 62 GLN H H 62 7.610 7.610 7.920 -0.310 17919 38986 1 95 . 1 1 63 63 LYS N N 63 120.300 120.300 118.377 1.923 17919 38987 1 95 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.950 0.051 17919 38988 1 95 . 1 1 63 63 LYS C C 63 175.810 175.810 176.959 -1.149 17919 38989 1 95 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.002 -0.212 17919 38990 1 95 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.675 0.975 17919 38991 1 95 . 1 1 63 63 LYS H H 63 8.490 8.490 8.490 -0.000 17919 38992 1 95 . 1 1 64 64 GLU N N 64 113.950 113.950 118.870 -4.920 17919 38993 1 95 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.435 0.030 17919 38994 1 95 . 1 1 64 64 GLU C C 64 175.250 175.250 175.504 -0.254 17919 38995 1 95 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.753 0.137 17919 38996 1 95 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.727 -2.826 17919 38997 1 95 . 1 1 64 64 GLU H H 64 9.280 9.280 8.499 0.781 17919 38998 1 95 . 1 1 65 65 SER N N 65 114.730 114.730 115.158 -0.428 17919 38999 1 95 . 1 1 65 65 SER HA H 65 4.640 4.640 4.565 0.075 17919 39000 1 95 . 1 1 65 65 SER C C 65 172.160 172.160 174.276 -2.116 17919 39001 1 95 . 1 1 65 65 SER CA C 65 60.890 60.890 58.030 2.860 17919 39002 1 95 . 1 1 65 65 SER CB C 65 64.910 64.910 63.442 1.468 17919 39003 1 95 . 1 1 65 65 SER H H 65 7.670 7.670 7.330 0.340 17919 39004 1 95 . 1 1 66 66 THR N N 66 117.110 117.110 120.794 -3.684 17919 39005 1 95 . 1 1 66 66 THR HA H 66 5.270 5.270 4.584 0.686 17919 39006 1 95 . 1 1 66 66 THR C C 66 173.950 173.950 174.050 -0.100 17919 39007 1 95 . 1 1 66 66 THR CA C 66 62.340 62.340 62.518 -0.178 17919 39008 1 95 . 1 1 66 66 THR CB C 66 70.080 70.080 69.535 0.545 17919 39009 1 95 . 1 1 66 66 THR H H 66 8.730 8.730 8.266 0.464 17919 39010 1 95 . 1 1 67 67 LEU N N 67 127.110 127.110 125.604 1.506 17919 39011 1 95 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.666 0.394 17919 39012 1 95 . 1 1 67 67 LEU C C 67 175.770 175.770 176.345 -0.575 17919 39013 1 95 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.773 0.127 17919 39014 1 95 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.437 0.823 17919 39015 1 95 . 1 1 67 67 LEU H H 67 9.410 9.410 7.838 1.572 17919 39016 1 95 . 1 1 68 68 HIS N N 68 118.380 118.380 121.027 -2.647 17919 39017 1 95 . 1 1 68 68 HIS HA H 68 5.240 5.240 4.844 0.396 17919 39018 1 95 . 1 1 68 68 HIS C C 68 173.150 173.150 175.415 -2.265 17919 39019 1 95 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.581 0.419 17919 39020 1 95 . 1 1 68 68 HIS CB C 68 30.530 30.530 28.366 2.164 17919 39021 1 95 . 1 1 68 68 HIS H H 68 9.230 9.230 8.522 0.708 17919 39022 1 95 . 1 1 69 69 LEU N N 69 124.460 124.460 124.418 0.042 17919 39023 1 95 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.177 1.013 17919 39024 1 95 . 1 1 69 69 LEU C C 69 175.270 175.270 175.098 0.172 17919 39025 1 95 . 1 1 69 69 LEU CA C 69 53.890 53.890 56.331 -2.441 17919 39026 1 95 . 1 1 69 69 LEU CB C 69 44.380 44.380 42.156 2.224 17919 39027 1 95 . 1 1 69 69 LEU H H 69 8.340 8.340 8.094 0.246 17919 39028 1 95 . 1 1 70 70 VAL N N 70 126.940 126.940 126.718 0.222 17919 39029 1 95 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.435 -0.085 17919 39030 1 95 . 1 1 70 70 VAL C C 70 174.000 174.000 174.739 -0.739 17919 39031 1 95 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.905 -0.105 17919 39032 1 95 . 1 1 70 70 VAL CB C 70 34.910 34.910 34.528 0.382 17919 39033 1 95 . 1 1 70 70 VAL H H 70 9.200 9.200 8.843 0.357 17919 39034 1 95 . 1 1 71 71 LEU N N 71 123.130 123.130 126.282 -3.152 17919 39035 1 95 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.142 -0.082 17919 39036 1 95 . 1 1 71 71 LEU C C 71 177.830 177.830 176.964 0.866 17919 39037 1 95 . 1 1 71 71 LEU CA C 71 53.940 53.940 54.179 -0.239 17919 39038 1 95 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.301 -0.452 17919 39039 1 95 . 1 1 71 71 LEU H H 71 8.120 8.120 8.561 -0.441 17919 39040 1 95 . 1 1 72 72 ARG N N 72 123.490 123.490 123.103 0.387 17919 39041 1 95 . 1 1 72 72 ARG HA H 72 4.301 4.301 5.023 -0.722 17919 39042 1 95 . 1 1 72 72 ARG C C 72 175.350 175.350 175.082 0.268 17919 39043 1 95 . 1 1 72 72 ARG CA C 72 55.610 55.610 54.407 1.203 17919 39044 1 95 . 1 1 72 72 ARG CB C 72 31.350 31.350 32.477 -1.127 17919 39045 1 95 . 1 1 72 72 ARG H H 72 8.580 8.580 8.281 0.299 17919 39046 1 96 . 1 1 2 2 GLN N N 2 123.220 123.220 119.771 3.449 17919 39047 1 96 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.323 -0.074 17919 39048 1 96 . 1 1 2 2 GLN C C 2 175.920 175.920 174.762 1.158 17919 39049 1 96 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.686 0.394 17919 39050 1 96 . 1 1 2 2 GLN CB C 2 30.760 30.760 31.618 -0.858 17919 39051 1 96 . 1 1 2 2 GLN H H 2 8.900 8.900 8.413 0.487 17919 39052 1 96 . 1 1 3 3 ILE N N 3 115.340 115.340 117.915 -2.575 17919 39053 1 96 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.098 0.115 17919 39054 1 96 . 1 1 3 3 ILE C C 3 172.450 172.450 173.016 -0.566 17919 39055 1 96 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.485 0.085 17919 39056 1 96 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.314 0.896 17919 39057 1 96 . 1 1 3 3 ILE H H 3 8.320 8.320 7.926 0.394 17919 39058 1 96 . 1 1 4 4 PHE N N 4 118.110 118.110 116.784 1.326 17919 39059 1 96 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.451 0.179 17919 39060 1 96 . 1 1 4 4 PHE C C 4 175.320 175.320 174.515 0.805 17919 39061 1 96 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.486 -0.276 17919 39062 1 96 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.889 -0.409 17919 39063 1 96 . 1 1 4 4 PHE H H 4 8.610 8.610 7.964 0.646 17919 39064 1 96 . 1 1 5 5 VAL N N 5 121.000 121.000 121.012 -0.012 17919 39065 1 96 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.936 -0.211 17919 39066 1 96 . 1 1 5 5 VAL C C 5 174.870 174.870 175.098 -0.228 17919 39067 1 96 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.543 -0.923 17919 39068 1 96 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.253 -0.023 17919 39069 1 96 . 1 1 5 5 VAL H H 5 9.300 9.300 8.568 0.732 17919 39070 1 96 . 1 1 6 6 LYS N N 6 127.520 127.520 127.518 0.002 17919 39071 1 96 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.213 0.154 17919 39072 1 96 . 1 1 6 6 LYS C C 6 177.140 177.140 176.790 0.350 17919 39073 1 96 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.588 -0.068 17919 39074 1 96 . 1 1 6 6 LYS CB C 6 35.050 35.050 33.697 1.353 17919 39075 1 96 . 1 1 6 6 LYS H H 6 8.820 8.820 9.220 -0.400 17919 39076 1 96 . 1 1 7 7 THR N N 7 115.400 115.400 114.982 0.418 17919 39077 1 96 . 1 1 7 7 THR HA H 7 4.970 4.970 4.360 0.610 17919 39078 1 96 . 1 1 7 7 THR C C 7 176.910 176.910 176.112 0.798 17919 39079 1 96 . 1 1 7 7 THR CA C 7 60.470 60.470 61.064 -0.594 17919 39080 1 96 . 1 1 7 7 THR CB C 7 70.630 70.630 70.508 0.122 17919 39081 1 96 . 1 1 7 7 THR H H 7 8.730 8.730 8.818 -0.088 17919 39082 1 96 . 1 1 8 8 LEU N N 8 121.330 121.330 121.918 -0.588 17919 39083 1 96 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.193 0.117 17919 39084 1 96 . 1 1 8 8 LEU C C 8 178.800 178.800 177.956 0.844 17919 39085 1 96 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.526 0.054 17919 39086 1 96 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.020 -0.050 17919 39087 1 96 . 1 1 8 8 LEU H H 8 9.100 9.100 8.854 0.246 17919 39088 1 96 . 1 1 9 9 THR N N 9 105.590 105.590 106.517 -0.927 17919 39089 1 96 . 1 1 9 9 THR HA H 9 4.428 4.428 4.282 0.146 17919 39090 1 96 . 1 1 9 9 THR C C 9 175.520 175.520 175.533 -0.013 17919 39091 1 96 . 1 1 9 9 THR CA C 9 61.400 61.400 61.740 -0.340 17919 39092 1 96 . 1 1 9 9 THR CB C 9 69.140 69.140 68.957 0.183 17919 39093 1 96 . 1 1 9 9 THR H H 9 7.630 7.630 7.737 -0.107 17919 39094 1 96 . 1 1 10 10 GLY N N 10 108.890 108.890 110.292 -1.402 17919 39095 1 96 . 1 1 10 10 GLY C C 10 174.070 174.070 174.242 -0.172 17919 39096 1 96 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.273 0.187 17919 39097 1 96 . 1 1 10 10 GLY H H 10 7.810 7.810 7.523 0.287 17919 39098 1 96 . 1 1 11 11 LYS N N 11 121.600 121.600 119.663 1.937 17919 39099 1 96 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.829 -0.468 17919 39100 1 96 . 1 1 11 11 LYS C C 11 175.940 175.940 175.112 0.828 17919 39101 1 96 . 1 1 11 11 LYS CA C 11 56.280 56.280 53.905 2.375 17919 39102 1 96 . 1 1 11 11 LYS CB C 11 33.200 33.200 35.055 -1.855 17919 39103 1 96 . 1 1 11 11 LYS H H 11 7.280 7.280 8.012 -0.732 17919 39104 1 96 . 1 1 12 12 THR N N 12 120.440 120.440 117.433 3.007 17919 39105 1 96 . 1 1 12 12 THR HA H 12 5.046 5.046 5.245 -0.199 17919 39106 1 96 . 1 1 12 12 THR C C 12 174.320 174.320 173.884 0.436 17919 39107 1 96 . 1 1 12 12 THR CA C 12 62.390 62.390 61.312 1.078 17919 39108 1 96 . 1 1 12 12 THR CB C 12 69.910 69.910 70.152 -0.242 17919 39109 1 96 . 1 1 12 12 THR H H 12 8.650 8.650 8.412 0.238 17919 39110 1 96 . 1 1 13 13 ILE N N 13 127.110 127.110 123.211 3.899 17919 39111 1 96 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.829 -0.285 17919 39112 1 96 . 1 1 13 13 ILE C C 13 175.220 175.220 173.977 1.243 17919 39113 1 96 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.185 0.795 17919 39114 1 96 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.825 -0.875 17919 39115 1 96 . 1 1 13 13 ILE H H 13 9.450 9.450 8.669 0.781 17919 39116 1 96 . 1 1 14 14 THR N N 14 121.520 121.520 120.667 0.853 17919 39117 1 96 . 1 1 14 14 THR HA H 14 4.964 4.964 5.060 -0.096 17919 39118 1 96 . 1 1 14 14 THR C C 14 173.790 173.790 173.078 0.712 17919 39119 1 96 . 1 1 14 14 THR CA C 14 61.940 61.940 61.686 0.254 17919 39120 1 96 . 1 1 14 14 THR CB C 14 69.650 69.650 70.529 -0.880 17919 39121 1 96 . 1 1 14 14 THR H H 14 8.710 8.710 8.361 0.349 17919 39122 1 96 . 1 1 15 15 LEU N N 15 124.800 124.800 127.592 -2.792 17919 39123 1 96 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.781 -0.001 17919 39124 1 96 . 1 1 15 15 LEU C C 15 174.670 174.670 175.202 -0.532 17919 39125 1 96 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.237 -0.407 17919 39126 1 96 . 1 1 15 15 LEU CB C 15 47.070 47.070 43.407 3.663 17919 39127 1 96 . 1 1 15 15 LEU H H 15 8.710 8.710 8.502 0.208 17919 39128 1 96 . 1 1 16 16 GLU N N 16 122.160 122.160 125.032 -2.872 17919 39129 1 96 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.002 -0.085 17919 39130 1 96 . 1 1 16 16 GLU C C 16 175.860 175.860 176.017 -0.157 17919 39131 1 96 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.975 -1.155 17919 39132 1 96 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.455 -1.005 17919 39133 1 96 . 1 1 16 16 GLU H H 16 8.140 8.140 8.818 -0.678 17919 39134 1 96 . 1 1 17 17 VAL N N 17 117.210 117.210 119.752 -2.542 17919 39135 1 96 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.770 -0.056 17919 39136 1 96 . 1 1 17 17 VAL C C 17 174.160 174.160 174.195 -0.035 17919 39137 1 96 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.881 -0.451 17919 39138 1 96 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.759 0.641 17919 39139 1 96 . 1 1 17 17 VAL H H 17 8.900 8.900 8.490 0.410 17919 39140 1 96 . 1 1 18 18 GLU N N 18 118.990 118.990 117.872 1.118 17919 39141 1 96 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.741 0.338 17919 39142 1 96 . 1 1 18 18 GLU C C 18 176.160 176.160 174.545 1.615 17919 39143 1 96 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.373 -0.653 17919 39144 1 96 . 1 1 18 18 GLU CB C 18 30.310 30.310 31.006 -0.696 17919 39145 1 96 . 1 1 18 18 GLU H H 18 8.640 8.640 7.872 0.768 17919 39146 1 96 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.302 -0.161 17919 39147 1 96 . 1 1 19 19 PRO C C 19 175.310 175.310 177.551 -2.241 17919 39148 1 96 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.342 0.128 17919 39149 1 96 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.804 0.146 17919 39150 1 96 . 1 1 20 20 SER N N 20 103.400 103.400 110.361 -6.961 17919 39151 1 96 . 1 1 20 20 SER HA H 20 4.370 4.370 4.370 0.000 17919 39152 1 96 . 1 1 20 20 SER C C 20 174.660 174.660 174.253 0.407 17919 39153 1 96 . 1 1 20 20 SER CA C 20 57.400 57.400 58.958 -1.558 17919 39154 1 96 . 1 1 20 20 SER CB C 20 63.370 63.370 63.215 0.155 17919 39155 1 96 . 1 1 20 20 SER H H 20 7.040 7.040 7.988 -0.948 17919 39156 1 96 . 1 1 21 21 ASP N N 21 123.480 123.480 123.211 0.269 17919 39157 1 96 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.538 0.157 17919 39158 1 96 . 1 1 21 21 ASP C C 21 176.360 176.360 175.307 1.053 17919 39159 1 96 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.283 0.417 17919 39160 1 96 . 1 1 21 21 ASP CB C 21 40.800 40.800 42.077 -1.277 17919 39161 1 96 . 1 1 21 21 ASP H H 21 8.030 8.030 7.871 0.159 17919 39162 1 96 . 1 1 22 22 THR N N 22 108.800 108.800 113.727 -4.927 17919 39163 1 96 . 1 1 22 22 THR HA H 22 4.920 4.920 4.709 0.211 17919 39164 1 96 . 1 1 22 22 THR C C 22 176.750 176.750 175.549 1.201 17919 39165 1 96 . 1 1 22 22 THR CA C 22 59.690 59.690 60.705 -1.015 17919 39166 1 96 . 1 1 22 22 THR CB C 22 71.200 71.200 71.159 0.040 17919 39167 1 96 . 1 1 22 22 THR H H 22 7.900 7.900 7.995 -0.095 17919 39168 1 96 . 1 1 23 23 ILE N N 23 121.190 121.190 121.777 -0.587 17919 39169 1 96 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.788 -0.131 17919 39170 1 96 . 1 1 23 23 ILE C C 23 179.040 179.040 177.760 1.280 17919 39171 1 96 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.052 -0.792 17919 39172 1 96 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.736 -2.386 17919 39173 1 96 . 1 1 23 23 ILE H H 23 8.560 8.560 8.646 -0.086 17919 39174 1 96 . 1 1 24 24 GLU N N 24 120.830 120.830 120.597 0.233 17919 39175 1 96 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.866 0.051 17919 39176 1 96 . 1 1 24 24 GLU C C 24 178.640 178.640 178.812 -0.172 17919 39177 1 96 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.391 -0.171 17919 39178 1 96 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.345 -1.065 17919 39179 1 96 . 1 1 24 24 GLU H H 24 9.760 9.760 8.573 1.187 17919 39180 1 96 . 1 1 25 25 ASN N N 25 120.570 120.570 117.364 3.206 17919 39181 1 96 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.498 0.027 17919 39182 1 96 . 1 1 25 25 ASN C C 25 178.380 178.380 178.097 0.283 17919 39183 1 96 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.111 -0.050 17919 39184 1 96 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.119 0.331 17919 39185 1 96 . 1 1 25 25 ASN H H 25 7.920 7.920 8.535 -0.615 17919 39186 1 96 . 1 1 26 26 VAL N N 26 121.710 121.710 120.772 0.938 17919 39187 1 96 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.551 -0.154 17919 39188 1 96 . 1 1 26 26 VAL C C 26 177.950 177.950 177.567 0.383 17919 39189 1 96 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.718 0.942 17919 39190 1 96 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.760 -0.920 17919 39191 1 96 . 1 1 26 26 VAL H H 26 8.070 8.070 7.854 0.216 17919 39192 1 96 . 1 1 27 27 LYS N N 27 118.860 118.860 119.949 -1.089 17919 39193 1 96 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.239 0.341 17919 39194 1 96 . 1 1 27 27 LYS C C 27 180.550 180.550 179.173 1.377 17919 39195 1 96 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.586 -0.336 17919 39196 1 96 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.222 1.508 17919 39197 1 96 . 1 1 27 27 LYS H H 27 8.560 8.560 7.846 0.714 17919 39198 1 96 . 1 1 28 28 ALA N N 28 123.440 123.440 122.146 1.294 17919 39199 1 96 . 1 1 28 28 ALA HA H 28 4.160 4.160 3.901 0.259 17919 39200 1 96 . 1 1 28 28 ALA C C 28 180.300 180.300 179.104 1.196 17919 39201 1 96 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.483 -0.114 17919 39202 1 96 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.266 -0.556 17919 39203 1 96 . 1 1 28 28 ALA H H 28 8.060 8.060 8.058 0.002 17919 39204 1 96 . 1 1 29 29 LYS N N 29 119.940 119.940 118.771 1.169 17919 39205 1 96 . 1 1 29 29 LYS HA H 29 4.207 4.207 3.918 0.289 17919 39206 1 96 . 1 1 29 29 LYS C C 29 180.320 180.320 179.368 0.952 17919 39207 1 96 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.315 0.335 17919 39208 1 96 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.117 1.173 17919 39209 1 96 . 1 1 29 29 LYS H H 29 7.850 7.850 7.442 0.408 17919 39210 1 96 . 1 1 30 30 ILE N N 30 121.080 121.080 119.406 1.674 17919 39211 1 96 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.656 -0.149 17919 39212 1 96 . 1 1 30 30 ILE C C 30 178.310 178.310 177.468 0.842 17919 39213 1 96 . 1 1 30 30 ILE CA C 30 66.150 66.150 64.832 1.318 17919 39214 1 96 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.284 -0.484 17919 39215 1 96 . 1 1 30 30 ILE H H 30 8.280 8.280 8.194 0.086 17919 39216 1 96 . 1 1 31 31 GLN N N 31 123.490 123.490 119.768 3.722 17919 39217 1 96 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.946 -0.117 17919 39218 1 96 . 1 1 31 31 GLN C C 31 178.890 178.890 178.281 0.609 17919 39219 1 96 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.263 0.737 17919 39220 1 96 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.423 -0.703 17919 39221 1 96 . 1 1 31 31 GLN H H 31 8.580 8.580 8.185 0.395 17919 39222 1 96 . 1 1 32 32 ASP N N 32 119.360 119.360 119.100 0.260 17919 39223 1 96 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.367 -0.013 17919 39224 1 96 . 1 1 32 32 ASP C C 32 177.250 177.250 177.696 -0.446 17919 39225 1 96 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.856 0.334 17919 39226 1 96 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.870 -0.290 17919 39227 1 96 . 1 1 32 32 ASP H H 32 8.010 8.010 8.053 -0.043 17919 39228 1 96 . 1 1 33 33 LYS N N 33 115.130 115.130 116.434 -1.304 17919 39229 1 96 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.414 -0.077 17919 39230 1 96 . 1 1 33 33 LYS C C 33 177.870 177.870 177.682 0.188 17919 39231 1 96 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.153 0.897 17919 39232 1 96 . 1 1 33 33 LYS CB C 33 34.170 34.170 34.737 -0.567 17919 39233 1 96 . 1 1 33 33 LYS H H 33 7.430 7.430 7.449 -0.019 17919 39234 1 96 . 1 1 34 34 GLU N N 34 113.870 113.870 117.187 -3.317 17919 39235 1 96 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.499 0.126 17919 39236 1 96 . 1 1 34 34 GLU C C 34 177.840 177.840 176.234 1.606 17919 39237 1 96 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.531 -0.361 17919 39238 1 96 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.082 1.578 17919 39239 1 96 . 1 1 34 34 GLU H H 34 8.740 8.740 7.843 0.897 17919 39240 1 96 . 1 1 35 35 GLY N N 35 108.650 108.650 109.037 -0.387 17919 39241 1 96 . 1 1 35 35 GLY C C 35 173.960 173.960 174.613 -0.653 17919 39242 1 96 . 1 1 35 35 GLY CA C 35 46.080 46.080 46.004 0.076 17919 39243 1 96 . 1 1 35 35 GLY H H 35 8.530 8.530 7.790 0.740 17919 39244 1 96 . 1 1 36 36 ILE N N 36 119.880 119.880 120.455 -0.575 17919 39245 1 96 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.375 0.070 17919 39246 1 96 . 1 1 36 36 ILE C C 36 173.590 173.590 173.684 -0.094 17919 39247 1 96 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.757 -0.007 17919 39248 1 96 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.398 2.182 17919 39249 1 96 . 1 1 36 36 ILE H H 36 6.150 6.150 7.579 -1.429 17919 39250 1 96 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.857 -0.223 17919 39251 1 96 . 1 1 37 37 PRO C C 37 176.940 176.940 176.119 0.821 17919 39252 1 96 . 1 1 37 37 PRO CA C 37 61.660 61.660 60.770 0.890 17919 39253 1 96 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.404 0.446 17919 39254 1 96 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.099 0.018 17919 39255 1 96 . 1 1 38 38 PRO C C 38 178.320 178.320 178.558 -0.238 17919 39256 1 96 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.930 0.331 17919 39257 1 96 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.911 0.979 17919 39258 1 96 . 1 1 39 39 ASP N N 39 113.380 113.380 116.463 -3.083 17919 39259 1 96 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.283 0.147 17919 39260 1 96 . 1 1 39 39 ASP C C 39 177.090 177.090 178.144 -1.054 17919 39261 1 96 . 1 1 39 39 ASP CA C 39 55.640 55.640 57.193 -1.553 17919 39262 1 96 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.599 -1.059 17919 39263 1 96 . 1 1 39 39 ASP H H 39 8.550 8.550 8.677 -0.127 17919 39264 1 96 . 1 1 40 40 GLN N N 40 116.780 116.780 116.457 0.323 17919 39265 1 96 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.251 0.213 17919 39266 1 96 . 1 1 40 40 GLN C C 40 175.380 175.380 176.265 -0.885 17919 39267 1 96 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.905 -1.265 17919 39268 1 96 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.572 0.568 17919 39269 1 96 . 1 1 40 40 GLN H H 40 7.820 7.820 8.287 -0.467 17919 39270 1 96 . 1 1 41 41 GLN N N 41 117.720 117.720 118.521 -0.801 17919 39271 1 96 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.727 -0.483 17919 39272 1 96 . 1 1 41 41 GLN C C 41 176.300 176.300 175.328 0.972 17919 39273 1 96 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.842 0.628 17919 39274 1 96 . 1 1 41 41 GLN CB C 41 31.650 31.650 30.557 1.093 17919 39275 1 96 . 1 1 41 41 GLN H H 41 7.480 7.480 7.420 0.060 17919 39276 1 96 . 1 1 42 42 ARG N N 42 122.680 122.680 122.267 0.413 17919 39277 1 96 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.697 -0.197 17919 39278 1 96 . 1 1 42 42 ARG C C 42 174.050 174.050 174.215 -0.165 17919 39279 1 96 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.183 -0.133 17919 39280 1 96 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.412 -1.662 17919 39281 1 96 . 1 1 42 42 ARG H H 42 8.530 8.530 8.093 0.437 17919 39282 1 96 . 1 1 43 43 LEU N N 43 124.040 124.040 124.533 -0.493 17919 39283 1 96 . 1 1 43 43 LEU C C 43 175.290 175.290 175.926 -0.636 17919 39284 1 96 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.599 -0.619 17919 39285 1 96 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.649 1.141 17919 39286 1 96 . 1 1 43 43 LEU H H 43 8.820 8.820 8.590 0.230 17919 39287 1 96 . 1 1 44 44 ILE N N 44 121.920 121.920 120.903 1.017 17919 39288 1 96 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.995 -0.003 17919 39289 1 96 . 1 1 44 44 ILE C C 44 176.060 176.060 174.367 1.693 17919 39290 1 96 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.465 -1.485 17919 39291 1 96 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.473 -0.053 17919 39292 1 96 . 1 1 44 44 ILE H H 44 9.030 9.030 8.146 0.884 17919 39293 1 96 . 1 1 45 45 PHE N N 45 125.390 125.390 127.282 -1.892 17919 39294 1 96 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.937 0.108 17919 39295 1 96 . 1 1 45 45 PHE C C 45 174.470 174.470 174.264 0.206 17919 39296 1 96 . 1 1 45 45 PHE CA C 45 57.020 57.020 57.495 -0.475 17919 39297 1 96 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.319 0.441 17919 39298 1 96 . 1 1 45 45 PHE H H 45 8.830 8.830 9.060 -0.230 17919 39299 1 96 . 1 1 46 46 ALA N N 46 132.200 132.200 129.364 2.836 17919 39300 1 96 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.629 0.061 17919 39301 1 96 . 1 1 46 46 ALA C C 46 177.290 177.290 177.934 -0.644 17919 39302 1 96 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.441 0.099 17919 39303 1 96 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.595 -0.024 17919 39304 1 96 . 1 1 46 46 ALA H H 46 8.810 8.810 8.409 0.401 17919 39305 1 96 . 1 1 47 47 GLY N N 47 102.340 102.340 103.913 -1.573 17919 39306 1 96 . 1 1 47 47 GLY C C 47 173.810 173.810 174.200 -0.390 17919 39307 1 96 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.835 0.515 17919 39308 1 96 . 1 1 47 47 GLY H H 47 8.130 8.130 8.311 -0.181 17919 39309 1 96 . 1 1 48 48 LYS N N 48 121.570 121.570 121.222 0.348 17919 39310 1 96 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.673 -0.051 17919 39311 1 96 . 1 1 48 48 LYS C C 48 174.700 174.700 175.821 -1.121 17919 39312 1 96 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.475 0.075 17919 39313 1 96 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.101 0.429 17919 39314 1 96 . 1 1 48 48 LYS H H 48 7.980 7.980 7.950 0.030 17919 39315 1 96 . 1 1 49 49 GLN N N 49 122.410 122.410 121.954 0.456 17919 39316 1 96 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.609 -0.049 17919 39317 1 96 . 1 1 49 49 GLN C C 49 175.670 175.670 176.137 -0.467 17919 39318 1 96 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.505 -0.765 17919 39319 1 96 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.484 -0.484 17919 39320 1 96 . 1 1 49 49 GLN H H 49 8.600 8.600 8.509 0.091 17919 39321 1 96 . 1 1 50 50 LEU N N 50 125.520 125.520 122.679 2.841 17919 39322 1 96 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.269 -0.179 17919 39323 1 96 . 1 1 50 50 LEU C C 50 176.660 176.660 176.718 -0.058 17919 39324 1 96 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.020 0.220 17919 39325 1 96 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.352 -0.782 17919 39326 1 96 . 1 1 50 50 LEU H H 50 8.530 8.530 8.378 0.152 17919 39327 1 96 . 1 1 51 51 GLU N N 51 122.940 122.940 123.078 -0.138 17919 39328 1 96 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.306 0.182 17919 39329 1 96 . 1 1 51 51 GLU C C 51 175.870 175.870 176.588 -0.718 17919 39330 1 96 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.779 0.181 17919 39331 1 96 . 1 1 51 51 GLU CB C 51 31.570 31.570 30.083 1.487 17919 39332 1 96 . 1 1 51 51 GLU H H 51 8.400 8.400 8.362 0.038 17919 39333 1 96 . 1 1 52 52 ASP N N 52 120.030 120.030 125.249 -5.219 17919 39334 1 96 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.423 -0.064 17919 39335 1 96 . 1 1 52 52 ASP C C 52 177.330 177.330 177.851 -0.521 17919 39336 1 96 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.219 -0.259 17919 39337 1 96 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.989 -0.139 17919 39338 1 96 . 1 1 52 52 ASP H H 52 8.160 8.160 8.786 -0.626 17919 39339 1 96 . 1 1 53 53 GLY N N 53 106.660 106.660 104.093 2.567 17919 39340 1 96 . 1 1 53 53 GLY C C 53 174.870 174.870 174.092 0.778 17919 39341 1 96 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.827 0.343 17919 39342 1 96 . 1 1 53 53 GLY H H 53 9.390 9.390 8.479 0.911 17919 39343 1 96 . 1 1 54 54 ARG N N 54 119.050 119.050 119.403 -0.353 17919 39344 1 96 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.572 0.123 17919 39345 1 96 . 1 1 54 54 ARG C C 54 175.350 175.350 175.674 -0.324 17919 39346 1 96 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.542 -0.152 17919 39347 1 96 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.842 -0.192 17919 39348 1 96 . 1 1 54 54 ARG H H 54 7.460 7.460 7.272 0.188 17919 39349 1 96 . 1 1 55 55 THR N N 55 108.400 108.400 112.954 -4.554 17919 39350 1 96 . 1 1 55 55 THR HA H 55 5.240 5.240 4.740 0.500 17919 39351 1 96 . 1 1 55 55 THR C C 55 176.560 176.560 176.047 0.513 17919 39352 1 96 . 1 1 55 55 THR CA C 55 59.690 59.690 61.413 -1.724 17919 39353 1 96 . 1 1 55 55 THR CB C 55 72.260 72.260 70.441 1.819 17919 39354 1 96 . 1 1 55 55 THR H H 55 8.730 8.730 8.658 0.072 17919 39355 1 96 . 1 1 56 56 LEU N N 56 117.920 117.920 123.669 -5.749 17919 39356 1 96 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.845 0.215 17919 39357 1 96 . 1 1 56 56 LEU C C 56 180.810 180.810 178.740 2.070 17919 39358 1 96 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.825 -0.115 17919 39359 1 96 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.036 -0.666 17919 39360 1 96 . 1 1 56 56 LEU H H 56 8.140 8.140 8.160 -0.020 17919 39361 1 96 . 1 1 57 57 SER N N 57 113.330 113.330 112.897 0.433 17919 39362 1 96 . 1 1 57 57 SER HA H 57 4.370 4.370 4.255 0.115 17919 39363 1 96 . 1 1 57 57 SER C C 57 178.310 178.310 176.552 1.758 17919 39364 1 96 . 1 1 57 57 SER CA C 57 61.080 61.080 61.365 -0.285 17919 39365 1 96 . 1 1 57 57 SER CB C 57 62.530 62.530 62.958 -0.428 17919 39366 1 96 . 1 1 57 57 SER H H 57 8.470 8.470 7.785 0.685 17919 39367 1 96 . 1 1 58 58 ASP N N 58 124.190 124.190 121.589 2.601 17919 39368 1 96 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.124 0.172 17919 39369 1 96 . 1 1 58 58 ASP C C 58 177.400 177.400 176.899 0.501 17919 39370 1 96 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.852 0.328 17919 39371 1 96 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.308 -0.208 17919 39372 1 96 . 1 1 58 58 ASP H H 58 7.930 7.930 7.858 0.072 17919 39373 1 96 . 1 1 59 59 TYR N N 59 115.510 115.510 115.081 0.429 17919 39374 1 96 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.627 0.043 17919 39375 1 96 . 1 1 59 59 TYR C C 59 174.700 174.700 174.669 0.031 17919 39376 1 96 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.139 1.111 17919 39377 1 96 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.850 1.220 17919 39378 1 96 . 1 1 59 59 TYR H H 59 7.250 7.250 7.124 0.126 17919 39379 1 96 . 1 1 60 60 ASN N N 60 115.900 115.900 116.981 -1.081 17919 39380 1 96 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.327 0.028 17919 39381 1 96 . 1 1 60 60 ASN C C 60 174.340 174.340 174.639 -0.299 17919 39382 1 96 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.021 0.099 17919 39383 1 96 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.256 0.154 17919 39384 1 96 . 1 1 60 60 ASN H H 60 8.150 8.150 7.589 0.561 17919 39385 1 96 . 1 1 61 61 ILE N N 61 118.600 118.600 119.861 -1.261 17919 39386 1 96 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.707 -0.314 17919 39387 1 96 . 1 1 61 61 ILE C C 61 174.610 174.610 175.299 -0.689 17919 39388 1 96 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.127 0.293 17919 39389 1 96 . 1 1 61 61 ILE CB C 61 36.740 36.740 36.894 -0.154 17919 39390 1 96 . 1 1 61 61 ILE H H 61 7.250 7.250 7.743 -0.493 17919 39391 1 96 . 1 1 62 62 GLN N N 62 124.740 124.740 126.406 -1.666 17919 39392 1 96 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.681 -0.175 17919 39393 1 96 . 1 1 62 62 GLN C C 62 175.970 175.970 175.860 0.110 17919 39394 1 96 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.189 0.471 17919 39395 1 96 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.096 0.554 17919 39396 1 96 . 1 1 62 62 GLN H H 62 7.610 7.610 7.991 -0.381 17919 39397 1 96 . 1 1 63 63 LYS N N 63 120.300 120.300 121.064 -0.764 17919 39398 1 96 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.975 0.026 17919 39399 1 96 . 1 1 63 63 LYS C C 63 175.810 175.810 177.935 -2.125 17919 39400 1 96 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.002 -0.212 17919 39401 1 96 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.964 0.686 17919 39402 1 96 . 1 1 63 63 LYS H H 63 8.490 8.490 8.634 -0.144 17919 39403 1 96 . 1 1 64 64 GLU N N 64 113.950 113.950 119.255 -5.305 17919 39404 1 96 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.418 0.047 17919 39405 1 96 . 1 1 64 64 GLU C C 64 175.250 175.250 175.676 -0.426 17919 39406 1 96 . 1 1 64 64 GLU CA C 64 57.890 57.890 58.025 -0.135 17919 39407 1 96 . 1 1 64 64 GLU CB C 64 25.900 25.900 27.738 -1.838 17919 39408 1 96 . 1 1 64 64 GLU H H 64 9.280 9.280 8.894 0.386 17919 39409 1 96 . 1 1 65 65 SER N N 65 114.730 114.730 117.721 -2.991 17919 39410 1 96 . 1 1 65 65 SER HA H 65 4.640 4.640 4.521 0.119 17919 39411 1 96 . 1 1 65 65 SER C C 65 172.160 172.160 174.428 -2.268 17919 39412 1 96 . 1 1 65 65 SER CA C 65 60.890 60.890 59.307 1.583 17919 39413 1 96 . 1 1 65 65 SER CB C 65 64.910 64.910 63.123 1.786 17919 39414 1 96 . 1 1 65 65 SER H H 65 7.670 7.670 7.685 -0.015 17919 39415 1 96 . 1 1 66 66 THR N N 66 117.110 117.110 121.976 -4.866 17919 39416 1 96 . 1 1 66 66 THR HA H 66 5.270 5.270 4.557 0.713 17919 39417 1 96 . 1 1 66 66 THR C C 66 173.950 173.950 174.782 -0.832 17919 39418 1 96 . 1 1 66 66 THR CA C 66 62.340 62.340 64.204 -1.864 17919 39419 1 96 . 1 1 66 66 THR CB C 66 70.080 70.080 69.312 0.768 17919 39420 1 96 . 1 1 66 66 THR H H 66 8.730 8.730 8.370 0.360 17919 39421 1 96 . 1 1 67 67 LEU N N 67 127.110 127.110 126.975 0.135 17919 39422 1 96 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.984 0.076 17919 39423 1 96 . 1 1 67 67 LEU C C 67 175.770 175.770 175.464 0.306 17919 39424 1 96 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.649 0.251 17919 39425 1 96 . 1 1 67 67 LEU CB C 67 44.260 44.260 46.266 -2.006 17919 39426 1 96 . 1 1 67 67 LEU H H 67 9.410 9.410 8.841 0.569 17919 39427 1 96 . 1 1 68 68 HIS N N 68 118.380 118.380 119.388 -1.008 17919 39428 1 96 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.568 -0.328 17919 39429 1 96 . 1 1 68 68 HIS C C 68 173.150 173.150 173.809 -0.659 17919 39430 1 96 . 1 1 68 68 HIS CA C 68 55.000 55.000 53.806 1.194 17919 39431 1 96 . 1 1 68 68 HIS CB C 68 30.530 30.530 33.769 -3.239 17919 39432 1 96 . 1 1 68 68 HIS H H 68 9.230 9.230 8.350 0.880 17919 39433 1 96 . 1 1 69 69 LEU N N 69 124.460 124.460 121.799 2.661 17919 39434 1 96 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.144 0.046 17919 39435 1 96 . 1 1 69 69 LEU C C 69 175.270 175.270 173.961 1.309 17919 39436 1 96 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.419 -0.528 17919 39437 1 96 . 1 1 69 69 LEU CB C 69 44.380 44.380 46.164 -1.784 17919 39438 1 96 . 1 1 69 69 LEU H H 69 8.340 8.340 7.322 1.018 17919 39439 1 96 . 1 1 70 70 VAL N N 70 126.940 126.940 120.164 6.776 17919 39440 1 96 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.569 -0.219 17919 39441 1 96 . 1 1 70 70 VAL C C 70 174.000 174.000 173.890 0.110 17919 39442 1 96 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.659 1.141 17919 39443 1 96 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.397 -0.487 17919 39444 1 96 . 1 1 70 70 VAL H H 70 9.200 9.200 8.004 1.196 17919 39445 1 96 . 1 1 71 71 LEU N N 71 123.130 123.130 121.873 1.257 17919 39446 1 96 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.149 -0.089 17919 39447 1 96 . 1 1 71 71 LEU C C 71 177.830 177.830 176.971 0.859 17919 39448 1 96 . 1 1 71 71 LEU CA C 71 53.940 53.940 54.056 -0.116 17919 39449 1 96 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.845 -0.995 17919 39450 1 96 . 1 1 71 71 LEU H H 71 8.120 8.120 8.273 -0.153 17919 39451 1 96 . 1 1 72 72 ARG N N 72 123.490 123.490 123.943 -0.453 17919 39452 1 96 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.531 -0.230 17919 39453 1 96 . 1 1 72 72 ARG C C 72 175.350 175.350 175.815 -0.465 17919 39454 1 96 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.444 0.166 17919 39455 1 96 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.561 0.789 17919 39456 1 96 . 1 1 72 72 ARG H H 72 8.580 8.580 8.577 0.003 17919 39457 1 97 . 1 1 2 2 GLN N N 2 123.220 123.220 126.048 -2.828 17919 39458 1 97 . 1 1 2 2 GLN HA H 2 5.249 5.249 4.623 0.626 17919 39459 1 97 . 1 1 2 2 GLN C C 2 175.920 175.920 175.217 0.703 17919 39460 1 97 . 1 1 2 2 GLN CA C 2 55.080 55.080 56.395 -1.315 17919 39461 1 97 . 1 1 2 2 GLN CB C 2 30.760 30.760 29.858 0.902 17919 39462 1 97 . 1 1 2 2 GLN H H 2 8.900 8.900 8.498 0.402 17919 39463 1 97 . 1 1 3 3 ILE N N 3 115.340 115.340 118.854 -3.514 17919 39464 1 97 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.507 -0.294 17919 39465 1 97 . 1 1 3 3 ILE C C 3 172.450 172.450 173.911 -1.461 17919 39466 1 97 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.300 0.270 17919 39467 1 97 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.114 1.096 17919 39468 1 97 . 1 1 3 3 ILE H H 3 8.320 8.320 7.911 0.409 17919 39469 1 97 . 1 1 4 4 PHE N N 4 118.110 118.110 120.340 -2.230 17919 39470 1 97 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.168 0.462 17919 39471 1 97 . 1 1 4 4 PHE C C 4 175.320 175.320 175.096 0.224 17919 39472 1 97 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.751 -0.541 17919 39473 1 97 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.120 -0.640 17919 39474 1 97 . 1 1 4 4 PHE H H 4 8.610 8.610 8.528 0.082 17919 39475 1 97 . 1 1 5 5 VAL N N 5 121.000 121.000 123.582 -2.582 17919 39476 1 97 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.660 0.065 17919 39477 1 97 . 1 1 5 5 VAL C C 5 174.870 174.870 174.737 0.133 17919 39478 1 97 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.484 -0.864 17919 39479 1 97 . 1 1 5 5 VAL CB C 5 34.230 34.230 32.922 1.308 17919 39480 1 97 . 1 1 5 5 VAL H H 5 9.300 9.300 9.083 0.217 17919 39481 1 97 . 1 1 6 6 LYS N N 6 127.520 127.520 129.357 -1.837 17919 39482 1 97 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.021 0.346 17919 39483 1 97 . 1 1 6 6 LYS C C 6 177.140 177.140 176.692 0.448 17919 39484 1 97 . 1 1 6 6 LYS CA C 6 54.520 54.520 55.184 -0.665 17919 39485 1 97 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.469 -0.419 17919 39486 1 97 . 1 1 6 6 LYS H H 6 8.820 8.820 9.061 -0.241 17919 39487 1 97 . 1 1 7 7 THR N N 7 115.400 115.400 116.991 -1.591 17919 39488 1 97 . 1 1 7 7 THR HA H 7 4.970 4.970 4.356 0.614 17919 39489 1 97 . 1 1 7 7 THR C C 7 176.910 176.910 176.072 0.838 17919 39490 1 97 . 1 1 7 7 THR CA C 7 60.470 60.470 61.563 -1.093 17919 39491 1 97 . 1 1 7 7 THR CB C 7 70.630 70.630 69.804 0.826 17919 39492 1 97 . 1 1 7 7 THR H H 7 8.730 8.730 8.503 0.227 17919 39493 1 97 . 1 1 8 8 LEU N N 8 121.330 121.330 122.652 -1.322 17919 39494 1 97 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.408 -0.098 17919 39495 1 97 . 1 1 8 8 LEU C C 8 178.800 178.800 177.644 1.156 17919 39496 1 97 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.246 0.334 17919 39497 1 97 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.234 -0.264 17919 39498 1 97 . 1 1 8 8 LEU H H 8 9.100 9.100 8.765 0.335 17919 39499 1 97 . 1 1 9 9 THR N N 9 105.590 105.590 108.493 -2.903 17919 39500 1 97 . 1 1 9 9 THR HA H 9 4.428 4.428 4.389 0.039 17919 39501 1 97 . 1 1 9 9 THR C C 9 175.520 175.520 175.483 0.037 17919 39502 1 97 . 1 1 9 9 THR CA C 9 61.400 61.400 61.754 -0.354 17919 39503 1 97 . 1 1 9 9 THR CB C 9 69.140 69.140 70.197 -1.057 17919 39504 1 97 . 1 1 9 9 THR H H 9 7.630 7.630 7.683 -0.053 17919 39505 1 97 . 1 1 10 10 GLY N N 10 108.890 108.890 111.215 -2.325 17919 39506 1 97 . 1 1 10 10 GLY C C 10 174.070 174.070 174.210 -0.140 17919 39507 1 97 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.750 0.710 17919 39508 1 97 . 1 1 10 10 GLY H H 10 7.810 7.810 7.665 0.145 17919 39509 1 97 . 1 1 11 11 LYS N N 11 121.600 121.600 123.027 -1.427 17919 39510 1 97 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.215 0.146 17919 39511 1 97 . 1 1 11 11 LYS C C 11 175.940 175.940 175.911 0.029 17919 39512 1 97 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.556 -0.276 17919 39513 1 97 . 1 1 11 11 LYS CB C 11 33.200 33.200 32.868 0.332 17919 39514 1 97 . 1 1 11 11 LYS H H 11 7.280 7.280 7.659 -0.379 17919 39515 1 97 . 1 1 12 12 THR N N 12 120.440 120.440 120.111 0.329 17919 39516 1 97 . 1 1 12 12 THR HA H 12 5.046 5.046 4.459 0.587 17919 39517 1 97 . 1 1 12 12 THR C C 12 174.320 174.320 174.326 -0.006 17919 39518 1 97 . 1 1 12 12 THR CA C 12 62.390 62.390 62.205 0.185 17919 39519 1 97 . 1 1 12 12 THR CB C 12 69.910 69.910 69.424 0.486 17919 39520 1 97 . 1 1 12 12 THR H H 12 8.650 8.650 8.429 0.221 17919 39521 1 97 . 1 1 13 13 ILE N N 13 127.110 127.110 127.399 -0.289 17919 39522 1 97 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.531 0.013 17919 39523 1 97 . 1 1 13 13 ILE C C 13 175.220 175.220 175.023 0.197 17919 39524 1 97 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.413 -0.433 17919 39525 1 97 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.570 0.380 17919 39526 1 97 . 1 1 13 13 ILE H H 13 9.450 9.450 8.512 0.938 17919 39527 1 97 . 1 1 14 14 THR N N 14 121.520 121.520 119.449 2.071 17919 39528 1 97 . 1 1 14 14 THR HA H 14 4.964 4.964 4.824 0.140 17919 39529 1 97 . 1 1 14 14 THR C C 14 173.790 173.790 173.586 0.204 17919 39530 1 97 . 1 1 14 14 THR CA C 14 61.940 61.940 60.636 1.304 17919 39531 1 97 . 1 1 14 14 THR CB C 14 69.650 69.650 70.626 -0.976 17919 39532 1 97 . 1 1 14 14 THR H H 14 8.710 8.710 8.525 0.185 17919 39533 1 97 . 1 1 15 15 LEU N N 15 124.800 124.800 126.075 -1.275 17919 39534 1 97 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.766 0.014 17919 39535 1 97 . 1 1 15 15 LEU C C 15 174.670 174.670 174.792 -0.122 17919 39536 1 97 . 1 1 15 15 LEU CA C 15 52.830 52.830 54.172 -1.343 17919 39537 1 97 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.509 1.561 17919 39538 1 97 . 1 1 15 15 LEU H H 15 8.710 8.710 8.045 0.665 17919 39539 1 97 . 1 1 16 16 GLU N N 16 122.160 122.160 124.991 -2.831 17919 39540 1 97 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.463 0.454 17919 39541 1 97 . 1 1 16 16 GLU C C 16 175.860 175.860 175.347 0.513 17919 39542 1 97 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.400 -0.580 17919 39543 1 97 . 1 1 16 16 GLU CB C 16 29.450 29.450 29.472 -0.022 17919 39544 1 97 . 1 1 16 16 GLU H H 16 8.140 8.140 8.666 -0.526 17919 39545 1 97 . 1 1 17 17 VAL N N 17 117.210 117.210 119.614 -2.404 17919 39546 1 97 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.717 -0.003 17919 39547 1 97 . 1 1 17 17 VAL C C 17 174.160 174.160 174.468 -0.308 17919 39548 1 97 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.419 0.011 17919 39549 1 97 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.524 0.876 17919 39550 1 97 . 1 1 17 17 VAL H H 17 8.900 8.900 8.280 0.620 17919 39551 1 97 . 1 1 18 18 GLU N N 18 118.990 118.990 119.213 -0.223 17919 39552 1 97 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.766 0.313 17919 39553 1 97 . 1 1 18 18 GLU C C 18 176.160 176.160 175.017 1.143 17919 39554 1 97 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.763 -0.043 17919 39555 1 97 . 1 1 18 18 GLU CB C 18 30.310 30.310 31.320 -1.010 17919 39556 1 97 . 1 1 18 18 GLU H H 18 8.640 8.640 8.234 0.406 17919 39557 1 97 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.249 -0.108 17919 39558 1 97 . 1 1 19 19 PRO C C 19 175.310 175.310 178.168 -2.858 17919 39559 1 97 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.472 -0.002 17919 39560 1 97 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.087 -0.137 17919 39561 1 97 . 1 1 20 20 SER N N 20 103.400 103.400 108.735 -5.335 17919 39562 1 97 . 1 1 20 20 SER HA H 20 4.370 4.370 4.245 0.125 17919 39563 1 97 . 1 1 20 20 SER C C 20 174.660 174.660 174.229 0.431 17919 39564 1 97 . 1 1 20 20 SER CA C 20 57.400 57.400 58.643 -1.243 17919 39565 1 97 . 1 1 20 20 SER CB C 20 63.370 63.370 62.900 0.470 17919 39566 1 97 . 1 1 20 20 SER H H 20 7.040 7.040 8.015 -0.975 17919 39567 1 97 . 1 1 21 21 ASP N N 21 123.480 123.480 123.867 -0.387 17919 39568 1 97 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.808 -0.113 17919 39569 1 97 . 1 1 21 21 ASP C C 21 176.360 176.360 175.375 0.985 17919 39570 1 97 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.006 1.694 17919 39571 1 97 . 1 1 21 21 ASP CB C 21 40.800 40.800 42.846 -2.046 17919 39572 1 97 . 1 1 21 21 ASP H H 21 8.030 8.030 7.888 0.142 17919 39573 1 97 . 1 1 22 22 THR N N 22 108.800 108.800 115.524 -6.724 17919 39574 1 97 . 1 1 22 22 THR HA H 22 4.920 4.920 4.711 0.209 17919 39575 1 97 . 1 1 22 22 THR C C 22 176.750 176.750 175.995 0.755 17919 39576 1 97 . 1 1 22 22 THR CA C 22 59.690 59.690 61.119 -1.429 17919 39577 1 97 . 1 1 22 22 THR CB C 22 71.200 71.200 70.463 0.737 17919 39578 1 97 . 1 1 22 22 THR H H 22 7.900 7.900 8.067 -0.167 17919 39579 1 97 . 1 1 23 23 ILE N N 23 121.190 121.190 124.205 -3.015 17919 39580 1 97 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.573 0.084 17919 39581 1 97 . 1 1 23 23 ILE C C 23 179.040 179.040 177.590 1.450 17919 39582 1 97 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.528 -1.268 17919 39583 1 97 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.273 -1.923 17919 39584 1 97 . 1 1 23 23 ILE H H 23 8.560 8.560 9.295 -0.735 17919 39585 1 97 . 1 1 24 24 GLU N N 24 120.830 120.830 118.874 1.956 17919 39586 1 97 . 1 1 24 24 GLU HA H 24 3.917 3.917 4.041 -0.124 17919 39587 1 97 . 1 1 24 24 GLU C C 24 178.640 178.640 178.943 -0.303 17919 39588 1 97 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.521 0.699 17919 39589 1 97 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.404 -1.124 17919 39590 1 97 . 1 1 24 24 GLU H H 24 9.760 9.760 7.935 1.825 17919 39591 1 97 . 1 1 25 25 ASN N N 25 120.570 120.570 117.076 3.494 17919 39592 1 97 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.589 -0.064 17919 39593 1 97 . 1 1 25 25 ASN C C 25 178.380 178.380 177.693 0.687 17919 39594 1 97 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.641 0.419 17919 39595 1 97 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.532 -0.082 17919 39596 1 97 . 1 1 25 25 ASN H H 25 7.920 7.920 7.738 0.182 17919 39597 1 97 . 1 1 26 26 VAL N N 26 121.710 121.710 120.908 0.802 17919 39598 1 97 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.787 -0.390 17919 39599 1 97 . 1 1 26 26 VAL C C 26 177.950 177.950 177.299 0.651 17919 39600 1 97 . 1 1 26 26 VAL CA C 26 67.660 67.660 64.847 2.813 17919 39601 1 97 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.868 -1.028 17919 39602 1 97 . 1 1 26 26 VAL H H 26 8.070 8.070 7.804 0.266 17919 39603 1 97 . 1 1 27 27 LYS N N 27 118.860 118.860 121.003 -2.143 17919 39604 1 97 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.133 0.447 17919 39605 1 97 . 1 1 27 27 LYS C C 27 180.550 180.550 178.934 1.616 17919 39606 1 97 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.731 -0.481 17919 39607 1 97 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.089 1.641 17919 39608 1 97 . 1 1 27 27 LYS H H 27 8.560 8.560 8.580 -0.020 17919 39609 1 97 . 1 1 28 28 ALA N N 28 123.440 123.440 121.665 1.775 17919 39610 1 97 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.009 0.151 17919 39611 1 97 . 1 1 28 28 ALA C C 28 180.300 180.300 179.189 1.111 17919 39612 1 97 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.195 0.175 17919 39613 1 97 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.262 -0.552 17919 39614 1 97 . 1 1 28 28 ALA H H 28 8.060 8.060 7.729 0.331 17919 39615 1 97 . 1 1 29 29 LYS N N 29 119.940 119.940 117.856 2.084 17919 39616 1 97 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.021 0.186 17919 39617 1 97 . 1 1 29 29 LYS C C 29 180.320 180.320 179.159 1.161 17919 39618 1 97 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.206 0.444 17919 39619 1 97 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.137 1.153 17919 39620 1 97 . 1 1 29 29 LYS H H 29 7.850 7.850 7.525 0.325 17919 39621 1 97 . 1 1 30 30 ILE N N 30 121.080 121.080 119.678 1.402 17919 39622 1 97 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.659 -0.152 17919 39623 1 97 . 1 1 30 30 ILE C C 30 178.310 178.310 177.410 0.900 17919 39624 1 97 . 1 1 30 30 ILE CA C 30 66.150 66.150 64.756 1.394 17919 39625 1 97 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.289 -0.489 17919 39626 1 97 . 1 1 30 30 ILE H H 30 8.280 8.280 7.270 1.010 17919 39627 1 97 . 1 1 31 31 GLN N N 31 123.490 123.490 120.344 3.146 17919 39628 1 97 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.893 -0.064 17919 39629 1 97 . 1 1 31 31 GLN C C 31 178.890 178.890 178.590 0.300 17919 39630 1 97 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.240 0.760 17919 39631 1 97 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.400 -0.680 17919 39632 1 97 . 1 1 31 31 GLN H H 31 8.580 8.580 7.847 0.733 17919 39633 1 97 . 1 1 32 32 ASP N N 32 119.360 119.360 118.849 0.511 17919 39634 1 97 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.404 -0.050 17919 39635 1 97 . 1 1 32 32 ASP C C 32 177.250 177.250 177.752 -0.502 17919 39636 1 97 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.698 0.492 17919 39637 1 97 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.835 -0.255 17919 39638 1 97 . 1 1 32 32 ASP H H 32 8.010 8.010 8.399 -0.389 17919 39639 1 97 . 1 1 33 33 LYS N N 33 115.130 115.130 116.195 -1.065 17919 39640 1 97 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.473 -0.136 17919 39641 1 97 . 1 1 33 33 LYS C C 33 177.870 177.870 177.696 0.174 17919 39642 1 97 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.355 0.695 17919 39643 1 97 . 1 1 33 33 LYS CB C 33 34.170 34.170 34.757 -0.587 17919 39644 1 97 . 1 1 33 33 LYS H H 33 7.430 7.430 7.515 -0.085 17919 39645 1 97 . 1 1 34 34 GLU N N 34 113.870 113.870 115.828 -1.958 17919 39646 1 97 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.524 0.101 17919 39647 1 97 . 1 1 34 34 GLU C C 34 177.840 177.840 176.911 0.929 17919 39648 1 97 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.812 -0.642 17919 39649 1 97 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.970 0.690 17919 39650 1 97 . 1 1 34 34 GLU H H 34 8.740 8.740 8.325 0.415 17919 39651 1 97 . 1 1 35 35 GLY N N 35 108.650 108.650 108.881 -0.231 17919 39652 1 97 . 1 1 35 35 GLY C C 35 173.960 173.960 174.860 -0.900 17919 39653 1 97 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.741 0.339 17919 39654 1 97 . 1 1 35 35 GLY H H 35 8.530 8.530 7.843 0.687 17919 39655 1 97 . 1 1 36 36 ILE N N 36 119.880 119.880 121.525 -1.645 17919 39656 1 97 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.205 0.240 17919 39657 1 97 . 1 1 36 36 ILE C C 36 173.590 173.590 174.544 -0.954 17919 39658 1 97 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.300 0.451 17919 39659 1 97 . 1 1 36 36 ILE CB C 36 40.580 40.580 36.848 3.732 17919 39660 1 97 . 1 1 36 36 ILE H H 36 6.150 6.150 7.805 -1.655 17919 39661 1 97 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.562 0.072 17919 39662 1 97 . 1 1 37 37 PRO C C 37 176.940 176.940 176.447 0.493 17919 39663 1 97 . 1 1 37 37 PRO CA C 37 61.660 61.660 62.316 -0.656 17919 39664 1 97 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.716 0.134 17919 39665 1 97 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.244 -0.127 17919 39666 1 97 . 1 1 38 38 PRO C C 38 178.320 178.320 177.436 0.884 17919 39667 1 97 . 1 1 38 38 PRO CA C 38 66.260 66.260 64.716 1.544 17919 39668 1 97 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.646 1.244 17919 39669 1 97 . 1 1 39 39 ASP N N 39 113.380 113.380 117.612 -4.232 17919 39670 1 97 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.317 0.113 17919 39671 1 97 . 1 1 39 39 ASP C C 39 177.090 177.090 177.544 -0.454 17919 39672 1 97 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.764 -1.124 17919 39673 1 97 . 1 1 39 39 ASP CB C 39 39.540 39.540 39.706 -0.166 17919 39674 1 97 . 1 1 39 39 ASP H H 39 8.550 8.550 8.674 -0.124 17919 39675 1 97 . 1 1 40 40 GLN N N 40 116.780 116.780 119.055 -2.275 17919 39676 1 97 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.316 0.148 17919 39677 1 97 . 1 1 40 40 GLN C C 40 175.380 175.380 175.545 -0.165 17919 39678 1 97 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.439 -0.799 17919 39679 1 97 . 1 1 40 40 GLN CB C 40 30.140 30.140 30.268 -0.128 17919 39680 1 97 . 1 1 40 40 GLN H H 40 7.820 7.820 7.468 0.352 17919 39681 1 97 . 1 1 41 41 GLN N N 41 117.720 117.720 117.324 0.396 17919 39682 1 97 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.631 -0.387 17919 39683 1 97 . 1 1 41 41 GLN C C 41 176.300 176.300 175.633 0.667 17919 39684 1 97 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.191 1.279 17919 39685 1 97 . 1 1 41 41 GLN CB C 41 31.650 31.650 30.127 1.523 17919 39686 1 97 . 1 1 41 41 GLN H H 41 7.480 7.480 7.347 0.133 17919 39687 1 97 . 1 1 42 42 ARG N N 42 122.680 122.680 121.797 0.883 17919 39688 1 97 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.558 -0.058 17919 39689 1 97 . 1 1 42 42 ARG C C 42 174.050 174.050 175.065 -1.015 17919 39690 1 97 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.739 0.311 17919 39691 1 97 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.194 -1.444 17919 39692 1 97 . 1 1 42 42 ARG H H 42 8.530 8.530 8.012 0.518 17919 39693 1 97 . 1 1 43 43 LEU N N 43 124.040 124.040 123.727 0.313 17919 39694 1 97 . 1 1 43 43 LEU C C 43 175.290 175.290 176.185 -0.895 17919 39695 1 97 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.736 -0.756 17919 39696 1 97 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.028 2.762 17919 39697 1 97 . 1 1 43 43 LEU H H 43 8.820 8.820 8.746 0.074 17919 39698 1 97 . 1 1 44 44 ILE N N 44 121.920 121.920 122.342 -0.422 17919 39699 1 97 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.842 0.150 17919 39700 1 97 . 1 1 44 44 ILE C C 44 176.060 176.060 174.415 1.645 17919 39701 1 97 . 1 1 44 44 ILE CA C 44 58.980 58.980 61.096 -2.116 17919 39702 1 97 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.448 -0.028 17919 39703 1 97 . 1 1 44 44 ILE H H 44 9.030 9.030 8.107 0.923 17919 39704 1 97 . 1 1 45 45 PHE N N 45 125.390 125.390 127.822 -2.432 17919 39705 1 97 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.056 -0.011 17919 39706 1 97 . 1 1 45 45 PHE C C 45 174.470 174.470 174.537 -0.067 17919 39707 1 97 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.483 0.538 17919 39708 1 97 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.194 0.566 17919 39709 1 97 . 1 1 45 45 PHE H H 45 8.830 8.830 9.071 -0.241 17919 39710 1 97 . 1 1 46 46 ALA N N 46 132.200 132.200 130.834 1.366 17919 39711 1 97 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.712 -0.022 17919 39712 1 97 . 1 1 46 46 ALA C C 46 177.290 177.290 177.581 -0.291 17919 39713 1 97 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.826 -0.286 17919 39714 1 97 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.346 0.224 17919 39715 1 97 . 1 1 46 46 ALA H H 46 8.810 8.810 8.778 0.032 17919 39716 1 97 . 1 1 47 47 GLY N N 47 102.340 102.340 104.024 -1.684 17919 39717 1 97 . 1 1 47 47 GLY C C 47 173.810 173.810 174.102 -0.292 17919 39718 1 97 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.490 -0.140 17919 39719 1 97 . 1 1 47 47 GLY H H 47 8.130 8.130 8.529 -0.399 17919 39720 1 97 . 1 1 48 48 LYS N N 48 121.570 121.570 120.848 0.722 17919 39721 1 97 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.643 -0.021 17919 39722 1 97 . 1 1 48 48 LYS C C 48 174.700 174.700 175.510 -0.810 17919 39723 1 97 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.770 -0.220 17919 39724 1 97 . 1 1 48 48 LYS CB C 48 34.530 34.530 35.013 -0.483 17919 39725 1 97 . 1 1 48 48 LYS H H 48 7.980 7.980 7.845 0.135 17919 39726 1 97 . 1 1 49 49 GLN N N 49 122.410 122.410 123.724 -1.314 17919 39727 1 97 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.738 -0.178 17919 39728 1 97 . 1 1 49 49 GLN C C 49 175.670 175.670 175.191 0.479 17919 39729 1 97 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.120 -0.380 17919 39730 1 97 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.454 -0.454 17919 39731 1 97 . 1 1 49 49 GLN H H 49 8.600 8.600 8.615 -0.015 17919 39732 1 97 . 1 1 50 50 LEU N N 50 125.520 125.520 124.596 0.924 17919 39733 1 97 . 1 1 50 50 LEU HA H 50 4.090 4.090 3.997 0.093 17919 39734 1 97 . 1 1 50 50 LEU C C 50 176.660 176.660 175.693 0.967 17919 39735 1 97 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.554 0.686 17919 39736 1 97 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.302 -0.732 17919 39737 1 97 . 1 1 50 50 LEU H H 50 8.530 8.530 8.465 0.065 17919 39738 1 97 . 1 1 51 51 GLU N N 51 122.940 122.940 124.282 -1.342 17919 39739 1 97 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.470 0.018 17919 39740 1 97 . 1 1 51 51 GLU C C 51 175.870 175.870 176.502 -0.632 17919 39741 1 97 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.195 0.765 17919 39742 1 97 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.420 0.150 17919 39743 1 97 . 1 1 51 51 GLU H H 51 8.400 8.400 8.770 -0.370 17919 39744 1 97 . 1 1 52 52 ASP N N 52 120.030 120.030 124.491 -4.461 17919 39745 1 97 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.392 -0.033 17919 39746 1 97 . 1 1 52 52 ASP C C 52 177.330 177.330 178.465 -1.135 17919 39747 1 97 . 1 1 52 52 ASP CA C 52 56.960 56.960 58.679 -1.719 17919 39748 1 97 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.770 0.080 17919 39749 1 97 . 1 1 52 52 ASP H H 52 8.160 8.160 8.832 -0.672 17919 39750 1 97 . 1 1 53 53 GLY N N 53 106.660 106.660 105.048 1.612 17919 39751 1 97 . 1 1 53 53 GLY C C 53 174.870 174.870 174.556 0.314 17919 39752 1 97 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.070 0.100 17919 39753 1 97 . 1 1 53 53 GLY H H 53 9.390 9.390 8.324 1.066 17919 39754 1 97 . 1 1 54 54 ARG N N 54 119.050 119.050 120.504 -1.454 17919 39755 1 97 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.669 0.026 17919 39756 1 97 . 1 1 54 54 ARG C C 54 175.350 175.350 176.100 -0.750 17919 39757 1 97 . 1 1 54 54 ARG CA C 54 54.390 54.390 55.285 -0.895 17919 39758 1 97 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.314 0.336 17919 39759 1 97 . 1 1 54 54 ARG H H 54 7.460 7.460 7.632 -0.172 17919 39760 1 97 . 1 1 55 55 THR N N 55 108.400 108.400 113.355 -4.955 17919 39761 1 97 . 1 1 55 55 THR HA H 55 5.240 5.240 4.876 0.364 17919 39762 1 97 . 1 1 55 55 THR C C 55 176.560 176.560 176.140 0.420 17919 39763 1 97 . 1 1 55 55 THR CA C 55 59.690 59.690 61.061 -1.371 17919 39764 1 97 . 1 1 55 55 THR CB C 55 72.260 72.260 70.739 1.521 17919 39765 1 97 . 1 1 55 55 THR H H 55 8.730 8.730 9.075 -0.345 17919 39766 1 97 . 1 1 56 56 LEU N N 56 117.920 117.920 121.855 -3.935 17919 39767 1 97 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.879 0.181 17919 39768 1 97 . 1 1 56 56 LEU C C 56 180.810 180.810 179.054 1.756 17919 39769 1 97 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.641 0.069 17919 39770 1 97 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.395 -1.025 17919 39771 1 97 . 1 1 56 56 LEU H H 56 8.140 8.140 8.505 -0.365 17919 39772 1 97 . 1 1 57 57 SER N N 57 113.330 113.330 112.664 0.666 17919 39773 1 97 . 1 1 57 57 SER HA H 57 4.370 4.370 4.141 0.229 17919 39774 1 97 . 1 1 57 57 SER C C 57 178.310 178.310 175.932 2.378 17919 39775 1 97 . 1 1 57 57 SER CA C 57 61.080 61.080 61.742 -0.662 17919 39776 1 97 . 1 1 57 57 SER CB C 57 62.530 62.530 62.671 -0.141 17919 39777 1 97 . 1 1 57 57 SER H H 57 8.470 8.470 7.960 0.510 17919 39778 1 97 . 1 1 58 58 ASP N N 58 124.190 124.190 121.004 3.186 17919 39779 1 97 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.382 -0.086 17919 39780 1 97 . 1 1 58 58 ASP C C 58 177.400 177.400 177.870 -0.470 17919 39781 1 97 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.454 0.726 17919 39782 1 97 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.457 -0.357 17919 39783 1 97 . 1 1 58 58 ASP H H 58 7.930 7.930 7.840 0.090 17919 39784 1 97 . 1 1 59 59 TYR N N 59 115.510 115.510 117.099 -1.589 17919 39785 1 97 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.572 0.098 17919 39786 1 97 . 1 1 59 59 TYR C C 59 174.700 174.700 174.956 -0.256 17919 39787 1 97 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.636 0.614 17919 39788 1 97 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.205 1.865 17919 39789 1 97 . 1 1 59 59 TYR H H 59 7.250 7.250 7.094 0.156 17919 39790 1 97 . 1 1 60 60 ASN N N 60 115.900 115.900 114.532 1.368 17919 39791 1 97 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.394 -0.039 17919 39792 1 97 . 1 1 60 60 ASN C C 60 174.340 174.340 174.457 -0.117 17919 39793 1 97 . 1 1 60 60 ASN CA C 60 54.120 54.120 53.822 0.298 17919 39794 1 97 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.074 0.336 17919 39795 1 97 . 1 1 60 60 ASN H H 60 8.150 8.150 7.560 0.590 17919 39796 1 97 . 1 1 61 61 ILE N N 61 118.600 118.600 120.811 -2.211 17919 39797 1 97 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.822 -0.429 17919 39798 1 97 . 1 1 61 61 ILE C C 61 174.610 174.610 175.599 -0.989 17919 39799 1 97 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.120 0.300 17919 39800 1 97 . 1 1 61 61 ILE CB C 61 36.740 36.740 36.664 0.076 17919 39801 1 97 . 1 1 61 61 ILE H H 61 7.250 7.250 8.285 -1.035 17919 39802 1 97 . 1 1 62 62 GLN N N 62 124.740 124.740 126.462 -1.722 17919 39803 1 97 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.726 -0.220 17919 39804 1 97 . 1 1 62 62 GLN C C 62 175.970 175.970 175.839 0.131 17919 39805 1 97 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.554 0.106 17919 39806 1 97 . 1 1 62 62 GLN CB C 62 31.650 31.650 30.709 0.941 17919 39807 1 97 . 1 1 62 62 GLN H H 62 7.610 7.610 8.023 -0.413 17919 39808 1 97 . 1 1 63 63 LYS N N 63 120.300 120.300 119.535 0.765 17919 39809 1 97 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.184 -0.183 17919 39810 1 97 . 1 1 63 63 LYS C C 63 175.810 175.810 176.958 -1.148 17919 39811 1 97 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.318 0.472 17919 39812 1 97 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.186 0.464 17919 39813 1 97 . 1 1 63 63 LYS H H 63 8.490 8.490 8.512 -0.022 17919 39814 1 97 . 1 1 64 64 GLU N N 64 113.950 113.950 121.242 -7.292 17919 39815 1 97 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.824 -0.359 17919 39816 1 97 . 1 1 64 64 GLU C C 64 175.250 175.250 175.269 -0.019 17919 39817 1 97 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.461 0.429 17919 39818 1 97 . 1 1 64 64 GLU CB C 64 25.900 25.900 29.084 -3.184 17919 39819 1 97 . 1 1 64 64 GLU H H 64 9.280 9.280 8.959 0.321 17919 39820 1 97 . 1 1 65 65 SER N N 65 114.730 114.730 113.896 0.834 17919 39821 1 97 . 1 1 65 65 SER HA H 65 4.640 4.640 4.713 -0.073 17919 39822 1 97 . 1 1 65 65 SER C C 65 172.160 172.160 174.222 -2.062 17919 39823 1 97 . 1 1 65 65 SER CA C 65 60.890 60.890 59.107 1.783 17919 39824 1 97 . 1 1 65 65 SER CB C 65 64.910 64.910 64.674 0.236 17919 39825 1 97 . 1 1 65 65 SER H H 65 7.670 7.670 7.547 0.123 17919 39826 1 97 . 1 1 66 66 THR N N 66 117.110 117.110 121.193 -4.083 17919 39827 1 97 . 1 1 66 66 THR HA H 66 5.270 5.270 5.033 0.237 17919 39828 1 97 . 1 1 66 66 THR C C 66 173.950 173.950 174.320 -0.370 17919 39829 1 97 . 1 1 66 66 THR CA C 66 62.340 62.340 63.211 -0.871 17919 39830 1 97 . 1 1 66 66 THR CB C 66 70.080 70.080 69.446 0.634 17919 39831 1 97 . 1 1 66 66 THR H H 66 8.730 8.730 8.641 0.089 17919 39832 1 97 . 1 1 67 67 LEU N N 67 127.110 127.110 126.934 0.176 17919 39833 1 97 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.801 0.259 17919 39834 1 97 . 1 1 67 67 LEU C C 67 175.770 175.770 175.977 -0.207 17919 39835 1 97 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.615 0.285 17919 39836 1 97 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.835 0.425 17919 39837 1 97 . 1 1 67 67 LEU H H 67 9.410 9.410 9.042 0.368 17919 39838 1 97 . 1 1 68 68 HIS N N 68 118.380 118.380 121.050 -2.670 17919 39839 1 97 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.661 -0.421 17919 39840 1 97 . 1 1 68 68 HIS C C 68 173.150 173.150 174.189 -1.039 17919 39841 1 97 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.236 0.764 17919 39842 1 97 . 1 1 68 68 HIS CB C 68 30.530 30.530 33.185 -2.655 17919 39843 1 97 . 1 1 68 68 HIS H H 68 9.230 9.230 8.625 0.605 17919 39844 1 97 . 1 1 69 69 LEU N N 69 124.460 124.460 120.875 3.585 17919 39845 1 97 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.048 0.142 17919 39846 1 97 . 1 1 69 69 LEU C C 69 175.270 175.270 174.323 0.947 17919 39847 1 97 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.417 -0.527 17919 39848 1 97 . 1 1 69 69 LEU CB C 69 44.380 44.380 45.336 -0.956 17919 39849 1 97 . 1 1 69 69 LEU H H 69 8.340 8.340 7.228 1.112 17919 39850 1 97 . 1 1 70 70 VAL N N 70 126.940 126.940 125.420 1.520 17919 39851 1 97 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.381 -0.031 17919 39852 1 97 . 1 1 70 70 VAL C C 70 174.000 174.000 174.503 -0.503 17919 39853 1 97 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.873 -0.073 17919 39854 1 97 . 1 1 70 70 VAL CB C 70 34.910 34.910 33.587 1.323 17919 39855 1 97 . 1 1 70 70 VAL H H 70 9.200 9.200 7.929 1.271 17919 39856 1 97 . 1 1 71 71 LEU N N 71 123.130 123.130 126.084 -2.954 17919 39857 1 97 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.853 0.207 17919 39858 1 97 . 1 1 71 71 LEU C C 71 177.830 177.830 178.069 -0.239 17919 39859 1 97 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.278 0.662 17919 39860 1 97 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.618 0.232 17919 39861 1 97 . 1 1 71 71 LEU H H 71 8.120 8.120 8.714 -0.594 17919 39862 1 97 . 1 1 72 72 ARG N N 72 123.490 123.490 124.545 -1.055 17919 39863 1 97 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.199 0.102 17919 39864 1 97 . 1 1 72 72 ARG C C 72 175.350 175.350 176.484 -1.134 17919 39865 1 97 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.745 -1.135 17919 39866 1 97 . 1 1 72 72 ARG CB C 72 31.350 31.350 28.206 3.144 17919 39867 1 97 . 1 1 72 72 ARG H H 72 8.580 8.580 8.627 -0.047 17919 39868 1 98 . 1 1 2 2 GLN N N 2 123.220 123.220 120.900 2.320 17919 39869 1 98 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.170 0.079 17919 39870 1 98 . 1 1 2 2 GLN C C 2 175.920 175.920 175.008 0.912 17919 39871 1 98 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.418 0.662 17919 39872 1 98 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.961 -0.201 17919 39873 1 98 . 1 1 2 2 GLN H H 2 8.900 8.900 8.325 0.575 17919 39874 1 98 . 1 1 3 3 ILE N N 3 115.340 115.340 117.134 -1.794 17919 39875 1 98 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.268 -0.055 17919 39876 1 98 . 1 1 3 3 ILE C C 3 172.450 172.450 173.405 -0.955 17919 39877 1 98 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.263 0.307 17919 39878 1 98 . 1 1 3 3 ILE CB C 3 42.210 42.210 40.890 1.320 17919 39879 1 98 . 1 1 3 3 ILE H H 3 8.320 8.320 8.461 -0.141 17919 39880 1 98 . 1 1 4 4 PHE N N 4 118.110 118.110 121.810 -3.700 17919 39881 1 98 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.443 0.187 17919 39882 1 98 . 1 1 4 4 PHE C C 4 175.320 175.320 175.427 -0.107 17919 39883 1 98 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.636 -0.426 17919 39884 1 98 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.385 0.095 17919 39885 1 98 . 1 1 4 4 PHE H H 4 8.610 8.610 8.722 -0.112 17919 39886 1 98 . 1 1 5 5 VAL N N 5 121.000 121.000 122.201 -1.201 17919 39887 1 98 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.663 0.062 17919 39888 1 98 . 1 1 5 5 VAL C C 5 174.870 174.870 174.899 -0.029 17919 39889 1 98 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.561 -0.941 17919 39890 1 98 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.646 0.584 17919 39891 1 98 . 1 1 5 5 VAL H H 5 9.300 9.300 9.272 0.028 17919 39892 1 98 . 1 1 6 6 LYS N N 6 127.520 127.520 128.612 -1.092 17919 39893 1 98 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.276 0.091 17919 39894 1 98 . 1 1 6 6 LYS C C 6 177.140 177.140 176.596 0.544 17919 39895 1 98 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.655 -0.135 17919 39896 1 98 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.836 0.214 17919 39897 1 98 . 1 1 6 6 LYS H H 6 8.820 8.820 8.762 0.058 17919 39898 1 98 . 1 1 7 7 THR N N 7 115.400 115.400 118.980 -3.580 17919 39899 1 98 . 1 1 7 7 THR HA H 7 4.970 4.970 4.574 0.396 17919 39900 1 98 . 1 1 7 7 THR C C 7 176.910 176.910 176.198 0.712 17919 39901 1 98 . 1 1 7 7 THR CA C 7 60.470 60.470 60.347 0.123 17919 39902 1 98 . 1 1 7 7 THR CB C 7 70.630 70.630 69.975 0.655 17919 39903 1 98 . 1 1 7 7 THR H H 7 8.730 8.730 8.440 0.290 17919 39904 1 98 . 1 1 8 8 LEU N N 8 121.330 121.330 121.485 -0.155 17919 39905 1 98 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.148 0.162 17919 39906 1 98 . 1 1 8 8 LEU C C 8 178.800 178.800 178.040 0.760 17919 39907 1 98 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.870 -0.289 17919 39908 1 98 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.079 -0.109 17919 39909 1 98 . 1 1 8 8 LEU H H 8 9.100 9.100 8.815 0.285 17919 39910 1 98 . 1 1 9 9 THR N N 9 105.590 105.590 107.043 -1.453 17919 39911 1 98 . 1 1 9 9 THR HA H 9 4.428 4.428 4.294 0.134 17919 39912 1 98 . 1 1 9 9 THR C C 9 175.520 175.520 175.712 -0.192 17919 39913 1 98 . 1 1 9 9 THR CA C 9 61.400 61.400 61.421 -0.021 17919 39914 1 98 . 1 1 9 9 THR CB C 9 69.140 69.140 68.556 0.584 17919 39915 1 98 . 1 1 9 9 THR H H 9 7.630 7.630 7.828 -0.198 17919 39916 1 98 . 1 1 10 10 GLY N N 10 108.890 108.890 110.706 -1.816 17919 39917 1 98 . 1 1 10 10 GLY C C 10 174.070 174.070 174.599 -0.529 17919 39918 1 98 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.837 -0.377 17919 39919 1 98 . 1 1 10 10 GLY H H 10 7.810 7.810 7.764 0.046 17919 39920 1 98 . 1 1 11 11 LYS N N 11 121.600 121.600 120.055 1.545 17919 39921 1 98 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.604 -0.243 17919 39922 1 98 . 1 1 11 11 LYS C C 11 175.940 175.940 175.771 0.169 17919 39923 1 98 . 1 1 11 11 LYS CA C 11 56.280 56.280 54.294 1.986 17919 39924 1 98 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.293 -0.093 17919 39925 1 98 . 1 1 11 11 LYS H H 11 7.280 7.280 7.772 -0.492 17919 39926 1 98 . 1 1 12 12 THR N N 12 120.440 120.440 120.185 0.255 17919 39927 1 98 . 1 1 12 12 THR HA H 12 5.046 5.046 4.890 0.156 17919 39928 1 98 . 1 1 12 12 THR C C 12 174.320 174.320 174.150 0.170 17919 39929 1 98 . 1 1 12 12 THR CA C 12 62.390 62.390 61.863 0.527 17919 39930 1 98 . 1 1 12 12 THR CB C 12 69.910 69.910 68.609 1.301 17919 39931 1 98 . 1 1 12 12 THR H H 12 8.650 8.650 8.504 0.146 17919 39932 1 98 . 1 1 13 13 ILE N N 13 127.110 127.110 129.414 -2.304 17919 39933 1 98 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.268 0.276 17919 39934 1 98 . 1 1 13 13 ILE C C 13 175.220 175.220 175.367 -0.147 17919 39935 1 98 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.904 -0.924 17919 39936 1 98 . 1 1 13 13 ILE CB C 13 40.950 40.950 39.114 1.836 17919 39937 1 98 . 1 1 13 13 ILE H H 13 9.450 9.450 8.954 0.496 17919 39938 1 98 . 1 1 14 14 THR N N 14 121.520 121.520 123.968 -2.448 17919 39939 1 98 . 1 1 14 14 THR HA H 14 4.964 4.964 4.747 0.217 17919 39940 1 98 . 1 1 14 14 THR C C 14 173.790 173.790 174.010 -0.220 17919 39941 1 98 . 1 1 14 14 THR CA C 14 61.940 61.940 62.699 -0.759 17919 39942 1 98 . 1 1 14 14 THR CB C 14 69.650 69.650 69.453 0.197 17919 39943 1 98 . 1 1 14 14 THR H H 14 8.710 8.710 8.655 0.055 17919 39944 1 98 . 1 1 15 15 LEU N N 15 124.800 124.800 129.154 -4.354 17919 39945 1 98 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.647 0.133 17919 39946 1 98 . 1 1 15 15 LEU C C 15 174.670 174.670 175.123 -0.453 17919 39947 1 98 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.730 -0.900 17919 39948 1 98 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.063 2.007 17919 39949 1 98 . 1 1 15 15 LEU H H 15 8.710 8.710 8.768 -0.059 17919 39950 1 98 . 1 1 16 16 GLU N N 16 122.160 122.160 124.127 -1.967 17919 39951 1 98 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.753 0.164 17919 39952 1 98 . 1 1 16 16 GLU C C 16 175.860 175.860 175.564 0.296 17919 39953 1 98 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.190 -0.370 17919 39954 1 98 . 1 1 16 16 GLU CB C 16 29.450 29.450 29.491 -0.042 17919 39955 1 98 . 1 1 16 16 GLU H H 16 8.140 8.140 8.561 -0.421 17919 39956 1 98 . 1 1 17 17 VAL N N 17 117.210 117.210 118.464 -1.254 17919 39957 1 98 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.559 0.155 17919 39958 1 98 . 1 1 17 17 VAL C C 17 174.160 174.160 175.074 -0.914 17919 39959 1 98 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.242 -0.812 17919 39960 1 98 . 1 1 17 17 VAL CB C 17 36.400 36.400 34.295 2.105 17919 39961 1 98 . 1 1 17 17 VAL H H 17 8.900 8.900 7.975 0.925 17919 39962 1 98 . 1 1 18 18 GLU N N 18 118.990 118.990 123.593 -4.603 17919 39963 1 98 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.859 0.220 17919 39964 1 98 . 1 1 18 18 GLU C C 18 176.160 176.160 175.599 0.561 17919 39965 1 98 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.346 0.374 17919 39966 1 98 . 1 1 18 18 GLU CB C 18 30.310 30.310 31.834 -1.524 17919 39967 1 98 . 1 1 18 18 GLU H H 18 8.640 8.640 8.223 0.417 17919 39968 1 98 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.269 -0.128 17919 39969 1 98 . 1 1 19 19 PRO C C 19 175.310 175.310 177.505 -2.195 17919 39970 1 98 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.237 0.232 17919 39971 1 98 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.921 0.029 17919 39972 1 98 . 1 1 20 20 SER N N 20 103.400 103.400 110.941 -7.541 17919 39973 1 98 . 1 1 20 20 SER HA H 20 4.370 4.370 4.274 0.096 17919 39974 1 98 . 1 1 20 20 SER C C 20 174.660 174.660 174.196 0.464 17919 39975 1 98 . 1 1 20 20 SER CA C 20 57.400 57.400 58.918 -1.518 17919 39976 1 98 . 1 1 20 20 SER CB C 20 63.370 63.370 62.884 0.486 17919 39977 1 98 . 1 1 20 20 SER H H 20 7.040 7.040 7.933 -0.893 17919 39978 1 98 . 1 1 21 21 ASP N N 21 123.480 123.480 123.900 -0.420 17919 39979 1 98 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.527 0.168 17919 39980 1 98 . 1 1 21 21 ASP C C 21 176.360 176.360 175.941 0.419 17919 39981 1 98 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.699 0.001 17919 39982 1 98 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.219 -0.419 17919 39983 1 98 . 1 1 21 21 ASP H H 21 8.030 8.030 7.696 0.334 17919 39984 1 98 . 1 1 22 22 THR N N 22 108.800 108.800 114.693 -5.893 17919 39985 1 98 . 1 1 22 22 THR HA H 22 4.920 4.920 4.502 0.418 17919 39986 1 98 . 1 1 22 22 THR C C 22 176.750 176.750 176.007 0.743 17919 39987 1 98 . 1 1 22 22 THR CA C 22 59.690 59.690 62.031 -2.341 17919 39988 1 98 . 1 1 22 22 THR CB C 22 71.200 71.200 69.602 1.598 17919 39989 1 98 . 1 1 22 22 THR H H 22 7.900 7.900 8.307 -0.407 17919 39990 1 98 . 1 1 23 23 ILE N N 23 121.190 121.190 122.890 -1.700 17919 39991 1 98 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.669 -0.012 17919 39992 1 98 . 1 1 23 23 ILE C C 23 179.040 179.040 177.562 1.478 17919 39993 1 98 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.475 -0.215 17919 39994 1 98 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.086 -1.736 17919 39995 1 98 . 1 1 23 23 ILE H H 23 8.560 8.560 8.825 -0.265 17919 39996 1 98 . 1 1 24 24 GLU N N 24 120.830 120.830 120.730 0.100 17919 39997 1 98 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.781 0.136 17919 39998 1 98 . 1 1 24 24 GLU C C 24 178.640 178.640 178.698 -0.058 17919 39999 1 98 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.280 -0.060 17919 40000 1 98 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.215 -0.935 17919 40001 1 98 . 1 1 24 24 GLU H H 24 9.760 9.760 8.182 1.578 17919 40002 1 98 . 1 1 25 25 ASN N N 25 120.570 120.570 116.895 3.675 17919 40003 1 98 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.491 0.034 17919 40004 1 98 . 1 1 25 25 ASN C C 25 178.380 178.380 177.942 0.438 17919 40005 1 98 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.317 -0.257 17919 40006 1 98 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.091 0.359 17919 40007 1 98 . 1 1 25 25 ASN H H 25 7.920 7.920 8.372 -0.452 17919 40008 1 98 . 1 1 26 26 VAL N N 26 121.710 121.710 120.384 1.326 17919 40009 1 98 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.644 -0.247 17919 40010 1 98 . 1 1 26 26 VAL C C 26 177.950 177.950 177.794 0.156 17919 40011 1 98 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.540 1.120 17919 40012 1 98 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.946 -1.106 17919 40013 1 98 . 1 1 26 26 VAL H H 26 8.070 8.070 7.547 0.523 17919 40014 1 98 . 1 1 27 27 LYS N N 27 118.860 118.860 120.178 -1.318 17919 40015 1 98 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.199 0.381 17919 40016 1 98 . 1 1 27 27 LYS C C 27 180.550 180.550 179.179 1.371 17919 40017 1 98 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.315 -0.065 17919 40018 1 98 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.160 1.570 17919 40019 1 98 . 1 1 27 27 LYS H H 27 8.560 8.560 7.855 0.705 17919 40020 1 98 . 1 1 28 28 ALA N N 28 123.440 123.440 123.789 -0.349 17919 40021 1 98 . 1 1 28 28 ALA HA H 28 4.160 4.160 3.923 0.237 17919 40022 1 98 . 1 1 28 28 ALA C C 28 180.300 180.300 178.893 1.407 17919 40023 1 98 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.544 -0.174 17919 40024 1 98 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.209 -0.499 17919 40025 1 98 . 1 1 28 28 ALA H H 28 8.060 8.060 8.551 -0.491 17919 40026 1 98 . 1 1 29 29 LYS N N 29 119.940 119.940 119.385 0.555 17919 40027 1 98 . 1 1 29 29 LYS HA H 29 4.207 4.207 3.994 0.213 17919 40028 1 98 . 1 1 29 29 LYS C C 29 180.320 180.320 179.419 0.901 17919 40029 1 98 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.474 0.176 17919 40030 1 98 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.337 0.953 17919 40031 1 98 . 1 1 29 29 LYS H H 29 7.850 7.850 7.696 0.154 17919 40032 1 98 . 1 1 30 30 ILE N N 30 121.080 121.080 119.426 1.654 17919 40033 1 98 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.620 -0.113 17919 40034 1 98 . 1 1 30 30 ILE C C 30 178.310 178.310 177.492 0.818 17919 40035 1 98 . 1 1 30 30 ILE CA C 30 66.150 66.150 64.863 1.287 17919 40036 1 98 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.552 -0.752 17919 40037 1 98 . 1 1 30 30 ILE H H 30 8.280 8.280 8.425 -0.145 17919 40038 1 98 . 1 1 31 31 GLN N N 31 123.490 123.490 120.774 2.716 17919 40039 1 98 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.886 -0.057 17919 40040 1 98 . 1 1 31 31 GLN C C 31 178.890 178.890 178.078 0.812 17919 40041 1 98 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.403 0.597 17919 40042 1 98 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.285 -0.565 17919 40043 1 98 . 1 1 31 31 GLN H H 31 8.580 8.580 7.909 0.671 17919 40044 1 98 . 1 1 32 32 ASP N N 32 119.360 119.360 118.957 0.403 17919 40045 1 98 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.362 -0.008 17919 40046 1 98 . 1 1 32 32 ASP C C 32 177.250 177.250 177.855 -0.605 17919 40047 1 98 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.849 0.341 17919 40048 1 98 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.557 0.023 17919 40049 1 98 . 1 1 32 32 ASP H H 32 8.010 8.010 8.253 -0.243 17919 40050 1 98 . 1 1 33 33 LYS N N 33 115.130 115.130 118.526 -3.396 17919 40051 1 98 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.294 0.043 17919 40052 1 98 . 1 1 33 33 LYS C C 33 177.870 177.870 178.412 -0.542 17919 40053 1 98 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.639 0.411 17919 40054 1 98 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.232 0.938 17919 40055 1 98 . 1 1 33 33 LYS H H 33 7.430 7.430 7.576 -0.146 17919 40056 1 98 . 1 1 34 34 GLU N N 34 113.870 113.870 115.820 -1.950 17919 40057 1 98 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.470 0.155 17919 40058 1 98 . 1 1 34 34 GLU C C 34 177.840 177.840 176.881 0.959 17919 40059 1 98 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.807 -0.637 17919 40060 1 98 . 1 1 34 34 GLU CB C 34 32.660 32.660 30.821 1.839 17919 40061 1 98 . 1 1 34 34 GLU H H 34 8.740 8.740 7.976 0.764 17919 40062 1 98 . 1 1 35 35 GLY N N 35 108.650 108.650 109.354 -0.704 17919 40063 1 98 . 1 1 35 35 GLY C C 35 173.960 173.960 174.636 -0.676 17919 40064 1 98 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.841 0.239 17919 40065 1 98 . 1 1 35 35 GLY H H 35 8.530 8.530 8.215 0.315 17919 40066 1 98 . 1 1 36 36 ILE N N 36 119.880 119.880 121.310 -1.430 17919 40067 1 98 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.339 0.106 17919 40068 1 98 . 1 1 36 36 ILE C C 36 173.590 173.590 174.504 -0.914 17919 40069 1 98 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.104 0.646 17919 40070 1 98 . 1 1 36 36 ILE CB C 36 40.580 40.580 36.928 3.652 17919 40071 1 98 . 1 1 36 36 ILE H H 36 6.150 6.150 7.717 -1.567 17919 40072 1 98 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.773 -0.139 17919 40073 1 98 . 1 1 37 37 PRO C C 37 176.940 176.940 176.216 0.724 17919 40074 1 98 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.409 0.251 17919 40075 1 98 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.705 0.145 17919 40076 1 98 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.255 -0.138 17919 40077 1 98 . 1 1 38 38 PRO C C 38 178.320 178.320 178.756 -0.436 17919 40078 1 98 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.460 0.800 17919 40079 1 98 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.881 1.009 17919 40080 1 98 . 1 1 39 39 ASP N N 39 113.380 113.380 117.096 -3.716 17919 40081 1 98 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.350 0.080 17919 40082 1 98 . 1 1 39 39 ASP C C 39 177.090 177.090 177.733 -0.643 17919 40083 1 98 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.991 -1.351 17919 40084 1 98 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.469 -0.929 17919 40085 1 98 . 1 1 39 39 ASP H H 39 8.550 8.550 8.720 -0.170 17919 40086 1 98 . 1 1 40 40 GLN N N 40 116.780 116.780 115.870 0.910 17919 40087 1 98 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.325 0.139 17919 40088 1 98 . 1 1 40 40 GLN C C 40 175.380 175.380 175.929 -0.549 17919 40089 1 98 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.093 -0.452 17919 40090 1 98 . 1 1 40 40 GLN CB C 40 30.140 30.140 30.020 0.120 17919 40091 1 98 . 1 1 40 40 GLN H H 40 7.820 7.820 7.882 -0.062 17919 40092 1 98 . 1 1 41 41 GLN N N 41 117.720 117.720 120.136 -2.416 17919 40093 1 98 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.792 -0.548 17919 40094 1 98 . 1 1 41 41 GLN C C 41 176.300 176.300 175.354 0.946 17919 40095 1 98 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.124 0.346 17919 40096 1 98 . 1 1 41 41 GLN CB C 41 31.650 31.650 30.010 1.640 17919 40097 1 98 . 1 1 41 41 GLN H H 41 7.480 7.480 7.572 -0.092 17919 40098 1 98 . 1 1 42 42 ARG N N 42 122.680 122.680 122.795 -0.115 17919 40099 1 98 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.658 -0.158 17919 40100 1 98 . 1 1 42 42 ARG C C 42 174.050 174.050 174.600 -0.550 17919 40101 1 98 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.834 0.215 17919 40102 1 98 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.439 -1.689 17919 40103 1 98 . 1 1 42 42 ARG H H 42 8.530 8.530 8.758 -0.228 17919 40104 1 98 . 1 1 43 43 LEU N N 43 124.040 124.040 122.629 1.411 17919 40105 1 98 . 1 1 43 43 LEU C C 43 175.290 175.290 175.596 -0.306 17919 40106 1 98 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.470 -0.490 17919 40107 1 98 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.685 1.105 17919 40108 1 98 . 1 1 43 43 LEU H H 43 8.820 8.820 8.658 0.162 17919 40109 1 98 . 1 1 44 44 ILE N N 44 121.920 121.920 120.426 1.494 17919 40110 1 98 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.918 0.074 17919 40111 1 98 . 1 1 44 44 ILE C C 44 176.060 176.060 174.408 1.652 17919 40112 1 98 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.497 -1.517 17919 40113 1 98 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.870 -0.450 17919 40114 1 98 . 1 1 44 44 ILE H H 44 9.030 9.030 8.214 0.815 17919 40115 1 98 . 1 1 45 45 PHE N N 45 125.390 125.390 127.715 -2.325 17919 40116 1 98 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.151 -0.106 17919 40117 1 98 . 1 1 45 45 PHE C C 45 174.470 174.470 174.442 0.028 17919 40118 1 98 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.557 0.463 17919 40119 1 98 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.225 0.535 17919 40120 1 98 . 1 1 45 45 PHE H H 45 8.830 8.830 8.599 0.231 17919 40121 1 98 . 1 1 46 46 ALA N N 46 132.200 132.200 129.868 2.332 17919 40122 1 98 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.659 0.031 17919 40123 1 98 . 1 1 46 46 ALA C C 46 177.290 177.290 177.551 -0.261 17919 40124 1 98 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.961 -0.421 17919 40125 1 98 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.473 0.097 17919 40126 1 98 . 1 1 46 46 ALA H H 46 8.810 8.810 8.920 -0.110 17919 40127 1 98 . 1 1 47 47 GLY N N 47 102.340 102.340 103.477 -1.137 17919 40128 1 98 . 1 1 47 47 GLY C C 47 173.810 173.810 174.509 -0.699 17919 40129 1 98 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.403 -0.053 17919 40130 1 98 . 1 1 47 47 GLY H H 47 8.130 8.130 8.567 -0.437 17919 40131 1 98 . 1 1 48 48 LYS N N 48 121.570 121.570 121.970 -0.400 17919 40132 1 98 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.518 0.104 17919 40133 1 98 . 1 1 48 48 LYS C C 48 174.700 174.700 175.499 -0.799 17919 40134 1 98 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.932 -0.382 17919 40135 1 98 . 1 1 48 48 LYS CB C 48 34.530 34.530 33.445 1.085 17919 40136 1 98 . 1 1 48 48 LYS H H 48 7.980 7.980 7.843 0.137 17919 40137 1 98 . 1 1 49 49 GLN N N 49 122.410 122.410 126.372 -3.962 17919 40138 1 98 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.555 0.005 17919 40139 1 98 . 1 1 49 49 GLN C C 49 175.670 175.670 175.766 -0.096 17919 40140 1 98 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.810 -0.070 17919 40141 1 98 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.302 -0.301 17919 40142 1 98 . 1 1 49 49 GLN H H 49 8.600 8.600 8.727 -0.127 17919 40143 1 98 . 1 1 50 50 LEU N N 50 125.520 125.520 126.878 -1.358 17919 40144 1 98 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.048 0.042 17919 40145 1 98 . 1 1 50 50 LEU C C 50 176.660 176.660 176.118 0.542 17919 40146 1 98 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.236 0.004 17919 40147 1 98 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.194 -0.624 17919 40148 1 98 . 1 1 50 50 LEU H H 50 8.530 8.530 8.531 -0.001 17919 40149 1 98 . 1 1 51 51 GLU N N 51 122.940 122.940 120.885 2.055 17919 40150 1 98 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.442 0.046 17919 40151 1 98 . 1 1 51 51 GLU C C 51 175.870 175.870 176.184 -0.314 17919 40152 1 98 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.210 0.750 17919 40153 1 98 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.973 -0.403 17919 40154 1 98 . 1 1 51 51 GLU H H 51 8.400 8.400 8.288 0.112 17919 40155 1 98 . 1 1 52 52 ASP N N 52 120.030 120.030 126.933 -6.903 17919 40156 1 98 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.453 -0.094 17919 40157 1 98 . 1 1 52 52 ASP C C 52 177.330 177.330 176.874 0.456 17919 40158 1 98 . 1 1 52 52 ASP CA C 52 56.960 56.960 56.889 0.071 17919 40159 1 98 . 1 1 52 52 ASP CB C 52 40.850 40.850 41.017 -0.167 17919 40160 1 98 . 1 1 52 52 ASP H H 52 8.160 8.160 8.899 -0.739 17919 40161 1 98 . 1 1 53 53 GLY N N 53 106.660 106.660 105.683 0.977 17919 40162 1 98 . 1 1 53 53 GLY C C 53 174.870 174.870 174.416 0.454 17919 40163 1 98 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.947 0.223 17919 40164 1 98 . 1 1 53 53 GLY H H 53 9.390 9.390 7.761 1.629 17919 40165 1 98 . 1 1 54 54 ARG N N 54 119.050 119.050 121.254 -2.204 17919 40166 1 98 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.706 -0.011 17919 40167 1 98 . 1 1 54 54 ARG C C 54 175.350 175.350 175.422 -0.072 17919 40168 1 98 . 1 1 54 54 ARG CA C 54 54.390 54.390 52.861 1.528 17919 40169 1 98 . 1 1 54 54 ARG CB C 54 32.650 32.650 31.263 1.387 17919 40170 1 98 . 1 1 54 54 ARG H H 54 7.460 7.460 7.828 -0.368 17919 40171 1 98 . 1 1 55 55 THR N N 55 108.400 108.400 110.346 -1.946 17919 40172 1 98 . 1 1 55 55 THR HA H 55 5.240 5.240 5.218 0.022 17919 40173 1 98 . 1 1 55 55 THR C C 55 176.560 176.560 176.180 0.380 17919 40174 1 98 . 1 1 55 55 THR CA C 55 59.690 59.690 59.548 0.142 17919 40175 1 98 . 1 1 55 55 THR CB C 55 72.260 72.260 71.825 0.435 17919 40176 1 98 . 1 1 55 55 THR H H 55 8.730 8.730 8.642 0.088 17919 40177 1 98 . 1 1 56 56 LEU N N 56 117.920 117.920 120.673 -2.753 17919 40178 1 98 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.057 0.003 17919 40179 1 98 . 1 1 56 56 LEU C C 56 180.810 180.810 178.840 1.970 17919 40180 1 98 . 1 1 56 56 LEU CA C 56 58.710 58.710 57.666 1.044 17919 40181 1 98 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.603 -1.233 17919 40182 1 98 . 1 1 56 56 LEU H H 56 8.140 8.140 8.412 -0.272 17919 40183 1 98 . 1 1 57 57 SER N N 57 113.330 113.330 115.607 -2.277 17919 40184 1 98 . 1 1 57 57 SER HA H 57 4.370 4.370 4.169 0.201 17919 40185 1 98 . 1 1 57 57 SER C C 57 178.310 178.310 176.842 1.468 17919 40186 1 98 . 1 1 57 57 SER CA C 57 61.080 61.080 62.015 -0.935 17919 40187 1 98 . 1 1 57 57 SER CB C 57 62.530 62.530 62.470 0.060 17919 40188 1 98 . 1 1 57 57 SER H H 57 8.470 8.470 7.907 0.564 17919 40189 1 98 . 1 1 58 58 ASP N N 58 124.190 124.190 122.802 1.388 17919 40190 1 98 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.413 -0.117 17919 40191 1 98 . 1 1 58 58 ASP C C 58 177.400 177.400 176.480 0.920 17919 40192 1 98 . 1 1 58 58 ASP CA C 58 57.180 57.180 57.099 0.081 17919 40193 1 98 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.863 -0.763 17919 40194 1 98 . 1 1 58 58 ASP H H 58 7.930 7.930 7.987 -0.057 17919 40195 1 98 . 1 1 59 59 TYR N N 59 115.510 115.510 114.584 0.926 17919 40196 1 98 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.690 -0.020 17919 40197 1 98 . 1 1 59 59 TYR C C 59 174.700 174.700 175.159 -0.459 17919 40198 1 98 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.289 0.961 17919 40199 1 98 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.300 1.770 17919 40200 1 98 . 1 1 59 59 TYR H H 59 7.250 7.250 7.478 -0.228 17919 40201 1 98 . 1 1 60 60 ASN N N 60 115.900 115.900 118.085 -2.185 17919 40202 1 98 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.375 -0.020 17919 40203 1 98 . 1 1 60 60 ASN C C 60 174.340 174.340 174.464 -0.124 17919 40204 1 98 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.255 -0.135 17919 40205 1 98 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.253 0.157 17919 40206 1 98 . 1 1 60 60 ASN H H 60 8.150 8.150 8.027 0.123 17919 40207 1 98 . 1 1 61 61 ILE N N 61 118.600 118.600 119.330 -0.730 17919 40208 1 98 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.853 -0.460 17919 40209 1 98 . 1 1 61 61 ILE C C 61 174.610 174.610 175.211 -0.601 17919 40210 1 98 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.532 0.888 17919 40211 1 98 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.159 -0.419 17919 40212 1 98 . 1 1 61 61 ILE H H 61 7.250 7.250 7.854 -0.605 17919 40213 1 98 . 1 1 62 62 GLN N N 62 124.740 124.740 125.290 -0.550 17919 40214 1 98 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.778 -0.272 17919 40215 1 98 . 1 1 62 62 GLN C C 62 175.970 175.970 175.694 0.276 17919 40216 1 98 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.374 0.286 17919 40217 1 98 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.660 -0.010 17919 40218 1 98 . 1 1 62 62 GLN H H 62 7.610 7.610 7.970 -0.360 17919 40219 1 98 . 1 1 63 63 LYS N N 63 120.300 120.300 121.397 -1.097 17919 40220 1 98 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.036 -0.035 17919 40221 1 98 . 1 1 63 63 LYS C C 63 175.810 175.810 176.905 -1.095 17919 40222 1 98 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.575 0.215 17919 40223 1 98 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.322 1.328 17919 40224 1 98 . 1 1 63 63 LYS H H 63 8.490 8.490 8.668 -0.178 17919 40225 1 98 . 1 1 64 64 GLU N N 64 113.950 113.950 119.711 -5.761 17919 40226 1 98 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.683 -0.218 17919 40227 1 98 . 1 1 64 64 GLU C C 64 175.250 175.250 175.805 -0.555 17919 40228 1 98 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.456 0.434 17919 40229 1 98 . 1 1 64 64 GLU CB C 64 25.900 25.900 27.505 -1.605 17919 40230 1 98 . 1 1 64 64 GLU H H 64 9.280 9.280 8.686 0.594 17919 40231 1 98 . 1 1 65 65 SER N N 65 114.730 114.730 114.310 0.420 17919 40232 1 98 . 1 1 65 65 SER HA H 65 4.640 4.640 4.509 0.131 17919 40233 1 98 . 1 1 65 65 SER C C 65 172.160 172.160 173.906 -1.746 17919 40234 1 98 . 1 1 65 65 SER CA C 65 60.890 60.890 59.790 1.100 17919 40235 1 98 . 1 1 65 65 SER CB C 65 64.910 64.910 64.313 0.597 17919 40236 1 98 . 1 1 65 65 SER H H 65 7.670 7.670 7.558 0.112 17919 40237 1 98 . 1 1 66 66 THR N N 66 117.110 117.110 117.060 0.050 17919 40238 1 98 . 1 1 66 66 THR HA H 66 5.270 5.270 5.255 0.015 17919 40239 1 98 . 1 1 66 66 THR C C 66 173.950 173.950 173.285 0.665 17919 40240 1 98 . 1 1 66 66 THR CA C 66 62.340 62.340 61.747 0.593 17919 40241 1 98 . 1 1 66 66 THR CB C 66 70.080 70.080 71.005 -0.925 17919 40242 1 98 . 1 1 66 66 THR H H 66 8.730 8.730 8.461 0.269 17919 40243 1 98 . 1 1 67 67 LEU N N 67 127.110 127.110 127.192 -0.082 17919 40244 1 98 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.975 0.085 17919 40245 1 98 . 1 1 67 67 LEU C C 67 175.770 175.770 176.046 -0.276 17919 40246 1 98 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.739 0.162 17919 40247 1 98 . 1 1 67 67 LEU CB C 67 44.260 44.260 42.934 1.326 17919 40248 1 98 . 1 1 67 67 LEU H H 67 9.410 9.410 8.388 1.022 17919 40249 1 98 . 1 1 68 68 HIS N N 68 118.380 118.380 124.194 -5.814 17919 40250 1 98 . 1 1 68 68 HIS HA H 68 5.240 5.240 4.968 0.272 17919 40251 1 98 . 1 1 68 68 HIS C C 68 173.150 173.150 175.311 -2.161 17919 40252 1 98 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.917 0.083 17919 40253 1 98 . 1 1 68 68 HIS CB C 68 30.530 30.530 28.899 1.631 17919 40254 1 98 . 1 1 68 68 HIS H H 68 9.230 9.230 9.090 0.140 17919 40255 1 98 . 1 1 69 69 LEU N N 69 124.460 124.460 128.488 -4.028 17919 40256 1 98 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.313 0.877 17919 40257 1 98 . 1 1 69 69 LEU C C 69 175.270 175.270 175.261 0.009 17919 40258 1 98 . 1 1 69 69 LEU CA C 69 53.890 53.890 55.668 -1.778 17919 40259 1 98 . 1 1 69 69 LEU CB C 69 44.380 44.380 41.227 3.153 17919 40260 1 98 . 1 1 69 69 LEU H H 69 8.340 8.340 7.941 0.399 17919 40261 1 98 . 1 1 70 70 VAL N N 70 126.940 126.940 127.881 -0.941 17919 40262 1 98 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.393 -0.043 17919 40263 1 98 . 1 1 70 70 VAL C C 70 174.000 174.000 174.948 -0.948 17919 40264 1 98 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.956 -0.156 17919 40265 1 98 . 1 1 70 70 VAL CB C 70 34.910 34.910 34.764 0.146 17919 40266 1 98 . 1 1 70 70 VAL H H 70 9.200 9.200 8.878 0.322 17919 40267 1 98 . 1 1 71 71 LEU N N 71 123.130 123.130 119.161 3.969 17919 40268 1 98 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.144 -0.084 17919 40269 1 98 . 1 1 71 71 LEU C C 71 177.830 177.830 176.268 1.562 17919 40270 1 98 . 1 1 71 71 LEU CA C 71 53.940 53.940 52.870 1.070 17919 40271 1 98 . 1 1 71 71 LEU CB C 71 42.850 42.850 45.809 -2.959 17919 40272 1 98 . 1 1 71 71 LEU H H 71 8.120 8.120 8.126 -0.006 17919 40273 1 98 . 1 1 72 72 ARG N N 72 123.490 123.490 121.317 2.173 17919 40274 1 98 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.403 -0.102 17919 40275 1 98 . 1 1 72 72 ARG C C 72 175.350 175.350 175.796 -0.446 17919 40276 1 98 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.954 -0.344 17919 40277 1 98 . 1 1 72 72 ARG CB C 72 31.350 31.350 31.309 0.041 17919 40278 1 98 . 1 1 72 72 ARG H H 72 8.580 8.580 7.999 0.581 17919 40279 1 99 . 1 1 2 2 GLN N N 2 123.220 123.220 123.236 -0.016 17919 40280 1 99 . 1 1 2 2 GLN HA H 2 5.249 5.249 4.744 0.505 17919 40281 1 99 . 1 1 2 2 GLN C C 2 175.920 175.920 174.808 1.112 17919 40282 1 99 . 1 1 2 2 GLN CA C 2 55.080 55.080 55.801 -0.721 17919 40283 1 99 . 1 1 2 2 GLN CB C 2 30.760 30.760 29.436 1.324 17919 40284 1 99 . 1 1 2 2 GLN H H 2 8.900 8.900 8.217 0.683 17919 40285 1 99 . 1 1 3 3 ILE N N 3 115.340 115.340 115.146 0.194 17919 40286 1 99 . 1 1 3 3 ILE HA H 3 4.213 4.213 3.993 0.221 17919 40287 1 99 . 1 1 3 3 ILE C C 3 172.450 172.450 174.124 -1.674 17919 40288 1 99 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.494 0.076 17919 40289 1 99 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.076 1.134 17919 40290 1 99 . 1 1 3 3 ILE H H 3 8.320 8.320 8.687 -0.367 17919 40291 1 99 . 1 1 4 4 PHE N N 4 118.110 118.110 120.678 -2.568 17919 40292 1 99 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.386 0.244 17919 40293 1 99 . 1 1 4 4 PHE C C 4 175.320 175.320 175.487 -0.167 17919 40294 1 99 . 1 1 4 4 PHE CA C 4 55.210 55.210 54.721 0.489 17919 40295 1 99 . 1 1 4 4 PHE CB C 4 41.480 41.480 40.187 1.293 17919 40296 1 99 . 1 1 4 4 PHE H H 4 8.610 8.610 8.144 0.466 17919 40297 1 99 . 1 1 5 5 VAL N N 5 121.000 121.000 123.328 -2.328 17919 40298 1 99 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.832 -0.107 17919 40299 1 99 . 1 1 5 5 VAL C C 5 174.870 174.870 174.966 -0.096 17919 40300 1 99 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.163 -0.543 17919 40301 1 99 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.178 1.052 17919 40302 1 99 . 1 1 5 5 VAL H H 5 9.300 9.300 8.332 0.968 17919 40303 1 99 . 1 1 6 6 LYS N N 6 127.520 127.520 128.747 -1.227 17919 40304 1 99 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.311 0.056 17919 40305 1 99 . 1 1 6 6 LYS C C 6 177.140 177.140 176.491 0.649 17919 40306 1 99 . 1 1 6 6 LYS CA C 6 54.520 54.520 53.634 0.886 17919 40307 1 99 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.619 -0.569 17919 40308 1 99 . 1 1 6 6 LYS H H 6 8.820 8.820 9.190 -0.370 17919 40309 1 99 . 1 1 7 7 THR N N 7 115.400 115.400 116.164 -0.764 17919 40310 1 99 . 1 1 7 7 THR HA H 7 4.970 4.970 4.712 0.258 17919 40311 1 99 . 1 1 7 7 THR C C 7 176.910 176.910 175.843 1.067 17919 40312 1 99 . 1 1 7 7 THR CA C 7 60.470 60.470 60.550 -0.080 17919 40313 1 99 . 1 1 7 7 THR CB C 7 70.630 70.630 70.710 -0.080 17919 40314 1 99 . 1 1 7 7 THR H H 7 8.730 8.730 8.060 0.670 17919 40315 1 99 . 1 1 8 8 LEU N N 8 121.330 121.330 120.520 0.810 17919 40316 1 99 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.027 0.283 17919 40317 1 99 . 1 1 8 8 LEU C C 8 178.800 178.800 178.443 0.357 17919 40318 1 99 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.718 -0.138 17919 40319 1 99 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.767 0.203 17919 40320 1 99 . 1 1 8 8 LEU H H 8 9.100 9.100 8.652 0.448 17919 40321 1 99 . 1 1 9 9 THR N N 9 105.590 105.590 106.866 -1.276 17919 40322 1 99 . 1 1 9 9 THR HA H 9 4.428 4.428 4.205 0.224 17919 40323 1 99 . 1 1 9 9 THR C C 9 175.520 175.520 175.713 -0.193 17919 40324 1 99 . 1 1 9 9 THR CA C 9 61.400 61.400 62.678 -1.278 17919 40325 1 99 . 1 1 9 9 THR CB C 9 69.140 69.140 68.243 0.897 17919 40326 1 99 . 1 1 9 9 THR H H 9 7.630 7.630 7.776 -0.146 17919 40327 1 99 . 1 1 10 10 GLY N N 10 108.890 108.890 111.097 -2.207 17919 40328 1 99 . 1 1 10 10 GLY C C 10 174.070 174.070 173.706 0.364 17919 40329 1 99 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.001 0.459 17919 40330 1 99 . 1 1 10 10 GLY H H 10 7.810 7.810 7.496 0.314 17919 40331 1 99 . 1 1 11 11 LYS N N 11 121.600 121.600 121.462 0.138 17919 40332 1 99 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.327 0.034 17919 40333 1 99 . 1 1 11 11 LYS C C 11 175.940 175.940 175.782 0.158 17919 40334 1 99 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.430 -0.150 17919 40335 1 99 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.335 -0.135 17919 40336 1 99 . 1 1 11 11 LYS H H 11 7.280 7.280 7.845 -0.565 17919 40337 1 99 . 1 1 12 12 THR N N 12 120.440 120.440 121.007 -0.567 17919 40338 1 99 . 1 1 12 12 THR HA H 12 5.046 5.046 4.589 0.457 17919 40339 1 99 . 1 1 12 12 THR C C 12 174.320 174.320 174.788 -0.468 17919 40340 1 99 . 1 1 12 12 THR CA C 12 62.390 62.390 62.855 -0.465 17919 40341 1 99 . 1 1 12 12 THR CB C 12 69.910 69.910 69.428 0.482 17919 40342 1 99 . 1 1 12 12 THR H H 12 8.650 8.650 8.268 0.382 17919 40343 1 99 . 1 1 13 13 ILE N N 13 127.110 127.110 127.061 0.049 17919 40344 1 99 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.420 0.124 17919 40345 1 99 . 1 1 13 13 ILE C C 13 175.220 175.220 174.455 0.765 17919 40346 1 99 . 1 1 13 13 ILE CA C 13 59.980 59.980 61.079 -1.099 17919 40347 1 99 . 1 1 13 13 ILE CB C 13 40.950 40.950 39.829 1.121 17919 40348 1 99 . 1 1 13 13 ILE H H 13 9.450 9.450 8.192 1.258 17919 40349 1 99 . 1 1 14 14 THR N N 14 121.520 121.520 122.494 -0.974 17919 40350 1 99 . 1 1 14 14 THR HA H 14 4.964 4.964 5.006 -0.042 17919 40351 1 99 . 1 1 14 14 THR C C 14 173.790 173.790 173.596 0.194 17919 40352 1 99 . 1 1 14 14 THR CA C 14 61.940 61.940 62.425 -0.485 17919 40353 1 99 . 1 1 14 14 THR CB C 14 69.650 69.650 69.656 -0.006 17919 40354 1 99 . 1 1 14 14 THR H H 14 8.710 8.710 8.400 0.310 17919 40355 1 99 . 1 1 15 15 LEU N N 15 124.800 124.800 126.709 -1.909 17919 40356 1 99 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.704 0.076 17919 40357 1 99 . 1 1 15 15 LEU C C 15 174.670 174.670 174.730 -0.060 17919 40358 1 99 . 1 1 15 15 LEU CA C 15 52.830 52.830 54.112 -1.282 17919 40359 1 99 . 1 1 15 15 LEU CB C 15 47.070 47.070 44.586 2.484 17919 40360 1 99 . 1 1 15 15 LEU H H 15 8.710 8.710 8.114 0.596 17919 40361 1 99 . 1 1 16 16 GLU N N 16 122.160 122.160 124.919 -2.759 17919 40362 1 99 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.407 0.510 17919 40363 1 99 . 1 1 16 16 GLU C C 16 175.860 175.860 175.282 0.578 17919 40364 1 99 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.680 -0.860 17919 40365 1 99 . 1 1 16 16 GLU CB C 16 29.450 29.450 29.490 -0.040 17919 40366 1 99 . 1 1 16 16 GLU H H 16 8.140 8.140 8.643 -0.503 17919 40367 1 99 . 1 1 17 17 VAL N N 17 117.210 117.210 119.846 -2.636 17919 40368 1 99 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.819 -0.105 17919 40369 1 99 . 1 1 17 17 VAL C C 17 174.160 174.160 175.353 -1.193 17919 40370 1 99 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.959 -0.529 17919 40371 1 99 . 1 1 17 17 VAL CB C 17 36.400 36.400 34.774 1.626 17919 40372 1 99 . 1 1 17 17 VAL H H 17 8.900 8.900 8.150 0.750 17919 40373 1 99 . 1 1 18 18 GLU N N 18 118.990 118.990 120.810 -1.820 17919 40374 1 99 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.946 0.133 17919 40375 1 99 . 1 1 18 18 GLU C C 18 176.160 176.160 175.499 0.661 17919 40376 1 99 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.003 -0.283 17919 40377 1 99 . 1 1 18 18 GLU CB C 18 30.310 30.310 32.007 -1.697 17919 40378 1 99 . 1 1 18 18 GLU H H 18 8.640 8.640 8.494 0.146 17919 40379 1 99 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.270 -0.129 17919 40380 1 99 . 1 1 19 19 PRO C C 19 175.310 175.310 177.827 -2.517 17919 40381 1 99 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.469 0.001 17919 40382 1 99 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.900 0.050 17919 40383 1 99 . 1 1 20 20 SER N N 20 103.400 103.400 109.451 -6.051 17919 40384 1 99 . 1 1 20 20 SER HA H 20 4.370 4.370 4.278 0.092 17919 40385 1 99 . 1 1 20 20 SER C C 20 174.660 174.660 174.333 0.327 17919 40386 1 99 . 1 1 20 20 SER CA C 20 57.400 57.400 59.092 -1.692 17919 40387 1 99 . 1 1 20 20 SER CB C 20 63.370 63.370 62.774 0.596 17919 40388 1 99 . 1 1 20 20 SER H H 20 7.040 7.040 7.976 -0.936 17919 40389 1 99 . 1 1 21 21 ASP N N 21 123.480 123.480 124.355 -0.875 17919 40390 1 99 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.654 0.041 17919 40391 1 99 . 1 1 21 21 ASP C C 21 176.360 176.360 176.205 0.155 17919 40392 1 99 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.443 0.257 17919 40393 1 99 . 1 1 21 21 ASP CB C 21 40.800 40.800 42.000 -1.200 17919 40394 1 99 . 1 1 21 21 ASP H H 21 8.030 8.030 7.672 0.358 17919 40395 1 99 . 1 1 22 22 THR N N 22 108.800 108.800 114.082 -5.282 17919 40396 1 99 . 1 1 22 22 THR HA H 22 4.920 4.920 4.468 0.452 17919 40397 1 99 . 1 1 22 22 THR C C 22 176.750 176.750 176.644 0.106 17919 40398 1 99 . 1 1 22 22 THR CA C 22 59.690 59.690 61.849 -2.159 17919 40399 1 99 . 1 1 22 22 THR CB C 22 71.200 71.200 69.922 1.278 17919 40400 1 99 . 1 1 22 22 THR H H 22 7.900 7.900 8.542 -0.642 17919 40401 1 99 . 1 1 23 23 ILE N N 23 121.190 121.190 121.270 -0.080 17919 40402 1 99 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.719 -0.062 17919 40403 1 99 . 1 1 23 23 ILE C C 23 179.040 179.040 177.802 1.238 17919 40404 1 99 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.567 -1.307 17919 40405 1 99 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.051 -1.701 17919 40406 1 99 . 1 1 23 23 ILE H H 23 8.560 8.560 9.017 -0.457 17919 40407 1 99 . 1 1 24 24 GLU N N 24 120.830 120.830 119.100 1.730 17919 40408 1 99 . 1 1 24 24 GLU HA H 24 3.917 3.917 4.095 -0.178 17919 40409 1 99 . 1 1 24 24 GLU C C 24 178.640 178.640 178.157 0.483 17919 40410 1 99 . 1 1 24 24 GLU CA C 24 60.220 60.220 58.539 1.681 17919 40411 1 99 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.040 -0.760 17919 40412 1 99 . 1 1 24 24 GLU H H 24 9.760 9.760 8.077 1.683 17919 40413 1 99 . 1 1 25 25 ASN N N 25 120.570 120.570 119.197 1.373 17919 40414 1 99 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.440 0.085 17919 40415 1 99 . 1 1 25 25 ASN C C 25 178.380 178.380 177.899 0.481 17919 40416 1 99 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.719 -0.659 17919 40417 1 99 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.285 0.165 17919 40418 1 99 . 1 1 25 25 ASN H H 25 7.920 7.920 7.625 0.295 17919 40419 1 99 . 1 1 26 26 VAL N N 26 121.710 121.710 120.804 0.906 17919 40420 1 99 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.480 -0.083 17919 40421 1 99 . 1 1 26 26 VAL C C 26 177.950 177.950 177.707 0.243 17919 40422 1 99 . 1 1 26 26 VAL CA C 26 67.660 67.660 67.169 0.491 17919 40423 1 99 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.297 -0.457 17919 40424 1 99 . 1 1 26 26 VAL H H 26 8.070 8.070 7.727 0.343 17919 40425 1 99 . 1 1 27 27 LYS N N 27 118.860 118.860 120.098 -1.238 17919 40426 1 99 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.171 0.409 17919 40427 1 99 . 1 1 27 27 LYS C C 27 180.550 180.550 179.085 1.465 17919 40428 1 99 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.722 -0.472 17919 40429 1 99 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.300 1.430 17919 40430 1 99 . 1 1 27 27 LYS H H 27 8.560 8.560 7.830 0.730 17919 40431 1 99 . 1 1 28 28 ALA N N 28 123.440 123.440 119.474 3.966 17919 40432 1 99 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.194 -0.034 17919 40433 1 99 . 1 1 28 28 ALA C C 28 180.300 180.300 179.437 0.863 17919 40434 1 99 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.632 0.738 17919 40435 1 99 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.448 -0.738 17919 40436 1 99 . 1 1 28 28 ALA H H 28 8.060 8.060 8.029 0.031 17919 40437 1 99 . 1 1 29 29 LYS N N 29 119.940 119.940 119.748 0.192 17919 40438 1 99 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.038 0.169 17919 40439 1 99 . 1 1 29 29 LYS C C 29 180.320 180.320 179.005 1.315 17919 40440 1 99 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.125 0.525 17919 40441 1 99 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.235 1.055 17919 40442 1 99 . 1 1 29 29 LYS H H 29 7.850 7.850 7.545 0.305 17919 40443 1 99 . 1 1 30 30 ILE N N 30 121.080 121.080 120.743 0.337 17919 40444 1 99 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.614 -0.107 17919 40445 1 99 . 1 1 30 30 ILE C C 30 178.310 178.310 177.440 0.870 17919 40446 1 99 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.425 0.725 17919 40447 1 99 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.220 -0.420 17919 40448 1 99 . 1 1 30 30 ILE H H 30 8.280 8.280 8.399 -0.119 17919 40449 1 99 . 1 1 31 31 GLN N N 31 123.490 123.490 119.884 3.606 17919 40450 1 99 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.010 -0.181 17919 40451 1 99 . 1 1 31 31 GLN C C 31 178.890 178.890 177.985 0.905 17919 40452 1 99 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.265 0.735 17919 40453 1 99 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.375 -0.655 17919 40454 1 99 . 1 1 31 31 GLN H H 31 8.580 8.580 8.274 0.306 17919 40455 1 99 . 1 1 32 32 ASP N N 32 119.360 119.360 118.509 0.851 17919 40456 1 99 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.440 -0.086 17919 40457 1 99 . 1 1 32 32 ASP C C 32 177.250 177.250 177.955 -0.705 17919 40458 1 99 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.353 0.836 17919 40459 1 99 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.871 -0.291 17919 40460 1 99 . 1 1 32 32 ASP H H 32 8.010 8.010 7.588 0.422 17919 40461 1 99 . 1 1 33 33 LYS N N 33 115.130 115.130 118.691 -3.561 17919 40462 1 99 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.200 0.137 17919 40463 1 99 . 1 1 33 33 LYS C C 33 177.870 177.870 177.535 0.335 17919 40464 1 99 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.607 0.443 17919 40465 1 99 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.305 0.865 17919 40466 1 99 . 1 1 33 33 LYS H H 33 7.430 7.430 7.758 -0.328 17919 40467 1 99 . 1 1 34 34 GLU N N 34 113.870 113.870 114.791 -0.921 17919 40468 1 99 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.486 0.139 17919 40469 1 99 . 1 1 34 34 GLU C C 34 177.840 177.840 176.680 1.160 17919 40470 1 99 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.570 -0.400 17919 40471 1 99 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.704 0.956 17919 40472 1 99 . 1 1 34 34 GLU H H 34 8.740 8.740 8.031 0.709 17919 40473 1 99 . 1 1 35 35 GLY N N 35 108.650 108.650 108.306 0.344 17919 40474 1 99 . 1 1 35 35 GLY C C 35 173.960 173.960 174.997 -1.037 17919 40475 1 99 . 1 1 35 35 GLY CA C 35 46.080 46.080 46.150 -0.070 17919 40476 1 99 . 1 1 35 35 GLY H H 35 8.530 8.530 7.716 0.814 17919 40477 1 99 . 1 1 36 36 ILE N N 36 119.880 119.880 122.016 -2.136 17919 40478 1 99 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.359 0.086 17919 40479 1 99 . 1 1 36 36 ILE C C 36 173.590 173.590 174.384 -0.794 17919 40480 1 99 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.005 -0.255 17919 40481 1 99 . 1 1 36 36 ILE CB C 36 40.580 40.580 37.700 2.880 17919 40482 1 99 . 1 1 36 36 ILE H H 36 6.150 6.150 7.775 -1.625 17919 40483 1 99 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.756 -0.122 17919 40484 1 99 . 1 1 37 37 PRO C C 37 176.940 176.940 176.144 0.796 17919 40485 1 99 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.307 0.353 17919 40486 1 99 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.064 0.785 17919 40487 1 99 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.237 -0.120 17919 40488 1 99 . 1 1 38 38 PRO C C 38 178.320 178.320 177.208 1.112 17919 40489 1 99 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.285 0.975 17919 40490 1 99 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.844 1.046 17919 40491 1 99 . 1 1 39 39 ASP N N 39 113.380 113.380 115.756 -2.376 17919 40492 1 99 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.398 0.032 17919 40493 1 99 . 1 1 39 39 ASP C C 39 177.090 177.090 177.708 -0.618 17919 40494 1 99 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.738 -1.098 17919 40495 1 99 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.111 -0.570 17919 40496 1 99 . 1 1 39 39 ASP H H 39 8.550 8.550 8.729 -0.179 17919 40497 1 99 . 1 1 40 40 GLN N N 40 116.780 116.780 118.713 -1.933 17919 40498 1 99 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.462 0.002 17919 40499 1 99 . 1 1 40 40 GLN C C 40 175.380 175.380 176.321 -0.941 17919 40500 1 99 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.688 -1.048 17919 40501 1 99 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.520 0.620 17919 40502 1 99 . 1 1 40 40 GLN H H 40 7.820 7.820 7.562 0.258 17919 40503 1 99 . 1 1 41 41 GLN N N 41 117.720 117.720 118.681 -0.961 17919 40504 1 99 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.492 -0.248 17919 40505 1 99 . 1 1 41 41 GLN C C 41 176.300 176.300 175.202 1.098 17919 40506 1 99 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.655 0.815 17919 40507 1 99 . 1 1 41 41 GLN CB C 41 31.650 31.650 30.267 1.383 17919 40508 1 99 . 1 1 41 41 GLN H H 41 7.480 7.480 7.354 0.126 17919 40509 1 99 . 1 1 42 42 ARG N N 42 122.680 122.680 125.785 -3.105 17919 40510 1 99 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.577 -0.077 17919 40511 1 99 . 1 1 42 42 ARG C C 42 174.050 174.050 174.170 -0.120 17919 40512 1 99 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.937 0.113 17919 40513 1 99 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.510 -0.760 17919 40514 1 99 . 1 1 42 42 ARG H H 42 8.530 8.530 8.130 0.400 17919 40515 1 99 . 1 1 43 43 LEU N N 43 124.040 124.040 129.050 -5.010 17919 40516 1 99 . 1 1 43 43 LEU C C 43 175.290 175.290 176.049 -0.759 17919 40517 1 99 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.841 -0.861 17919 40518 1 99 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.086 2.704 17919 40519 1 99 . 1 1 43 43 LEU H H 43 8.820 8.820 8.582 0.238 17919 40520 1 99 . 1 1 44 44 ILE N N 44 121.920 121.920 119.761 2.159 17919 40521 1 99 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.801 0.191 17919 40522 1 99 . 1 1 44 44 ILE C C 44 176.060 176.060 173.364 2.696 17919 40523 1 99 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.535 -0.555 17919 40524 1 99 . 1 1 44 44 ILE CB C 44 41.420 41.420 42.118 -0.698 17919 40525 1 99 . 1 1 44 44 ILE H H 44 9.030 9.030 8.862 0.168 17919 40526 1 99 . 1 1 45 45 PHE N N 45 125.390 125.390 125.589 -0.199 17919 40527 1 99 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.981 0.064 17919 40528 1 99 . 1 1 45 45 PHE C C 45 174.470 174.470 174.499 -0.029 17919 40529 1 99 . 1 1 45 45 PHE CA C 45 57.020 57.020 55.894 1.126 17919 40530 1 99 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.899 0.861 17919 40531 1 99 . 1 1 45 45 PHE H H 45 8.830 8.830 9.074 -0.244 17919 40532 1 99 . 1 1 46 46 ALA N N 46 132.200 132.200 131.106 1.094 17919 40533 1 99 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.764 -0.074 17919 40534 1 99 . 1 1 46 46 ALA C C 46 177.290 177.290 177.359 -0.069 17919 40535 1 99 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.853 -0.313 17919 40536 1 99 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.148 0.422 17919 40537 1 99 . 1 1 46 46 ALA H H 46 8.810 8.810 9.279 -0.469 17919 40538 1 99 . 1 1 47 47 GLY N N 47 102.340 102.340 104.360 -2.020 17919 40539 1 99 . 1 1 47 47 GLY C C 47 173.810 173.810 174.124 -0.314 17919 40540 1 99 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.362 -0.012 17919 40541 1 99 . 1 1 47 47 GLY H H 47 8.130 8.130 8.680 -0.550 17919 40542 1 99 . 1 1 48 48 LYS N N 48 121.570 121.570 120.453 1.117 17919 40543 1 99 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.588 0.034 17919 40544 1 99 . 1 1 48 48 LYS C C 48 174.700 174.700 175.144 -0.444 17919 40545 1 99 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.528 0.022 17919 40546 1 99 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.699 -0.169 17919 40547 1 99 . 1 1 48 48 LYS H H 48 7.980 7.980 7.863 0.117 17919 40548 1 99 . 1 1 49 49 GLN N N 49 122.410 122.410 124.493 -2.083 17919 40549 1 99 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.214 0.346 17919 40550 1 99 . 1 1 49 49 GLN C C 49 175.670 175.670 175.196 0.474 17919 40551 1 99 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.597 -0.857 17919 40552 1 99 . 1 1 49 49 GLN CB C 49 29.000 29.000 28.909 0.091 17919 40553 1 99 . 1 1 49 49 GLN H H 49 8.600 8.600 8.649 -0.049 17919 40554 1 99 . 1 1 50 50 LEU N N 50 125.520 125.520 127.557 -2.037 17919 40555 1 99 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.434 -0.344 17919 40556 1 99 . 1 1 50 50 LEU C C 50 176.660 176.660 176.458 0.202 17919 40557 1 99 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.871 0.369 17919 40558 1 99 . 1 1 50 50 LEU CB C 50 41.570 41.570 43.096 -1.526 17919 40559 1 99 . 1 1 50 50 LEU H H 50 8.530 8.530 8.592 -0.062 17919 40560 1 99 . 1 1 51 51 GLU N N 51 122.940 122.940 120.512 2.428 17919 40561 1 99 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.589 -0.101 17919 40562 1 99 . 1 1 51 51 GLU C C 51 175.870 175.870 176.131 -0.261 17919 40563 1 99 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.334 0.626 17919 40564 1 99 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.035 -0.465 17919 40565 1 99 . 1 1 51 51 GLU H H 51 8.400 8.400 8.361 0.039 17919 40566 1 99 . 1 1 52 52 ASP N N 52 120.030 120.030 126.186 -6.156 17919 40567 1 99 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.460 -0.101 17919 40568 1 99 . 1 1 52 52 ASP C C 52 177.330 177.330 175.874 1.456 17919 40569 1 99 . 1 1 52 52 ASP CA C 52 56.960 56.960 56.377 0.584 17919 40570 1 99 . 1 1 52 52 ASP CB C 52 40.850 40.850 41.040 -0.190 17919 40571 1 99 . 1 1 52 52 ASP H H 52 8.160 8.160 8.756 -0.596 17919 40572 1 99 . 1 1 53 53 GLY N N 53 106.660 106.660 103.874 2.786 17919 40573 1 99 . 1 1 53 53 GLY C C 53 174.870 174.870 173.672 1.198 17919 40574 1 99 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.549 0.621 17919 40575 1 99 . 1 1 53 53 GLY H H 53 9.390 9.390 8.024 1.366 17919 40576 1 99 . 1 1 54 54 ARG N N 54 119.050 119.050 122.367 -3.317 17919 40577 1 99 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.721 -0.026 17919 40578 1 99 . 1 1 54 54 ARG C C 54 175.350 175.350 174.847 0.503 17919 40579 1 99 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.340 0.050 17919 40580 1 99 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.714 -1.064 17919 40581 1 99 . 1 1 54 54 ARG H H 54 7.460 7.460 7.737 -0.277 17919 40582 1 99 . 1 1 55 55 THR N N 55 108.400 108.400 114.155 -5.755 17919 40583 1 99 . 1 1 55 55 THR HA H 55 5.240 5.240 5.070 0.170 17919 40584 1 99 . 1 1 55 55 THR C C 55 176.560 176.560 175.555 1.005 17919 40585 1 99 . 1 1 55 55 THR CA C 55 59.690 59.690 60.149 -0.459 17919 40586 1 99 . 1 1 55 55 THR CB C 55 72.260 72.260 71.342 0.918 17919 40587 1 99 . 1 1 55 55 THR H H 55 8.730 8.730 8.187 0.543 17919 40588 1 99 . 1 1 56 56 LEU N N 56 117.920 117.920 121.564 -3.644 17919 40589 1 99 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.176 -0.116 17919 40590 1 99 . 1 1 56 56 LEU C C 56 180.810 180.810 178.559 2.251 17919 40591 1 99 . 1 1 56 56 LEU CA C 56 58.710 58.710 57.667 1.043 17919 40592 1 99 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.574 -1.204 17919 40593 1 99 . 1 1 56 56 LEU H H 56 8.140 8.140 8.307 -0.167 17919 40594 1 99 . 1 1 57 57 SER N N 57 113.330 113.330 115.812 -2.482 17919 40595 1 99 . 1 1 57 57 SER HA H 57 4.370 4.370 4.126 0.244 17919 40596 1 99 . 1 1 57 57 SER C C 57 178.310 178.310 176.769 1.541 17919 40597 1 99 . 1 1 57 57 SER CA C 57 61.080 61.080 61.511 -0.431 17919 40598 1 99 . 1 1 57 57 SER CB C 57 62.530 62.530 62.376 0.154 17919 40599 1 99 . 1 1 57 57 SER H H 57 8.470 8.470 7.865 0.605 17919 40600 1 99 . 1 1 58 58 ASP N N 58 124.190 124.190 122.444 1.746 17919 40601 1 99 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.374 -0.078 17919 40602 1 99 . 1 1 58 58 ASP C C 58 177.400 177.400 177.675 -0.275 17919 40603 1 99 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.703 0.477 17919 40604 1 99 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.275 -0.175 17919 40605 1 99 . 1 1 58 58 ASP H H 58 7.930 7.930 7.651 0.279 17919 40606 1 99 . 1 1 59 59 TYR N N 59 115.510 115.510 116.370 -0.860 17919 40607 1 99 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.510 0.160 17919 40608 1 99 . 1 1 59 59 TYR C C 59 174.700 174.700 175.810 -1.110 17919 40609 1 99 . 1 1 59 59 TYR CA C 59 58.250 58.250 58.205 0.045 17919 40610 1 99 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.212 1.858 17919 40611 1 99 . 1 1 59 59 TYR H H 59 7.250 7.250 7.386 -0.136 17919 40612 1 99 . 1 1 60 60 ASN N N 60 115.900 115.900 117.470 -1.570 17919 40613 1 99 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.382 -0.027 17919 40614 1 99 . 1 1 60 60 ASN C C 60 174.340 174.340 174.837 -0.497 17919 40615 1 99 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.365 -0.245 17919 40616 1 99 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.466 -0.056 17919 40617 1 99 . 1 1 60 60 ASN H H 60 8.150 8.150 8.040 0.110 17919 40618 1 99 . 1 1 61 61 ILE N N 61 118.600 118.600 120.371 -1.771 17919 40619 1 99 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.689 -0.296 17919 40620 1 99 . 1 1 61 61 ILE C C 61 174.610 174.610 174.970 -0.360 17919 40621 1 99 . 1 1 61 61 ILE CA C 61 62.420 62.420 63.075 -0.656 17919 40622 1 99 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.581 -0.841 17919 40623 1 99 . 1 1 61 61 ILE H H 61 7.250 7.250 8.182 -0.932 17919 40624 1 99 . 1 1 62 62 GLN N N 62 124.740 124.740 125.387 -0.647 17919 40625 1 99 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.641 -0.135 17919 40626 1 99 . 1 1 62 62 GLN C C 62 175.970 175.970 175.899 0.071 17919 40627 1 99 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.551 0.109 17919 40628 1 99 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.675 -0.025 17919 40629 1 99 . 1 1 62 62 GLN H H 62 7.610 7.610 7.832 -0.222 17919 40630 1 99 . 1 1 63 63 LYS N N 63 120.300 120.300 120.067 0.233 17919 40631 1 99 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.973 0.028 17919 40632 1 99 . 1 1 63 63 LYS C C 63 175.810 175.810 176.738 -0.928 17919 40633 1 99 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.699 0.091 17919 40634 1 99 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.895 0.755 17919 40635 1 99 . 1 1 63 63 LYS H H 63 8.490 8.490 8.321 0.169 17919 40636 1 99 . 1 1 64 64 GLU N N 64 113.950 113.950 119.075 -5.125 17919 40637 1 99 . 1 1 64 64 GLU HA H 64 3.465 3.465 2.970 0.495 17919 40638 1 99 . 1 1 64 64 GLU C C 64 175.250 175.250 175.678 -0.428 17919 40639 1 99 . 1 1 64 64 GLU CA C 64 57.890 57.890 56.859 1.031 17919 40640 1 99 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.472 -2.572 17919 40641 1 99 . 1 1 64 64 GLU H H 64 9.280 9.280 8.622 0.658 17919 40642 1 99 . 1 1 65 65 SER N N 65 114.730 114.730 115.465 -0.735 17919 40643 1 99 . 1 1 65 65 SER HA H 65 4.640 4.640 4.414 0.226 17919 40644 1 99 . 1 1 65 65 SER C C 65 172.160 172.160 173.775 -1.615 17919 40645 1 99 . 1 1 65 65 SER CA C 65 60.890 60.890 59.756 1.134 17919 40646 1 99 . 1 1 65 65 SER CB C 65 64.910 64.910 63.840 1.070 17919 40647 1 99 . 1 1 65 65 SER H H 65 7.670 7.670 7.337 0.333 17919 40648 1 99 . 1 1 66 66 THR N N 66 117.110 117.110 117.856 -0.746 17919 40649 1 99 . 1 1 66 66 THR HA H 66 5.270 5.270 5.288 -0.018 17919 40650 1 99 . 1 1 66 66 THR C C 66 173.950 173.950 173.956 -0.006 17919 40651 1 99 . 1 1 66 66 THR CA C 66 62.340 62.340 61.793 0.547 17919 40652 1 99 . 1 1 66 66 THR CB C 66 70.080 70.080 70.069 0.011 17919 40653 1 99 . 1 1 66 66 THR H H 66 8.730 8.730 8.288 0.442 17919 40654 1 99 . 1 1 67 67 LEU N N 67 127.110 127.110 126.777 0.333 17919 40655 1 99 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.541 0.519 17919 40656 1 99 . 1 1 67 67 LEU C C 67 175.770 175.770 175.769 0.001 17919 40657 1 99 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.252 -0.351 17919 40658 1 99 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.160 1.100 17919 40659 1 99 . 1 1 67 67 LEU H H 67 9.410 9.410 8.543 0.867 17919 40660 1 99 . 1 1 68 68 HIS N N 68 118.380 118.380 116.968 1.412 17919 40661 1 99 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.585 -0.345 17919 40662 1 99 . 1 1 68 68 HIS C C 68 173.150 173.150 174.590 -1.440 17919 40663 1 99 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.830 0.170 17919 40664 1 99 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.578 -2.048 17919 40665 1 99 . 1 1 68 68 HIS H H 68 9.230 9.230 9.026 0.204 17919 40666 1 99 . 1 1 69 69 LEU N N 69 124.460 124.460 123.375 1.085 17919 40667 1 99 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.394 -0.204 17919 40668 1 99 . 1 1 69 69 LEU C C 69 175.270 175.270 174.470 0.800 17919 40669 1 99 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.644 -0.754 17919 40670 1 99 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.761 -0.381 17919 40671 1 99 . 1 1 69 69 LEU H H 69 8.340 8.340 8.160 0.180 17919 40672 1 99 . 1 1 70 70 VAL N N 70 126.940 126.940 126.497 0.443 17919 40673 1 99 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.395 -0.045 17919 40674 1 99 . 1 1 70 70 VAL C C 70 174.000 174.000 174.718 -0.718 17919 40675 1 99 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.800 -0.000 17919 40676 1 99 . 1 1 70 70 VAL CB C 70 34.910 34.910 33.625 1.285 17919 40677 1 99 . 1 1 70 70 VAL H H 70 9.200 9.200 8.095 1.105 17919 40678 1 99 . 1 1 71 71 LEU N N 71 123.130 123.130 123.103 0.027 17919 40679 1 99 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.704 0.356 17919 40680 1 99 . 1 1 71 71 LEU C C 71 177.830 177.830 177.428 0.402 17919 40681 1 99 . 1 1 71 71 LEU CA C 71 53.940 53.940 54.075 -0.136 17919 40682 1 99 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.776 0.074 17919 40683 1 99 . 1 1 71 71 LEU H H 71 8.120 8.120 8.351 -0.231 17919 40684 1 99 . 1 1 72 72 ARG N N 72 123.490 123.490 124.319 -0.829 17919 40685 1 99 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.518 -0.217 17919 40686 1 99 . 1 1 72 72 ARG C C 72 175.350 175.350 175.732 -0.382 17919 40687 1 99 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.237 0.373 17919 40688 1 99 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.703 0.647 17919 40689 1 99 . 1 1 72 72 ARG H H 72 8.580 8.580 8.795 -0.215 17919 40690 1 100 . 1 1 2 2 GLN N N 2 123.220 123.220 123.401 -0.181 17919 40691 1 100 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.314 -0.065 17919 40692 1 100 . 1 1 2 2 GLN C C 2 175.920 175.920 175.164 0.756 17919 40693 1 100 . 1 1 2 2 GLN CA C 2 55.080 55.080 55.398 -0.318 17919 40694 1 100 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.198 0.562 17919 40695 1 100 . 1 1 2 2 GLN H H 2 8.900 8.900 8.461 0.439 17919 40696 1 100 . 1 1 3 3 ILE N N 3 115.340 115.340 118.075 -2.735 17919 40697 1 100 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.229 -0.016 17919 40698 1 100 . 1 1 3 3 ILE C C 3 172.450 172.450 173.418 -0.968 17919 40699 1 100 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.426 0.144 17919 40700 1 100 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.540 0.670 17919 40701 1 100 . 1 1 3 3 ILE H H 3 8.320 8.320 8.108 0.212 17919 40702 1 100 . 1 1 4 4 PHE N N 4 118.110 118.110 118.817 -0.707 17919 40703 1 100 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.265 0.365 17919 40704 1 100 . 1 1 4 4 PHE C C 4 175.320 175.320 175.216 0.104 17919 40705 1 100 . 1 1 4 4 PHE CA C 4 55.210 55.210 56.005 -0.795 17919 40706 1 100 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.264 -0.784 17919 40707 1 100 . 1 1 4 4 PHE H H 4 8.610 8.610 8.216 0.394 17919 40708 1 100 . 1 1 5 5 VAL N N 5 121.000 121.000 120.529 0.471 17919 40709 1 100 . 1 1 5 5 VAL HA H 5 4.725 4.725 5.053 -0.328 17919 40710 1 100 . 1 1 5 5 VAL C C 5 174.870 174.870 174.819 0.051 17919 40711 1 100 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.221 -0.601 17919 40712 1 100 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.258 -0.028 17919 40713 1 100 . 1 1 5 5 VAL H H 5 9.300 9.300 8.804 0.496 17919 40714 1 100 . 1 1 6 6 LYS N N 6 127.520 127.520 128.258 -0.738 17919 40715 1 100 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.303 0.064 17919 40716 1 100 . 1 1 6 6 LYS C C 6 177.140 177.140 176.492 0.648 17919 40717 1 100 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.751 -0.231 17919 40718 1 100 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.395 -0.345 17919 40719 1 100 . 1 1 6 6 LYS H H 6 8.820 8.820 8.887 -0.068 17919 40720 1 100 . 1 1 7 7 THR N N 7 115.400 115.400 117.716 -2.316 17919 40721 1 100 . 1 1 7 7 THR HA H 7 4.970 4.970 4.815 0.155 17919 40722 1 100 . 1 1 7 7 THR C C 7 176.910 176.910 176.382 0.528 17919 40723 1 100 . 1 1 7 7 THR CA C 7 60.470 60.470 60.540 -0.070 17919 40724 1 100 . 1 1 7 7 THR CB C 7 70.630 70.630 70.216 0.414 17919 40725 1 100 . 1 1 7 7 THR H H 7 8.730 8.730 8.531 0.199 17919 40726 1 100 . 1 1 8 8 LEU N N 8 121.330 121.330 121.653 -0.323 17919 40727 1 100 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.051 0.259 17919 40728 1 100 . 1 1 8 8 LEU C C 8 178.800 178.800 177.195 1.605 17919 40729 1 100 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.658 -0.078 17919 40730 1 100 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.868 0.102 17919 40731 1 100 . 1 1 8 8 LEU H H 8 9.100 9.100 8.555 0.545 17919 40732 1 100 . 1 1 9 9 THR N N 9 105.590 105.590 107.167 -1.577 17919 40733 1 100 . 1 1 9 9 THR HA H 9 4.428 4.428 4.342 0.086 17919 40734 1 100 . 1 1 9 9 THR C C 9 175.520 175.520 174.993 0.527 17919 40735 1 100 . 1 1 9 9 THR CA C 9 61.400 61.400 61.860 -0.460 17919 40736 1 100 . 1 1 9 9 THR CB C 9 69.140 69.140 69.354 -0.214 17919 40737 1 100 . 1 1 9 9 THR H H 9 7.630 7.630 7.757 -0.127 17919 40738 1 100 . 1 1 10 10 GLY N N 10 108.890 108.890 111.156 -2.266 17919 40739 1 100 . 1 1 10 10 GLY C C 10 174.070 174.070 173.964 0.106 17919 40740 1 100 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.794 0.666 17919 40741 1 100 . 1 1 10 10 GLY H H 10 7.810 7.810 7.912 -0.102 17919 40742 1 100 . 1 1 11 11 LYS N N 11 121.600 121.600 121.800 -0.200 17919 40743 1 100 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.240 0.121 17919 40744 1 100 . 1 1 11 11 LYS C C 11 175.940 175.940 176.123 -0.183 17919 40745 1 100 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.858 -0.578 17919 40746 1 100 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.184 0.015 17919 40747 1 100 . 1 1 11 11 LYS H H 11 7.280 7.280 7.609 -0.329 17919 40748 1 100 . 1 1 12 12 THR N N 12 120.440 120.440 120.375 0.065 17919 40749 1 100 . 1 1 12 12 THR HA H 12 5.046 5.046 4.994 0.052 17919 40750 1 100 . 1 1 12 12 THR C C 12 174.320 174.320 174.363 -0.043 17919 40751 1 100 . 1 1 12 12 THR CA C 12 62.390 62.390 61.869 0.521 17919 40752 1 100 . 1 1 12 12 THR CB C 12 69.910 69.910 70.133 -0.223 17919 40753 1 100 . 1 1 12 12 THR H H 12 8.650 8.650 8.321 0.329 17919 40754 1 100 . 1 1 13 13 ILE N N 13 127.110 127.110 126.933 0.177 17919 40755 1 100 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.490 0.054 17919 40756 1 100 . 1 1 13 13 ILE C C 13 175.220 175.220 174.914 0.306 17919 40757 1 100 . 1 1 13 13 ILE CA C 13 59.980 59.980 58.819 1.161 17919 40758 1 100 . 1 1 13 13 ILE CB C 13 40.950 40.950 39.213 1.737 17919 40759 1 100 . 1 1 13 13 ILE H H 13 9.450 9.450 9.006 0.444 17919 40760 1 100 . 1 1 14 14 THR N N 14 121.520 121.520 123.062 -1.542 17919 40761 1 100 . 1 1 14 14 THR HA H 14 4.964 4.964 4.564 0.400 17919 40762 1 100 . 1 1 14 14 THR C C 14 173.790 173.790 173.684 0.106 17919 40763 1 100 . 1 1 14 14 THR CA C 14 61.940 61.940 62.919 -0.979 17919 40764 1 100 . 1 1 14 14 THR CB C 14 69.650 69.650 69.838 -0.188 17919 40765 1 100 . 1 1 14 14 THR H H 14 8.710 8.710 8.527 0.183 17919 40766 1 100 . 1 1 15 15 LEU N N 15 124.800 124.800 125.757 -0.957 17919 40767 1 100 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.756 0.024 17919 40768 1 100 . 1 1 15 15 LEU C C 15 174.670 174.670 174.798 -0.128 17919 40769 1 100 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.654 -0.824 17919 40770 1 100 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.626 1.444 17919 40771 1 100 . 1 1 15 15 LEU H H 15 8.710 8.710 8.090 0.620 17919 40772 1 100 . 1 1 16 16 GLU N N 16 122.160 122.160 125.186 -3.026 17919 40773 1 100 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.492 0.425 17919 40774 1 100 . 1 1 16 16 GLU C C 16 175.860 175.860 175.395 0.465 17919 40775 1 100 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.548 -0.728 17919 40776 1 100 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.148 -0.698 17919 40777 1 100 . 1 1 16 16 GLU H H 16 8.140 8.140 8.652 -0.512 17919 40778 1 100 . 1 1 17 17 VAL N N 17 117.210 117.210 120.944 -3.734 17919 40779 1 100 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.944 -0.230 17919 40780 1 100 . 1 1 17 17 VAL C C 17 174.160 174.160 174.622 -0.462 17919 40781 1 100 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.654 -0.223 17919 40782 1 100 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.712 0.689 17919 40783 1 100 . 1 1 17 17 VAL H H 17 8.900 8.900 8.952 -0.052 17919 40784 1 100 . 1 1 18 18 GLU N N 18 118.990 118.990 119.428 -0.438 17919 40785 1 100 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.923 0.156 17919 40786 1 100 . 1 1 18 18 GLU C C 18 176.160 176.160 175.393 0.767 17919 40787 1 100 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.759 -0.039 17919 40788 1 100 . 1 1 18 18 GLU CB C 18 30.310 30.310 32.178 -1.868 17919 40789 1 100 . 1 1 18 18 GLU H H 18 8.640 8.640 8.175 0.465 17919 40790 1 100 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.267 -0.126 17919 40791 1 100 . 1 1 19 19 PRO C C 19 175.310 175.310 178.163 -2.853 17919 40792 1 100 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.383 0.087 17919 40793 1 100 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.054 -0.104 17919 40794 1 100 . 1 1 20 20 SER N N 20 103.400 103.400 111.916 -8.516 17919 40795 1 100 . 1 1 20 20 SER HA H 20 4.370 4.370 4.249 0.121 17919 40796 1 100 . 1 1 20 20 SER C C 20 174.660 174.660 174.726 -0.066 17919 40797 1 100 . 1 1 20 20 SER CA C 20 57.400 57.400 59.907 -2.507 17919 40798 1 100 . 1 1 20 20 SER CB C 20 63.370 63.370 63.135 0.235 17919 40799 1 100 . 1 1 20 20 SER H H 20 7.040 7.040 8.204 -1.164 17919 40800 1 100 . 1 1 21 21 ASP N N 21 123.480 123.480 122.493 0.987 17919 40801 1 100 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.758 -0.063 17919 40802 1 100 . 1 1 21 21 ASP C C 21 176.360 176.360 175.505 0.855 17919 40803 1 100 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.343 1.357 17919 40804 1 100 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.345 -0.545 17919 40805 1 100 . 1 1 21 21 ASP H H 21 8.030 8.030 7.768 0.262 17919 40806 1 100 . 1 1 22 22 THR N N 22 108.800 108.800 113.368 -4.568 17919 40807 1 100 . 1 1 22 22 THR HA H 22 4.920 4.920 4.276 0.644 17919 40808 1 100 . 1 1 22 22 THR C C 22 176.750 176.750 175.428 1.322 17919 40809 1 100 . 1 1 22 22 THR CA C 22 59.690 59.690 62.781 -3.091 17919 40810 1 100 . 1 1 22 22 THR CB C 22 71.200 71.200 69.831 1.369 17919 40811 1 100 . 1 1 22 22 THR H H 22 7.900 7.900 8.320 -0.420 17919 40812 1 100 . 1 1 23 23 ILE N N 23 121.190 121.190 123.945 -2.755 17919 40813 1 100 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.874 -0.217 17919 40814 1 100 . 1 1 23 23 ILE C C 23 179.040 179.040 177.551 1.489 17919 40815 1 100 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.118 0.142 17919 40816 1 100 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.569 -2.219 17919 40817 1 100 . 1 1 23 23 ILE H H 23 8.560 8.560 8.524 0.036 17919 40818 1 100 . 1 1 24 24 GLU N N 24 120.830 120.830 120.731 0.099 17919 40819 1 100 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.936 -0.019 17919 40820 1 100 . 1 1 24 24 GLU C C 24 178.640 178.640 178.275 0.365 17919 40821 1 100 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.842 0.378 17919 40822 1 100 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.635 -1.355 17919 40823 1 100 . 1 1 24 24 GLU H H 24 9.760 9.760 8.665 1.095 17919 40824 1 100 . 1 1 25 25 ASN N N 25 120.570 120.570 118.223 2.347 17919 40825 1 100 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.553 -0.028 17919 40826 1 100 . 1 1 25 25 ASN C C 25 178.380 178.380 177.902 0.478 17919 40827 1 100 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.571 0.489 17919 40828 1 100 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.257 0.193 17919 40829 1 100 . 1 1 25 25 ASN H H 25 7.920 7.920 7.579 0.341 17919 40830 1 100 . 1 1 26 26 VAL N N 26 121.710 121.710 120.581 1.129 17919 40831 1 100 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.538 -0.141 17919 40832 1 100 . 1 1 26 26 VAL C C 26 177.950 177.950 177.770 0.180 17919 40833 1 100 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.378 1.282 17919 40834 1 100 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.442 -0.602 17919 40835 1 100 . 1 1 26 26 VAL H H 26 8.070 8.070 8.086 -0.016 17919 40836 1 100 . 1 1 27 27 LYS N N 27 118.860 118.860 118.715 0.145 17919 40837 1 100 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.267 0.313 17919 40838 1 100 . 1 1 27 27 LYS C C 27 180.550 180.550 178.766 1.784 17919 40839 1 100 . 1 1 27 27 LYS CA C 27 59.250 59.250 58.839 0.411 17919 40840 1 100 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.327 1.403 17919 40841 1 100 . 1 1 27 27 LYS H H 27 8.560 8.560 8.420 0.140 17919 40842 1 100 . 1 1 28 28 ALA N N 28 123.440 123.440 122.106 1.334 17919 40843 1 100 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.085 0.075 17919 40844 1 100 . 1 1 28 28 ALA C C 28 180.300 180.300 178.805 1.495 17919 40845 1 100 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.160 0.210 17919 40846 1 100 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.415 -0.705 17919 40847 1 100 . 1 1 28 28 ALA H H 28 8.060 8.060 8.360 -0.300 17919 40848 1 100 . 1 1 29 29 LYS N N 29 119.940 119.940 119.822 0.118 17919 40849 1 100 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.194 0.013 17919 40850 1 100 . 1 1 29 29 LYS C C 29 180.320 180.320 179.082 1.238 17919 40851 1 100 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.264 0.386 17919 40852 1 100 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.153 1.137 17919 40853 1 100 . 1 1 29 29 LYS H H 29 7.850 7.850 7.352 0.498 17919 40854 1 100 . 1 1 30 30 ILE N N 30 121.080 121.080 119.478 1.602 17919 40855 1 100 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.604 -0.097 17919 40856 1 100 . 1 1 30 30 ILE C C 30 178.310 178.310 177.814 0.496 17919 40857 1 100 . 1 1 30 30 ILE CA C 30 66.150 66.150 64.711 1.439 17919 40858 1 100 . 1 1 30 30 ILE CB C 30 36.800 36.800 36.709 0.091 17919 40859 1 100 . 1 1 30 30 ILE H H 30 8.280 8.280 7.638 0.642 17919 40860 1 100 . 1 1 31 31 GLN N N 31 123.490 123.490 119.609 3.881 17919 40861 1 100 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.911 -0.082 17919 40862 1 100 . 1 1 31 31 GLN C C 31 178.890 178.890 178.150 0.740 17919 40863 1 100 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.062 0.938 17919 40864 1 100 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.571 -0.851 17919 40865 1 100 . 1 1 31 31 GLN H H 31 8.580 8.580 7.777 0.803 17919 40866 1 100 . 1 1 32 32 ASP N N 32 119.360 119.360 119.156 0.204 17919 40867 1 100 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.385 -0.031 17919 40868 1 100 . 1 1 32 32 ASP C C 32 177.250 177.250 178.304 -1.054 17919 40869 1 100 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.636 0.554 17919 40870 1 100 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.654 -0.074 17919 40871 1 100 . 1 1 32 32 ASP H H 32 8.010 8.010 8.190 -0.180 17919 40872 1 100 . 1 1 33 33 LYS N N 33 115.130 115.130 118.674 -3.544 17919 40873 1 100 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.253 0.084 17919 40874 1 100 . 1 1 33 33 LYS C C 33 177.870 177.870 178.530 -0.660 17919 40875 1 100 . 1 1 33 33 LYS CA C 33 58.050 58.050 59.001 -0.951 17919 40876 1 100 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.547 0.623 17919 40877 1 100 . 1 1 33 33 LYS H H 33 7.430 7.430 7.554 -0.124 17919 40878 1 100 . 1 1 34 34 GLU N N 34 113.870 113.870 114.382 -0.512 17919 40879 1 100 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.504 0.121 17919 40880 1 100 . 1 1 34 34 GLU C C 34 177.840 177.840 177.269 0.571 17919 40881 1 100 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.848 -0.678 17919 40882 1 100 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.336 1.324 17919 40883 1 100 . 1 1 34 34 GLU H H 34 8.740 8.740 8.461 0.279 17919 40884 1 100 . 1 1 35 35 GLY N N 35 108.650 108.650 109.232 -0.582 17919 40885 1 100 . 1 1 35 35 GLY C C 35 173.960 173.960 174.583 -0.623 17919 40886 1 100 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.812 0.268 17919 40887 1 100 . 1 1 35 35 GLY H H 35 8.530 8.530 7.815 0.715 17919 40888 1 100 . 1 1 36 36 ILE N N 36 119.880 119.880 121.941 -2.061 17919 40889 1 100 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.305 0.140 17919 40890 1 100 . 1 1 36 36 ILE C C 36 173.590 173.590 174.548 -0.958 17919 40891 1 100 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.009 -0.259 17919 40892 1 100 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.301 2.279 17919 40893 1 100 . 1 1 36 36 ILE H H 36 6.150 6.150 7.637 -1.487 17919 40894 1 100 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.859 -0.225 17919 40895 1 100 . 1 1 37 37 PRO C C 37 176.940 176.940 176.180 0.760 17919 40896 1 100 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.255 0.405 17919 40897 1 100 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.156 0.694 17919 40898 1 100 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.201 -0.084 17919 40899 1 100 . 1 1 38 38 PRO C C 38 178.320 178.320 178.286 0.034 17919 40900 1 100 . 1 1 38 38 PRO CA C 38 66.260 66.260 66.076 0.184 17919 40901 1 100 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.868 1.022 17919 40902 1 100 . 1 1 39 39 ASP N N 39 113.380 113.380 115.227 -1.847 17919 40903 1 100 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.376 0.054 17919 40904 1 100 . 1 1 39 39 ASP C C 39 177.090 177.090 177.362 -0.272 17919 40905 1 100 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.723 -1.083 17919 40906 1 100 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.209 -0.669 17919 40907 1 100 . 1 1 39 39 ASP H H 39 8.550 8.550 8.711 -0.161 17919 40908 1 100 . 1 1 40 40 GLN N N 40 116.780 116.780 116.392 0.388 17919 40909 1 100 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.312 0.152 17919 40910 1 100 . 1 1 40 40 GLN C C 40 175.380 175.380 175.901 -0.521 17919 40911 1 100 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.450 0.190 17919 40912 1 100 . 1 1 40 40 GLN CB C 40 30.140 30.140 28.717 1.423 17919 40913 1 100 . 1 1 40 40 GLN H H 40 7.820 7.820 7.716 0.104 17919 40914 1 100 . 1 1 41 41 GLN N N 41 117.720 117.720 118.850 -1.130 17919 40915 1 100 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.632 -0.388 17919 40916 1 100 . 1 1 41 41 GLN C C 41 176.300 176.300 175.527 0.773 17919 40917 1 100 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.106 1.364 17919 40918 1 100 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.977 1.673 17919 40919 1 100 . 1 1 41 41 GLN H H 41 7.480 7.480 7.349 0.131 17919 40920 1 100 . 1 1 42 42 ARG N N 42 122.680 122.680 127.056 -4.376 17919 40921 1 100 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.622 -0.122 17919 40922 1 100 . 1 1 42 42 ARG C C 42 174.050 174.050 174.186 -0.136 17919 40923 1 100 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.789 0.260 17919 40924 1 100 . 1 1 42 42 ARG CB C 42 31.750 31.750 31.440 0.310 17919 40925 1 100 . 1 1 42 42 ARG H H 42 8.530 8.530 8.160 0.370 17919 40926 1 100 . 1 1 43 43 LEU N N 43 124.040 124.040 127.891 -3.851 17919 40927 1 100 . 1 1 43 43 LEU C C 43 175.290 175.290 175.945 -0.655 17919 40928 1 100 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.882 -0.902 17919 40929 1 100 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.326 2.464 17919 40930 1 100 . 1 1 43 43 LEU H H 43 8.820 8.820 8.850 -0.030 17919 40931 1 100 . 1 1 44 44 ILE N N 44 121.920 121.920 117.775 4.145 17919 40932 1 100 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.040 -0.048 17919 40933 1 100 . 1 1 44 44 ILE C C 44 176.060 176.060 173.582 2.478 17919 40934 1 100 . 1 1 44 44 ILE CA C 44 58.980 58.980 58.861 0.119 17919 40935 1 100 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.662 -0.242 17919 40936 1 100 . 1 1 44 44 ILE H H 44 9.030 9.030 8.728 0.302 17919 40937 1 100 . 1 1 45 45 PHE N N 45 125.390 125.390 127.147 -1.757 17919 40938 1 100 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.835 0.210 17919 40939 1 100 . 1 1 45 45 PHE C C 45 174.470 174.470 174.477 -0.007 17919 40940 1 100 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.632 0.388 17919 40941 1 100 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.047 0.713 17919 40942 1 100 . 1 1 45 45 PHE H H 45 8.830 8.830 8.226 0.604 17919 40943 1 100 . 1 1 46 46 ALA N N 46 132.200 132.200 127.337 4.863 17919 40944 1 100 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.588 0.102 17919 40945 1 100 . 1 1 46 46 ALA C C 46 177.290 177.290 177.793 -0.503 17919 40946 1 100 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.619 -0.079 17919 40947 1 100 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.656 -0.086 17919 40948 1 100 . 1 1 46 46 ALA H H 46 8.810 8.810 8.390 0.420 17919 40949 1 100 . 1 1 47 47 GLY N N 47 102.340 102.340 104.554 -2.214 17919 40950 1 100 . 1 1 47 47 GLY C C 47 173.810 173.810 174.358 -0.548 17919 40951 1 100 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.918 0.432 17919 40952 1 100 . 1 1 47 47 GLY H H 47 8.130 8.130 8.283 -0.153 17919 40953 1 100 . 1 1 48 48 LYS N N 48 121.570 121.570 123.423 -1.853 17919 40954 1 100 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.630 -0.008 17919 40955 1 100 . 1 1 48 48 LYS C C 48 174.700 174.700 175.845 -1.145 17919 40956 1 100 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.848 -0.298 17919 40957 1 100 . 1 1 48 48 LYS CB C 48 34.530 34.530 33.877 0.653 17919 40958 1 100 . 1 1 48 48 LYS H H 48 7.980 7.980 7.888 0.092 17919 40959 1 100 . 1 1 49 49 GLN N N 49 122.410 122.410 123.833 -1.423 17919 40960 1 100 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.441 0.119 17919 40961 1 100 . 1 1 49 49 GLN C C 49 175.670 175.670 175.282 0.388 17919 40962 1 100 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.492 -0.752 17919 40963 1 100 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.346 -0.346 17919 40964 1 100 . 1 1 49 49 GLN H H 49 8.600 8.600 8.533 0.067 17919 40965 1 100 . 1 1 50 50 LEU N N 50 125.520 125.520 124.585 0.935 17919 40966 1 100 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.202 -0.112 17919 40967 1 100 . 1 1 50 50 LEU C C 50 176.660 176.660 176.145 0.515 17919 40968 1 100 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.097 0.143 17919 40969 1 100 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.486 -0.916 17919 40970 1 100 . 1 1 50 50 LEU H H 50 8.530 8.530 8.278 0.252 17919 40971 1 100 . 1 1 51 51 GLU N N 51 122.940 122.940 124.894 -1.954 17919 40972 1 100 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.524 -0.036 17919 40973 1 100 . 1 1 51 51 GLU C C 51 175.870 175.870 176.953 -1.083 17919 40974 1 100 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.396 0.564 17919 40975 1 100 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.739 -0.169 17919 40976 1 100 . 1 1 51 51 GLU H H 51 8.400 8.400 8.622 -0.222 17919 40977 1 100 . 1 1 52 52 ASP N N 52 120.030 120.030 125.881 -5.851 17919 40978 1 100 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.299 0.060 17919 40979 1 100 . 1 1 52 52 ASP C C 52 177.330 177.330 178.533 -1.203 17919 40980 1 100 . 1 1 52 52 ASP CA C 52 56.960 56.960 58.548 -1.588 17919 40981 1 100 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.564 0.286 17919 40982 1 100 . 1 1 52 52 ASP H H 52 8.160 8.160 8.884 -0.724 17919 40983 1 100 . 1 1 53 53 GLY N N 53 106.660 106.660 104.934 1.726 17919 40984 1 100 . 1 1 53 53 GLY C C 53 174.870 174.870 174.698 0.172 17919 40985 1 100 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.383 -0.213 17919 40986 1 100 . 1 1 53 53 GLY H H 53 9.390 9.390 8.268 1.122 17919 40987 1 100 . 1 1 54 54 ARG N N 54 119.050 119.050 122.496 -3.446 17919 40988 1 100 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.524 0.171 17919 40989 1 100 . 1 1 54 54 ARG C C 54 175.350 175.350 176.528 -1.178 17919 40990 1 100 . 1 1 54 54 ARG CA C 54 54.390 54.390 55.061 -0.671 17919 40991 1 100 . 1 1 54 54 ARG CB C 54 32.650 32.650 30.763 1.887 17919 40992 1 100 . 1 1 54 54 ARG H H 54 7.460 7.460 7.959 -0.499 17919 40993 1 100 . 1 1 55 55 THR N N 55 108.400 108.400 114.838 -6.438 17919 40994 1 100 . 1 1 55 55 THR HA H 55 5.240 5.240 4.417 0.823 17919 40995 1 100 . 1 1 55 55 THR C C 55 176.560 176.560 175.623 0.937 17919 40996 1 100 . 1 1 55 55 THR CA C 55 59.690 59.690 61.588 -1.898 17919 40997 1 100 . 1 1 55 55 THR CB C 55 72.260 72.260 70.009 2.251 17919 40998 1 100 . 1 1 55 55 THR H H 55 8.730 8.730 8.541 0.189 17919 40999 1 100 . 1 1 56 56 LEU N N 56 117.920 117.920 120.417 -2.497 17919 41000 1 100 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.301 -0.241 17919 41001 1 100 . 1 1 56 56 LEU C C 56 180.810 180.810 179.031 1.779 17919 41002 1 100 . 1 1 56 56 LEU CA C 56 58.710 58.710 57.695 1.015 17919 41003 1 100 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.966 -1.596 17919 41004 1 100 . 1 1 56 56 LEU H H 56 8.140 8.140 8.169 -0.029 17919 41005 1 100 . 1 1 57 57 SER N N 57 113.330 113.330 114.660 -1.330 17919 41006 1 100 . 1 1 57 57 SER HA H 57 4.370 4.370 4.005 0.365 17919 41007 1 100 . 1 1 57 57 SER C C 57 178.310 178.310 176.660 1.650 17919 41008 1 100 . 1 1 57 57 SER CA C 57 61.080 61.080 61.792 -0.712 17919 41009 1 100 . 1 1 57 57 SER CB C 57 62.530 62.530 62.160 0.370 17919 41010 1 100 . 1 1 57 57 SER H H 57 8.470 8.470 7.973 0.497 17919 41011 1 100 . 1 1 58 58 ASP N N 58 124.190 124.190 122.106 2.084 17919 41012 1 100 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.341 -0.045 17919 41013 1 100 . 1 1 58 58 ASP C C 58 177.400 177.400 176.897 0.503 17919 41014 1 100 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.242 0.938 17919 41015 1 100 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.538 -0.439 17919 41016 1 100 . 1 1 58 58 ASP H H 58 7.930 7.930 7.931 -0.001 17919 41017 1 100 . 1 1 59 59 TYR N N 59 115.510 115.510 116.483 -0.973 17919 41018 1 100 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.652 0.018 17919 41019 1 100 . 1 1 59 59 TYR C C 59 174.700 174.700 174.958 -0.258 17919 41020 1 100 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.640 0.610 17919 41021 1 100 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.647 1.423 17919 41022 1 100 . 1 1 59 59 TYR H H 59 7.250 7.250 7.341 -0.091 17919 41023 1 100 . 1 1 60 60 ASN N N 60 115.900 115.900 115.230 0.670 17919 41024 1 100 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.364 -0.009 17919 41025 1 100 . 1 1 60 60 ASN C C 60 174.340 174.340 174.317 0.023 17919 41026 1 100 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.431 -0.311 17919 41027 1 100 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.755 -0.345 17919 41028 1 100 . 1 1 60 60 ASN H H 60 8.150 8.150 7.828 0.322 17919 41029 1 100 . 1 1 61 61 ILE N N 61 118.600 118.600 120.684 -2.084 17919 41030 1 100 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.897 -0.504 17919 41031 1 100 . 1 1 61 61 ILE C C 61 174.610 174.610 174.422 0.188 17919 41032 1 100 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.672 0.748 17919 41033 1 100 . 1 1 61 61 ILE CB C 61 36.740 36.740 36.609 0.131 17919 41034 1 100 . 1 1 61 61 ILE H H 61 7.250 7.250 7.512 -0.262 17919 41035 1 100 . 1 1 62 62 GLN N N 62 124.740 124.740 125.585 -0.845 17919 41036 1 100 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.704 -0.198 17919 41037 1 100 . 1 1 62 62 GLN C C 62 175.970 175.970 175.929 0.041 17919 41038 1 100 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.387 0.273 17919 41039 1 100 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.409 0.241 17919 41040 1 100 . 1 1 62 62 GLN H H 62 7.610 7.610 7.763 -0.153 17919 41041 1 100 . 1 1 63 63 LYS N N 63 120.300 120.300 121.257 -0.957 17919 41042 1 100 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.994 0.007 17919 41043 1 100 . 1 1 63 63 LYS C C 63 175.810 175.810 176.563 -0.753 17919 41044 1 100 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.752 0.038 17919 41045 1 100 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.175 1.475 17919 41046 1 100 . 1 1 63 63 LYS H H 63 8.490 8.490 8.556 -0.066 17919 41047 1 100 . 1 1 64 64 GLU N N 64 113.950 113.950 119.317 -5.367 17919 41048 1 100 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.803 -0.338 17919 41049 1 100 . 1 1 64 64 GLU C C 64 175.250 175.250 175.759 -0.509 17919 41050 1 100 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.496 0.394 17919 41051 1 100 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.853 -2.953 17919 41052 1 100 . 1 1 64 64 GLU H H 64 9.280 9.280 8.843 0.437 17919 41053 1 100 . 1 1 65 65 SER N N 65 114.730 114.730 115.257 -0.527 17919 41054 1 100 . 1 1 65 65 SER HA H 65 4.640 4.640 4.617 0.023 17919 41055 1 100 . 1 1 65 65 SER C C 65 172.160 172.160 174.381 -2.221 17919 41056 1 100 . 1 1 65 65 SER CA C 65 60.890 60.890 59.336 1.554 17919 41057 1 100 . 1 1 65 65 SER CB C 65 64.910 64.910 63.764 1.146 17919 41058 1 100 . 1 1 65 65 SER H H 65 7.670 7.670 7.580 0.090 17919 41059 1 100 . 1 1 66 66 THR N N 66 117.110 117.110 123.788 -6.678 17919 41060 1 100 . 1 1 66 66 THR HA H 66 5.270 5.270 4.739 0.531 17919 41061 1 100 . 1 1 66 66 THR C C 66 173.950 173.950 174.342 -0.392 17919 41062 1 100 . 1 1 66 66 THR CA C 66 62.340 62.340 62.747 -0.407 17919 41063 1 100 . 1 1 66 66 THR CB C 66 70.080 70.080 68.926 1.154 17919 41064 1 100 . 1 1 66 66 THR H H 66 8.730 8.730 8.651 0.079 17919 41065 1 100 . 1 1 67 67 LEU N N 67 127.110 127.110 128.464 -1.354 17919 41066 1 100 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.599 0.461 17919 41067 1 100 . 1 1 67 67 LEU C C 67 175.770 175.770 176.503 -0.733 17919 41068 1 100 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.453 -0.553 17919 41069 1 100 . 1 1 67 67 LEU CB C 67 44.260 44.260 42.939 1.321 17919 41070 1 100 . 1 1 67 67 LEU H H 67 9.410 9.410 9.003 0.407 17919 41071 1 100 . 1 1 68 68 HIS N N 68 118.380 118.380 119.283 -0.903 17919 41072 1 100 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.048 0.192 17919 41073 1 100 . 1 1 68 68 HIS C C 68 173.150 173.150 174.853 -1.703 17919 41074 1 100 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.320 0.680 17919 41075 1 100 . 1 1 68 68 HIS CB C 68 30.530 30.530 30.372 0.158 17919 41076 1 100 . 1 1 68 68 HIS H H 68 9.230 9.230 8.434 0.796 17919 41077 1 100 . 1 1 69 69 LEU N N 69 124.460 124.460 126.826 -2.366 17919 41078 1 100 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.006 0.184 17919 41079 1 100 . 1 1 69 69 LEU C C 69 175.270 175.270 174.871 0.399 17919 41080 1 100 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.214 -0.324 17919 41081 1 100 . 1 1 69 69 LEU CB C 69 44.380 44.380 43.632 0.748 17919 41082 1 100 . 1 1 69 69 LEU H H 69 8.340 8.340 8.379 -0.039 17919 41083 1 100 . 1 1 70 70 VAL N N 70 126.940 126.940 122.204 4.736 17919 41084 1 100 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.617 -0.267 17919 41085 1 100 . 1 1 70 70 VAL C C 70 174.000 174.000 174.053 -0.053 17919 41086 1 100 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.588 1.212 17919 41087 1 100 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.927 -1.017 17919 41088 1 100 . 1 1 70 70 VAL H H 70 9.200 9.200 9.014 0.186 17919 41089 1 100 . 1 1 71 71 LEU N N 71 123.130 123.130 121.097 2.033 17919 41090 1 100 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.574 0.486 17919 41091 1 100 . 1 1 71 71 LEU C C 71 177.830 177.830 177.247 0.583 17919 41092 1 100 . 1 1 71 71 LEU CA C 71 53.940 53.940 54.397 -0.457 17919 41093 1 100 . 1 1 71 71 LEU CB C 71 42.850 42.850 41.933 0.917 17919 41094 1 100 . 1 1 71 71 LEU H H 71 8.120 8.120 8.320 -0.200 17919 41095 1 100 . 1 1 72 72 ARG N N 72 123.490 123.490 126.674 -3.184 17919 41096 1 100 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.429 -0.128 17919 41097 1 100 . 1 1 72 72 ARG C C 72 175.350 175.350 175.121 0.229 17919 41098 1 100 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.224 0.386 17919 41099 1 100 . 1 1 72 72 ARG CB C 72 31.350 31.350 29.388 1.962 17919 41100 1 100 . 1 1 72 72 ARG H H 72 8.580 8.580 8.347 0.233 17919 41101 1 101 . 1 1 2 2 GLN N N 2 123.220 123.220 122.747 0.473 17919 41102 1 101 . 1 1 2 2 GLN HA H 2 5.249 5.249 4.659 0.590 17919 41103 1 101 . 1 1 2 2 GLN C C 2 175.920 175.920 174.967 0.953 17919 41104 1 101 . 1 1 2 2 GLN CA C 2 55.080 55.080 55.132 -0.052 17919 41105 1 101 . 1 1 2 2 GLN CB C 2 30.760 30.760 29.366 1.395 17919 41106 1 101 . 1 1 2 2 GLN H H 2 8.900 8.900 8.573 0.327 17919 41107 1 101 . 1 1 3 3 ILE N N 3 115.340 115.340 119.729 -4.389 17919 41108 1 101 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.260 -0.047 17919 41109 1 101 . 1 1 3 3 ILE C C 3 172.450 172.450 173.639 -1.189 17919 41110 1 101 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.156 0.414 17919 41111 1 101 . 1 1 3 3 ILE CB C 3 42.210 42.210 40.438 1.772 17919 41112 1 101 . 1 1 3 3 ILE H H 3 8.320 8.320 7.665 0.654 17919 41113 1 101 . 1 1 4 4 PHE N N 4 118.110 118.110 118.763 -0.653 17919 41114 1 101 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.396 0.234 17919 41115 1 101 . 1 1 4 4 PHE C C 4 175.320 175.320 174.988 0.332 17919 41116 1 101 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.699 -0.489 17919 41117 1 101 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.336 -0.856 17919 41118 1 101 . 1 1 4 4 PHE H H 4 8.610 8.610 8.301 0.309 17919 41119 1 101 . 1 1 5 5 VAL N N 5 121.000 121.000 120.763 0.237 17919 41120 1 101 . 1 1 5 5 VAL HA H 5 4.725 4.725 5.052 -0.327 17919 41121 1 101 . 1 1 5 5 VAL C C 5 174.870 174.870 175.457 -0.587 17919 41122 1 101 . 1 1 5 5 VAL CA C 5 60.620 60.620 60.593 0.027 17919 41123 1 101 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.438 -0.208 17919 41124 1 101 . 1 1 5 5 VAL H H 5 9.300 9.300 9.257 0.043 17919 41125 1 101 . 1 1 6 6 LYS N N 6 127.520 127.520 128.068 -0.548 17919 41126 1 101 . 1 1 6 6 LYS HA H 6 5.367 5.367 4.911 0.456 17919 41127 1 101 . 1 1 6 6 LYS C C 6 177.140 177.140 176.326 0.814 17919 41128 1 101 . 1 1 6 6 LYS CA C 6 54.520 54.520 55.422 -0.902 17919 41129 1 101 . 1 1 6 6 LYS CB C 6 35.050 35.050 33.352 1.698 17919 41130 1 101 . 1 1 6 6 LYS H H 6 8.820 8.820 8.883 -0.063 17919 41131 1 101 . 1 1 7 7 THR N N 7 115.400 115.400 115.963 -0.563 17919 41132 1 101 . 1 1 7 7 THR HA H 7 4.970 4.970 4.665 0.305 17919 41133 1 101 . 1 1 7 7 THR C C 7 176.910 176.910 176.266 0.644 17919 41134 1 101 . 1 1 7 7 THR CA C 7 60.470 60.470 60.053 0.417 17919 41135 1 101 . 1 1 7 7 THR CB C 7 70.630 70.630 70.915 -0.285 17919 41136 1 101 . 1 1 7 7 THR H H 7 8.730 8.730 8.020 0.710 17919 41137 1 101 . 1 1 8 8 LEU N N 8 121.330 121.330 121.049 0.281 17919 41138 1 101 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.016 0.294 17919 41139 1 101 . 1 1 8 8 LEU C C 8 178.800 178.800 177.285 1.515 17919 41140 1 101 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.740 -0.160 17919 41141 1 101 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.716 0.254 17919 41142 1 101 . 1 1 8 8 LEU H H 8 9.100 9.100 8.015 1.085 17919 41143 1 101 . 1 1 9 9 THR N N 9 105.590 105.590 106.026 -0.436 17919 41144 1 101 . 1 1 9 9 THR HA H 9 4.428 4.428 4.176 0.252 17919 41145 1 101 . 1 1 9 9 THR C C 9 175.520 175.520 175.702 -0.182 17919 41146 1 101 . 1 1 9 9 THR CA C 9 61.400 61.400 62.740 -1.340 17919 41147 1 101 . 1 1 9 9 THR CB C 9 69.140 69.140 68.347 0.793 17919 41148 1 101 . 1 1 9 9 THR H H 9 7.630 7.630 7.822 -0.192 17919 41149 1 101 . 1 1 10 10 GLY N N 10 108.890 108.890 109.287 -0.397 17919 41150 1 101 . 1 1 10 10 GLY C C 10 174.070 174.070 173.777 0.293 17919 41151 1 101 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.678 0.782 17919 41152 1 101 . 1 1 10 10 GLY H H 10 7.810 7.810 7.856 -0.046 17919 41153 1 101 . 1 1 11 11 LYS N N 11 121.600 121.600 121.072 0.528 17919 41154 1 101 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.806 -0.445 17919 41155 1 101 . 1 1 11 11 LYS C C 11 175.940 175.940 175.173 0.767 17919 41156 1 101 . 1 1 11 11 LYS CA C 11 56.280 56.280 54.721 1.559 17919 41157 1 101 . 1 1 11 11 LYS CB C 11 33.200 33.200 34.888 -1.688 17919 41158 1 101 . 1 1 11 11 LYS H H 11 7.280 7.280 7.674 -0.394 17919 41159 1 101 . 1 1 12 12 THR N N 12 120.440 120.440 116.377 4.063 17919 41160 1 101 . 1 1 12 12 THR HA H 12 5.046 5.046 4.941 0.105 17919 41161 1 101 . 1 1 12 12 THR C C 12 174.320 174.320 174.312 0.008 17919 41162 1 101 . 1 1 12 12 THR CA C 12 62.390 62.390 62.041 0.349 17919 41163 1 101 . 1 1 12 12 THR CB C 12 69.910 69.910 70.290 -0.380 17919 41164 1 101 . 1 1 12 12 THR H H 12 8.650 8.650 8.420 0.230 17919 41165 1 101 . 1 1 13 13 ILE N N 13 127.110 127.110 128.774 -1.664 17919 41166 1 101 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.411 0.133 17919 41167 1 101 . 1 1 13 13 ILE C C 13 175.220 175.220 174.791 0.429 17919 41168 1 101 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.558 -0.578 17919 41169 1 101 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.020 -0.070 17919 41170 1 101 . 1 1 13 13 ILE H H 13 9.450 9.450 8.966 0.484 17919 41171 1 101 . 1 1 14 14 THR N N 14 121.520 121.520 123.840 -2.320 17919 41172 1 101 . 1 1 14 14 THR HA H 14 4.964 4.964 4.968 -0.004 17919 41173 1 101 . 1 1 14 14 THR C C 14 173.790 173.790 173.909 -0.119 17919 41174 1 101 . 1 1 14 14 THR CA C 14 61.940 61.940 62.453 -0.513 17919 41175 1 101 . 1 1 14 14 THR CB C 14 69.650 69.650 69.625 0.025 17919 41176 1 101 . 1 1 14 14 THR H H 14 8.710 8.710 8.591 0.119 17919 41177 1 101 . 1 1 15 15 LEU N N 15 124.800 124.800 128.868 -4.068 17919 41178 1 101 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.659 0.121 17919 41179 1 101 . 1 1 15 15 LEU C C 15 174.670 174.670 175.080 -0.410 17919 41180 1 101 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.749 -0.919 17919 41181 1 101 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.244 1.826 17919 41182 1 101 . 1 1 15 15 LEU H H 15 8.710 8.710 8.302 0.408 17919 41183 1 101 . 1 1 16 16 GLU N N 16 122.160 122.160 123.233 -1.073 17919 41184 1 101 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.995 -0.078 17919 41185 1 101 . 1 1 16 16 GLU C C 16 175.860 175.860 175.788 0.072 17919 41186 1 101 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.150 -0.330 17919 41187 1 101 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.775 -1.325 17919 41188 1 101 . 1 1 16 16 GLU H H 16 8.140 8.140 8.571 -0.431 17919 41189 1 101 . 1 1 17 17 VAL N N 17 117.210 117.210 121.064 -3.854 17919 41190 1 101 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.689 0.025 17919 41191 1 101 . 1 1 17 17 VAL C C 17 174.160 174.160 174.258 -0.098 17919 41192 1 101 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.155 -0.725 17919 41193 1 101 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.469 0.931 17919 41194 1 101 . 1 1 17 17 VAL H H 17 8.900 8.900 8.829 0.071 17919 41195 1 101 . 1 1 18 18 GLU N N 18 118.990 118.990 118.532 0.458 17919 41196 1 101 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.864 0.215 17919 41197 1 101 . 1 1 18 18 GLU C C 18 176.160 176.160 175.093 1.067 17919 41198 1 101 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.312 -0.592 17919 41199 1 101 . 1 1 18 18 GLU CB C 18 30.310 30.310 32.064 -1.754 17919 41200 1 101 . 1 1 18 18 GLU H H 18 8.640 8.640 8.443 0.197 17919 41201 1 101 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.285 -0.144 17919 41202 1 101 . 1 1 19 19 PRO C C 19 175.310 175.310 177.653 -2.343 17919 41203 1 101 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.360 0.110 17919 41204 1 101 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.007 -0.056 17919 41205 1 101 . 1 1 20 20 SER N N 20 103.400 103.400 108.621 -5.221 17919 41206 1 101 . 1 1 20 20 SER HA H 20 4.370 4.370 4.407 -0.037 17919 41207 1 101 . 1 1 20 20 SER C C 20 174.660 174.660 174.367 0.293 17919 41208 1 101 . 1 1 20 20 SER CA C 20 57.400 57.400 58.044 -0.644 17919 41209 1 101 . 1 1 20 20 SER CB C 20 63.370 63.370 62.864 0.506 17919 41210 1 101 . 1 1 20 20 SER H H 20 7.040 7.040 8.032 -0.992 17919 41211 1 101 . 1 1 21 21 ASP N N 21 123.480 123.480 123.681 -0.201 17919 41212 1 101 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.717 -0.022 17919 41213 1 101 . 1 1 21 21 ASP C C 21 176.360 176.360 175.608 0.752 17919 41214 1 101 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.212 1.488 17919 41215 1 101 . 1 1 21 21 ASP CB C 21 40.800 40.800 42.599 -1.799 17919 41216 1 101 . 1 1 21 21 ASP H H 21 8.030 8.030 8.054 -0.024 17919 41217 1 101 . 1 1 22 22 THR N N 22 108.800 108.800 113.493 -4.693 17919 41218 1 101 . 1 1 22 22 THR HA H 22 4.920 4.920 4.765 0.155 17919 41219 1 101 . 1 1 22 22 THR C C 22 176.750 176.750 175.567 1.183 17919 41220 1 101 . 1 1 22 22 THR CA C 22 59.690 59.690 60.722 -1.032 17919 41221 1 101 . 1 1 22 22 THR CB C 22 71.200 71.200 70.876 0.324 17919 41222 1 101 . 1 1 22 22 THR H H 22 7.900 7.900 8.122 -0.222 17919 41223 1 101 . 1 1 23 23 ILE N N 23 121.190 121.190 122.414 -1.224 17919 41224 1 101 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.774 -0.117 17919 41225 1 101 . 1 1 23 23 ILE C C 23 179.040 179.040 177.932 1.108 17919 41226 1 101 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.574 -0.314 17919 41227 1 101 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.528 -2.178 17919 41228 1 101 . 1 1 23 23 ILE H H 23 8.560 8.560 8.887 -0.327 17919 41229 1 101 . 1 1 24 24 GLU N N 24 120.830 120.830 119.977 0.853 17919 41230 1 101 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.889 0.028 17919 41231 1 101 . 1 1 24 24 GLU C C 24 178.640 178.640 178.768 -0.128 17919 41232 1 101 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.755 0.465 17919 41233 1 101 . 1 1 24 24 GLU CB C 24 28.280 28.280 28.933 -0.653 17919 41234 1 101 . 1 1 24 24 GLU H H 24 9.760 9.760 7.790 1.970 17919 41235 1 101 . 1 1 25 25 ASN N N 25 120.570 120.570 116.788 3.782 17919 41236 1 101 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.529 -0.004 17919 41237 1 101 . 1 1 25 25 ASN C C 25 178.380 178.380 177.824 0.556 17919 41238 1 101 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.793 0.267 17919 41239 1 101 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.193 0.257 17919 41240 1 101 . 1 1 25 25 ASN H H 25 7.920 7.920 8.296 -0.376 17919 41241 1 101 . 1 1 26 26 VAL N N 26 121.710 121.710 121.297 0.413 17919 41242 1 101 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.728 -0.331 17919 41243 1 101 . 1 1 26 26 VAL C C 26 177.950 177.950 177.142 0.808 17919 41244 1 101 . 1 1 26 26 VAL CA C 26 67.660 67.660 65.585 2.075 17919 41245 1 101 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.520 -0.680 17919 41246 1 101 . 1 1 26 26 VAL H H 26 8.070 8.070 8.117 -0.047 17919 41247 1 101 . 1 1 27 27 LYS N N 27 118.860 118.860 119.585 -0.725 17919 41248 1 101 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.208 0.372 17919 41249 1 101 . 1 1 27 27 LYS C C 27 180.550 180.550 179.015 1.535 17919 41250 1 101 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.507 -0.257 17919 41251 1 101 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.159 1.571 17919 41252 1 101 . 1 1 27 27 LYS H H 27 8.560 8.560 8.249 0.311 17919 41253 1 101 . 1 1 28 28 ALA N N 28 123.440 123.440 122.303 1.137 17919 41254 1 101 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.126 0.034 17919 41255 1 101 . 1 1 28 28 ALA C C 28 180.300 180.300 178.951 1.349 17919 41256 1 101 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.942 0.428 17919 41257 1 101 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.278 -0.568 17919 41258 1 101 . 1 1 28 28 ALA H H 28 8.060 8.060 8.349 -0.289 17919 41259 1 101 . 1 1 29 29 LYS N N 29 119.940 119.940 119.915 0.025 17919 41260 1 101 . 1 1 29 29 LYS HA H 29 4.207 4.207 3.985 0.222 17919 41261 1 101 . 1 1 29 29 LYS C C 29 180.320 180.320 179.004 1.316 17919 41262 1 101 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.514 0.136 17919 41263 1 101 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.317 0.973 17919 41264 1 101 . 1 1 29 29 LYS H H 29 7.850 7.850 7.420 0.430 17919 41265 1 101 . 1 1 30 30 ILE N N 30 121.080 121.080 119.987 1.093 17919 41266 1 101 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.548 -0.041 17919 41267 1 101 . 1 1 30 30 ILE C C 30 178.310 178.310 177.555 0.755 17919 41268 1 101 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.580 0.570 17919 41269 1 101 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.449 -0.649 17919 41270 1 101 . 1 1 30 30 ILE H H 30 8.280 8.280 8.125 0.155 17919 41271 1 101 . 1 1 31 31 GLN N N 31 123.490 123.490 119.586 3.904 17919 41272 1 101 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.861 -0.032 17919 41273 1 101 . 1 1 31 31 GLN C C 31 178.890 178.890 177.851 1.039 17919 41274 1 101 . 1 1 31 31 GLN CA C 31 60.000 60.000 58.913 1.087 17919 41275 1 101 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.533 -0.813 17919 41276 1 101 . 1 1 31 31 GLN H H 31 8.580 8.580 8.073 0.507 17919 41277 1 101 . 1 1 32 32 ASP N N 32 119.360 119.360 119.551 -0.191 17919 41278 1 101 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.364 -0.010 17919 41279 1 101 . 1 1 32 32 ASP C C 32 177.250 177.250 178.275 -1.025 17919 41280 1 101 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.983 0.207 17919 41281 1 101 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.928 -0.348 17919 41282 1 101 . 1 1 32 32 ASP H H 32 8.010 8.010 8.134 -0.124 17919 41283 1 101 . 1 1 33 33 LYS N N 33 115.130 115.130 118.158 -3.028 17919 41284 1 101 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.223 0.114 17919 41285 1 101 . 1 1 33 33 LYS C C 33 177.870 177.870 178.027 -0.157 17919 41286 1 101 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.978 0.072 17919 41287 1 101 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.303 0.866 17919 41288 1 101 . 1 1 33 33 LYS H H 33 7.430 7.430 7.770 -0.340 17919 41289 1 101 . 1 1 34 34 GLU N N 34 113.870 113.870 113.869 0.001 17919 41290 1 101 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.533 0.092 17919 41291 1 101 . 1 1 34 34 GLU C C 34 177.840 177.840 176.470 1.370 17919 41292 1 101 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.797 -0.627 17919 41293 1 101 . 1 1 34 34 GLU CB C 34 32.660 32.660 32.117 0.543 17919 41294 1 101 . 1 1 34 34 GLU H H 34 8.740 8.740 8.261 0.479 17919 41295 1 101 . 1 1 35 35 GLY N N 35 108.650 108.650 109.430 -0.780 17919 41296 1 101 . 1 1 35 35 GLY C C 35 173.960 173.960 174.557 -0.597 17919 41297 1 101 . 1 1 35 35 GLY CA C 35 46.080 46.080 46.098 -0.018 17919 41298 1 101 . 1 1 35 35 GLY H H 35 8.530 8.530 7.857 0.673 17919 41299 1 101 . 1 1 36 36 ILE N N 36 119.880 119.880 120.378 -0.498 17919 41300 1 101 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.308 0.137 17919 41301 1 101 . 1 1 36 36 ILE C C 36 173.590 173.590 173.830 -0.240 17919 41302 1 101 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.078 -0.328 17919 41303 1 101 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.151 2.429 17919 41304 1 101 . 1 1 36 36 ILE H H 36 6.150 6.150 7.670 -1.520 17919 41305 1 101 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.839 -0.205 17919 41306 1 101 . 1 1 37 37 PRO C C 37 176.940 176.940 176.071 0.869 17919 41307 1 101 . 1 1 37 37 PRO CA C 37 61.660 61.660 60.957 0.703 17919 41308 1 101 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.246 0.604 17919 41309 1 101 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.095 0.022 17919 41310 1 101 . 1 1 38 38 PRO C C 38 178.320 178.320 178.001 0.319 17919 41311 1 101 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.994 0.266 17919 41312 1 101 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.820 1.070 17919 41313 1 101 . 1 1 39 39 ASP N N 39 113.380 113.380 113.779 -0.399 17919 41314 1 101 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.395 0.035 17919 41315 1 101 . 1 1 39 39 ASP C C 39 177.090 177.090 177.894 -0.804 17919 41316 1 101 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.629 -0.989 17919 41317 1 101 . 1 1 39 39 ASP CB C 39 39.540 39.540 39.537 0.003 17919 41318 1 101 . 1 1 39 39 ASP H H 39 8.550 8.550 8.672 -0.122 17919 41319 1 101 . 1 1 40 40 GLN N N 40 116.780 116.780 118.003 -1.223 17919 41320 1 101 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.404 0.060 17919 41321 1 101 . 1 1 40 40 GLN C C 40 175.380 175.380 176.090 -0.710 17919 41322 1 101 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.017 -0.378 17919 41323 1 101 . 1 1 40 40 GLN CB C 40 30.140 30.140 30.133 0.007 17919 41324 1 101 . 1 1 40 40 GLN H H 40 7.820 7.820 7.725 0.095 17919 41325 1 101 . 1 1 41 41 GLN N N 41 117.720 117.720 120.021 -2.301 17919 41326 1 101 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.324 -0.080 17919 41327 1 101 . 1 1 41 41 GLN C C 41 176.300 176.300 174.622 1.678 17919 41328 1 101 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.619 0.851 17919 41329 1 101 . 1 1 41 41 GLN CB C 41 31.650 31.650 28.659 2.991 17919 41330 1 101 . 1 1 41 41 GLN H H 41 7.480 7.480 7.607 -0.127 17919 41331 1 101 . 1 1 42 42 ARG N N 42 122.680 122.680 126.830 -4.150 17919 41332 1 101 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.369 0.131 17919 41333 1 101 . 1 1 42 42 ARG C C 42 174.050 174.050 174.710 -0.660 17919 41334 1 101 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.335 -0.285 17919 41335 1 101 . 1 1 42 42 ARG CB C 42 31.750 31.750 30.577 1.173 17919 41336 1 101 . 1 1 42 42 ARG H H 42 8.530 8.530 7.993 0.537 17919 41337 1 101 . 1 1 43 43 LEU N N 43 124.040 124.040 126.762 -2.722 17919 41338 1 101 . 1 1 43 43 LEU C C 43 175.290 175.290 176.188 -0.898 17919 41339 1 101 . 1 1 43 43 LEU CA C 43 52.980 52.980 55.217 -2.237 17919 41340 1 101 . 1 1 43 43 LEU CB C 43 45.790 45.790 42.498 3.292 17919 41341 1 101 . 1 1 43 43 LEU H H 43 8.820 8.820 8.601 0.219 17919 41342 1 101 . 1 1 44 44 ILE N N 44 121.920 121.920 121.949 -0.029 17919 41343 1 101 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.672 0.320 17919 41344 1 101 . 1 1 44 44 ILE C C 44 176.060 176.060 174.754 1.306 17919 41345 1 101 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.900 -1.920 17919 41346 1 101 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.040 0.380 17919 41347 1 101 . 1 1 44 44 ILE H H 44 9.030 9.030 8.306 0.724 17919 41348 1 101 . 1 1 45 45 PHE N N 45 125.390 125.390 128.612 -3.222 17919 41349 1 101 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.980 0.065 17919 41350 1 101 . 1 1 45 45 PHE C C 45 174.470 174.470 175.307 -0.837 17919 41351 1 101 . 1 1 45 45 PHE CA C 45 57.020 57.020 57.209 -0.189 17919 41352 1 101 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.469 1.290 17919 41353 1 101 . 1 1 45 45 PHE H H 45 8.830 8.830 8.346 0.484 17919 41354 1 101 . 1 1 46 46 ALA N N 46 132.200 132.200 122.503 9.697 17919 41355 1 101 . 1 1 46 46 ALA HA H 46 3.690 3.690 4.491 -0.801 17919 41356 1 101 . 1 1 46 46 ALA C C 46 177.290 177.290 177.776 -0.486 17919 41357 1 101 . 1 1 46 46 ALA CA C 46 52.540 52.540 51.589 0.951 17919 41358 1 101 . 1 1 46 46 ALA CB C 46 16.570 16.570 18.082 -1.512 17919 41359 1 101 . 1 1 46 46 ALA H H 46 8.810 8.810 8.467 0.343 17919 41360 1 101 . 1 1 47 47 GLY N N 47 102.340 102.340 111.060 -8.720 17919 41361 1 101 . 1 1 47 47 GLY C C 47 173.810 173.810 174.370 -0.560 17919 41362 1 101 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.829 -0.479 17919 41363 1 101 . 1 1 47 47 GLY H H 47 8.130 8.130 8.604 -0.474 17919 41364 1 101 . 1 1 48 48 LYS N N 48 121.570 121.570 122.145 -0.575 17919 41365 1 101 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.696 -0.074 17919 41366 1 101 . 1 1 48 48 LYS C C 48 174.700 174.700 175.426 -0.726 17919 41367 1 101 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.586 -0.036 17919 41368 1 101 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.576 -0.046 17919 41369 1 101 . 1 1 48 48 LYS H H 48 7.980 7.980 7.936 0.043 17919 41370 1 101 . 1 1 49 49 GLN N N 49 122.410 122.410 121.689 0.721 17919 41371 1 101 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.757 -0.197 17919 41372 1 101 . 1 1 49 49 GLN C C 49 175.670 175.670 175.772 -0.102 17919 41373 1 101 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.086 -0.346 17919 41374 1 101 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.439 -0.439 17919 41375 1 101 . 1 1 49 49 GLN H H 49 8.600 8.600 8.542 0.058 17919 41376 1 101 . 1 1 50 50 LEU N N 50 125.520 125.520 123.888 1.632 17919 41377 1 101 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.075 0.015 17919 41378 1 101 . 1 1 50 50 LEU C C 50 176.660 176.660 176.427 0.233 17919 41379 1 101 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.712 0.529 17919 41380 1 101 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.313 0.257 17919 41381 1 101 . 1 1 50 50 LEU H H 50 8.530 8.530 8.175 0.355 17919 41382 1 101 . 1 1 51 51 GLU N N 51 122.940 122.940 124.901 -1.961 17919 41383 1 101 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.257 0.231 17919 41384 1 101 . 1 1 51 51 GLU C C 51 175.870 175.870 177.100 -1.230 17919 41385 1 101 . 1 1 51 51 GLU CA C 51 55.960 55.960 56.713 -0.753 17919 41386 1 101 . 1 1 51 51 GLU CB C 51 31.570 31.570 30.226 1.344 17919 41387 1 101 . 1 1 51 51 GLU H H 51 8.400 8.400 8.052 0.348 17919 41388 1 101 . 1 1 52 52 ASP N N 52 120.030 120.030 126.066 -6.036 17919 41389 1 101 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.411 -0.052 17919 41390 1 101 . 1 1 52 52 ASP C C 52 177.330 177.330 178.217 -0.887 17919 41391 1 101 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.823 -0.863 17919 41392 1 101 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.906 -0.056 17919 41393 1 101 . 1 1 52 52 ASP H H 52 8.160 8.160 8.799 -0.639 17919 41394 1 101 . 1 1 53 53 GLY N N 53 106.660 106.660 107.117 -0.457 17919 41395 1 101 . 1 1 53 53 GLY C C 53 174.870 174.870 174.442 0.428 17919 41396 1 101 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.154 0.016 17919 41397 1 101 . 1 1 53 53 GLY H H 53 9.390 9.390 8.474 0.916 17919 41398 1 101 . 1 1 54 54 ARG N N 54 119.050 119.050 120.720 -1.670 17919 41399 1 101 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.620 0.075 17919 41400 1 101 . 1 1 54 54 ARG C C 54 175.350 175.350 175.374 -0.024 17919 41401 1 101 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.316 0.074 17919 41402 1 101 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.041 0.609 17919 41403 1 101 . 1 1 54 54 ARG H H 54 7.460 7.460 7.615 -0.155 17919 41404 1 101 . 1 1 55 55 THR N N 55 108.400 108.400 112.485 -4.085 17919 41405 1 101 . 1 1 55 55 THR HA H 55 5.240 5.240 4.877 0.363 17919 41406 1 101 . 1 1 55 55 THR C C 55 176.560 176.560 176.194 0.366 17919 41407 1 101 . 1 1 55 55 THR CA C 55 59.690 59.690 60.601 -0.911 17919 41408 1 101 . 1 1 55 55 THR CB C 55 72.260 72.260 70.862 1.398 17919 41409 1 101 . 1 1 55 55 THR H H 55 8.730 8.730 8.367 0.363 17919 41410 1 101 . 1 1 56 56 LEU N N 56 117.920 117.920 120.843 -2.923 17919 41411 1 101 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.844 0.216 17919 41412 1 101 . 1 1 56 56 LEU C C 56 180.810 180.810 178.862 1.948 17919 41413 1 101 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.266 0.444 17919 41414 1 101 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.277 -0.907 17919 41415 1 101 . 1 1 56 56 LEU H H 56 8.140 8.140 8.043 0.097 17919 41416 1 101 . 1 1 57 57 SER N N 57 113.330 113.330 115.943 -2.613 17919 41417 1 101 . 1 1 57 57 SER HA H 57 4.370 4.370 4.010 0.360 17919 41418 1 101 . 1 1 57 57 SER C C 57 178.310 178.310 176.935 1.375 17919 41419 1 101 . 1 1 57 57 SER CA C 57 61.080 61.080 62.384 -1.304 17919 41420 1 101 . 1 1 57 57 SER CB C 57 62.530 62.530 62.702 -0.172 17919 41421 1 101 . 1 1 57 57 SER H H 57 8.470 8.470 8.122 0.348 17919 41422 1 101 . 1 1 58 58 ASP N N 58 124.190 124.190 121.221 2.969 17919 41423 1 101 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.221 0.075 17919 41424 1 101 . 1 1 58 58 ASP C C 58 177.400 177.400 177.512 -0.112 17919 41425 1 101 . 1 1 58 58 ASP CA C 58 57.180 57.180 57.062 0.118 17919 41426 1 101 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.245 -0.145 17919 41427 1 101 . 1 1 58 58 ASP H H 58 7.930 7.930 7.795 0.135 17919 41428 1 101 . 1 1 59 59 TYR N N 59 115.510 115.510 115.322 0.188 17919 41429 1 101 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.562 0.108 17919 41430 1 101 . 1 1 59 59 TYR C C 59 174.700 174.700 174.909 -0.209 17919 41431 1 101 . 1 1 59 59 TYR CA C 59 58.250 58.250 56.816 1.434 17919 41432 1 101 . 1 1 59 59 TYR CB C 59 40.070 40.070 37.749 2.321 17919 41433 1 101 . 1 1 59 59 TYR H H 59 7.250 7.250 7.221 0.029 17919 41434 1 101 . 1 1 60 60 ASN N N 60 115.900 115.900 115.987 -0.087 17919 41435 1 101 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.314 0.041 17919 41436 1 101 . 1 1 60 60 ASN C C 60 174.340 174.340 174.477 -0.137 17919 41437 1 101 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.296 -0.176 17919 41438 1 101 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.246 0.164 17919 41439 1 101 . 1 1 60 60 ASN H H 60 8.150 8.150 7.850 0.300 17919 41440 1 101 . 1 1 61 61 ILE N N 61 118.600 118.600 120.277 -1.677 17919 41441 1 101 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.926 -0.533 17919 41442 1 101 . 1 1 61 61 ILE C C 61 174.610 174.610 174.977 -0.367 17919 41443 1 101 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.562 0.858 17919 41444 1 101 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.193 -0.453 17919 41445 1 101 . 1 1 61 61 ILE H H 61 7.250 7.250 8.001 -0.751 17919 41446 1 101 . 1 1 62 62 GLN N N 62 124.740 124.740 127.333 -2.593 17919 41447 1 101 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.731 -0.225 17919 41448 1 101 . 1 1 62 62 GLN C C 62 175.970 175.970 175.278 0.692 17919 41449 1 101 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.664 -0.004 17919 41450 1 101 . 1 1 62 62 GLN CB C 62 31.650 31.650 30.718 0.932 17919 41451 1 101 . 1 1 62 62 GLN H H 62 7.610 7.610 8.027 -0.417 17919 41452 1 101 . 1 1 63 63 LYS N N 63 120.300 120.300 119.724 0.576 17919 41453 1 101 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.927 0.074 17919 41454 1 101 . 1 1 63 63 LYS C C 63 175.810 175.810 176.392 -0.582 17919 41455 1 101 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.002 -0.212 17919 41456 1 101 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.639 1.011 17919 41457 1 101 . 1 1 63 63 LYS H H 63 8.490 8.490 8.686 -0.196 17919 41458 1 101 . 1 1 64 64 GLU N N 64 113.950 113.950 117.519 -3.569 17919 41459 1 101 . 1 1 64 64 GLU HA H 64 3.465 3.465 4.076 -0.611 17919 41460 1 101 . 1 1 64 64 GLU C C 64 175.250 175.250 175.315 -0.065 17919 41461 1 101 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.609 0.281 17919 41462 1 101 . 1 1 64 64 GLU CB C 64 25.900 25.900 27.907 -2.006 17919 41463 1 101 . 1 1 64 64 GLU H H 64 9.280 9.280 8.688 0.592 17919 41464 1 101 . 1 1 65 65 SER N N 65 114.730 114.730 114.911 -0.181 17919 41465 1 101 . 1 1 65 65 SER HA H 65 4.640 4.640 4.667 -0.027 17919 41466 1 101 . 1 1 65 65 SER C C 65 172.160 172.160 173.636 -1.476 17919 41467 1 101 . 1 1 65 65 SER CA C 65 60.890 60.890 59.696 1.194 17919 41468 1 101 . 1 1 65 65 SER CB C 65 64.910 64.910 64.624 0.286 17919 41469 1 101 . 1 1 65 65 SER H H 65 7.670 7.670 7.848 -0.178 17919 41470 1 101 . 1 1 66 66 THR N N 66 117.110 117.110 116.633 0.477 17919 41471 1 101 . 1 1 66 66 THR HA H 66 5.270 5.270 5.498 -0.228 17919 41472 1 101 . 1 1 66 66 THR C C 66 173.950 173.950 173.774 0.176 17919 41473 1 101 . 1 1 66 66 THR CA C 66 62.340 62.340 61.999 0.341 17919 41474 1 101 . 1 1 66 66 THR CB C 66 70.080 70.080 71.806 -1.726 17919 41475 1 101 . 1 1 66 66 THR H H 66 8.730 8.730 8.457 0.273 17919 41476 1 101 . 1 1 67 67 LEU N N 67 127.110 127.110 125.712 1.398 17919 41477 1 101 . 1 1 67 67 LEU HA H 67 5.060 5.060 5.162 -0.102 17919 41478 1 101 . 1 1 67 67 LEU C C 67 175.770 175.770 175.413 0.357 17919 41479 1 101 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.941 -0.041 17919 41480 1 101 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.763 0.497 17919 41481 1 101 . 1 1 67 67 LEU H H 67 9.410 9.410 8.605 0.805 17919 41482 1 101 . 1 1 68 68 HIS N N 68 118.380 118.380 121.060 -2.680 17919 41483 1 101 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.809 -0.569 17919 41484 1 101 . 1 1 68 68 HIS C C 68 173.150 173.150 174.150 -1.000 17919 41485 1 101 . 1 1 68 68 HIS CA C 68 55.000 55.000 53.660 1.340 17919 41486 1 101 . 1 1 68 68 HIS CB C 68 30.530 30.530 33.690 -3.160 17919 41487 1 101 . 1 1 68 68 HIS H H 68 9.230 9.230 8.963 0.267 17919 41488 1 101 . 1 1 69 69 LEU N N 69 124.460 124.460 120.243 4.217 17919 41489 1 101 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.793 0.397 17919 41490 1 101 . 1 1 69 69 LEU C C 69 175.270 175.270 173.894 1.376 17919 41491 1 101 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.934 -1.044 17919 41492 1 101 . 1 1 69 69 LEU CB C 69 44.380 44.380 45.637 -1.257 17919 41493 1 101 . 1 1 69 69 LEU H H 69 8.340 8.340 6.919 1.421 17919 41494 1 101 . 1 1 70 70 VAL N N 70 126.940 126.940 121.801 5.139 17919 41495 1 101 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.606 -0.256 17919 41496 1 101 . 1 1 70 70 VAL C C 70 174.000 174.000 173.592 0.408 17919 41497 1 101 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.751 1.049 17919 41498 1 101 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.842 -0.932 17919 41499 1 101 . 1 1 70 70 VAL H H 70 9.200 9.200 7.962 1.238 17919 41500 1 101 . 1 1 71 71 LEU N N 71 123.130 123.130 122.114 1.016 17919 41501 1 101 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.095 -0.035 17919 41502 1 101 . 1 1 71 71 LEU C C 71 177.830 177.830 176.756 1.074 17919 41503 1 101 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.047 0.893 17919 41504 1 101 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.448 0.402 17919 41505 1 101 . 1 1 71 71 LEU H H 71 8.120 8.120 8.221 -0.101 17919 41506 1 101 . 1 1 72 72 ARG N N 72 123.490 123.490 126.388 -2.898 17919 41507 1 101 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.245 0.056 17919 41508 1 101 . 1 1 72 72 ARG C C 72 175.350 175.350 175.310 0.040 17919 41509 1 101 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.209 -0.599 17919 41510 1 101 . 1 1 72 72 ARG CB C 72 31.350 31.350 29.457 1.893 17919 41511 1 101 . 1 1 72 72 ARG H H 72 8.580 8.580 8.318 0.262 17919 41512 1 102 . 1 1 2 2 GLN N N 2 123.220 123.220 121.325 1.895 17919 41513 1 102 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.380 -0.131 17919 41514 1 102 . 1 1 2 2 GLN C C 2 175.920 175.920 175.201 0.719 17919 41515 1 102 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.817 0.263 17919 41516 1 102 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.881 -0.121 17919 41517 1 102 . 1 1 2 2 GLN H H 2 8.900 8.900 8.398 0.502 17919 41518 1 102 . 1 1 3 3 ILE N N 3 115.340 115.340 117.462 -2.122 17919 41519 1 102 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.344 -0.131 17919 41520 1 102 . 1 1 3 3 ILE C C 3 172.450 172.450 173.317 -0.867 17919 41521 1 102 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.864 -0.294 17919 41522 1 102 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.790 0.420 17919 41523 1 102 . 1 1 3 3 ILE H H 3 8.320 8.320 8.652 -0.332 17919 41524 1 102 . 1 1 4 4 PHE N N 4 118.110 118.110 120.523 -2.413 17919 41525 1 102 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.261 0.369 17919 41526 1 102 . 1 1 4 4 PHE C C 4 175.320 175.320 174.802 0.518 17919 41527 1 102 . 1 1 4 4 PHE CA C 4 55.210 55.210 56.253 -1.043 17919 41528 1 102 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.474 -0.994 17919 41529 1 102 . 1 1 4 4 PHE H H 4 8.610 8.610 8.323 0.287 17919 41530 1 102 . 1 1 5 5 VAL N N 5 121.000 121.000 122.835 -1.835 17919 41531 1 102 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.783 -0.058 17919 41532 1 102 . 1 1 5 5 VAL C C 5 174.870 174.870 174.764 0.106 17919 41533 1 102 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.411 -0.791 17919 41534 1 102 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.043 0.187 17919 41535 1 102 . 1 1 5 5 VAL H H 5 9.300 9.300 9.255 0.045 17919 41536 1 102 . 1 1 6 6 LYS N N 6 127.520 127.520 128.944 -1.424 17919 41537 1 102 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.363 0.004 17919 41538 1 102 . 1 1 6 6 LYS C C 6 177.140 177.140 176.634 0.506 17919 41539 1 102 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.721 -0.201 17919 41540 1 102 . 1 1 6 6 LYS CB C 6 35.050 35.050 33.961 1.089 17919 41541 1 102 . 1 1 6 6 LYS H H 6 8.820 8.820 8.687 0.133 17919 41542 1 102 . 1 1 7 7 THR N N 7 115.400 115.400 116.864 -1.464 17919 41543 1 102 . 1 1 7 7 THR HA H 7 4.970 4.970 4.360 0.610 17919 41544 1 102 . 1 1 7 7 THR C C 7 176.910 176.910 176.353 0.557 17919 41545 1 102 . 1 1 7 7 THR CA C 7 60.470 60.470 60.300 0.170 17919 41546 1 102 . 1 1 7 7 THR CB C 7 70.630 70.630 69.644 0.986 17919 41547 1 102 . 1 1 7 7 THR H H 7 8.730 8.730 8.481 0.249 17919 41548 1 102 . 1 1 8 8 LEU N N 8 121.330 121.330 120.024 1.306 17919 41549 1 102 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.262 0.048 17919 41550 1 102 . 1 1 8 8 LEU C C 8 178.800 178.800 177.918 0.882 17919 41551 1 102 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.898 -0.318 17919 41552 1 102 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.719 0.251 17919 41553 1 102 . 1 1 8 8 LEU H H 8 9.100 9.100 8.899 0.201 17919 41554 1 102 . 1 1 9 9 THR N N 9 105.590 105.590 107.478 -1.888 17919 41555 1 102 . 1 1 9 9 THR HA H 9 4.428 4.428 4.294 0.134 17919 41556 1 102 . 1 1 9 9 THR C C 9 175.520 175.520 175.598 -0.078 17919 41557 1 102 . 1 1 9 9 THR CA C 9 61.400 61.400 62.020 -0.620 17919 41558 1 102 . 1 1 9 9 THR CB C 9 69.140 69.140 68.876 0.264 17919 41559 1 102 . 1 1 9 9 THR H H 9 7.630 7.630 7.591 0.039 17919 41560 1 102 . 1 1 10 10 GLY N N 10 108.890 108.890 111.241 -2.351 17919 41561 1 102 . 1 1 10 10 GLY C C 10 174.070 174.070 173.661 0.409 17919 41562 1 102 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.066 0.394 17919 41563 1 102 . 1 1 10 10 GLY H H 10 7.810 7.810 7.784 0.026 17919 41564 1 102 . 1 1 11 11 LYS N N 11 121.600 121.600 121.139 0.461 17919 41565 1 102 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.317 0.044 17919 41566 1 102 . 1 1 11 11 LYS C C 11 175.940 175.940 175.960 -0.020 17919 41567 1 102 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.286 -0.006 17919 41568 1 102 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.342 -0.142 17919 41569 1 102 . 1 1 11 11 LYS H H 11 7.280 7.280 7.457 -0.177 17919 41570 1 102 . 1 1 12 12 THR N N 12 120.440 120.440 119.127 1.313 17919 41571 1 102 . 1 1 12 12 THR HA H 12 5.046 5.046 4.845 0.201 17919 41572 1 102 . 1 1 12 12 THR C C 12 174.320 174.320 174.690 -0.370 17919 41573 1 102 . 1 1 12 12 THR CA C 12 62.390 62.390 62.734 -0.344 17919 41574 1 102 . 1 1 12 12 THR CB C 12 69.910 69.910 69.697 0.213 17919 41575 1 102 . 1 1 12 12 THR H H 12 8.650 8.650 8.275 0.375 17919 41576 1 102 . 1 1 13 13 ILE N N 13 127.110 127.110 126.744 0.366 17919 41577 1 102 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.505 0.039 17919 41578 1 102 . 1 1 13 13 ILE C C 13 175.220 175.220 175.309 -0.089 17919 41579 1 102 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.281 -0.301 17919 41580 1 102 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.216 -0.266 17919 41581 1 102 . 1 1 13 13 ILE H H 13 9.450 9.450 8.959 0.491 17919 41582 1 102 . 1 1 14 14 THR N N 14 121.520 121.520 122.099 -0.579 17919 41583 1 102 . 1 1 14 14 THR HA H 14 4.964 4.964 5.128 -0.164 17919 41584 1 102 . 1 1 14 14 THR C C 14 173.790 173.790 173.751 0.039 17919 41585 1 102 . 1 1 14 14 THR CA C 14 61.940 61.940 61.303 0.637 17919 41586 1 102 . 1 1 14 14 THR CB C 14 69.650 69.650 70.124 -0.474 17919 41587 1 102 . 1 1 14 14 THR H H 14 8.710 8.710 8.322 0.388 17919 41588 1 102 . 1 1 15 15 LEU N N 15 124.800 124.800 125.590 -0.790 17919 41589 1 102 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.684 0.096 17919 41590 1 102 . 1 1 15 15 LEU C C 15 174.670 174.670 174.802 -0.132 17919 41591 1 102 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.834 -1.004 17919 41592 1 102 . 1 1 15 15 LEU CB C 15 47.070 47.070 46.194 0.876 17919 41593 1 102 . 1 1 15 15 LEU H H 15 8.710 8.710 8.389 0.321 17919 41594 1 102 . 1 1 16 16 GLU N N 16 122.160 122.160 123.716 -1.556 17919 41595 1 102 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.696 0.221 17919 41596 1 102 . 1 1 16 16 GLU C C 16 175.860 175.860 175.749 0.111 17919 41597 1 102 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.245 -0.425 17919 41598 1 102 . 1 1 16 16 GLU CB C 16 29.450 29.450 29.595 -0.145 17919 41599 1 102 . 1 1 16 16 GLU H H 16 8.140 8.140 8.613 -0.473 17919 41600 1 102 . 1 1 17 17 VAL N N 17 117.210 117.210 120.762 -3.552 17919 41601 1 102 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.782 -0.068 17919 41602 1 102 . 1 1 17 17 VAL C C 17 174.160 174.160 175.510 -1.350 17919 41603 1 102 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.525 -0.095 17919 41604 1 102 . 1 1 17 17 VAL CB C 17 36.400 36.400 34.580 1.820 17919 41605 1 102 . 1 1 17 17 VAL H H 17 8.900 8.900 8.386 0.514 17919 41606 1 102 . 1 1 18 18 GLU N N 18 118.990 118.990 118.149 0.841 17919 41607 1 102 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.784 0.295 17919 41608 1 102 . 1 1 18 18 GLU C C 18 176.160 176.160 174.878 1.282 17919 41609 1 102 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.995 -0.275 17919 41610 1 102 . 1 1 18 18 GLU CB C 18 30.310 30.310 31.464 -1.154 17919 41611 1 102 . 1 1 18 18 GLU H H 18 8.640 8.640 8.098 0.542 17919 41612 1 102 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.544 -0.403 17919 41613 1 102 . 1 1 19 19 PRO C C 19 175.310 175.310 177.092 -1.782 17919 41614 1 102 . 1 1 19 19 PRO CA C 19 65.470 65.470 64.334 1.136 17919 41615 1 102 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.929 0.021 17919 41616 1 102 . 1 1 20 20 SER N N 20 103.400 103.400 112.120 -8.720 17919 41617 1 102 . 1 1 20 20 SER HA H 20 4.370 4.370 4.352 0.018 17919 41618 1 102 . 1 1 20 20 SER C C 20 174.660 174.660 174.787 -0.127 17919 41619 1 102 . 1 1 20 20 SER CA C 20 57.400 57.400 58.653 -1.253 17919 41620 1 102 . 1 1 20 20 SER CB C 20 63.370 63.370 63.189 0.181 17919 41621 1 102 . 1 1 20 20 SER H H 20 7.040 7.040 7.971 -0.931 17919 41622 1 102 . 1 1 21 21 ASP N N 21 123.480 123.480 124.564 -1.084 17919 41623 1 102 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.753 -0.058 17919 41624 1 102 . 1 1 21 21 ASP C C 21 176.360 176.360 175.769 0.591 17919 41625 1 102 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.832 0.868 17919 41626 1 102 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.951 -1.151 17919 41627 1 102 . 1 1 21 21 ASP H H 21 8.030 8.030 7.728 0.302 17919 41628 1 102 . 1 1 22 22 THR N N 22 108.800 108.800 111.631 -2.831 17919 41629 1 102 . 1 1 22 22 THR HA H 22 4.920 4.920 4.944 -0.024 17919 41630 1 102 . 1 1 22 22 THR C C 22 176.750 176.750 176.079 0.671 17919 41631 1 102 . 1 1 22 22 THR CA C 22 59.690 59.690 60.340 -0.650 17919 41632 1 102 . 1 1 22 22 THR CB C 22 71.200 71.200 71.358 -0.158 17919 41633 1 102 . 1 1 22 22 THR H H 22 7.900 7.900 8.137 -0.237 17919 41634 1 102 . 1 1 23 23 ILE N N 23 121.190 121.190 123.315 -2.125 17919 41635 1 102 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.672 -0.015 17919 41636 1 102 . 1 1 23 23 ILE C C 23 179.040 179.040 177.797 1.243 17919 41637 1 102 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.895 -0.635 17919 41638 1 102 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.348 -1.998 17919 41639 1 102 . 1 1 23 23 ILE H H 23 8.560 8.560 9.009 -0.449 17919 41640 1 102 . 1 1 24 24 GLU N N 24 120.830 120.830 119.493 1.337 17919 41641 1 102 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.933 -0.016 17919 41642 1 102 . 1 1 24 24 GLU C C 24 178.640 178.640 179.062 -0.422 17919 41643 1 102 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.411 0.809 17919 41644 1 102 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.494 -1.214 17919 41645 1 102 . 1 1 24 24 GLU H H 24 9.760 9.760 7.996 1.764 17919 41646 1 102 . 1 1 25 25 ASN N N 25 120.570 120.570 118.629 1.941 17919 41647 1 102 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.512 0.013 17919 41648 1 102 . 1 1 25 25 ASN C C 25 178.380 178.380 177.903 0.477 17919 41649 1 102 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.691 0.369 17919 41650 1 102 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.219 0.231 17919 41651 1 102 . 1 1 25 25 ASN H H 25 7.920 7.920 7.560 0.360 17919 41652 1 102 . 1 1 26 26 VAL N N 26 121.710 121.710 117.466 4.244 17919 41653 1 102 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.683 -0.286 17919 41654 1 102 . 1 1 26 26 VAL C C 26 177.950 177.950 177.711 0.239 17919 41655 1 102 . 1 1 26 26 VAL CA C 26 67.660 67.660 65.831 1.829 17919 41656 1 102 . 1 1 26 26 VAL CB C 26 30.840 30.840 30.391 0.449 17919 41657 1 102 . 1 1 26 26 VAL H H 26 8.070 8.070 8.506 -0.436 17919 41658 1 102 . 1 1 27 27 LYS N N 27 118.860 118.860 118.851 0.009 17919 41659 1 102 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.375 0.205 17919 41660 1 102 . 1 1 27 27 LYS C C 27 180.550 180.550 178.415 2.135 17919 41661 1 102 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.004 0.246 17919 41662 1 102 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.176 1.554 17919 41663 1 102 . 1 1 27 27 LYS H H 27 8.560 8.560 8.105 0.455 17919 41664 1 102 . 1 1 28 28 ALA N N 28 123.440 123.440 120.867 2.573 17919 41665 1 102 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.514 -0.354 17919 41666 1 102 . 1 1 28 28 ALA C C 28 180.300 180.300 179.089 1.211 17919 41667 1 102 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.332 1.038 17919 41668 1 102 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.485 -0.776 17919 41669 1 102 . 1 1 28 28 ALA H H 28 8.060 8.060 7.749 0.311 17919 41670 1 102 . 1 1 29 29 LYS N N 29 119.940 119.940 119.300 0.640 17919 41671 1 102 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.123 0.084 17919 41672 1 102 . 1 1 29 29 LYS C C 29 180.320 180.320 178.556 1.764 17919 41673 1 102 . 1 1 29 29 LYS CA C 29 59.650 59.650 58.616 1.034 17919 41674 1 102 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.550 0.740 17919 41675 1 102 . 1 1 29 29 LYS H H 29 7.850 7.850 7.388 0.462 17919 41676 1 102 . 1 1 30 30 ILE N N 30 121.080 121.080 120.445 0.635 17919 41677 1 102 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.555 -0.048 17919 41678 1 102 . 1 1 30 30 ILE C C 30 178.310 178.310 177.759 0.551 17919 41679 1 102 . 1 1 30 30 ILE CA C 30 66.150 66.150 64.935 1.215 17919 41680 1 102 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.798 -0.998 17919 41681 1 102 . 1 1 30 30 ILE H H 30 8.280 8.280 7.808 0.472 17919 41682 1 102 . 1 1 31 31 GLN N N 31 123.490 123.490 120.440 3.050 17919 41683 1 102 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.985 -0.156 17919 41684 1 102 . 1 1 31 31 GLN C C 31 178.890 178.890 178.193 0.697 17919 41685 1 102 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.168 0.832 17919 41686 1 102 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.342 -0.622 17919 41687 1 102 . 1 1 31 31 GLN H H 31 8.580 8.580 8.250 0.330 17919 41688 1 102 . 1 1 32 32 ASP N N 32 119.360 119.360 118.534 0.826 17919 41689 1 102 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.397 -0.043 17919 41690 1 102 . 1 1 32 32 ASP C C 32 177.250 177.250 177.601 -0.351 17919 41691 1 102 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.387 0.803 17919 41692 1 102 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.708 -0.128 17919 41693 1 102 . 1 1 32 32 ASP H H 32 8.010 8.010 7.941 0.069 17919 41694 1 102 . 1 1 33 33 LYS N N 33 115.130 115.130 117.013 -1.883 17919 41695 1 102 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.450 -0.113 17919 41696 1 102 . 1 1 33 33 LYS C C 33 177.870 177.870 177.990 -0.120 17919 41697 1 102 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.767 0.283 17919 41698 1 102 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.843 0.327 17919 41699 1 102 . 1 1 33 33 LYS H H 33 7.430 7.430 7.870 -0.440 17919 41700 1 102 . 1 1 34 34 GLU N N 34 113.870 113.870 116.661 -2.791 17919 41701 1 102 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.366 0.259 17919 41702 1 102 . 1 1 34 34 GLU C C 34 177.840 177.840 177.655 0.185 17919 41703 1 102 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.519 -1.349 17919 41704 1 102 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.122 1.538 17919 41705 1 102 . 1 1 34 34 GLU H H 34 8.740 8.740 7.898 0.842 17919 41706 1 102 . 1 1 35 35 GLY N N 35 108.650 108.650 109.270 -0.620 17919 41707 1 102 . 1 1 35 35 GLY C C 35 173.960 173.960 174.678 -0.718 17919 41708 1 102 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.673 0.407 17919 41709 1 102 . 1 1 35 35 GLY H H 35 8.530 8.530 8.143 0.387 17919 41710 1 102 . 1 1 36 36 ILE N N 36 119.880 119.880 117.946 1.934 17919 41711 1 102 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.656 -0.211 17919 41712 1 102 . 1 1 36 36 ILE C C 36 173.590 173.590 173.731 -0.141 17919 41713 1 102 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.080 0.670 17919 41714 1 102 . 1 1 36 36 ILE CB C 36 40.580 40.580 37.239 3.341 17919 41715 1 102 . 1 1 36 36 ILE H H 36 6.150 6.150 7.599 -1.449 17919 41716 1 102 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.744 -0.110 17919 41717 1 102 . 1 1 37 37 PRO C C 37 176.940 176.940 175.958 0.982 17919 41718 1 102 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.937 -0.277 17919 41719 1 102 . 1 1 37 37 PRO CB C 37 31.850 31.850 30.569 1.282 17919 41720 1 102 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.279 -0.162 17919 41721 1 102 . 1 1 38 38 PRO C C 38 178.320 178.320 177.918 0.402 17919 41722 1 102 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.495 0.765 17919 41723 1 102 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.782 1.108 17919 41724 1 102 . 1 1 39 39 ASP N N 39 113.380 113.380 115.756 -2.376 17919 41725 1 102 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.575 -0.145 17919 41726 1 102 . 1 1 39 39 ASP C C 39 177.090 177.090 177.160 -0.070 17919 41727 1 102 . 1 1 39 39 ASP CA C 39 55.640 55.640 55.474 0.166 17919 41728 1 102 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.164 -0.624 17919 41729 1 102 . 1 1 39 39 ASP H H 39 8.550 8.550 8.576 -0.026 17919 41730 1 102 . 1 1 40 40 GLN N N 40 116.780 116.780 117.235 -0.455 17919 41731 1 102 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.299 0.165 17919 41732 1 102 . 1 1 40 40 GLN C C 40 175.380 175.380 176.174 -0.794 17919 41733 1 102 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.599 -0.959 17919 41734 1 102 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.188 0.952 17919 41735 1 102 . 1 1 40 40 GLN H H 40 7.820 7.820 7.946 -0.126 17919 41736 1 102 . 1 1 41 41 GLN N N 41 117.720 117.720 118.249 -0.529 17919 41737 1 102 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.669 -0.425 17919 41738 1 102 . 1 1 41 41 GLN C C 41 176.300 176.300 175.277 1.023 17919 41739 1 102 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.201 0.269 17919 41740 1 102 . 1 1 41 41 GLN CB C 41 31.650 31.650 30.237 1.413 17919 41741 1 102 . 1 1 41 41 GLN H H 41 7.480 7.480 7.708 -0.228 17919 41742 1 102 . 1 1 42 42 ARG N N 42 122.680 122.680 121.481 1.199 17919 41743 1 102 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.668 -0.168 17919 41744 1 102 . 1 1 42 42 ARG C C 42 174.050 174.050 173.896 0.154 17919 41745 1 102 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.125 -0.075 17919 41746 1 102 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.732 -1.982 17919 41747 1 102 . 1 1 42 42 ARG H H 42 8.530 8.530 8.132 0.398 17919 41748 1 102 . 1 1 43 43 LEU N N 43 124.040 124.040 125.562 -1.522 17919 41749 1 102 . 1 1 43 43 LEU C C 43 175.290 175.290 175.720 -0.430 17919 41750 1 102 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.445 -0.465 17919 41751 1 102 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.490 1.300 17919 41752 1 102 . 1 1 43 43 LEU H H 43 8.820 8.820 8.752 0.068 17919 41753 1 102 . 1 1 44 44 ILE N N 44 121.920 121.920 121.041 0.879 17919 41754 1 102 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.860 0.132 17919 41755 1 102 . 1 1 44 44 ILE C C 44 176.060 176.060 174.224 1.836 17919 41756 1 102 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.493 -1.513 17919 41757 1 102 . 1 1 44 44 ILE CB C 44 41.420 41.420 40.712 0.708 17919 41758 1 102 . 1 1 44 44 ILE H H 44 9.030 9.030 8.369 0.661 17919 41759 1 102 . 1 1 45 45 PHE N N 45 125.390 125.390 127.646 -2.256 17919 41760 1 102 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.012 0.033 17919 41761 1 102 . 1 1 45 45 PHE C C 45 174.470 174.470 174.186 0.284 17919 41762 1 102 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.663 0.357 17919 41763 1 102 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.140 0.620 17919 41764 1 102 . 1 1 45 45 PHE H H 45 8.830 8.830 8.876 -0.046 17919 41765 1 102 . 1 1 46 46 ALA N N 46 132.200 132.200 129.240 2.960 17919 41766 1 102 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.544 0.146 17919 41767 1 102 . 1 1 46 46 ALA C C 46 177.290 177.290 177.651 -0.361 17919 41768 1 102 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.105 0.435 17919 41769 1 102 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.339 0.231 17919 41770 1 102 . 1 1 46 46 ALA H H 46 8.810 8.810 8.536 0.274 17919 41771 1 102 . 1 1 47 47 GLY N N 47 102.340 102.340 102.566 -0.226 17919 41772 1 102 . 1 1 47 47 GLY C C 47 173.810 173.810 174.077 -0.267 17919 41773 1 102 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.086 0.264 17919 41774 1 102 . 1 1 47 47 GLY H H 47 8.130 8.130 8.423 -0.293 17919 41775 1 102 . 1 1 48 48 LYS N N 48 121.570 121.570 120.860 0.710 17919 41776 1 102 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.592 0.030 17919 41777 1 102 . 1 1 48 48 LYS C C 48 174.700 174.700 175.484 -0.784 17919 41778 1 102 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.935 -0.385 17919 41779 1 102 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.228 0.302 17919 41780 1 102 . 1 1 48 48 LYS H H 48 7.980 7.980 7.834 0.146 17919 41781 1 102 . 1 1 49 49 GLN N N 49 122.410 122.410 123.331 -0.921 17919 41782 1 102 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.617 -0.057 17919 41783 1 102 . 1 1 49 49 GLN C C 49 175.670 175.670 176.003 -0.333 17919 41784 1 102 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.174 -0.434 17919 41785 1 102 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.703 -0.703 17919 41786 1 102 . 1 1 49 49 GLN H H 49 8.600 8.600 8.574 0.026 17919 41787 1 102 . 1 1 50 50 LEU N N 50 125.520 125.520 123.242 2.278 17919 41788 1 102 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.399 -0.309 17919 41789 1 102 . 1 1 50 50 LEU C C 50 176.660 176.660 175.837 0.823 17919 41790 1 102 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.610 -0.370 17919 41791 1 102 . 1 1 50 50 LEU CB C 50 41.570 41.570 43.030 -1.460 17919 41792 1 102 . 1 1 50 50 LEU H H 50 8.530 8.530 8.770 -0.240 17919 41793 1 102 . 1 1 51 51 GLU N N 51 122.940 122.940 118.251 4.689 17919 41794 1 102 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.450 0.038 17919 41795 1 102 . 1 1 51 51 GLU C C 51 175.870 175.870 175.635 0.235 17919 41796 1 102 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.755 0.205 17919 41797 1 102 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.964 -1.394 17919 41798 1 102 . 1 1 51 51 GLU H H 51 8.400 8.400 8.363 0.037 17919 41799 1 102 . 1 1 52 52 ASP N N 52 120.030 120.030 124.154 -4.124 17919 41800 1 102 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.556 -0.197 17919 41801 1 102 . 1 1 52 52 ASP C C 52 177.330 177.330 177.741 -0.411 17919 41802 1 102 . 1 1 52 52 ASP CA C 52 56.960 56.960 56.575 0.384 17919 41803 1 102 . 1 1 52 52 ASP CB C 52 40.850 40.850 41.083 -0.233 17919 41804 1 102 . 1 1 52 52 ASP H H 52 8.160 8.160 8.692 -0.532 17919 41805 1 102 . 1 1 53 53 GLY N N 53 106.660 106.660 106.610 0.050 17919 41806 1 102 . 1 1 53 53 GLY C C 53 174.870 174.870 173.569 1.301 17919 41807 1 102 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.904 0.266 17919 41808 1 102 . 1 1 53 53 GLY H H 53 9.390 9.390 8.650 0.740 17919 41809 1 102 . 1 1 54 54 ARG N N 54 119.050 119.050 117.661 1.389 17919 41810 1 102 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.552 0.143 17919 41811 1 102 . 1 1 54 54 ARG C C 54 175.350 175.350 174.388 0.962 17919 41812 1 102 . 1 1 54 54 ARG CA C 54 54.390 54.390 53.823 0.567 17919 41813 1 102 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.273 0.377 17919 41814 1 102 . 1 1 54 54 ARG H H 54 7.460 7.460 7.209 0.251 17919 41815 1 102 . 1 1 55 55 THR N N 55 108.400 108.400 111.191 -2.791 17919 41816 1 102 . 1 1 55 55 THR HA H 55 5.240 5.240 4.913 0.327 17919 41817 1 102 . 1 1 55 55 THR C C 55 176.560 176.560 176.672 -0.112 17919 41818 1 102 . 1 1 55 55 THR CA C 55 59.690 59.690 60.099 -0.409 17919 41819 1 102 . 1 1 55 55 THR CB C 55 72.260 72.260 70.872 1.388 17919 41820 1 102 . 1 1 55 55 THR H H 55 8.730 8.730 8.714 0.016 17919 41821 1 102 . 1 1 56 56 LEU N N 56 117.920 117.920 123.138 -5.218 17919 41822 1 102 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.009 0.051 17919 41823 1 102 . 1 1 56 56 LEU C C 56 180.810 180.810 178.727 2.083 17919 41824 1 102 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.731 -0.021 17919 41825 1 102 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.358 -0.989 17919 41826 1 102 . 1 1 56 56 LEU H H 56 8.140 8.140 8.436 -0.296 17919 41827 1 102 . 1 1 57 57 SER N N 57 113.330 113.330 114.765 -1.435 17919 41828 1 102 . 1 1 57 57 SER HA H 57 4.370 4.370 4.141 0.229 17919 41829 1 102 . 1 1 57 57 SER C C 57 178.310 178.310 176.643 1.667 17919 41830 1 102 . 1 1 57 57 SER CA C 57 61.080 61.080 61.961 -0.881 17919 41831 1 102 . 1 1 57 57 SER CB C 57 62.530 62.530 62.778 -0.248 17919 41832 1 102 . 1 1 57 57 SER H H 57 8.470 8.470 8.122 0.348 17919 41833 1 102 . 1 1 58 58 ASP N N 58 124.190 124.190 121.517 2.673 17919 41834 1 102 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.289 0.007 17919 41835 1 102 . 1 1 58 58 ASP C C 58 177.400 177.400 176.654 0.746 17919 41836 1 102 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.480 0.700 17919 41837 1 102 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.247 -0.147 17919 41838 1 102 . 1 1 58 58 ASP H H 58 7.930 7.930 8.121 -0.191 17919 41839 1 102 . 1 1 59 59 TYR N N 59 115.510 115.510 115.121 0.389 17919 41840 1 102 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.710 -0.040 17919 41841 1 102 . 1 1 59 59 TYR C C 59 174.700 174.700 175.148 -0.448 17919 41842 1 102 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.377 0.873 17919 41843 1 102 . 1 1 59 59 TYR CB C 59 40.070 40.070 39.072 0.998 17919 41844 1 102 . 1 1 59 59 TYR H H 59 7.250 7.250 7.275 -0.025 17919 41845 1 102 . 1 1 60 60 ASN N N 60 115.900 115.900 115.990 -0.090 17919 41846 1 102 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.374 -0.019 17919 41847 1 102 . 1 1 60 60 ASN C C 60 174.340 174.340 174.467 -0.127 17919 41848 1 102 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.117 0.002 17919 41849 1 102 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.596 -0.186 17919 41850 1 102 . 1 1 60 60 ASN H H 60 8.150 8.150 7.863 0.287 17919 41851 1 102 . 1 1 61 61 ILE N N 61 118.600 118.600 121.395 -2.795 17919 41852 1 102 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.723 -0.330 17919 41853 1 102 . 1 1 61 61 ILE C C 61 174.610 174.610 174.990 -0.380 17919 41854 1 102 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.595 0.825 17919 41855 1 102 . 1 1 61 61 ILE CB C 61 36.740 36.740 36.035 0.705 17919 41856 1 102 . 1 1 61 61 ILE H H 61 7.250 7.250 7.636 -0.386 17919 41857 1 102 . 1 1 62 62 GLN N N 62 124.740 124.740 124.895 -0.155 17919 41858 1 102 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.423 0.083 17919 41859 1 102 . 1 1 62 62 GLN C C 62 175.970 175.970 176.435 -0.465 17919 41860 1 102 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.825 -0.166 17919 41861 1 102 . 1 1 62 62 GLN CB C 62 31.650 31.650 29.542 2.108 17919 41862 1 102 . 1 1 62 62 GLN H H 62 7.610 7.610 7.780 -0.170 17919 41863 1 102 . 1 1 63 63 LYS N N 63 120.300 120.300 120.559 -0.259 17919 41864 1 102 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.040 -0.039 17919 41865 1 102 . 1 1 63 63 LYS C C 63 175.810 175.810 177.163 -1.353 17919 41866 1 102 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.895 -0.105 17919 41867 1 102 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.547 1.103 17919 41868 1 102 . 1 1 63 63 LYS H H 63 8.490 8.490 8.781 -0.291 17919 41869 1 102 . 1 1 64 64 GLU N N 64 113.950 113.950 119.281 -5.331 17919 41870 1 102 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.974 -0.508 17919 41871 1 102 . 1 1 64 64 GLU C C 64 175.250 175.250 175.688 -0.438 17919 41872 1 102 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.691 0.199 17919 41873 1 102 . 1 1 64 64 GLU CB C 64 25.900 25.900 29.032 -3.132 17919 41874 1 102 . 1 1 64 64 GLU H H 64 9.280 9.280 9.027 0.253 17919 41875 1 102 . 1 1 65 65 SER N N 65 114.730 114.730 116.015 -1.285 17919 41876 1 102 . 1 1 65 65 SER HA H 65 4.640 4.640 4.462 0.178 17919 41877 1 102 . 1 1 65 65 SER C C 65 172.160 172.160 174.195 -2.035 17919 41878 1 102 . 1 1 65 65 SER CA C 65 60.890 60.890 60.118 0.772 17919 41879 1 102 . 1 1 65 65 SER CB C 65 64.910 64.910 63.798 1.112 17919 41880 1 102 . 1 1 65 65 SER H H 65 7.670 7.670 7.792 -0.122 17919 41881 1 102 . 1 1 66 66 THR N N 66 117.110 117.110 121.619 -4.509 17919 41882 1 102 . 1 1 66 66 THR HA H 66 5.270 5.270 4.849 0.421 17919 41883 1 102 . 1 1 66 66 THR C C 66 173.950 173.950 174.115 -0.165 17919 41884 1 102 . 1 1 66 66 THR CA C 66 62.340 62.340 63.015 -0.675 17919 41885 1 102 . 1 1 66 66 THR CB C 66 70.080 70.080 69.288 0.792 17919 41886 1 102 . 1 1 66 66 THR H H 66 8.730 8.730 8.558 0.172 17919 41887 1 102 . 1 1 67 67 LEU N N 67 127.110 127.110 128.233 -1.123 17919 41888 1 102 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.823 0.237 17919 41889 1 102 . 1 1 67 67 LEU C C 67 175.770 175.770 175.455 0.315 17919 41890 1 102 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.761 0.139 17919 41891 1 102 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.000 0.260 17919 41892 1 102 . 1 1 67 67 LEU H H 67 9.410 9.410 9.062 0.348 17919 41893 1 102 . 1 1 68 68 HIS N N 68 118.380 118.380 122.018 -3.638 17919 41894 1 102 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.402 -0.162 17919 41895 1 102 . 1 1 68 68 HIS C C 68 173.150 173.150 173.657 -0.507 17919 41896 1 102 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.323 0.677 17919 41897 1 102 . 1 1 68 68 HIS CB C 68 30.530 30.530 33.614 -3.084 17919 41898 1 102 . 1 1 68 68 HIS H H 68 9.230 9.230 9.012 0.218 17919 41899 1 102 . 1 1 69 69 LEU N N 69 124.460 124.460 123.963 0.497 17919 41900 1 102 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.373 -0.183 17919 41901 1 102 . 1 1 69 69 LEU C C 69 175.270 175.270 175.217 0.053 17919 41902 1 102 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.683 0.207 17919 41903 1 102 . 1 1 69 69 LEU CB C 69 44.380 44.380 45.727 -1.347 17919 41904 1 102 . 1 1 69 69 LEU H H 69 8.340 8.340 7.410 0.930 17919 41905 1 102 . 1 1 70 70 VAL N N 70 126.940 126.940 120.814 6.126 17919 41906 1 102 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.590 -0.240 17919 41907 1 102 . 1 1 70 70 VAL C C 70 174.000 174.000 174.171 -0.171 17919 41908 1 102 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.467 1.333 17919 41909 1 102 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.150 -0.240 17919 41910 1 102 . 1 1 70 70 VAL H H 70 9.200 9.200 8.749 0.451 17919 41911 1 102 . 1 1 71 71 LEU N N 71 123.130 123.130 120.622 2.508 17919 41912 1 102 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.139 -0.079 17919 41913 1 102 . 1 1 71 71 LEU C C 71 177.830 177.830 176.785 1.045 17919 41914 1 102 . 1 1 71 71 LEU CA C 71 53.940 53.940 52.892 1.048 17919 41915 1 102 . 1 1 71 71 LEU CB C 71 42.850 42.850 44.331 -1.481 17919 41916 1 102 . 1 1 71 71 LEU H H 71 8.120 8.120 8.302 -0.182 17919 41917 1 102 . 1 1 72 72 ARG N N 72 123.490 123.490 125.100 -1.610 17919 41918 1 102 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.345 -0.044 17919 41919 1 102 . 1 1 72 72 ARG C C 72 175.350 175.350 175.204 0.146 17919 41920 1 102 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.352 -0.742 17919 41921 1 102 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.992 0.358 17919 41922 1 102 . 1 1 72 72 ARG H H 72 8.580 8.580 8.470 0.110 17919 41923 1 103 . 1 1 2 2 GLN N N 2 123.220 123.220 120.616 2.604 17919 41924 1 103 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.247 0.002 17919 41925 1 103 . 1 1 2 2 GLN C C 2 175.920 175.920 175.122 0.798 17919 41926 1 103 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.311 0.769 17919 41927 1 103 . 1 1 2 2 GLN CB C 2 30.760 30.760 31.134 -0.374 17919 41928 1 103 . 1 1 2 2 GLN H H 2 8.900 8.900 8.391 0.509 17919 41929 1 103 . 1 1 3 3 ILE N N 3 115.340 115.340 116.860 -1.520 17919 41930 1 103 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.101 0.112 17919 41931 1 103 . 1 1 3 3 ILE C C 3 172.450 172.450 173.538 -1.088 17919 41932 1 103 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.740 -0.170 17919 41933 1 103 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.513 0.697 17919 41934 1 103 . 1 1 3 3 ILE H H 3 8.320 8.320 7.610 0.710 17919 41935 1 103 . 1 1 4 4 PHE N N 4 118.110 118.110 119.019 -0.909 17919 41936 1 103 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.228 0.402 17919 41937 1 103 . 1 1 4 4 PHE C C 4 175.320 175.320 175.472 -0.152 17919 41938 1 103 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.710 -0.500 17919 41939 1 103 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.980 -0.500 17919 41940 1 103 . 1 1 4 4 PHE H H 4 8.610 8.610 7.964 0.646 17919 41941 1 103 . 1 1 5 5 VAL N N 5 121.000 121.000 121.602 -0.602 17919 41942 1 103 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.905 -0.180 17919 41943 1 103 . 1 1 5 5 VAL C C 5 174.870 174.870 175.571 -0.701 17919 41944 1 103 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.347 -0.727 17919 41945 1 103 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.094 1.136 17919 41946 1 103 . 1 1 5 5 VAL H H 5 9.300 9.300 8.636 0.664 17919 41947 1 103 . 1 1 6 6 LYS N N 6 127.520 127.520 129.597 -2.077 17919 41948 1 103 . 1 1 6 6 LYS HA H 6 5.367 5.367 4.859 0.507 17919 41949 1 103 . 1 1 6 6 LYS C C 6 177.140 177.140 176.594 0.546 17919 41950 1 103 . 1 1 6 6 LYS CA C 6 54.520 54.520 55.587 -1.067 17919 41951 1 103 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.856 0.194 17919 41952 1 103 . 1 1 6 6 LYS H H 6 8.820 8.820 8.918 -0.098 17919 41953 1 103 . 1 1 7 7 THR N N 7 115.400 115.400 116.823 -1.423 17919 41954 1 103 . 1 1 7 7 THR HA H 7 4.970 4.970 4.341 0.629 17919 41955 1 103 . 1 1 7 7 THR C C 7 176.910 176.910 176.079 0.831 17919 41956 1 103 . 1 1 7 7 THR CA C 7 60.470 60.470 60.436 0.034 17919 41957 1 103 . 1 1 7 7 THR CB C 7 70.630 70.630 70.172 0.457 17919 41958 1 103 . 1 1 7 7 THR H H 7 8.730 8.730 8.600 0.130 17919 41959 1 103 . 1 1 8 8 LEU N N 8 121.330 121.330 120.839 0.491 17919 41960 1 103 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.291 0.019 17919 41961 1 103 . 1 1 8 8 LEU C C 8 178.800 178.800 177.542 1.258 17919 41962 1 103 . 1 1 8 8 LEU CA C 8 57.580 57.580 58.152 -0.572 17919 41963 1 103 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.903 0.067 17919 41964 1 103 . 1 1 8 8 LEU H H 8 9.100 9.100 8.721 0.379 17919 41965 1 103 . 1 1 9 9 THR N N 9 105.590 105.590 108.116 -2.526 17919 41966 1 103 . 1 1 9 9 THR HA H 9 4.428 4.428 4.348 0.080 17919 41967 1 103 . 1 1 9 9 THR C C 9 175.520 175.520 175.137 0.383 17919 41968 1 103 . 1 1 9 9 THR CA C 9 61.400 61.400 61.724 -0.324 17919 41969 1 103 . 1 1 9 9 THR CB C 9 69.140 69.140 68.869 0.271 17919 41970 1 103 . 1 1 9 9 THR H H 9 7.630 7.630 7.670 -0.040 17919 41971 1 103 . 1 1 10 10 GLY N N 10 108.890 108.890 109.653 -0.763 17919 41972 1 103 . 1 1 10 10 GLY C C 10 174.070 174.070 173.611 0.459 17919 41973 1 103 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.719 0.741 17919 41974 1 103 . 1 1 10 10 GLY H H 10 7.810 7.810 7.393 0.417 17919 41975 1 103 . 1 1 11 11 LYS N N 11 121.600 121.600 123.260 -1.660 17919 41976 1 103 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.182 0.179 17919 41977 1 103 . 1 1 11 11 LYS C C 11 175.940 175.940 176.299 -0.359 17919 41978 1 103 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.978 -0.698 17919 41979 1 103 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.182 0.018 17919 41980 1 103 . 1 1 11 11 LYS H H 11 7.280 7.280 7.848 -0.568 17919 41981 1 103 . 1 1 12 12 THR N N 12 120.440 120.440 120.992 -0.552 17919 41982 1 103 . 1 1 12 12 THR HA H 12 5.046 5.046 4.807 0.239 17919 41983 1 103 . 1 1 12 12 THR C C 12 174.320 174.320 174.817 -0.497 17919 41984 1 103 . 1 1 12 12 THR CA C 12 62.390 62.390 62.655 -0.265 17919 41985 1 103 . 1 1 12 12 THR CB C 12 69.910 69.910 69.545 0.365 17919 41986 1 103 . 1 1 12 12 THR H H 12 8.650 8.650 8.233 0.417 17919 41987 1 103 . 1 1 13 13 ILE N N 13 127.110 127.110 118.227 8.883 17919 41988 1 103 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.611 -0.067 17919 41989 1 103 . 1 1 13 13 ILE C C 13 175.220 175.220 174.936 0.284 17919 41990 1 103 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.114 0.866 17919 41991 1 103 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.008 -0.058 17919 41992 1 103 . 1 1 13 13 ILE H H 13 9.450 9.450 8.798 0.652 17919 41993 1 103 . 1 1 14 14 THR N N 14 121.520 121.520 120.324 1.196 17919 41994 1 103 . 1 1 14 14 THR HA H 14 4.964 4.964 4.693 0.271 17919 41995 1 103 . 1 1 14 14 THR C C 14 173.790 173.790 174.223 -0.433 17919 41996 1 103 . 1 1 14 14 THR CA C 14 61.940 61.940 62.770 -0.830 17919 41997 1 103 . 1 1 14 14 THR CB C 14 69.650 69.650 69.758 -0.108 17919 41998 1 103 . 1 1 14 14 THR H H 14 8.710 8.710 8.337 0.373 17919 41999 1 103 . 1 1 15 15 LEU N N 15 124.800 124.800 127.692 -2.892 17919 42000 1 103 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.627 0.153 17919 42001 1 103 . 1 1 15 15 LEU C C 15 174.670 174.670 175.129 -0.459 17919 42002 1 103 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.709 -0.879 17919 42003 1 103 . 1 1 15 15 LEU CB C 15 47.070 47.070 44.782 2.288 17919 42004 1 103 . 1 1 15 15 LEU H H 15 8.710 8.710 8.092 0.618 17919 42005 1 103 . 1 1 16 16 GLU N N 16 122.160 122.160 122.762 -0.602 17919 42006 1 103 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.615 0.302 17919 42007 1 103 . 1 1 16 16 GLU C C 16 175.860 175.860 176.279 -0.419 17919 42008 1 103 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.919 -1.099 17919 42009 1 103 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.165 -0.714 17919 42010 1 103 . 1 1 16 16 GLU H H 16 8.140 8.140 8.610 -0.470 17919 42011 1 103 . 1 1 17 17 VAL N N 17 117.210 117.210 120.906 -3.696 17919 42012 1 103 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.716 -0.002 17919 42013 1 103 . 1 1 17 17 VAL C C 17 174.160 174.160 174.973 -0.813 17919 42014 1 103 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.148 -0.717 17919 42015 1 103 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.749 0.651 17919 42016 1 103 . 1 1 17 17 VAL H H 17 8.900 8.900 8.952 -0.052 17919 42017 1 103 . 1 1 18 18 GLU N N 18 118.990 118.990 121.455 -2.465 17919 42018 1 103 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.893 0.186 17919 42019 1 103 . 1 1 18 18 GLU C C 18 176.160 176.160 175.337 0.823 17919 42020 1 103 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.906 -0.186 17919 42021 1 103 . 1 1 18 18 GLU CB C 18 30.310 30.310 32.010 -1.700 17919 42022 1 103 . 1 1 18 18 GLU H H 18 8.640 8.640 8.098 0.542 17919 42023 1 103 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.274 -0.133 17919 42024 1 103 . 1 1 19 19 PRO C C 19 175.310 175.310 177.674 -2.364 17919 42025 1 103 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.254 0.216 17919 42026 1 103 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.987 -0.037 17919 42027 1 103 . 1 1 20 20 SER N N 20 103.400 103.400 109.243 -5.843 17919 42028 1 103 . 1 1 20 20 SER HA H 20 4.370 4.370 4.346 0.024 17919 42029 1 103 . 1 1 20 20 SER C C 20 174.660 174.660 174.357 0.303 17919 42030 1 103 . 1 1 20 20 SER CA C 20 57.400 57.400 58.408 -1.008 17919 42031 1 103 . 1 1 20 20 SER CB C 20 63.370 63.370 62.930 0.440 17919 42032 1 103 . 1 1 20 20 SER H H 20 7.040 7.040 7.922 -0.882 17919 42033 1 103 . 1 1 21 21 ASP N N 21 123.480 123.480 124.469 -0.989 17919 42034 1 103 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.696 -0.001 17919 42035 1 103 . 1 1 21 21 ASP C C 21 176.360 176.360 175.932 0.428 17919 42036 1 103 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.694 1.006 17919 42037 1 103 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.662 -0.862 17919 42038 1 103 . 1 1 21 21 ASP H H 21 8.030 8.030 7.754 0.276 17919 42039 1 103 . 1 1 22 22 THR N N 22 108.800 108.800 113.595 -4.795 17919 42040 1 103 . 1 1 22 22 THR HA H 22 4.920 4.920 4.652 0.268 17919 42041 1 103 . 1 1 22 22 THR C C 22 176.750 176.750 175.884 0.866 17919 42042 1 103 . 1 1 22 22 THR CA C 22 59.690 59.690 61.579 -1.889 17919 42043 1 103 . 1 1 22 22 THR CB C 22 71.200 71.200 69.913 1.287 17919 42044 1 103 . 1 1 22 22 THR H H 22 7.900 7.900 8.437 -0.537 17919 42045 1 103 . 1 1 23 23 ILE N N 23 121.190 121.190 122.738 -1.548 17919 42046 1 103 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.775 -0.118 17919 42047 1 103 . 1 1 23 23 ILE C C 23 179.040 179.040 177.933 1.107 17919 42048 1 103 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.151 0.109 17919 42049 1 103 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.239 -1.889 17919 42050 1 103 . 1 1 23 23 ILE H H 23 8.560 8.560 9.177 -0.617 17919 42051 1 103 . 1 1 24 24 GLU N N 24 120.830 120.830 120.457 0.373 17919 42052 1 103 . 1 1 24 24 GLU HA H 24 3.917 3.917 4.010 -0.093 17919 42053 1 103 . 1 1 24 24 GLU C C 24 178.640 178.640 178.853 -0.213 17919 42054 1 103 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.654 0.566 17919 42055 1 103 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.311 -1.031 17919 42056 1 103 . 1 1 24 24 GLU H H 24 9.760 9.760 8.564 1.196 17919 42057 1 103 . 1 1 25 25 ASN N N 25 120.570 120.570 117.403 3.167 17919 42058 1 103 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.483 0.042 17919 42059 1 103 . 1 1 25 25 ASN C C 25 178.380 178.380 177.803 0.577 17919 42060 1 103 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.220 -0.160 17919 42061 1 103 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.470 -0.020 17919 42062 1 103 . 1 1 25 25 ASN H H 25 7.920 7.920 7.729 0.191 17919 42063 1 103 . 1 1 26 26 VAL N N 26 121.710 121.710 119.157 2.553 17919 42064 1 103 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.569 -0.172 17919 42065 1 103 . 1 1 26 26 VAL C C 26 177.950 177.950 177.602 0.348 17919 42066 1 103 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.237 1.423 17919 42067 1 103 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.263 -0.423 17919 42068 1 103 . 1 1 26 26 VAL H H 26 8.070 8.070 7.763 0.307 17919 42069 1 103 . 1 1 27 27 LYS N N 27 118.860 118.860 120.719 -1.859 17919 42070 1 103 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.141 0.439 17919 42071 1 103 . 1 1 27 27 LYS C C 27 180.550 180.550 178.624 1.926 17919 42072 1 103 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.527 -0.277 17919 42073 1 103 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.475 1.255 17919 42074 1 103 . 1 1 27 27 LYS H H 27 8.560 8.560 8.205 0.355 17919 42075 1 103 . 1 1 28 28 ALA N N 28 123.440 123.440 122.300 1.140 17919 42076 1 103 . 1 1 28 28 ALA HA H 28 4.160 4.160 3.966 0.194 17919 42077 1 103 . 1 1 28 28 ALA C C 28 180.300 180.300 179.228 1.072 17919 42078 1 103 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.327 0.043 17919 42079 1 103 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.435 -0.725 17919 42080 1 103 . 1 1 28 28 ALA H H 28 8.060 8.060 8.112 -0.052 17919 42081 1 103 . 1 1 29 29 LYS N N 29 119.940 119.940 119.732 0.208 17919 42082 1 103 . 1 1 29 29 LYS HA H 29 4.207 4.207 3.883 0.324 17919 42083 1 103 . 1 1 29 29 LYS C C 29 180.320 180.320 179.186 1.134 17919 42084 1 103 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.611 0.039 17919 42085 1 103 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.235 1.055 17919 42086 1 103 . 1 1 29 29 LYS H H 29 7.850 7.850 7.686 0.164 17919 42087 1 103 . 1 1 30 30 ILE N N 30 121.080 121.080 119.887 1.193 17919 42088 1 103 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.586 -0.079 17919 42089 1 103 . 1 1 30 30 ILE C C 30 178.310 178.310 177.765 0.545 17919 42090 1 103 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.094 1.056 17919 42091 1 103 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.500 -0.700 17919 42092 1 103 . 1 1 30 30 ILE H H 30 8.280 8.280 8.556 -0.276 17919 42093 1 103 . 1 1 31 31 GLN N N 31 123.490 123.490 120.550 2.940 17919 42094 1 103 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.036 -0.207 17919 42095 1 103 . 1 1 31 31 GLN C C 31 178.890 178.890 178.436 0.454 17919 42096 1 103 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.116 0.884 17919 42097 1 103 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.316 -0.596 17919 42098 1 103 . 1 1 31 31 GLN H H 31 8.580 8.580 8.039 0.541 17919 42099 1 103 . 1 1 32 32 ASP N N 32 119.360 119.360 118.900 0.460 17919 42100 1 103 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.456 -0.102 17919 42101 1 103 . 1 1 32 32 ASP C C 32 177.250 177.250 178.043 -0.793 17919 42102 1 103 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.686 0.504 17919 42103 1 103 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.998 -0.418 17919 42104 1 103 . 1 1 32 32 ASP H H 32 8.010 8.010 8.267 -0.257 17919 42105 1 103 . 1 1 33 33 LYS N N 33 115.130 115.130 118.967 -3.837 17919 42106 1 103 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.241 0.096 17919 42107 1 103 . 1 1 33 33 LYS C C 33 177.870 177.870 178.077 -0.207 17919 42108 1 103 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.889 0.161 17919 42109 1 103 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.342 0.828 17919 42110 1 103 . 1 1 33 33 LYS H H 33 7.430 7.430 7.707 -0.277 17919 42111 1 103 . 1 1 34 34 GLU N N 34 113.870 113.870 115.691 -1.821 17919 42112 1 103 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.484 0.141 17919 42113 1 103 . 1 1 34 34 GLU C C 34 177.840 177.840 176.862 0.978 17919 42114 1 103 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.035 -0.865 17919 42115 1 103 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.549 1.111 17919 42116 1 103 . 1 1 34 34 GLU H H 34 8.740 8.740 7.958 0.782 17919 42117 1 103 . 1 1 35 35 GLY N N 35 108.650 108.650 108.538 0.112 17919 42118 1 103 . 1 1 35 35 GLY C C 35 173.960 173.960 174.561 -0.601 17919 42119 1 103 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.558 0.522 17919 42120 1 103 . 1 1 35 35 GLY H H 35 8.530 8.530 8.071 0.459 17919 42121 1 103 . 1 1 36 36 ILE N N 36 119.880 119.880 121.454 -1.574 17919 42122 1 103 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.373 0.072 17919 42123 1 103 . 1 1 36 36 ILE C C 36 173.590 173.590 174.165 -0.575 17919 42124 1 103 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.011 -0.261 17919 42125 1 103 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.079 2.501 17919 42126 1 103 . 1 1 36 36 ILE H H 36 6.150 6.150 7.690 -1.540 17919 42127 1 103 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.594 0.040 17919 42128 1 103 . 1 1 37 37 PRO C C 37 176.940 176.940 176.131 0.809 17919 42129 1 103 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.768 -0.108 17919 42130 1 103 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.019 0.831 17919 42131 1 103 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.135 -0.018 17919 42132 1 103 . 1 1 38 38 PRO C C 38 178.320 178.320 178.411 -0.091 17919 42133 1 103 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.855 0.405 17919 42134 1 103 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.934 0.956 17919 42135 1 103 . 1 1 39 39 ASP N N 39 113.380 113.380 114.720 -1.340 17919 42136 1 103 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.330 0.100 17919 42137 1 103 . 1 1 39 39 ASP C C 39 177.090 177.090 177.351 -0.261 17919 42138 1 103 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.577 -0.937 17919 42139 1 103 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.380 -0.841 17919 42140 1 103 . 1 1 39 39 ASP H H 39 8.550 8.550 8.708 -0.158 17919 42141 1 103 . 1 1 40 40 GLN N N 40 116.780 116.780 116.257 0.523 17919 42142 1 103 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.286 0.178 17919 42143 1 103 . 1 1 40 40 GLN C C 40 175.380 175.380 176.078 -0.698 17919 42144 1 103 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.259 -0.619 17919 42145 1 103 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.473 0.667 17919 42146 1 103 . 1 1 40 40 GLN H H 40 7.820 7.820 7.818 0.002 17919 42147 1 103 . 1 1 41 41 GLN N N 41 117.720 117.720 118.766 -1.046 17919 42148 1 103 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.578 -0.334 17919 42149 1 103 . 1 1 41 41 GLN C C 41 176.300 176.300 175.342 0.958 17919 42150 1 103 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.385 1.085 17919 42151 1 103 . 1 1 41 41 GLN CB C 41 31.650 31.650 30.390 1.260 17919 42152 1 103 . 1 1 41 41 GLN H H 41 7.480 7.480 7.412 0.068 17919 42153 1 103 . 1 1 42 42 ARG N N 42 122.680 122.680 124.155 -1.475 17919 42154 1 103 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.552 -0.052 17919 42155 1 103 . 1 1 42 42 ARG C C 42 174.050 174.050 175.011 -0.961 17919 42156 1 103 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.828 0.222 17919 42157 1 103 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.560 -0.811 17919 42158 1 103 . 1 1 42 42 ARG H H 42 8.530 8.530 8.495 0.035 17919 42159 1 103 . 1 1 43 43 LEU N N 43 124.040 124.040 123.946 0.094 17919 42160 1 103 . 1 1 43 43 LEU C C 43 175.290 175.290 175.983 -0.693 17919 42161 1 103 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.502 -0.522 17919 42162 1 103 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.705 2.085 17919 42163 1 103 . 1 1 43 43 LEU H H 43 8.820 8.820 8.688 0.132 17919 42164 1 103 . 1 1 44 44 ILE N N 44 121.920 121.920 123.171 -1.251 17919 42165 1 103 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.116 -0.124 17919 42166 1 103 . 1 1 44 44 ILE C C 44 176.060 176.060 174.192 1.868 17919 42167 1 103 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.853 -1.873 17919 42168 1 103 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.861 -0.441 17919 42169 1 103 . 1 1 44 44 ILE H H 44 9.030 9.030 8.270 0.760 17919 42170 1 103 . 1 1 45 45 PHE N N 45 125.390 125.390 127.900 -2.510 17919 42171 1 103 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.034 0.011 17919 42172 1 103 . 1 1 45 45 PHE C C 45 174.470 174.470 174.591 -0.121 17919 42173 1 103 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.108 0.912 17919 42174 1 103 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.138 0.622 17919 42175 1 103 . 1 1 45 45 PHE H H 45 8.830 8.830 9.017 -0.187 17919 42176 1 103 . 1 1 46 46 ALA N N 46 132.200 132.200 129.495 2.705 17919 42177 1 103 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.623 0.067 17919 42178 1 103 . 1 1 46 46 ALA C C 46 177.290 177.290 177.728 -0.438 17919 42179 1 103 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.639 -0.099 17919 42180 1 103 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.258 0.312 17919 42181 1 103 . 1 1 46 46 ALA H H 46 8.810 8.810 8.766 0.044 17919 42182 1 103 . 1 1 47 47 GLY N N 47 102.340 102.340 104.425 -2.085 17919 42183 1 103 . 1 1 47 47 GLY C C 47 173.810 173.810 173.905 -0.095 17919 42184 1 103 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.068 0.282 17919 42185 1 103 . 1 1 47 47 GLY H H 47 8.130 8.130 8.549 -0.419 17919 42186 1 103 . 1 1 48 48 LYS N N 48 121.570 121.570 120.313 1.257 17919 42187 1 103 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.589 0.033 17919 42188 1 103 . 1 1 48 48 LYS C C 48 174.700 174.700 175.955 -1.255 17919 42189 1 103 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.637 -0.087 17919 42190 1 103 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.246 0.284 17919 42191 1 103 . 1 1 48 48 LYS H H 48 7.980 7.980 7.766 0.214 17919 42192 1 103 . 1 1 49 49 GLN N N 49 122.410 122.410 122.423 -0.013 17919 42193 1 103 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.499 0.061 17919 42194 1 103 . 1 1 49 49 GLN C C 49 175.670 175.670 176.050 -0.380 17919 42195 1 103 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.807 -1.067 17919 42196 1 103 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.366 -0.366 17919 42197 1 103 . 1 1 49 49 GLN H H 49 8.600 8.600 8.531 0.069 17919 42198 1 103 . 1 1 50 50 LEU N N 50 125.520 125.520 125.611 -0.091 17919 42199 1 103 . 1 1 50 50 LEU HA H 50 4.090 4.090 3.895 0.195 17919 42200 1 103 . 1 1 50 50 LEU C C 50 176.660 176.660 176.127 0.533 17919 42201 1 103 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.306 -0.066 17919 42202 1 103 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.645 -0.076 17919 42203 1 103 . 1 1 50 50 LEU H H 50 8.530 8.530 8.296 0.234 17919 42204 1 103 . 1 1 51 51 GLU N N 51 122.940 122.940 124.670 -1.730 17919 42205 1 103 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.524 -0.036 17919 42206 1 103 . 1 1 51 51 GLU C C 51 175.870 175.870 176.406 -0.536 17919 42207 1 103 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.304 0.656 17919 42208 1 103 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.432 0.138 17919 42209 1 103 . 1 1 51 51 GLU H H 51 8.400 8.400 7.901 0.499 17919 42210 1 103 . 1 1 52 52 ASP N N 52 120.030 120.030 124.987 -4.957 17919 42211 1 103 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.463 -0.104 17919 42212 1 103 . 1 1 52 52 ASP C C 52 177.330 177.330 177.288 0.042 17919 42213 1 103 . 1 1 52 52 ASP CA C 52 56.960 56.960 56.373 0.586 17919 42214 1 103 . 1 1 52 52 ASP CB C 52 40.850 40.850 41.227 -0.377 17919 42215 1 103 . 1 1 52 52 ASP H H 52 8.160 8.160 8.807 -0.647 17919 42216 1 103 . 1 1 53 53 GLY N N 53 106.660 106.660 105.422 1.238 17919 42217 1 103 . 1 1 53 53 GLY C C 53 174.870 174.870 174.245 0.625 17919 42218 1 103 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.990 0.180 17919 42219 1 103 . 1 1 53 53 GLY H H 53 9.390 9.390 8.578 0.812 17919 42220 1 103 . 1 1 54 54 ARG N N 54 119.050 119.050 119.765 -0.715 17919 42221 1 103 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.817 -0.122 17919 42222 1 103 . 1 1 54 54 ARG C C 54 175.350 175.350 175.038 0.312 17919 42223 1 103 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.047 0.343 17919 42224 1 103 . 1 1 54 54 ARG CB C 54 32.650 32.650 34.255 -1.605 17919 42225 1 103 . 1 1 54 54 ARG H H 54 7.460 7.460 7.652 -0.192 17919 42226 1 103 . 1 1 55 55 THR N N 55 108.400 108.400 111.393 -2.993 17919 42227 1 103 . 1 1 55 55 THR HA H 55 5.240 5.240 5.031 0.209 17919 42228 1 103 . 1 1 55 55 THR C C 55 176.560 176.560 175.924 0.636 17919 42229 1 103 . 1 1 55 55 THR CA C 55 59.690 59.690 60.401 -0.711 17919 42230 1 103 . 1 1 55 55 THR CB C 55 72.260 72.260 70.943 1.317 17919 42231 1 103 . 1 1 55 55 THR H H 55 8.730 8.730 8.915 -0.185 17919 42232 1 103 . 1 1 56 56 LEU N N 56 117.920 117.920 121.220 -3.300 17919 42233 1 103 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.091 -0.031 17919 42234 1 103 . 1 1 56 56 LEU C C 56 180.810 180.810 178.781 2.029 17919 42235 1 103 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.264 0.446 17919 42236 1 103 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.316 -0.946 17919 42237 1 103 . 1 1 56 56 LEU H H 56 8.140 8.140 8.081 0.059 17919 42238 1 103 . 1 1 57 57 SER N N 57 113.330 113.330 115.047 -1.717 17919 42239 1 103 . 1 1 57 57 SER HA H 57 4.370 4.370 4.109 0.261 17919 42240 1 103 . 1 1 57 57 SER C C 57 178.310 178.310 176.872 1.438 17919 42241 1 103 . 1 1 57 57 SER CA C 57 61.080 61.080 61.898 -0.818 17919 42242 1 103 . 1 1 57 57 SER CB C 57 62.530 62.530 62.540 -0.010 17919 42243 1 103 . 1 1 57 57 SER H H 57 8.470 8.470 7.991 0.479 17919 42244 1 103 . 1 1 58 58 ASP N N 58 124.190 124.190 121.514 2.676 17919 42245 1 103 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.293 0.003 17919 42246 1 103 . 1 1 58 58 ASP C C 58 177.400 177.400 176.833 0.567 17919 42247 1 103 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.592 0.588 17919 42248 1 103 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.468 -0.368 17919 42249 1 103 . 1 1 58 58 ASP H H 58 7.930 7.930 7.844 0.086 17919 42250 1 103 . 1 1 59 59 TYR N N 59 115.510 115.510 114.828 0.682 17919 42251 1 103 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.685 -0.015 17919 42252 1 103 . 1 1 59 59 TYR C C 59 174.700 174.700 175.199 -0.499 17919 42253 1 103 . 1 1 59 59 TYR CA C 59 58.250 58.250 56.993 1.256 17919 42254 1 103 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.337 1.733 17919 42255 1 103 . 1 1 59 59 TYR H H 59 7.250 7.250 7.218 0.032 17919 42256 1 103 . 1 1 60 60 ASN N N 60 115.900 115.900 117.047 -1.147 17919 42257 1 103 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.400 -0.045 17919 42258 1 103 . 1 1 60 60 ASN C C 60 174.340 174.340 174.718 -0.378 17919 42259 1 103 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.267 -0.147 17919 42260 1 103 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.402 0.008 17919 42261 1 103 . 1 1 60 60 ASN H H 60 8.150 8.150 7.585 0.565 17919 42262 1 103 . 1 1 61 61 ILE N N 61 118.600 118.600 120.016 -1.416 17919 42263 1 103 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.751 -0.358 17919 42264 1 103 . 1 1 61 61 ILE C C 61 174.610 174.610 174.552 0.058 17919 42265 1 103 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.611 0.809 17919 42266 1 103 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.225 -0.485 17919 42267 1 103 . 1 1 61 61 ILE H H 61 7.250 7.250 8.057 -0.807 17919 42268 1 103 . 1 1 62 62 GLN N N 62 124.740 124.740 124.811 -0.071 17919 42269 1 103 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.743 -0.237 17919 42270 1 103 . 1 1 62 62 GLN C C 62 175.970 175.970 175.653 0.317 17919 42271 1 103 . 1 1 62 62 GLN CA C 62 53.660 53.660 52.918 0.742 17919 42272 1 103 . 1 1 62 62 GLN CB C 62 31.650 31.650 32.058 -0.408 17919 42273 1 103 . 1 1 62 62 GLN H H 62 7.610 7.610 8.313 -0.703 17919 42274 1 103 . 1 1 63 63 LYS N N 63 120.300 120.300 126.724 -6.424 17919 42275 1 103 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.840 0.161 17919 42276 1 103 . 1 1 63 63 LYS C C 63 175.810 175.810 176.570 -0.760 17919 42277 1 103 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.256 -0.466 17919 42278 1 103 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.835 0.815 17919 42279 1 103 . 1 1 63 63 LYS H H 63 8.490 8.490 8.870 -0.380 17919 42280 1 103 . 1 1 64 64 GLU N N 64 113.950 113.950 120.675 -6.725 17919 42281 1 103 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.602 -0.137 17919 42282 1 103 . 1 1 64 64 GLU C C 64 175.250 175.250 175.696 -0.446 17919 42283 1 103 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.381 0.509 17919 42284 1 103 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.767 -2.866 17919 42285 1 103 . 1 1 64 64 GLU H H 64 9.280 9.280 8.932 0.348 17919 42286 1 103 . 1 1 65 65 SER N N 65 114.730 114.730 115.940 -1.210 17919 42287 1 103 . 1 1 65 65 SER HA H 65 4.640 4.640 4.478 0.162 17919 42288 1 103 . 1 1 65 65 SER C C 65 172.160 172.160 174.362 -2.202 17919 42289 1 103 . 1 1 65 65 SER CA C 65 60.890 60.890 60.288 0.602 17919 42290 1 103 . 1 1 65 65 SER CB C 65 64.910 64.910 63.770 1.139 17919 42291 1 103 . 1 1 65 65 SER H H 65 7.670 7.670 7.825 -0.155 17919 42292 1 103 . 1 1 66 66 THR N N 66 117.110 117.110 121.815 -4.705 17919 42293 1 103 . 1 1 66 66 THR HA H 66 5.270 5.270 4.814 0.456 17919 42294 1 103 . 1 1 66 66 THR C C 66 173.950 173.950 174.462 -0.512 17919 42295 1 103 . 1 1 66 66 THR CA C 66 62.340 62.340 63.312 -0.973 17919 42296 1 103 . 1 1 66 66 THR CB C 66 70.080 70.080 69.493 0.587 17919 42297 1 103 . 1 1 66 66 THR H H 66 8.730 8.730 8.700 0.030 17919 42298 1 103 . 1 1 67 67 LEU N N 67 127.110 127.110 126.674 0.436 17919 42299 1 103 . 1 1 67 67 LEU HA H 67 5.060 5.060 5.156 -0.096 17919 42300 1 103 . 1 1 67 67 LEU C C 67 175.770 175.770 175.756 0.014 17919 42301 1 103 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.641 0.259 17919 42302 1 103 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.611 -0.351 17919 42303 1 103 . 1 1 67 67 LEU H H 67 9.410 9.410 9.092 0.318 17919 42304 1 103 . 1 1 68 68 HIS N N 68 118.380 118.380 120.013 -1.633 17919 42305 1 103 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.675 -0.435 17919 42306 1 103 . 1 1 68 68 HIS C C 68 173.150 173.150 173.814 -0.664 17919 42307 1 103 . 1 1 68 68 HIS CA C 68 55.000 55.000 53.947 1.053 17919 42308 1 103 . 1 1 68 68 HIS CB C 68 30.530 30.530 33.894 -3.364 17919 42309 1 103 . 1 1 68 68 HIS H H 68 9.230 9.230 8.808 0.422 17919 42310 1 103 . 1 1 69 69 LEU N N 69 124.460 124.460 123.524 0.936 17919 42311 1 103 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.178 0.012 17919 42312 1 103 . 1 1 69 69 LEU C C 69 175.270 175.270 175.227 0.043 17919 42313 1 103 . 1 1 69 69 LEU CA C 69 53.890 53.890 52.864 1.026 17919 42314 1 103 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.454 -0.074 17919 42315 1 103 . 1 1 69 69 LEU H H 69 8.340 8.340 7.417 0.923 17919 42316 1 103 . 1 1 70 70 VAL N N 70 126.940 126.940 128.090 -1.150 17919 42317 1 103 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.242 0.108 17919 42318 1 103 . 1 1 70 70 VAL C C 70 174.000 174.000 174.916 -0.916 17919 42319 1 103 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.505 0.295 17919 42320 1 103 . 1 1 70 70 VAL CB C 70 34.910 34.910 32.206 2.704 17919 42321 1 103 . 1 1 70 70 VAL H H 70 9.200 9.200 8.539 0.661 17919 42322 1 103 . 1 1 71 71 LEU N N 71 123.130 123.130 127.700 -4.570 17919 42323 1 103 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.760 0.300 17919 42324 1 103 . 1 1 71 71 LEU C C 71 177.830 177.830 177.881 -0.051 17919 42325 1 103 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.275 0.665 17919 42326 1 103 . 1 1 71 71 LEU CB C 71 42.850 42.850 41.666 1.184 17919 42327 1 103 . 1 1 71 71 LEU H H 71 8.120 8.120 8.497 -0.377 17919 42328 1 103 . 1 1 72 72 ARG N N 72 123.490 123.490 123.959 -0.469 17919 42329 1 103 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.221 0.080 17919 42330 1 103 . 1 1 72 72 ARG C C 72 175.350 175.350 175.772 -0.422 17919 42331 1 103 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.402 -0.792 17919 42332 1 103 . 1 1 72 72 ARG CB C 72 31.350 31.350 31.106 0.244 17919 42333 1 103 . 1 1 72 72 ARG H H 72 8.580 8.580 8.134 0.446 17919 42334 1 104 . 1 1 2 2 GLN N N 2 123.220 123.220 120.566 2.654 17919 42335 1 104 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.514 -0.265 17919 42336 1 104 . 1 1 2 2 GLN C C 2 175.920 175.920 175.038 0.882 17919 42337 1 104 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.281 0.799 17919 42338 1 104 . 1 1 2 2 GLN CB C 2 30.760 30.760 31.118 -0.358 17919 42339 1 104 . 1 1 2 2 GLN H H 2 8.900 8.900 8.333 0.567 17919 42340 1 104 . 1 1 3 3 ILE N N 3 115.340 115.340 116.300 -0.960 17919 42341 1 104 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.099 0.114 17919 42342 1 104 . 1 1 3 3 ILE C C 3 172.450 172.450 173.382 -0.932 17919 42343 1 104 . 1 1 3 3 ILE CA C 3 59.570 59.570 60.335 -0.765 17919 42344 1 104 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.431 0.779 17919 42345 1 104 . 1 1 3 3 ILE H H 3 8.320 8.320 8.164 0.156 17919 42346 1 104 . 1 1 4 4 PHE N N 4 118.110 118.110 123.310 -5.200 17919 42347 1 104 . 1 1 4 4 PHE HA H 4 5.630 5.630 4.986 0.644 17919 42348 1 104 . 1 1 4 4 PHE C C 4 175.320 175.320 175.410 -0.090 17919 42349 1 104 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.938 -0.729 17919 42350 1 104 . 1 1 4 4 PHE CB C 4 41.480 41.480 40.777 0.703 17919 42351 1 104 . 1 1 4 4 PHE H H 4 8.610 8.610 8.887 -0.277 17919 42352 1 104 . 1 1 5 5 VAL N N 5 121.000 121.000 124.608 -3.608 17919 42353 1 104 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.674 0.051 17919 42354 1 104 . 1 1 5 5 VAL C C 5 174.870 174.870 175.314 -0.444 17919 42355 1 104 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.612 -0.992 17919 42356 1 104 . 1 1 5 5 VAL CB C 5 34.230 34.230 32.071 2.159 17919 42357 1 104 . 1 1 5 5 VAL H H 5 9.300 9.300 8.425 0.875 17919 42358 1 104 . 1 1 6 6 LYS N N 6 127.520 127.520 128.509 -0.989 17919 42359 1 104 . 1 1 6 6 LYS HA H 6 5.367 5.367 4.952 0.415 17919 42360 1 104 . 1 1 6 6 LYS C C 6 177.140 177.140 176.382 0.758 17919 42361 1 104 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.837 -0.317 17919 42362 1 104 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.684 0.366 17919 42363 1 104 . 1 1 6 6 LYS H H 6 8.820 8.820 9.127 -0.307 17919 42364 1 104 . 1 1 7 7 THR N N 7 115.400 115.400 115.291 0.109 17919 42365 1 104 . 1 1 7 7 THR HA H 7 4.970 4.970 4.683 0.287 17919 42366 1 104 . 1 1 7 7 THR C C 7 176.910 176.910 175.847 1.063 17919 42367 1 104 . 1 1 7 7 THR CA C 7 60.470 60.470 60.422 0.049 17919 42368 1 104 . 1 1 7 7 THR CB C 7 70.630 70.630 70.840 -0.210 17919 42369 1 104 . 1 1 7 7 THR H H 7 8.730 8.730 8.352 0.378 17919 42370 1 104 . 1 1 8 8 LEU N N 8 121.330 121.330 120.976 0.354 17919 42371 1 104 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.372 -0.062 17919 42372 1 104 . 1 1 8 8 LEU C C 8 178.800 178.800 177.424 1.376 17919 42373 1 104 . 1 1 8 8 LEU CA C 8 57.580 57.580 56.527 1.053 17919 42374 1 104 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.367 -0.397 17919 42375 1 104 . 1 1 8 8 LEU H H 8 9.100 9.100 8.248 0.852 17919 42376 1 104 . 1 1 9 9 THR N N 9 105.590 105.590 108.262 -2.672 17919 42377 1 104 . 1 1 9 9 THR HA H 9 4.428 4.428 4.410 0.018 17919 42378 1 104 . 1 1 9 9 THR C C 9 175.520 175.520 175.653 -0.133 17919 42379 1 104 . 1 1 9 9 THR CA C 9 61.400 61.400 62.019 -0.619 17919 42380 1 104 . 1 1 9 9 THR CB C 9 69.140 69.140 69.230 -0.090 17919 42381 1 104 . 1 1 9 9 THR H H 9 7.630 7.630 7.726 -0.096 17919 42382 1 104 . 1 1 10 10 GLY N N 10 108.890 108.890 109.054 -0.164 17919 42383 1 104 . 1 1 10 10 GLY C C 10 174.070 174.070 173.668 0.402 17919 42384 1 104 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.789 0.671 17919 42385 1 104 . 1 1 10 10 GLY H H 10 7.810 7.810 8.039 -0.229 17919 42386 1 104 . 1 1 11 11 LYS N N 11 121.600 121.600 119.315 2.285 17919 42387 1 104 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.804 -0.443 17919 42388 1 104 . 1 1 11 11 LYS C C 11 175.940 175.940 174.293 1.647 17919 42389 1 104 . 1 1 11 11 LYS CA C 11 56.280 56.280 54.405 1.875 17919 42390 1 104 . 1 1 11 11 LYS CB C 11 33.200 33.200 35.188 -1.988 17919 42391 1 104 . 1 1 11 11 LYS H H 11 7.280 7.280 7.990 -0.710 17919 42392 1 104 . 1 1 12 12 THR N N 12 120.440 120.440 118.761 1.679 17919 42393 1 104 . 1 1 12 12 THR HA H 12 5.046 5.046 4.839 0.207 17919 42394 1 104 . 1 1 12 12 THR C C 12 174.320 174.320 174.312 0.008 17919 42395 1 104 . 1 1 12 12 THR CA C 12 62.390 62.390 61.757 0.633 17919 42396 1 104 . 1 1 12 12 THR CB C 12 69.910 69.910 69.683 0.227 17919 42397 1 104 . 1 1 12 12 THR H H 12 8.650 8.650 8.446 0.204 17919 42398 1 104 . 1 1 13 13 ILE N N 13 127.110 127.110 128.932 -1.822 17919 42399 1 104 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.577 -0.033 17919 42400 1 104 . 1 1 13 13 ILE C C 13 175.220 175.220 175.047 0.173 17919 42401 1 104 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.645 -0.665 17919 42402 1 104 . 1 1 13 13 ILE CB C 13 40.950 40.950 39.286 1.664 17919 42403 1 104 . 1 1 13 13 ILE H H 13 9.450 9.450 8.800 0.650 17919 42404 1 104 . 1 1 14 14 THR N N 14 121.520 121.520 123.573 -2.053 17919 42405 1 104 . 1 1 14 14 THR HA H 14 4.964 4.964 4.558 0.406 17919 42406 1 104 . 1 1 14 14 THR C C 14 173.790 173.790 174.097 -0.307 17919 42407 1 104 . 1 1 14 14 THR CA C 14 61.940 61.940 62.168 -0.228 17919 42408 1 104 . 1 1 14 14 THR CB C 14 69.650 69.650 69.583 0.067 17919 42409 1 104 . 1 1 14 14 THR H H 14 8.710 8.710 8.222 0.488 17919 42410 1 104 . 1 1 15 15 LEU N N 15 124.800 124.800 128.030 -3.230 17919 42411 1 104 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.719 0.061 17919 42412 1 104 . 1 1 15 15 LEU C C 15 174.670 174.670 175.281 -0.611 17919 42413 1 104 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.805 -0.975 17919 42414 1 104 . 1 1 15 15 LEU CB C 15 47.070 47.070 44.459 2.611 17919 42415 1 104 . 1 1 15 15 LEU H H 15 8.710 8.710 8.125 0.585 17919 42416 1 104 . 1 1 16 16 GLU N N 16 122.160 122.160 123.915 -1.755 17919 42417 1 104 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.127 -0.210 17919 42418 1 104 . 1 1 16 16 GLU C C 16 175.860 175.860 175.615 0.245 17919 42419 1 104 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.474 -0.654 17919 42420 1 104 . 1 1 16 16 GLU CB C 16 29.450 29.450 31.123 -1.673 17919 42421 1 104 . 1 1 16 16 GLU H H 16 8.140 8.140 8.628 -0.488 17919 42422 1 104 . 1 1 17 17 VAL N N 17 117.210 117.210 119.465 -2.255 17919 42423 1 104 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.615 0.099 17919 42424 1 104 . 1 1 17 17 VAL C C 17 174.160 174.160 174.185 -0.025 17919 42425 1 104 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.634 -0.204 17919 42426 1 104 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.239 1.161 17919 42427 1 104 . 1 1 17 17 VAL H H 17 8.900 8.900 8.938 -0.038 17919 42428 1 104 . 1 1 18 18 GLU N N 18 118.990 118.990 119.680 -0.690 17919 42429 1 104 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.815 0.264 17919 42430 1 104 . 1 1 18 18 GLU C C 18 176.160 176.160 175.456 0.704 17919 42431 1 104 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.816 -0.096 17919 42432 1 104 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.475 -0.165 17919 42433 1 104 . 1 1 18 18 GLU H H 18 8.640 8.640 8.326 0.314 17919 42434 1 104 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.193 -0.052 17919 42435 1 104 . 1 1 19 19 PRO C C 19 175.310 175.310 177.894 -2.584 17919 42436 1 104 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.656 -0.186 17919 42437 1 104 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.964 -0.014 17919 42438 1 104 . 1 1 20 20 SER N N 20 103.400 103.400 108.531 -5.131 17919 42439 1 104 . 1 1 20 20 SER HA H 20 4.370 4.370 4.280 0.090 17919 42440 1 104 . 1 1 20 20 SER C C 20 174.660 174.660 174.779 -0.119 17919 42441 1 104 . 1 1 20 20 SER CA C 20 57.400 57.400 58.989 -1.589 17919 42442 1 104 . 1 1 20 20 SER CB C 20 63.370 63.370 63.188 0.182 17919 42443 1 104 . 1 1 20 20 SER H H 20 7.040 7.040 7.850 -0.810 17919 42444 1 104 . 1 1 21 21 ASP N N 21 123.480 123.480 124.705 -1.225 17919 42445 1 104 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.694 0.001 17919 42446 1 104 . 1 1 21 21 ASP C C 21 176.360 176.360 175.662 0.698 17919 42447 1 104 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.286 0.414 17919 42448 1 104 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.903 -1.103 17919 42449 1 104 . 1 1 21 21 ASP H H 21 8.030 8.030 7.697 0.333 17919 42450 1 104 . 1 1 22 22 THR N N 22 108.800 108.800 111.255 -2.455 17919 42451 1 104 . 1 1 22 22 THR HA H 22 4.920 4.920 4.886 0.034 17919 42452 1 104 . 1 1 22 22 THR C C 22 176.750 176.750 175.785 0.965 17919 42453 1 104 . 1 1 22 22 THR CA C 22 59.690 59.690 60.216 -0.526 17919 42454 1 104 . 1 1 22 22 THR CB C 22 71.200 71.200 71.337 -0.137 17919 42455 1 104 . 1 1 22 22 THR H H 22 7.900 7.900 8.089 -0.189 17919 42456 1 104 . 1 1 23 23 ILE N N 23 121.190 121.190 123.693 -2.503 17919 42457 1 104 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.778 -0.121 17919 42458 1 104 . 1 1 23 23 ILE C C 23 179.040 179.040 177.387 1.653 17919 42459 1 104 . 1 1 23 23 ILE CA C 23 62.260 62.260 61.426 0.834 17919 42460 1 104 . 1 1 23 23 ILE CB C 23 34.350 34.350 35.985 -1.635 17919 42461 1 104 . 1 1 23 23 ILE H H 23 8.560 8.560 8.950 -0.390 17919 42462 1 104 . 1 1 24 24 GLU N N 24 120.830 120.830 121.781 -0.951 17919 42463 1 104 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.965 -0.048 17919 42464 1 104 . 1 1 24 24 GLU C C 24 178.640 178.640 178.940 -0.300 17919 42465 1 104 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.096 0.124 17919 42466 1 104 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.360 -1.080 17919 42467 1 104 . 1 1 24 24 GLU H H 24 9.760 9.760 8.686 1.074 17919 42468 1 104 . 1 1 25 25 ASN N N 25 120.570 120.570 117.275 3.295 17919 42469 1 104 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.519 0.006 17919 42470 1 104 . 1 1 25 25 ASN C C 25 178.380 178.380 177.548 0.832 17919 42471 1 104 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.788 0.272 17919 42472 1 104 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.890 -0.440 17919 42473 1 104 . 1 1 25 25 ASN H H 25 7.920 7.920 7.770 0.150 17919 42474 1 104 . 1 1 26 26 VAL N N 26 121.710 121.710 119.708 2.002 17919 42475 1 104 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.959 -0.562 17919 42476 1 104 . 1 1 26 26 VAL C C 26 177.950 177.950 177.178 0.772 17919 42477 1 104 . 1 1 26 26 VAL CA C 26 67.660 67.660 62.771 4.889 17919 42478 1 104 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.945 -1.105 17919 42479 1 104 . 1 1 26 26 VAL H H 26 8.070 8.070 7.777 0.293 17919 42480 1 104 . 1 1 27 27 LYS N N 27 118.860 118.860 121.591 -2.731 17919 42481 1 104 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.180 0.400 17919 42482 1 104 . 1 1 27 27 LYS C C 27 180.550 180.550 178.731 1.819 17919 42483 1 104 . 1 1 27 27 LYS CA C 27 59.250 59.250 60.067 -0.817 17919 42484 1 104 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.230 1.500 17919 42485 1 104 . 1 1 27 27 LYS H H 27 8.560 8.560 8.531 0.029 17919 42486 1 104 . 1 1 28 28 ALA N N 28 123.440 123.440 120.025 3.415 17919 42487 1 104 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.151 0.009 17919 42488 1 104 . 1 1 28 28 ALA C C 28 180.300 180.300 179.001 1.299 17919 42489 1 104 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.565 0.805 17919 42490 1 104 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.334 -0.624 17919 42491 1 104 . 1 1 28 28 ALA H H 28 8.060 8.060 7.831 0.229 17919 42492 1 104 . 1 1 29 29 LYS N N 29 119.940 119.940 119.716 0.224 17919 42493 1 104 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.068 0.139 17919 42494 1 104 . 1 1 29 29 LYS C C 29 180.320 180.320 178.861 1.459 17919 42495 1 104 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.244 0.406 17919 42496 1 104 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.352 0.938 17919 42497 1 104 . 1 1 29 29 LYS H H 29 7.850 7.850 7.188 0.662 17919 42498 1 104 . 1 1 30 30 ILE N N 30 121.080 121.080 120.410 0.670 17919 42499 1 104 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.567 -0.060 17919 42500 1 104 . 1 1 30 30 ILE C C 30 178.310 178.310 177.544 0.766 17919 42501 1 104 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.547 0.603 17919 42502 1 104 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.584 -0.784 17919 42503 1 104 . 1 1 30 30 ILE H H 30 8.280 8.280 7.644 0.636 17919 42504 1 104 . 1 1 31 31 GLN N N 31 123.490 123.490 119.942 3.548 17919 42505 1 104 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.050 -0.221 17919 42506 1 104 . 1 1 31 31 GLN C C 31 178.890 178.890 178.330 0.560 17919 42507 1 104 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.060 0.940 17919 42508 1 104 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.696 -0.976 17919 42509 1 104 . 1 1 31 31 GLN H H 31 8.580 8.580 8.266 0.314 17919 42510 1 104 . 1 1 32 32 ASP N N 32 119.360 119.360 119.110 0.250 17919 42511 1 104 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.439 -0.085 17919 42512 1 104 . 1 1 32 32 ASP C C 32 177.250 177.250 177.877 -0.627 17919 42513 1 104 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.612 0.577 17919 42514 1 104 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.530 0.050 17919 42515 1 104 . 1 1 32 32 ASP H H 32 8.010 8.010 8.015 -0.005 17919 42516 1 104 . 1 1 33 33 LYS N N 33 115.130 115.130 118.808 -3.678 17919 42517 1 104 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.274 0.063 17919 42518 1 104 . 1 1 33 33 LYS C C 33 177.870 177.870 177.918 -0.048 17919 42519 1 104 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.076 -0.026 17919 42520 1 104 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.482 0.688 17919 42521 1 104 . 1 1 33 33 LYS H H 33 7.430 7.430 7.441 -0.011 17919 42522 1 104 . 1 1 34 34 GLU N N 34 113.870 113.870 116.954 -3.084 17919 42523 1 104 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.366 0.259 17919 42524 1 104 . 1 1 34 34 GLU C C 34 177.840 177.840 177.215 0.625 17919 42525 1 104 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.687 -0.517 17919 42526 1 104 . 1 1 34 34 GLU CB C 34 32.660 32.660 30.584 2.075 17919 42527 1 104 . 1 1 34 34 GLU H H 34 8.740 8.740 8.210 0.530 17919 42528 1 104 . 1 1 35 35 GLY N N 35 108.650 108.650 107.888 0.762 17919 42529 1 104 . 1 1 35 35 GLY C C 35 173.960 173.960 174.962 -1.002 17919 42530 1 104 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.961 0.119 17919 42531 1 104 . 1 1 35 35 GLY H H 35 8.530 8.530 7.853 0.677 17919 42532 1 104 . 1 1 36 36 ILE N N 36 119.880 119.880 122.640 -2.760 17919 42533 1 104 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.253 0.192 17919 42534 1 104 . 1 1 36 36 ILE C C 36 173.590 173.590 174.173 -0.583 17919 42535 1 104 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.269 -0.519 17919 42536 1 104 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.078 2.502 17919 42537 1 104 . 1 1 36 36 ILE H H 36 6.150 6.150 7.770 -1.620 17919 42538 1 104 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.753 -0.119 17919 42539 1 104 . 1 1 37 37 PRO C C 37 176.940 176.940 175.850 1.090 17919 42540 1 104 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.496 0.164 17919 42541 1 104 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.335 0.514 17919 42542 1 104 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.240 -0.123 17919 42543 1 104 . 1 1 38 38 PRO C C 38 178.320 178.320 177.015 1.305 17919 42544 1 104 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.094 1.166 17919 42545 1 104 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.845 1.045 17919 42546 1 104 . 1 1 39 39 ASP N N 39 113.380 113.380 114.139 -0.759 17919 42547 1 104 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.456 -0.026 17919 42548 1 104 . 1 1 39 39 ASP C C 39 177.090 177.090 176.925 0.165 17919 42549 1 104 . 1 1 39 39 ASP CA C 39 55.640 55.640 55.549 0.091 17919 42550 1 104 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.046 -0.506 17919 42551 1 104 . 1 1 39 39 ASP H H 39 8.550 8.550 8.742 -0.192 17919 42552 1 104 . 1 1 40 40 GLN N N 40 116.780 116.780 117.806 -1.026 17919 42553 1 104 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.406 0.058 17919 42554 1 104 . 1 1 40 40 GLN C C 40 175.380 175.380 175.693 -0.313 17919 42555 1 104 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.715 -0.075 17919 42556 1 104 . 1 1 40 40 GLN CB C 40 30.140 30.140 30.351 -0.211 17919 42557 1 104 . 1 1 40 40 GLN H H 40 7.820 7.820 7.557 0.263 17919 42558 1 104 . 1 1 41 41 GLN N N 41 117.720 117.720 120.637 -2.917 17919 42559 1 104 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.089 0.155 17919 42560 1 104 . 1 1 41 41 GLN C C 41 176.300 176.300 176.061 0.239 17919 42561 1 104 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.800 -0.330 17919 42562 1 104 . 1 1 41 41 GLN CB C 41 31.650 31.650 28.742 2.908 17919 42563 1 104 . 1 1 41 41 GLN H H 41 7.480 7.480 7.653 -0.173 17919 42564 1 104 . 1 1 42 42 ARG N N 42 122.680 122.680 127.130 -4.450 17919 42565 1 104 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.464 0.036 17919 42566 1 104 . 1 1 42 42 ARG C C 42 174.050 174.050 174.788 -0.738 17919 42567 1 104 . 1 1 42 42 ARG CA C 42 55.050 55.050 53.965 1.085 17919 42568 1 104 . 1 1 42 42 ARG CB C 42 31.750 31.750 29.120 2.630 17919 42569 1 104 . 1 1 42 42 ARG H H 42 8.530 8.530 8.269 0.261 17919 42570 1 104 . 1 1 43 43 LEU N N 43 124.040 124.040 125.810 -1.770 17919 42571 1 104 . 1 1 43 43 LEU C C 43 175.290 175.290 175.430 -0.140 17919 42572 1 104 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.971 -1.991 17919 42573 1 104 . 1 1 43 43 LEU CB C 43 45.790 45.790 41.851 3.939 17919 42574 1 104 . 1 1 43 43 LEU H H 43 8.820 8.820 7.637 1.183 17919 42575 1 104 . 1 1 44 44 ILE N N 44 121.920 121.920 120.792 1.128 17919 42576 1 104 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.839 0.153 17919 42577 1 104 . 1 1 44 44 ILE C C 44 176.060 176.060 173.634 2.426 17919 42578 1 104 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.227 -0.247 17919 42579 1 104 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.433 -0.013 17919 42580 1 104 . 1 1 44 44 ILE H H 44 9.030 9.030 8.040 0.990 17919 42581 1 104 . 1 1 45 45 PHE N N 45 125.390 125.390 123.439 1.951 17919 42582 1 104 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.953 0.092 17919 42583 1 104 . 1 1 45 45 PHE C C 45 174.470 174.470 174.256 0.214 17919 42584 1 104 . 1 1 45 45 PHE CA C 45 57.020 57.020 57.911 -0.891 17919 42585 1 104 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.006 0.754 17919 42586 1 104 . 1 1 45 45 PHE H H 45 8.830 8.830 8.314 0.516 17919 42587 1 104 . 1 1 46 46 ALA N N 46 132.200 132.200 129.553 2.647 17919 42588 1 104 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.595 0.095 17919 42589 1 104 . 1 1 46 46 ALA C C 46 177.290 177.290 177.768 -0.478 17919 42590 1 104 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.240 0.300 17919 42591 1 104 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.301 0.269 17919 42592 1 104 . 1 1 46 46 ALA H H 46 8.810 8.810 8.706 0.104 17919 42593 1 104 . 1 1 47 47 GLY N N 47 102.340 102.340 103.896 -1.556 17919 42594 1 104 . 1 1 47 47 GLY C C 47 173.810 173.810 173.999 -0.189 17919 42595 1 104 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.229 0.121 17919 42596 1 104 . 1 1 47 47 GLY H H 47 8.130 8.130 8.525 -0.395 17919 42597 1 104 . 1 1 48 48 LYS N N 48 121.570 121.570 119.831 1.739 17919 42598 1 104 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.540 0.082 17919 42599 1 104 . 1 1 48 48 LYS C C 48 174.700 174.700 175.651 -0.951 17919 42600 1 104 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.591 -0.041 17919 42601 1 104 . 1 1 48 48 LYS CB C 48 34.530 34.530 35.062 -0.532 17919 42602 1 104 . 1 1 48 48 LYS H H 48 7.980 7.980 7.745 0.235 17919 42603 1 104 . 1 1 49 49 GLN N N 49 122.410 122.410 122.101 0.309 17919 42604 1 104 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.071 0.489 17919 42605 1 104 . 1 1 49 49 GLN C C 49 175.670 175.670 175.907 -0.237 17919 42606 1 104 . 1 1 49 49 GLN CA C 49 55.740 55.740 57.235 -1.495 17919 42607 1 104 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.034 -0.034 17919 42608 1 104 . 1 1 49 49 GLN H H 49 8.600 8.600 8.578 0.022 17919 42609 1 104 . 1 1 50 50 LEU N N 50 125.520 125.520 124.823 0.697 17919 42610 1 104 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.631 -0.541 17919 42611 1 104 . 1 1 50 50 LEU C C 50 176.660 176.660 176.506 0.154 17919 42612 1 104 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.470 0.770 17919 42613 1 104 . 1 1 50 50 LEU CB C 50 41.570 41.570 43.863 -2.293 17919 42614 1 104 . 1 1 50 50 LEU H H 50 8.530 8.530 8.204 0.326 17919 42615 1 104 . 1 1 51 51 GLU N N 51 122.940 122.940 119.093 3.847 17919 42616 1 104 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.593 -0.105 17919 42617 1 104 . 1 1 51 51 GLU C C 51 175.870 175.870 175.689 0.181 17919 42618 1 104 . 1 1 51 51 GLU CA C 51 55.960 55.960 56.483 -0.523 17919 42619 1 104 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.844 -0.274 17919 42620 1 104 . 1 1 51 51 GLU H H 51 8.400 8.400 8.410 -0.010 17919 42621 1 104 . 1 1 52 52 ASP N N 52 120.030 120.030 117.001 3.029 17919 42622 1 104 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.758 -0.399 17919 42623 1 104 . 1 1 52 52 ASP C C 52 177.330 177.330 178.305 -0.975 17919 42624 1 104 . 1 1 52 52 ASP CA C 52 56.960 56.960 55.475 1.485 17919 42625 1 104 . 1 1 52 52 ASP CB C 52 40.850 40.850 42.590 -1.740 17919 42626 1 104 . 1 1 52 52 ASP H H 52 8.160 8.160 8.469 -0.309 17919 42627 1 104 . 1 1 53 53 GLY N N 53 106.660 106.660 108.555 -1.895 17919 42628 1 104 . 1 1 53 53 GLY C C 53 174.870 174.870 174.181 0.689 17919 42629 1 104 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.762 -0.592 17919 42630 1 104 . 1 1 53 53 GLY H H 53 9.390 9.390 8.421 0.969 17919 42631 1 104 . 1 1 54 54 ARG N N 54 119.050 119.050 121.396 -2.346 17919 42632 1 104 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.326 0.369 17919 42633 1 104 . 1 1 54 54 ARG C C 54 175.350 175.350 175.216 0.134 17919 42634 1 104 . 1 1 54 54 ARG CA C 54 54.390 54.390 55.159 -0.769 17919 42635 1 104 . 1 1 54 54 ARG CB C 54 32.650 32.650 31.498 1.152 17919 42636 1 104 . 1 1 54 54 ARG H H 54 7.460 7.460 7.713 -0.253 17919 42637 1 104 . 1 1 55 55 THR N N 55 108.400 108.400 115.710 -7.310 17919 42638 1 104 . 1 1 55 55 THR HA H 55 5.240 5.240 5.036 0.204 17919 42639 1 104 . 1 1 55 55 THR C C 55 176.560 176.560 176.127 0.433 17919 42640 1 104 . 1 1 55 55 THR CA C 55 59.690 59.690 60.215 -0.525 17919 42641 1 104 . 1 1 55 55 THR CB C 55 72.260 72.260 70.970 1.290 17919 42642 1 104 . 1 1 55 55 THR H H 55 8.730 8.730 8.230 0.500 17919 42643 1 104 . 1 1 56 56 LEU N N 56 117.920 117.920 122.237 -4.317 17919 42644 1 104 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.839 0.221 17919 42645 1 104 . 1 1 56 56 LEU C C 56 180.810 180.810 178.820 1.990 17919 42646 1 104 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.639 0.071 17919 42647 1 104 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.041 -0.671 17919 42648 1 104 . 1 1 56 56 LEU H H 56 8.140 8.140 8.349 -0.209 17919 42649 1 104 . 1 1 57 57 SER N N 57 113.330 113.330 112.360 0.970 17919 42650 1 104 . 1 1 57 57 SER HA H 57 4.370 4.370 4.192 0.178 17919 42651 1 104 . 1 1 57 57 SER C C 57 178.310 178.310 176.846 1.464 17919 42652 1 104 . 1 1 57 57 SER CA C 57 61.080 61.080 60.944 0.136 17919 42653 1 104 . 1 1 57 57 SER CB C 57 62.530 62.530 62.601 -0.071 17919 42654 1 104 . 1 1 57 57 SER H H 57 8.470 8.470 7.884 0.586 17919 42655 1 104 . 1 1 58 58 ASP N N 58 124.190 124.190 123.427 0.763 17919 42656 1 104 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.419 -0.123 17919 42657 1 104 . 1 1 58 58 ASP C C 58 177.400 177.400 177.720 -0.320 17919 42658 1 104 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.271 0.909 17919 42659 1 104 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.583 -0.483 17919 42660 1 104 . 1 1 58 58 ASP H H 58 7.930 7.930 7.513 0.417 17919 42661 1 104 . 1 1 59 59 TYR N N 59 115.510 115.510 115.827 -0.317 17919 42662 1 104 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.415 0.255 17919 42663 1 104 . 1 1 59 59 TYR C C 59 174.700 174.700 175.371 -0.671 17919 42664 1 104 . 1 1 59 59 TYR CA C 59 58.250 58.250 58.995 -0.745 17919 42665 1 104 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.158 1.912 17919 42666 1 104 . 1 1 59 59 TYR H H 59 7.250 7.250 7.397 -0.147 17919 42667 1 104 . 1 1 60 60 ASN N N 60 115.900 115.900 115.661 0.239 17919 42668 1 104 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.374 -0.019 17919 42669 1 104 . 1 1 60 60 ASN C C 60 174.340 174.340 174.085 0.255 17919 42670 1 104 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.145 -0.025 17919 42671 1 104 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.560 -0.150 17919 42672 1 104 . 1 1 60 60 ASN H H 60 8.150 8.150 7.660 0.490 17919 42673 1 104 . 1 1 61 61 ILE N N 61 118.600 118.600 120.640 -2.040 17919 42674 1 104 . 1 1 61 61 ILE HA H 61 3.393 3.393 4.135 -0.742 17919 42675 1 104 . 1 1 61 61 ILE C C 61 174.610 174.610 174.604 0.006 17919 42676 1 104 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.462 0.958 17919 42677 1 104 . 1 1 61 61 ILE CB C 61 36.740 36.740 38.001 -1.261 17919 42678 1 104 . 1 1 61 61 ILE H H 61 7.250 7.250 7.858 -0.608 17919 42679 1 104 . 1 1 62 62 GLN N N 62 124.740 124.740 126.842 -2.102 17919 42680 1 104 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.723 -0.217 17919 42681 1 104 . 1 1 62 62 GLN C C 62 175.970 175.970 175.524 0.446 17919 42682 1 104 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.876 -0.216 17919 42683 1 104 . 1 1 62 62 GLN CB C 62 31.650 31.650 30.906 0.744 17919 42684 1 104 . 1 1 62 62 GLN H H 62 7.610 7.610 7.924 -0.314 17919 42685 1 104 . 1 1 63 63 LYS N N 63 120.300 120.300 120.155 0.145 17919 42686 1 104 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.148 -0.147 17919 42687 1 104 . 1 1 63 63 LYS C C 63 175.810 175.810 176.616 -0.806 17919 42688 1 104 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.321 0.469 17919 42689 1 104 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.677 0.973 17919 42690 1 104 . 1 1 63 63 LYS H H 63 8.490 8.490 8.451 0.039 17919 42691 1 104 . 1 1 64 64 GLU N N 64 113.950 113.950 120.378 -6.428 17919 42692 1 104 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.681 -0.216 17919 42693 1 104 . 1 1 64 64 GLU C C 64 175.250 175.250 175.953 -0.703 17919 42694 1 104 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.306 0.584 17919 42695 1 104 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.604 -2.704 17919 42696 1 104 . 1 1 64 64 GLU H H 64 9.280 9.280 9.002 0.278 17919 42697 1 104 . 1 1 65 65 SER N N 65 114.730 114.730 114.609 0.121 17919 42698 1 104 . 1 1 65 65 SER HA H 65 4.640 4.640 4.701 -0.061 17919 42699 1 104 . 1 1 65 65 SER C C 65 172.160 172.160 174.272 -2.112 17919 42700 1 104 . 1 1 65 65 SER CA C 65 60.890 60.890 59.518 1.372 17919 42701 1 104 . 1 1 65 65 SER CB C 65 64.910 64.910 64.448 0.462 17919 42702 1 104 . 1 1 65 65 SER H H 65 7.670 7.670 7.437 0.233 17919 42703 1 104 . 1 1 66 66 THR N N 66 117.110 117.110 120.826 -3.716 17919 42704 1 104 . 1 1 66 66 THR HA H 66 5.270 5.270 5.351 -0.081 17919 42705 1 104 . 1 1 66 66 THR C C 66 173.950 173.950 174.323 -0.373 17919 42706 1 104 . 1 1 66 66 THR CA C 66 62.340 62.340 61.886 0.454 17919 42707 1 104 . 1 1 66 66 THR CB C 66 70.080 70.080 70.017 0.063 17919 42708 1 104 . 1 1 66 66 THR H H 66 8.730 8.730 8.498 0.232 17919 42709 1 104 . 1 1 67 67 LEU N N 67 127.110 127.110 126.806 0.304 17919 42710 1 104 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.857 0.203 17919 42711 1 104 . 1 1 67 67 LEU C C 67 175.770 175.770 174.997 0.773 17919 42712 1 104 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.178 -0.278 17919 42713 1 104 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.534 0.726 17919 42714 1 104 . 1 1 67 67 LEU H H 67 9.410 9.410 9.041 0.369 17919 42715 1 104 . 1 1 68 68 HIS N N 68 118.380 118.380 121.217 -2.837 17919 42716 1 104 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.201 0.039 17919 42717 1 104 . 1 1 68 68 HIS C C 68 173.150 173.150 173.747 -0.597 17919 42718 1 104 . 1 1 68 68 HIS CA C 68 55.000 55.000 53.911 1.089 17919 42719 1 104 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.798 -2.268 17919 42720 1 104 . 1 1 68 68 HIS H H 68 9.230 9.230 8.952 0.278 17919 42721 1 104 . 1 1 69 69 LEU N N 69 124.460 124.460 130.570 -6.110 17919 42722 1 104 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.268 0.922 17919 42723 1 104 . 1 1 69 69 LEU C C 69 175.270 175.270 174.207 1.063 17919 42724 1 104 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.233 -0.343 17919 42725 1 104 . 1 1 69 69 LEU CB C 69 44.380 44.380 42.312 2.068 17919 42726 1 104 . 1 1 69 69 LEU H H 69 8.340 8.340 8.248 0.092 17919 42727 1 104 . 1 1 70 70 VAL N N 70 126.940 126.940 126.968 -0.028 17919 42728 1 104 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.106 0.244 17919 42729 1 104 . 1 1 70 70 VAL C C 70 174.000 174.000 174.768 -0.768 17919 42730 1 104 . 1 1 70 70 VAL CA C 70 60.800 60.800 62.063 -1.263 17919 42731 1 104 . 1 1 70 70 VAL CB C 70 34.910 34.910 32.878 2.032 17919 42732 1 104 . 1 1 70 70 VAL H H 70 9.200 9.200 8.211 0.989 17919 42733 1 104 . 1 1 71 71 LEU N N 71 123.130 123.130 121.072 2.058 17919 42734 1 104 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.625 0.435 17919 42735 1 104 . 1 1 71 71 LEU C C 71 177.830 177.830 176.334 1.496 17919 42736 1 104 . 1 1 71 71 LEU CA C 71 53.940 53.940 52.946 0.994 17919 42737 1 104 . 1 1 71 71 LEU CB C 71 42.850 42.850 45.498 -2.648 17919 42738 1 104 . 1 1 71 71 LEU H H 71 8.120 8.120 8.046 0.074 17919 42739 1 104 . 1 1 72 72 ARG N N 72 123.490 123.490 121.579 1.911 17919 42740 1 104 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.243 0.058 17919 42741 1 104 . 1 1 72 72 ARG C C 72 175.350 175.350 175.119 0.231 17919 42742 1 104 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.784 -1.174 17919 42743 1 104 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.532 0.819 17919 42744 1 104 . 1 1 72 72 ARG H H 72 8.580 8.580 8.478 0.102 17919 42745 1 105 . 1 1 2 2 GLN N N 2 123.220 123.220 121.560 1.660 17919 42746 1 105 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.231 0.018 17919 42747 1 105 . 1 1 2 2 GLN C C 2 175.920 175.920 174.339 1.581 17919 42748 1 105 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.327 0.753 17919 42749 1 105 . 1 1 2 2 GLN CB C 2 30.760 30.760 31.768 -1.008 17919 42750 1 105 . 1 1 2 2 GLN H H 2 8.900 8.900 8.414 0.486 17919 42751 1 105 . 1 1 3 3 ILE N N 3 115.340 115.340 119.351 -4.011 17919 42752 1 105 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.321 -0.108 17919 42753 1 105 . 1 1 3 3 ILE C C 3 172.450 172.450 173.186 -0.736 17919 42754 1 105 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.083 0.487 17919 42755 1 105 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.521 0.689 17919 42756 1 105 . 1 1 3 3 ILE H H 3 8.320 8.320 8.265 0.055 17919 42757 1 105 . 1 1 4 4 PHE N N 4 118.110 118.110 121.327 -3.217 17919 42758 1 105 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.250 0.380 17919 42759 1 105 . 1 1 4 4 PHE C C 4 175.320 175.320 175.176 0.144 17919 42760 1 105 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.345 -0.135 17919 42761 1 105 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.656 -0.176 17919 42762 1 105 . 1 1 4 4 PHE H H 4 8.610 8.610 8.217 0.393 17919 42763 1 105 . 1 1 5 5 VAL N N 5 121.000 121.000 121.350 -0.350 17919 42764 1 105 . 1 1 5 5 VAL HA H 5 4.725 4.725 5.185 -0.460 17919 42765 1 105 . 1 1 5 5 VAL C C 5 174.870 174.870 174.775 0.095 17919 42766 1 105 . 1 1 5 5 VAL CA C 5 60.620 60.620 60.956 -0.336 17919 42767 1 105 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.182 0.048 17919 42768 1 105 . 1 1 5 5 VAL H H 5 9.300 9.300 9.223 0.077 17919 42769 1 105 . 1 1 6 6 LYS N N 6 127.520 127.520 128.177 -0.657 17919 42770 1 105 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.168 0.199 17919 42771 1 105 . 1 1 6 6 LYS C C 6 177.140 177.140 175.853 1.287 17919 42772 1 105 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.388 0.132 17919 42773 1 105 . 1 1 6 6 LYS CB C 6 35.050 35.050 36.184 -1.133 17919 42774 1 105 . 1 1 6 6 LYS H H 6 8.820 8.820 9.004 -0.184 17919 42775 1 105 . 1 1 7 7 THR N N 7 115.400 115.400 115.558 -0.158 17919 42776 1 105 . 1 1 7 7 THR HA H 7 4.970 4.970 4.617 0.353 17919 42777 1 105 . 1 1 7 7 THR C C 7 176.910 176.910 177.366 -0.456 17919 42778 1 105 . 1 1 7 7 THR CA C 7 60.470 60.470 60.889 -0.419 17919 42779 1 105 . 1 1 7 7 THR CB C 7 70.630 70.630 70.514 0.115 17919 42780 1 105 . 1 1 7 7 THR H H 7 8.730 8.730 7.957 0.773 17919 42781 1 105 . 1 1 8 8 LEU N N 8 121.330 121.330 119.824 1.506 17919 42782 1 105 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.099 0.211 17919 42783 1 105 . 1 1 8 8 LEU C C 8 178.800 178.800 177.495 1.305 17919 42784 1 105 . 1 1 8 8 LEU CA C 8 57.580 57.580 58.060 -0.480 17919 42785 1 105 . 1 1 8 8 LEU CB C 8 41.970 41.970 40.969 1.001 17919 42786 1 105 . 1 1 8 8 LEU H H 8 9.100 9.100 8.972 0.128 17919 42787 1 105 . 1 1 9 9 THR N N 9 105.590 105.590 107.486 -1.896 17919 42788 1 105 . 1 1 9 9 THR HA H 9 4.428 4.428 4.213 0.215 17919 42789 1 105 . 1 1 9 9 THR C C 9 175.520 175.520 175.780 -0.260 17919 42790 1 105 . 1 1 9 9 THR CA C 9 61.400 61.400 62.212 -0.812 17919 42791 1 105 . 1 1 9 9 THR CB C 9 69.140 69.140 68.972 0.168 17919 42792 1 105 . 1 1 9 9 THR H H 9 7.630 7.630 7.682 -0.052 17919 42793 1 105 . 1 1 10 10 GLY N N 10 108.890 108.890 110.660 -1.770 17919 42794 1 105 . 1 1 10 10 GLY C C 10 174.070 174.070 174.396 -0.326 17919 42795 1 105 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.778 0.682 17919 42796 1 105 . 1 1 10 10 GLY H H 10 7.810 7.810 7.895 -0.085 17919 42797 1 105 . 1 1 11 11 LYS N N 11 121.600 121.600 121.483 0.117 17919 42798 1 105 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.066 0.295 17919 42799 1 105 . 1 1 11 11 LYS C C 11 175.940 175.940 175.941 -0.001 17919 42800 1 105 . 1 1 11 11 LYS CA C 11 56.280 56.280 57.731 -1.451 17919 42801 1 105 . 1 1 11 11 LYS CB C 11 33.200 33.200 32.626 0.574 17919 42802 1 105 . 1 1 11 11 LYS H H 11 7.280 7.280 7.643 -0.363 17919 42803 1 105 . 1 1 12 12 THR N N 12 120.440 120.440 116.785 3.655 17919 42804 1 105 . 1 1 12 12 THR HA H 12 5.046 5.046 4.920 0.126 17919 42805 1 105 . 1 1 12 12 THR C C 12 174.320 174.320 174.168 0.152 17919 42806 1 105 . 1 1 12 12 THR CA C 12 62.390 62.390 61.882 0.508 17919 42807 1 105 . 1 1 12 12 THR CB C 12 69.910 69.910 70.008 -0.098 17919 42808 1 105 . 1 1 12 12 THR H H 12 8.650 8.650 8.226 0.424 17919 42809 1 105 . 1 1 13 13 ILE N N 13 127.110 127.110 128.425 -1.315 17919 42810 1 105 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.482 0.062 17919 42811 1 105 . 1 1 13 13 ILE C C 13 175.220 175.220 175.087 0.133 17919 42812 1 105 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.468 -0.488 17919 42813 1 105 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.199 0.751 17919 42814 1 105 . 1 1 13 13 ILE H H 13 9.450 9.450 9.107 0.343 17919 42815 1 105 . 1 1 14 14 THR N N 14 121.520 121.520 123.664 -2.144 17919 42816 1 105 . 1 1 14 14 THR HA H 14 4.964 4.964 4.977 -0.013 17919 42817 1 105 . 1 1 14 14 THR C C 14 173.790 173.790 173.992 -0.202 17919 42818 1 105 . 1 1 14 14 THR CA C 14 61.940 61.940 62.405 -0.465 17919 42819 1 105 . 1 1 14 14 THR CB C 14 69.650 69.650 69.907 -0.257 17919 42820 1 105 . 1 1 14 14 THR H H 14 8.710 8.710 8.532 0.178 17919 42821 1 105 . 1 1 15 15 LEU N N 15 124.800 124.800 127.673 -2.873 17919 42822 1 105 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.722 0.058 17919 42823 1 105 . 1 1 15 15 LEU C C 15 174.670 174.670 176.016 -1.346 17919 42824 1 105 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.641 -0.811 17919 42825 1 105 . 1 1 15 15 LEU CB C 15 47.070 47.070 44.971 2.099 17919 42826 1 105 . 1 1 15 15 LEU H H 15 8.710 8.710 8.588 0.122 17919 42827 1 105 . 1 1 16 16 GLU N N 16 122.160 122.160 123.497 -1.337 17919 42828 1 105 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.001 -0.084 17919 42829 1 105 . 1 1 16 16 GLU C C 16 175.860 175.860 175.979 -0.119 17919 42830 1 105 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.474 -0.654 17919 42831 1 105 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.739 -1.289 17919 42832 1 105 . 1 1 16 16 GLU H H 16 8.140 8.140 8.556 -0.416 17919 42833 1 105 . 1 1 17 17 VAL N N 17 117.210 117.210 118.919 -1.709 17919 42834 1 105 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.517 0.197 17919 42835 1 105 . 1 1 17 17 VAL C C 17 174.160 174.160 174.567 -0.407 17919 42836 1 105 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.954 -0.524 17919 42837 1 105 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.094 1.306 17919 42838 1 105 . 1 1 17 17 VAL H H 17 8.900 8.900 8.975 -0.075 17919 42839 1 105 . 1 1 18 18 GLU N N 18 118.990 118.990 121.301 -2.311 17919 42840 1 105 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.941 0.139 17919 42841 1 105 . 1 1 18 18 GLU C C 18 176.160 176.160 175.510 0.650 17919 42842 1 105 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.748 -0.028 17919 42843 1 105 . 1 1 18 18 GLU CB C 18 30.310 30.310 32.109 -1.799 17919 42844 1 105 . 1 1 18 18 GLU H H 18 8.640 8.640 8.062 0.578 17919 42845 1 105 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.316 -0.175 17919 42846 1 105 . 1 1 19 19 PRO C C 19 175.310 175.310 177.875 -2.565 17919 42847 1 105 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.051 0.419 17919 42848 1 105 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.734 0.216 17919 42849 1 105 . 1 1 20 20 SER N N 20 103.400 103.400 113.558 -10.158 17919 42850 1 105 . 1 1 20 20 SER HA H 20 4.370 4.370 4.264 0.106 17919 42851 1 105 . 1 1 20 20 SER C C 20 174.660 174.660 174.731 -0.071 17919 42852 1 105 . 1 1 20 20 SER CA C 20 57.400 57.400 59.755 -2.355 17919 42853 1 105 . 1 1 20 20 SER CB C 20 63.370 63.370 62.691 0.679 17919 42854 1 105 . 1 1 20 20 SER H H 20 7.040 7.040 8.365 -1.325 17919 42855 1 105 . 1 1 21 21 ASP N N 21 123.480 123.480 122.272 1.208 17919 42856 1 105 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.550 0.145 17919 42857 1 105 . 1 1 21 21 ASP C C 21 176.360 176.360 175.586 0.774 17919 42858 1 105 . 1 1 21 21 ASP CA C 21 55.700 55.700 56.129 -0.429 17919 42859 1 105 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.863 -1.063 17919 42860 1 105 . 1 1 21 21 ASP H H 21 8.030 8.030 7.699 0.331 17919 42861 1 105 . 1 1 22 22 THR N N 22 108.800 108.800 113.816 -5.016 17919 42862 1 105 . 1 1 22 22 THR HA H 22 4.920 4.920 4.742 0.178 17919 42863 1 105 . 1 1 22 22 THR C C 22 176.750 176.750 176.127 0.623 17919 42864 1 105 . 1 1 22 22 THR CA C 22 59.690 59.690 60.854 -1.164 17919 42865 1 105 . 1 1 22 22 THR CB C 22 71.200 71.200 70.722 0.478 17919 42866 1 105 . 1 1 22 22 THR H H 22 7.900 7.900 8.075 -0.175 17919 42867 1 105 . 1 1 23 23 ILE N N 23 121.190 121.190 122.928 -1.738 17919 42868 1 105 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.766 -0.109 17919 42869 1 105 . 1 1 23 23 ILE C C 23 179.040 179.040 177.756 1.284 17919 42870 1 105 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.671 -0.411 17919 42871 1 105 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.168 -1.818 17919 42872 1 105 . 1 1 23 23 ILE H H 23 8.560 8.560 9.119 -0.559 17919 42873 1 105 . 1 1 24 24 GLU N N 24 120.830 120.830 121.587 -0.757 17919 42874 1 105 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.879 0.038 17919 42875 1 105 . 1 1 24 24 GLU C C 24 178.640 178.640 178.799 -0.159 17919 42876 1 105 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.220 -0.000 17919 42877 1 105 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.434 -1.154 17919 42878 1 105 . 1 1 24 24 GLU H H 24 9.760 9.760 8.642 1.118 17919 42879 1 105 . 1 1 25 25 ASN N N 25 120.570 120.570 118.124 2.446 17919 42880 1 105 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.432 0.093 17919 42881 1 105 . 1 1 25 25 ASN C C 25 178.380 178.380 178.203 0.177 17919 42882 1 105 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.761 0.299 17919 42883 1 105 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.645 -0.195 17919 42884 1 105 . 1 1 25 25 ASN H H 25 7.920 7.920 7.962 -0.042 17919 42885 1 105 . 1 1 26 26 VAL N N 26 121.710 121.710 121.725 -0.015 17919 42886 1 105 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.637 -0.240 17919 42887 1 105 . 1 1 26 26 VAL C C 26 177.950 177.950 177.076 0.874 17919 42888 1 105 . 1 1 26 26 VAL CA C 26 67.660 67.660 65.949 1.711 17919 42889 1 105 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.950 -1.110 17919 42890 1 105 . 1 1 26 26 VAL H H 26 8.070 8.070 8.193 -0.123 17919 42891 1 105 . 1 1 27 27 LYS N N 27 118.860 118.860 119.824 -0.964 17919 42892 1 105 . 1 1 27 27 LYS HA H 27 4.580 4.580 3.977 0.603 17919 42893 1 105 . 1 1 27 27 LYS C C 27 180.550 180.550 178.885 1.665 17919 42894 1 105 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.928 -0.678 17919 42895 1 105 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.278 1.452 17919 42896 1 105 . 1 1 27 27 LYS H H 27 8.560 8.560 8.399 0.161 17919 42897 1 105 . 1 1 28 28 ALA N N 28 123.440 123.440 120.429 3.011 17919 42898 1 105 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.014 0.146 17919 42899 1 105 . 1 1 28 28 ALA C C 28 180.300 180.300 179.091 1.209 17919 42900 1 105 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.211 0.159 17919 42901 1 105 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.391 -0.681 17919 42902 1 105 . 1 1 28 28 ALA H H 28 8.060 8.060 8.158 -0.098 17919 42903 1 105 . 1 1 29 29 LYS N N 29 119.940 119.940 119.718 0.222 17919 42904 1 105 . 1 1 29 29 LYS HA H 29 4.207 4.207 3.911 0.296 17919 42905 1 105 . 1 1 29 29 LYS C C 29 180.320 180.320 179.112 1.208 17919 42906 1 105 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.227 0.423 17919 42907 1 105 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.025 1.265 17919 42908 1 105 . 1 1 29 29 LYS H H 29 7.850 7.850 7.351 0.499 17919 42909 1 105 . 1 1 30 30 ILE N N 30 121.080 121.080 119.998 1.082 17919 42910 1 105 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.577 -0.070 17919 42911 1 105 . 1 1 30 30 ILE C C 30 178.310 178.310 177.569 0.741 17919 42912 1 105 . 1 1 30 30 ILE CA C 30 66.150 66.150 64.938 1.212 17919 42913 1 105 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.544 -0.744 17919 42914 1 105 . 1 1 30 30 ILE H H 30 8.280 8.280 7.574 0.706 17919 42915 1 105 . 1 1 31 31 GLN N N 31 123.490 123.490 120.372 3.118 17919 42916 1 105 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.005 -0.176 17919 42917 1 105 . 1 1 31 31 GLN C C 31 178.890 178.890 178.487 0.403 17919 42918 1 105 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.207 0.793 17919 42919 1 105 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.414 -0.694 17919 42920 1 105 . 1 1 31 31 GLN H H 31 8.580 8.580 8.267 0.313 17919 42921 1 105 . 1 1 32 32 ASP N N 32 119.360 119.360 118.013 1.347 17919 42922 1 105 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.435 -0.081 17919 42923 1 105 . 1 1 32 32 ASP C C 32 177.250 177.250 177.483 -0.233 17919 42924 1 105 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.426 0.764 17919 42925 1 105 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.709 -0.129 17919 42926 1 105 . 1 1 32 32 ASP H H 32 8.010 8.010 7.826 0.184 17919 42927 1 105 . 1 1 33 33 LYS N N 33 115.130 115.130 116.846 -1.716 17919 42928 1 105 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.553 -0.216 17919 42929 1 105 . 1 1 33 33 LYS C C 33 177.870 177.870 177.396 0.474 17919 42930 1 105 . 1 1 33 33 LYS CA C 33 58.050 58.050 56.733 1.317 17919 42931 1 105 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.734 0.436 17919 42932 1 105 . 1 1 33 33 LYS H H 33 7.430 7.430 7.798 -0.368 17919 42933 1 105 . 1 1 34 34 GLU N N 34 113.870 113.870 115.012 -1.142 17919 42934 1 105 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.493 0.132 17919 42935 1 105 . 1 1 34 34 GLU C C 34 177.840 177.840 177.053 0.787 17919 42936 1 105 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.033 -0.863 17919 42937 1 105 . 1 1 34 34 GLU CB C 34 32.660 32.660 32.509 0.151 17919 42938 1 105 . 1 1 34 34 GLU H H 34 8.740 8.740 7.953 0.787 17919 42939 1 105 . 1 1 35 35 GLY N N 35 108.650 108.650 110.495 -1.845 17919 42940 1 105 . 1 1 35 35 GLY C C 35 173.960 173.960 174.478 -0.518 17919 42941 1 105 . 1 1 35 35 GLY CA C 35 46.080 46.080 46.244 -0.164 17919 42942 1 105 . 1 1 35 35 GLY H H 35 8.530 8.530 8.330 0.200 17919 42943 1 105 . 1 1 36 36 ILE N N 36 119.880 119.880 116.708 3.172 17919 42944 1 105 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.487 -0.042 17919 42945 1 105 . 1 1 36 36 ILE C C 36 173.590 173.590 174.110 -0.520 17919 42946 1 105 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.642 0.108 17919 42947 1 105 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.172 2.408 17919 42948 1 105 . 1 1 36 36 ILE H H 36 6.150 6.150 7.514 -1.364 17919 42949 1 105 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.563 0.071 17919 42950 1 105 . 1 1 37 37 PRO C C 37 176.940 176.940 176.020 0.920 17919 42951 1 105 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.984 -0.324 17919 42952 1 105 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.163 0.687 17919 42953 1 105 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.315 -0.198 17919 42954 1 105 . 1 1 38 38 PRO C C 38 178.320 178.320 176.844 1.476 17919 42955 1 105 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.245 1.015 17919 42956 1 105 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.794 1.097 17919 42957 1 105 . 1 1 39 39 ASP N N 39 113.380 113.380 114.496 -1.116 17919 42958 1 105 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.632 -0.202 17919 42959 1 105 . 1 1 39 39 ASP C C 39 177.090 177.090 176.432 0.658 17919 42960 1 105 . 1 1 39 39 ASP CA C 39 55.640 55.640 54.417 1.223 17919 42961 1 105 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.714 -1.174 17919 42962 1 105 . 1 1 39 39 ASP H H 39 8.550 8.550 8.477 0.073 17919 42963 1 105 . 1 1 40 40 GLN N N 40 116.780 116.780 118.737 -1.957 17919 42964 1 105 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.225 0.239 17919 42965 1 105 . 1 1 40 40 GLN C C 40 175.380 175.380 176.716 -1.336 17919 42966 1 105 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.614 -0.974 17919 42967 1 105 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.297 0.843 17919 42968 1 105 . 1 1 40 40 GLN H H 40 7.820 7.820 7.699 0.121 17919 42969 1 105 . 1 1 41 41 GLN N N 41 117.720 117.720 119.236 -1.516 17919 42970 1 105 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.230 0.014 17919 42971 1 105 . 1 1 41 41 GLN C C 41 176.300 176.300 175.558 0.742 17919 42972 1 105 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.342 0.128 17919 42973 1 105 . 1 1 41 41 GLN CB C 41 31.650 31.650 28.646 3.004 17919 42974 1 105 . 1 1 41 41 GLN H H 41 7.480 7.480 7.454 0.026 17919 42975 1 105 . 1 1 42 42 ARG N N 42 122.680 122.680 125.998 -3.318 17919 42976 1 105 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.531 -0.031 17919 42977 1 105 . 1 1 42 42 ARG C C 42 174.050 174.050 174.296 -0.246 17919 42978 1 105 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.969 0.081 17919 42979 1 105 . 1 1 42 42 ARG CB C 42 31.750 31.750 31.296 0.454 17919 42980 1 105 . 1 1 42 42 ARG H H 42 8.530 8.530 8.091 0.439 17919 42981 1 105 . 1 1 43 43 LEU N N 43 124.040 124.040 127.627 -3.587 17919 42982 1 105 . 1 1 43 43 LEU C C 43 175.290 175.290 175.222 0.068 17919 42983 1 105 . 1 1 43 43 LEU CA C 43 52.980 52.980 52.433 0.547 17919 42984 1 105 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.153 1.637 17919 42985 1 105 . 1 1 43 43 LEU H H 43 8.820 8.820 8.735 0.085 17919 42986 1 105 . 1 1 44 44 ILE N N 44 121.920 121.920 127.901 -5.981 17919 42987 1 105 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.203 -0.211 17919 42988 1 105 . 1 1 44 44 ILE C C 44 176.060 176.060 174.268 1.792 17919 42989 1 105 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.940 -0.960 17919 42990 1 105 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.868 -0.448 17919 42991 1 105 . 1 1 44 44 ILE H H 44 9.030 9.030 8.085 0.945 17919 42992 1 105 . 1 1 45 45 PHE N N 45 125.390 125.390 126.319 -0.929 17919 42993 1 105 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.978 0.067 17919 42994 1 105 . 1 1 45 45 PHE C C 45 174.470 174.470 174.217 0.253 17919 42995 1 105 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.755 0.265 17919 42996 1 105 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.459 1.301 17919 42997 1 105 . 1 1 45 45 PHE H H 45 8.830 8.830 8.835 -0.005 17919 42998 1 105 . 1 1 46 46 ALA N N 46 132.200 132.200 129.923 2.277 17919 42999 1 105 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.680 0.010 17919 43000 1 105 . 1 1 46 46 ALA C C 46 177.290 177.290 177.822 -0.532 17919 43001 1 105 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.416 0.124 17919 43002 1 105 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.851 -0.281 17919 43003 1 105 . 1 1 46 46 ALA H H 46 8.810 8.810 8.686 0.124 17919 43004 1 105 . 1 1 47 47 GLY N N 47 102.340 102.340 103.273 -0.933 17919 43005 1 105 . 1 1 47 47 GLY C C 47 173.810 173.810 174.032 -0.222 17919 43006 1 105 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.895 0.455 17919 43007 1 105 . 1 1 47 47 GLY H H 47 8.130 8.130 8.486 -0.356 17919 43008 1 105 . 1 1 48 48 LYS N N 48 121.570 121.570 121.690 -0.120 17919 43009 1 105 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.584 0.038 17919 43010 1 105 . 1 1 48 48 LYS C C 48 174.700 174.700 175.098 -0.398 17919 43011 1 105 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.019 -0.469 17919 43012 1 105 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.109 0.421 17919 43013 1 105 . 1 1 48 48 LYS H H 48 7.980 7.980 7.474 0.506 17919 43014 1 105 . 1 1 49 49 GLN N N 49 122.410 122.410 123.488 -1.078 17919 43015 1 105 . 1 1 49 49 GLN HA H 49 4.560 4.560 5.057 -0.497 17919 43016 1 105 . 1 1 49 49 GLN C C 49 175.670 175.670 175.557 0.113 17919 43017 1 105 . 1 1 49 49 GLN CA C 49 55.740 55.740 54.798 0.942 17919 43018 1 105 . 1 1 49 49 GLN CB C 49 29.000 29.000 30.202 -1.202 17919 43019 1 105 . 1 1 49 49 GLN H H 49 8.600 8.600 8.516 0.084 17919 43020 1 105 . 1 1 50 50 LEU N N 50 125.520 125.520 127.286 -1.766 17919 43021 1 105 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.124 -0.034 17919 43022 1 105 . 1 1 50 50 LEU C C 50 176.660 176.660 176.193 0.467 17919 43023 1 105 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.312 -0.072 17919 43024 1 105 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.881 -0.311 17919 43025 1 105 . 1 1 50 50 LEU H H 50 8.530 8.530 8.372 0.158 17919 43026 1 105 . 1 1 51 51 GLU N N 51 122.940 122.940 125.843 -2.903 17919 43027 1 105 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.416 0.072 17919 43028 1 105 . 1 1 51 51 GLU C C 51 175.870 175.870 176.941 -1.071 17919 43029 1 105 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.876 0.084 17919 43030 1 105 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.772 -0.202 17919 43031 1 105 . 1 1 51 51 GLU H H 51 8.400 8.400 8.307 0.093 17919 43032 1 105 . 1 1 52 52 ASP N N 52 120.030 120.030 125.909 -5.879 17919 43033 1 105 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.433 -0.074 17919 43034 1 105 . 1 1 52 52 ASP C C 52 177.330 177.330 177.759 -0.429 17919 43035 1 105 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.602 -0.642 17919 43036 1 105 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.541 0.309 17919 43037 1 105 . 1 1 52 52 ASP H H 52 8.160 8.160 8.694 -0.534 17919 43038 1 105 . 1 1 53 53 GLY N N 53 106.660 106.660 105.640 1.020 17919 43039 1 105 . 1 1 53 53 GLY C C 53 174.870 174.870 174.450 0.420 17919 43040 1 105 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.193 -0.023 17919 43041 1 105 . 1 1 53 53 GLY H H 53 9.390 9.390 8.538 0.852 17919 43042 1 105 . 1 1 54 54 ARG N N 54 119.050 119.050 120.312 -1.262 17919 43043 1 105 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.713 -0.018 17919 43044 1 105 . 1 1 54 54 ARG C C 54 175.350 175.350 175.113 0.237 17919 43045 1 105 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.115 0.275 17919 43046 1 105 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.907 -0.257 17919 43047 1 105 . 1 1 54 54 ARG H H 54 7.460 7.460 7.527 -0.067 17919 43048 1 105 . 1 1 55 55 THR N N 55 108.400 108.400 112.951 -4.551 17919 43049 1 105 . 1 1 55 55 THR HA H 55 5.240 5.240 4.998 0.242 17919 43050 1 105 . 1 1 55 55 THR C C 55 176.560 176.560 176.823 -0.263 17919 43051 1 105 . 1 1 55 55 THR CA C 55 59.690 59.690 59.911 -0.221 17919 43052 1 105 . 1 1 55 55 THR CB C 55 72.260 72.260 70.381 1.879 17919 43053 1 105 . 1 1 55 55 THR H H 55 8.730 8.730 8.857 -0.127 17919 43054 1 105 . 1 1 56 56 LEU N N 56 117.920 117.920 122.703 -4.783 17919 43055 1 105 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.735 0.325 17919 43056 1 105 . 1 1 56 56 LEU C C 56 180.810 180.810 178.746 2.064 17919 43057 1 105 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.891 -0.181 17919 43058 1 105 . 1 1 56 56 LEU CB C 56 40.370 40.370 40.915 -0.545 17919 43059 1 105 . 1 1 56 56 LEU H H 56 8.140 8.140 8.129 0.011 17919 43060 1 105 . 1 1 57 57 SER N N 57 113.330 113.330 113.401 -0.071 17919 43061 1 105 . 1 1 57 57 SER HA H 57 4.370 4.370 4.145 0.225 17919 43062 1 105 . 1 1 57 57 SER C C 57 178.310 178.310 176.713 1.597 17919 43063 1 105 . 1 1 57 57 SER CA C 57 61.080 61.080 61.804 -0.724 17919 43064 1 105 . 1 1 57 57 SER CB C 57 62.530 62.530 62.761 -0.231 17919 43065 1 105 . 1 1 57 57 SER H H 57 8.470 8.470 8.167 0.303 17919 43066 1 105 . 1 1 58 58 ASP N N 58 124.190 124.190 120.937 3.253 17919 43067 1 105 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.298 -0.002 17919 43068 1 105 . 1 1 58 58 ASP C C 58 177.400 177.400 176.843 0.557 17919 43069 1 105 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.349 0.831 17919 43070 1 105 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.269 -0.169 17919 43071 1 105 . 1 1 58 58 ASP H H 58 7.930 7.930 7.732 0.198 17919 43072 1 105 . 1 1 59 59 TYR N N 59 115.510 115.510 115.199 0.311 17919 43073 1 105 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.693 -0.023 17919 43074 1 105 . 1 1 59 59 TYR C C 59 174.700 174.700 175.036 -0.336 17919 43075 1 105 . 1 1 59 59 TYR CA C 59 58.250 58.250 56.127 2.123 17919 43076 1 105 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.877 1.193 17919 43077 1 105 . 1 1 59 59 TYR H H 59 7.250 7.250 7.252 -0.002 17919 43078 1 105 . 1 1 60 60 ASN N N 60 115.900 115.900 116.792 -0.892 17919 43079 1 105 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.413 -0.058 17919 43080 1 105 . 1 1 60 60 ASN C C 60 174.340 174.340 173.900 0.440 17919 43081 1 105 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.442 -0.322 17919 43082 1 105 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.906 -0.496 17919 43083 1 105 . 1 1 60 60 ASN H H 60 8.150 8.150 7.772 0.378 17919 43084 1 105 . 1 1 61 61 ILE N N 61 118.600 118.600 120.141 -1.541 17919 43085 1 105 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.729 -0.336 17919 43086 1 105 . 1 1 61 61 ILE C C 61 174.610 174.610 175.117 -0.507 17919 43087 1 105 . 1 1 61 61 ILE CA C 61 62.420 62.420 60.432 1.988 17919 43088 1 105 . 1 1 61 61 ILE CB C 61 36.740 36.740 35.514 1.226 17919 43089 1 105 . 1 1 61 61 ILE H H 61 7.250 7.250 7.891 -0.641 17919 43090 1 105 . 1 1 62 62 GLN N N 62 124.740 124.740 126.154 -1.414 17919 43091 1 105 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.683 -0.177 17919 43092 1 105 . 1 1 62 62 GLN C C 62 175.970 175.970 175.288 0.682 17919 43093 1 105 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.660 0.000 17919 43094 1 105 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.263 0.387 17919 43095 1 105 . 1 1 62 62 GLN H H 62 7.610 7.610 7.835 -0.225 17919 43096 1 105 . 1 1 63 63 LYS N N 63 120.300 120.300 119.266 1.034 17919 43097 1 105 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.962 0.039 17919 43098 1 105 . 1 1 63 63 LYS C C 63 175.810 175.810 177.235 -1.425 17919 43099 1 105 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.777 0.013 17919 43100 1 105 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.277 0.373 17919 43101 1 105 . 1 1 63 63 LYS H H 63 8.490 8.490 8.392 0.098 17919 43102 1 105 . 1 1 64 64 GLU N N 64 113.950 113.950 119.338 -5.388 17919 43103 1 105 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.445 0.020 17919 43104 1 105 . 1 1 64 64 GLU C C 64 175.250 175.250 175.722 -0.472 17919 43105 1 105 . 1 1 64 64 GLU CA C 64 57.890 57.890 58.205 -0.315 17919 43106 1 105 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.071 -2.171 17919 43107 1 105 . 1 1 64 64 GLU H H 64 9.280 9.280 8.555 0.725 17919 43108 1 105 . 1 1 65 65 SER N N 65 114.730 114.730 114.363 0.367 17919 43109 1 105 . 1 1 65 65 SER HA H 65 4.640 4.640 4.497 0.143 17919 43110 1 105 . 1 1 65 65 SER C C 65 172.160 172.160 174.320 -2.160 17919 43111 1 105 . 1 1 65 65 SER CA C 65 60.890 60.890 60.215 0.675 17919 43112 1 105 . 1 1 65 65 SER CB C 65 64.910 64.910 64.052 0.859 17919 43113 1 105 . 1 1 65 65 SER H H 65 7.670 7.670 7.809 -0.139 17919 43114 1 105 . 1 1 66 66 THR N N 66 117.110 117.110 120.189 -3.079 17919 43115 1 105 . 1 1 66 66 THR HA H 66 5.270 5.270 5.177 0.093 17919 43116 1 105 . 1 1 66 66 THR C C 66 173.950 173.950 174.590 -0.640 17919 43117 1 105 . 1 1 66 66 THR CA C 66 62.340 62.340 62.354 -0.014 17919 43118 1 105 . 1 1 66 66 THR CB C 66 70.080 70.080 70.063 0.017 17919 43119 1 105 . 1 1 66 66 THR H H 66 8.730 8.730 8.495 0.235 17919 43120 1 105 . 1 1 67 67 LEU N N 67 127.110 127.110 129.899 -2.789 17919 43121 1 105 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.798 0.262 17919 43122 1 105 . 1 1 67 67 LEU C C 67 175.770 175.770 175.965 -0.195 17919 43123 1 105 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.214 -0.314 17919 43124 1 105 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.120 1.140 17919 43125 1 105 . 1 1 67 67 LEU H H 67 9.410 9.410 9.263 0.147 17919 43126 1 105 . 1 1 68 68 HIS N N 68 118.380 118.380 124.012 -5.632 17919 43127 1 105 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.273 -0.033 17919 43128 1 105 . 1 1 68 68 HIS C C 68 173.150 173.150 174.160 -1.010 17919 43129 1 105 . 1 1 68 68 HIS CA C 68 55.000 55.000 55.584 -0.584 17919 43130 1 105 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.539 -2.009 17919 43131 1 105 . 1 1 68 68 HIS H H 68 9.230 9.230 9.283 -0.053 17919 43132 1 105 . 1 1 69 69 LEU N N 69 124.460 124.460 119.236 5.224 17919 43133 1 105 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.867 0.323 17919 43134 1 105 . 1 1 69 69 LEU C C 69 175.270 175.270 173.852 1.418 17919 43135 1 105 . 1 1 69 69 LEU CA C 69 53.890 53.890 55.091 -1.201 17919 43136 1 105 . 1 1 69 69 LEU CB C 69 44.380 44.380 45.729 -1.349 17919 43137 1 105 . 1 1 69 69 LEU H H 69 8.340 8.340 6.738 1.602 17919 43138 1 105 . 1 1 70 70 VAL N N 70 126.940 126.940 124.765 2.175 17919 43139 1 105 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.392 -0.042 17919 43140 1 105 . 1 1 70 70 VAL C C 70 174.000 174.000 174.466 -0.466 17919 43141 1 105 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.668 0.132 17919 43142 1 105 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.103 -0.193 17919 43143 1 105 . 1 1 70 70 VAL H H 70 9.200 9.200 8.370 0.830 17919 43144 1 105 . 1 1 71 71 LEU N N 71 123.130 123.130 126.592 -3.462 17919 43145 1 105 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.302 0.758 17919 43146 1 105 . 1 1 71 71 LEU C C 71 177.830 177.830 176.458 1.372 17919 43147 1 105 . 1 1 71 71 LEU CA C 71 53.940 53.940 55.238 -1.298 17919 43148 1 105 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.893 -0.043 17919 43149 1 105 . 1 1 71 71 LEU H H 71 8.120 8.120 8.570 -0.450 17919 43150 1 105 . 1 1 72 72 ARG N N 72 123.490 123.490 122.838 0.652 17919 43151 1 105 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.666 -0.365 17919 43152 1 105 . 1 1 72 72 ARG C C 72 175.350 175.350 174.652 0.698 17919 43153 1 105 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.021 0.589 17919 43154 1 105 . 1 1 72 72 ARG CB C 72 31.350 31.350 31.777 -0.427 17919 43155 1 105 . 1 1 72 72 ARG H H 72 8.580 8.580 8.065 0.515 17919 43156 1 106 . 1 1 2 2 GLN N N 2 123.220 123.220 121.632 1.588 17919 43157 1 106 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.162 0.087 17919 43158 1 106 . 1 1 2 2 GLN C C 2 175.920 175.920 175.261 0.659 17919 43159 1 106 . 1 1 2 2 GLN CA C 2 55.080 55.080 55.144 -0.064 17919 43160 1 106 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.559 0.201 17919 43161 1 106 . 1 1 2 2 GLN H H 2 8.900 8.900 8.424 0.476 17919 43162 1 106 . 1 1 3 3 ILE N N 3 115.340 115.340 118.396 -3.056 17919 43163 1 106 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.059 0.154 17919 43164 1 106 . 1 1 3 3 ILE C C 3 172.450 172.450 173.639 -1.189 17919 43165 1 106 . 1 1 3 3 ILE CA C 3 59.570 59.570 58.903 0.667 17919 43166 1 106 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.011 1.199 17919 43167 1 106 . 1 1 3 3 ILE H H 3 8.320 8.320 7.633 0.687 17919 43168 1 106 . 1 1 4 4 PHE N N 4 118.110 118.110 118.954 -0.844 17919 43169 1 106 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.249 0.381 17919 43170 1 106 . 1 1 4 4 PHE C C 4 175.320 175.320 175.400 -0.080 17919 43171 1 106 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.438 -0.228 17919 43172 1 106 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.942 -0.462 17919 43173 1 106 . 1 1 4 4 PHE H H 4 8.610 8.610 8.230 0.380 17919 43174 1 106 . 1 1 5 5 VAL N N 5 121.000 121.000 121.052 -0.052 17919 43175 1 106 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.772 -0.047 17919 43176 1 106 . 1 1 5 5 VAL C C 5 174.870 174.870 174.733 0.137 17919 43177 1 106 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.145 -0.526 17919 43178 1 106 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.547 -0.317 17919 43179 1 106 . 1 1 5 5 VAL H H 5 9.300 9.300 8.973 0.327 17919 43180 1 106 . 1 1 6 6 LYS N N 6 127.520 127.520 129.785 -2.265 17919 43181 1 106 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.070 0.297 17919 43182 1 106 . 1 1 6 6 LYS C C 6 177.140 177.140 176.420 0.720 17919 43183 1 106 . 1 1 6 6 LYS CA C 6 54.520 54.520 55.126 -0.606 17919 43184 1 106 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.791 0.259 17919 43185 1 106 . 1 1 6 6 LYS H H 6 8.820 8.820 9.281 -0.461 17919 43186 1 106 . 1 1 7 7 THR N N 7 115.400 115.400 118.089 -2.689 17919 43187 1 106 . 1 1 7 7 THR HA H 7 4.970 4.970 4.871 0.099 17919 43188 1 106 . 1 1 7 7 THR C C 7 176.910 176.910 176.174 0.736 17919 43189 1 106 . 1 1 7 7 THR CA C 7 60.470 60.470 60.824 -0.354 17919 43190 1 106 . 1 1 7 7 THR CB C 7 70.630 70.630 70.393 0.237 17919 43191 1 106 . 1 1 7 7 THR H H 7 8.730 8.730 8.827 -0.097 17919 43192 1 106 . 1 1 8 8 LEU N N 8 121.330 121.330 124.146 -2.816 17919 43193 1 106 . 1 1 8 8 LEU HA H 8 4.310 4.310 3.905 0.405 17919 43194 1 106 . 1 1 8 8 LEU C C 8 178.800 178.800 177.805 0.995 17919 43195 1 106 . 1 1 8 8 LEU CA C 8 57.580 57.580 58.292 -0.712 17919 43196 1 106 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.909 0.061 17919 43197 1 106 . 1 1 8 8 LEU H H 8 9.100 9.100 8.376 0.724 17919 43198 1 106 . 1 1 9 9 THR N N 9 105.590 105.590 109.650 -4.060 17919 43199 1 106 . 1 1 9 9 THR HA H 9 4.428 4.428 4.186 0.242 17919 43200 1 106 . 1 1 9 9 THR C C 9 175.520 175.520 175.182 0.338 17919 43201 1 106 . 1 1 9 9 THR CA C 9 61.400 61.400 63.946 -2.546 17919 43202 1 106 . 1 1 9 9 THR CB C 9 69.140 69.140 68.759 0.381 17919 43203 1 106 . 1 1 9 9 THR H H 9 7.630 7.630 7.894 -0.264 17919 43204 1 106 . 1 1 10 10 GLY N N 10 108.890 108.890 108.412 0.478 17919 43205 1 106 . 1 1 10 10 GLY C C 10 174.070 174.070 173.038 1.032 17919 43206 1 106 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.878 0.582 17919 43207 1 106 . 1 1 10 10 GLY H H 10 7.810 7.810 7.651 0.159 17919 43208 1 106 . 1 1 11 11 LYS N N 11 121.600 121.600 121.892 -0.292 17919 43209 1 106 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.717 -0.356 17919 43210 1 106 . 1 1 11 11 LYS C C 11 175.940 175.940 174.755 1.185 17919 43211 1 106 . 1 1 11 11 LYS CA C 11 56.280 56.280 54.692 1.588 17919 43212 1 106 . 1 1 11 11 LYS CB C 11 33.200 33.200 34.681 -1.481 17919 43213 1 106 . 1 1 11 11 LYS H H 11 7.280 7.280 7.768 -0.488 17919 43214 1 106 . 1 1 12 12 THR N N 12 120.440 120.440 118.430 2.010 17919 43215 1 106 . 1 1 12 12 THR HA H 12 5.046 5.046 5.089 -0.043 17919 43216 1 106 . 1 1 12 12 THR C C 12 174.320 174.320 173.539 0.781 17919 43217 1 106 . 1 1 12 12 THR CA C 12 62.390 62.390 60.688 1.702 17919 43218 1 106 . 1 1 12 12 THR CB C 12 69.910 69.910 70.766 -0.856 17919 43219 1 106 . 1 1 12 12 THR H H 12 8.650 8.650 8.314 0.336 17919 43220 1 106 . 1 1 13 13 ILE N N 13 127.110 127.110 122.891 4.219 17919 43221 1 106 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.540 0.004 17919 43222 1 106 . 1 1 13 13 ILE C C 13 175.220 175.220 174.951 0.269 17919 43223 1 106 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.343 0.637 17919 43224 1 106 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.998 -1.048 17919 43225 1 106 . 1 1 13 13 ILE H H 13 9.450 9.450 8.595 0.855 17919 43226 1 106 . 1 1 14 14 THR N N 14 121.520 121.520 122.084 -0.564 17919 43227 1 106 . 1 1 14 14 THR HA H 14 4.964 4.964 5.146 -0.182 17919 43228 1 106 . 1 1 14 14 THR C C 14 173.790 173.790 173.847 -0.057 17919 43229 1 106 . 1 1 14 14 THR CA C 14 61.940 61.940 61.801 0.139 17919 43230 1 106 . 1 1 14 14 THR CB C 14 69.650 69.650 70.285 -0.635 17919 43231 1 106 . 1 1 14 14 THR H H 14 8.710 8.710 8.465 0.245 17919 43232 1 106 . 1 1 15 15 LEU N N 15 124.800 124.800 126.769 -1.969 17919 43233 1 106 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.808 -0.028 17919 43234 1 106 . 1 1 15 15 LEU C C 15 174.670 174.670 175.422 -0.752 17919 43235 1 106 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.515 -0.685 17919 43236 1 106 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.116 1.954 17919 43237 1 106 . 1 1 15 15 LEU H H 15 8.710 8.710 8.390 0.320 17919 43238 1 106 . 1 1 16 16 GLU N N 16 122.160 122.160 122.190 -0.030 17919 43239 1 106 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.616 0.301 17919 43240 1 106 . 1 1 16 16 GLU C C 16 175.860 175.860 175.555 0.305 17919 43241 1 106 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.264 -0.444 17919 43242 1 106 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.018 -0.568 17919 43243 1 106 . 1 1 16 16 GLU H H 16 8.140 8.140 8.610 -0.470 17919 43244 1 106 . 1 1 17 17 VAL N N 17 117.210 117.210 121.100 -3.890 17919 43245 1 106 . 1 1 17 17 VAL HA H 17 4.714 4.714 5.023 -0.309 17919 43246 1 106 . 1 1 17 17 VAL C C 17 174.160 174.160 175.252 -1.092 17919 43247 1 106 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.753 -0.323 17919 43248 1 106 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.718 0.682 17919 43249 1 106 . 1 1 17 17 VAL H H 17 8.900 8.900 8.629 0.271 17919 43250 1 106 . 1 1 18 18 GLU N N 18 118.990 118.990 120.708 -1.718 17919 43251 1 106 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.890 0.189 17919 43252 1 106 . 1 1 18 18 GLU C C 18 176.160 176.160 175.694 0.466 17919 43253 1 106 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.849 -0.129 17919 43254 1 106 . 1 1 18 18 GLU CB C 18 30.310 30.310 32.387 -2.077 17919 43255 1 106 . 1 1 18 18 GLU H H 18 8.640 8.640 8.729 -0.089 17919 43256 1 106 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.253 -0.112 17919 43257 1 106 . 1 1 19 19 PRO C C 19 175.310 175.310 178.110 -2.800 17919 43258 1 106 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.316 0.154 17919 43259 1 106 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.832 0.118 17919 43260 1 106 . 1 1 20 20 SER N N 20 103.400 103.400 110.908 -7.508 17919 43261 1 106 . 1 1 20 20 SER HA H 20 4.370 4.370 4.237 0.133 17919 43262 1 106 . 1 1 20 20 SER C C 20 174.660 174.660 174.636 0.024 17919 43263 1 106 . 1 1 20 20 SER CA C 20 57.400 57.400 58.604 -1.204 17919 43264 1 106 . 1 1 20 20 SER CB C 20 63.370 63.370 62.754 0.616 17919 43265 1 106 . 1 1 20 20 SER H H 20 7.040 7.040 8.124 -1.084 17919 43266 1 106 . 1 1 21 21 ASP N N 21 123.480 123.480 123.944 -0.464 17919 43267 1 106 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.677 0.018 17919 43268 1 106 . 1 1 21 21 ASP C C 21 176.360 176.360 175.768 0.592 17919 43269 1 106 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.146 0.554 17919 43270 1 106 . 1 1 21 21 ASP CB C 21 40.800 40.800 42.076 -1.276 17919 43271 1 106 . 1 1 21 21 ASP H H 21 8.030 8.030 7.807 0.223 17919 43272 1 106 . 1 1 22 22 THR N N 22 108.800 108.800 111.339 -2.539 17919 43273 1 106 . 1 1 22 22 THR HA H 22 4.920 4.920 4.486 0.434 17919 43274 1 106 . 1 1 22 22 THR C C 22 176.750 176.750 175.922 0.828 17919 43275 1 106 . 1 1 22 22 THR CA C 22 59.690 59.690 61.071 -1.381 17919 43276 1 106 . 1 1 22 22 THR CB C 22 71.200 71.200 70.812 0.388 17919 43277 1 106 . 1 1 22 22 THR H H 22 7.900 7.900 8.293 -0.393 17919 43278 1 106 . 1 1 23 23 ILE N N 23 121.190 121.190 122.753 -1.563 17919 43279 1 106 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.738 -0.081 17919 43280 1 106 . 1 1 23 23 ILE C C 23 179.040 179.040 177.553 1.487 17919 43281 1 106 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.480 -1.220 17919 43282 1 106 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.681 -2.331 17919 43283 1 106 . 1 1 23 23 ILE H H 23 8.560 8.560 8.833 -0.273 17919 43284 1 106 . 1 1 24 24 GLU N N 24 120.830 120.830 120.961 -0.131 17919 43285 1 106 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.877 0.040 17919 43286 1 106 . 1 1 24 24 GLU C C 24 178.640 178.640 179.017 -0.377 17919 43287 1 106 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.090 0.130 17919 43288 1 106 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.477 -1.197 17919 43289 1 106 . 1 1 24 24 GLU H H 24 9.760 9.760 8.088 1.672 17919 43290 1 106 . 1 1 25 25 ASN N N 25 120.570 120.570 117.906 2.664 17919 43291 1 106 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.481 0.044 17919 43292 1 106 . 1 1 25 25 ASN C C 25 178.380 178.380 178.092 0.288 17919 43293 1 106 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.977 0.083 17919 43294 1 106 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.512 -0.062 17919 43295 1 106 . 1 1 25 25 ASN H H 25 7.920 7.920 7.975 -0.055 17919 43296 1 106 . 1 1 26 26 VAL N N 26 121.710 121.710 120.925 0.785 17919 43297 1 106 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.768 -0.371 17919 43298 1 106 . 1 1 26 26 VAL C C 26 177.950 177.950 176.944 1.006 17919 43299 1 106 . 1 1 26 26 VAL CA C 26 67.660 67.660 65.722 1.938 17919 43300 1 106 . 1 1 26 26 VAL CB C 26 30.840 30.840 32.051 -1.211 17919 43301 1 106 . 1 1 26 26 VAL H H 26 8.070 8.070 7.871 0.199 17919 43302 1 106 . 1 1 27 27 LYS N N 27 118.860 118.860 120.996 -2.136 17919 43303 1 106 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.072 0.508 17919 43304 1 106 . 1 1 27 27 LYS C C 27 180.550 180.550 178.888 1.662 17919 43305 1 106 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.987 -0.737 17919 43306 1 106 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.235 1.495 17919 43307 1 106 . 1 1 27 27 LYS H H 27 8.560 8.560 8.215 0.345 17919 43308 1 106 . 1 1 28 28 ALA N N 28 123.440 123.440 120.660 2.780 17919 43309 1 106 . 1 1 28 28 ALA HA H 28 4.160 4.160 3.982 0.178 17919 43310 1 106 . 1 1 28 28 ALA C C 28 180.300 180.300 179.233 1.067 17919 43311 1 106 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.136 0.234 17919 43312 1 106 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.335 -0.625 17919 43313 1 106 . 1 1 28 28 ALA H H 28 8.060 8.060 7.832 0.228 17919 43314 1 106 . 1 1 29 29 LYS N N 29 119.940 119.940 119.280 0.660 17919 43315 1 106 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.020 0.187 17919 43316 1 106 . 1 1 29 29 LYS C C 29 180.320 180.320 178.968 1.352 17919 43317 1 106 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.503 0.147 17919 43318 1 106 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.304 0.986 17919 43319 1 106 . 1 1 29 29 LYS H H 29 7.850 7.850 7.620 0.230 17919 43320 1 106 . 1 1 30 30 ILE N N 30 121.080 121.080 120.175 0.905 17919 43321 1 106 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.620 -0.113 17919 43322 1 106 . 1 1 30 30 ILE C C 30 178.310 178.310 177.515 0.795 17919 43323 1 106 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.476 0.674 17919 43324 1 106 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.293 -0.493 17919 43325 1 106 . 1 1 30 30 ILE H H 30 8.280 8.280 7.840 0.440 17919 43326 1 106 . 1 1 31 31 GLN N N 31 123.490 123.490 119.532 3.958 17919 43327 1 106 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.967 -0.138 17919 43328 1 106 . 1 1 31 31 GLN C C 31 178.890 178.890 177.791 1.099 17919 43329 1 106 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.077 0.923 17919 43330 1 106 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.419 -0.699 17919 43331 1 106 . 1 1 31 31 GLN H H 31 8.580 8.580 8.087 0.493 17919 43332 1 106 . 1 1 32 32 ASP N N 32 119.360 119.360 120.220 -0.860 17919 43333 1 106 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.387 -0.033 17919 43334 1 106 . 1 1 32 32 ASP C C 32 177.250 177.250 178.099 -0.849 17919 43335 1 106 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.825 0.364 17919 43336 1 106 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.951 -0.371 17919 43337 1 106 . 1 1 32 32 ASP H H 32 8.010 8.010 7.929 0.081 17919 43338 1 106 . 1 1 33 33 LYS N N 33 115.130 115.130 119.392 -4.262 17919 43339 1 106 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.159 0.178 17919 43340 1 106 . 1 1 33 33 LYS C C 33 177.870 177.870 178.853 -0.983 17919 43341 1 106 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.199 -0.149 17919 43342 1 106 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.124 1.046 17919 43343 1 106 . 1 1 33 33 LYS H H 33 7.430 7.430 7.736 -0.306 17919 43344 1 106 . 1 1 34 34 GLU N N 34 113.870 113.870 115.461 -1.591 17919 43345 1 106 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.444 0.181 17919 43346 1 106 . 1 1 34 34 GLU C C 34 177.840 177.840 176.984 0.856 17919 43347 1 106 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.338 -1.168 17919 43348 1 106 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.242 1.418 17919 43349 1 106 . 1 1 34 34 GLU H H 34 8.740 8.740 8.149 0.591 17919 43350 1 106 . 1 1 35 35 GLY N N 35 108.650 108.650 107.839 0.811 17919 43351 1 106 . 1 1 35 35 GLY C C 35 173.960 173.960 174.475 -0.515 17919 43352 1 106 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.489 0.591 17919 43353 1 106 . 1 1 35 35 GLY H H 35 8.530 8.530 7.814 0.716 17919 43354 1 106 . 1 1 36 36 ILE N N 36 119.880 119.880 122.182 -2.302 17919 43355 1 106 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.229 0.216 17919 43356 1 106 . 1 1 36 36 ILE C C 36 173.590 173.590 174.064 -0.474 17919 43357 1 106 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.453 -0.702 17919 43358 1 106 . 1 1 36 36 ILE CB C 36 40.580 40.580 37.823 2.757 17919 43359 1 106 . 1 1 36 36 ILE H H 36 6.150 6.150 7.698 -1.548 17919 43360 1 106 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.439 0.195 17919 43361 1 106 . 1 1 37 37 PRO C C 37 176.940 176.940 176.104 0.836 17919 43362 1 106 . 1 1 37 37 PRO CA C 37 61.660 61.660 62.387 -0.727 17919 43363 1 106 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.737 0.113 17919 43364 1 106 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.292 -0.175 17919 43365 1 106 . 1 1 38 38 PRO C C 38 178.320 178.320 178.187 0.133 17919 43366 1 106 . 1 1 38 38 PRO CA C 38 66.260 66.260 64.957 1.303 17919 43367 1 106 . 1 1 38 38 PRO CB C 38 32.890 32.890 32.022 0.868 17919 43368 1 106 . 1 1 39 39 ASP N N 39 113.380 113.380 119.535 -6.155 17919 43369 1 106 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.271 0.159 17919 43370 1 106 . 1 1 39 39 ASP C C 39 177.090 177.090 177.972 -0.882 17919 43371 1 106 . 1 1 39 39 ASP CA C 39 55.640 55.640 57.395 -1.755 17919 43372 1 106 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.025 -0.485 17919 43373 1 106 . 1 1 39 39 ASP H H 39 8.550 8.550 8.713 -0.163 17919 43374 1 106 . 1 1 40 40 GLN N N 40 116.780 116.780 117.535 -0.755 17919 43375 1 106 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.014 0.450 17919 43376 1 106 . 1 1 40 40 GLN C C 40 175.380 175.380 176.258 -0.878 17919 43377 1 106 . 1 1 40 40 GLN CA C 40 55.640 55.640 57.977 -2.337 17919 43378 1 106 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.055 1.085 17919 43379 1 106 . 1 1 40 40 GLN H H 40 7.820 7.820 7.895 -0.075 17919 43380 1 106 . 1 1 41 41 GLN N N 41 117.720 117.720 116.923 0.797 17919 43381 1 106 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.566 -0.322 17919 43382 1 106 . 1 1 41 41 GLN C C 41 176.300 176.300 175.087 1.213 17919 43383 1 106 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.366 1.104 17919 43384 1 106 . 1 1 41 41 GLN CB C 41 31.650 31.650 30.337 1.313 17919 43385 1 106 . 1 1 41 41 GLN H H 41 7.480 7.480 7.448 0.032 17919 43386 1 106 . 1 1 42 42 ARG N N 42 122.680 122.680 123.778 -1.098 17919 43387 1 106 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.692 -0.192 17919 43388 1 106 . 1 1 42 42 ARG C C 42 174.050 174.050 174.498 -0.448 17919 43389 1 106 . 1 1 42 42 ARG CA C 42 55.050 55.050 53.755 1.296 17919 43390 1 106 . 1 1 42 42 ARG CB C 42 31.750 31.750 31.786 -0.036 17919 43391 1 106 . 1 1 42 42 ARG H H 42 8.530 8.530 7.968 0.562 17919 43392 1 106 . 1 1 43 43 LEU N N 43 124.040 124.040 127.926 -3.886 17919 43393 1 106 . 1 1 43 43 LEU C C 43 175.290 175.290 176.381 -1.091 17919 43394 1 106 . 1 1 43 43 LEU CA C 43 52.980 52.980 55.156 -2.176 17919 43395 1 106 . 1 1 43 43 LEU CB C 43 45.790 45.790 42.684 3.106 17919 43396 1 106 . 1 1 43 43 LEU H H 43 8.820 8.820 8.816 0.004 17919 43397 1 106 . 1 1 44 44 ILE N N 44 121.920 121.920 121.801 0.119 17919 43398 1 106 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.264 -0.272 17919 43399 1 106 . 1 1 44 44 ILE C C 44 176.060 176.060 174.790 1.270 17919 43400 1 106 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.901 -0.921 17919 43401 1 106 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.364 0.056 17919 43402 1 106 . 1 1 44 44 ILE H H 44 9.030 9.030 8.673 0.357 17919 43403 1 106 . 1 1 45 45 PHE N N 45 125.390 125.390 127.287 -1.897 17919 43404 1 106 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.808 0.237 17919 43405 1 106 . 1 1 45 45 PHE C C 45 174.470 174.470 174.115 0.355 17919 43406 1 106 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.652 0.368 17919 43407 1 106 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.962 0.798 17919 43408 1 106 . 1 1 45 45 PHE H H 45 8.830 8.830 8.280 0.550 17919 43409 1 106 . 1 1 46 46 ALA N N 46 132.200 132.200 129.517 2.683 17919 43410 1 106 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.663 0.027 17919 43411 1 106 . 1 1 46 46 ALA C C 46 177.290 177.290 177.346 -0.056 17919 43412 1 106 . 1 1 46 46 ALA CA C 46 52.540 52.540 53.013 -0.472 17919 43413 1 106 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.567 0.003 17919 43414 1 106 . 1 1 46 46 ALA H H 46 8.810 8.810 8.811 -0.001 17919 43415 1 106 . 1 1 47 47 GLY N N 47 102.340 102.340 103.603 -1.263 17919 43416 1 106 . 1 1 47 47 GLY C C 47 173.810 173.810 174.484 -0.674 17919 43417 1 106 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.485 -0.135 17919 43418 1 106 . 1 1 47 47 GLY H H 47 8.130 8.130 8.536 -0.406 17919 43419 1 106 . 1 1 48 48 LYS N N 48 121.570 121.570 121.588 -0.018 17919 43420 1 106 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.535 0.087 17919 43421 1 106 . 1 1 48 48 LYS C C 48 174.700 174.700 175.710 -1.010 17919 43422 1 106 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.819 -0.270 17919 43423 1 106 . 1 1 48 48 LYS CB C 48 34.530 34.530 33.910 0.620 17919 43424 1 106 . 1 1 48 48 LYS H H 48 7.980 7.980 7.541 0.439 17919 43425 1 106 . 1 1 49 49 GLN N N 49 122.410 122.410 123.500 -1.090 17919 43426 1 106 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.247 0.313 17919 43427 1 106 . 1 1 49 49 GLN C C 49 175.670 175.670 175.752 -0.082 17919 43428 1 106 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.681 -0.941 17919 43429 1 106 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.198 -0.198 17919 43430 1 106 . 1 1 49 49 GLN H H 49 8.600 8.600 8.630 -0.030 17919 43431 1 106 . 1 1 50 50 LEU N N 50 125.520 125.520 129.310 -3.790 17919 43432 1 106 . 1 1 50 50 LEU HA H 50 4.090 4.090 3.987 0.103 17919 43433 1 106 . 1 1 50 50 LEU C C 50 176.660 176.660 175.615 1.045 17919 43434 1 106 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.923 0.317 17919 43435 1 106 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.292 0.278 17919 43436 1 106 . 1 1 50 50 LEU H H 50 8.530 8.530 8.555 -0.025 17919 43437 1 106 . 1 1 51 51 GLU N N 51 122.940 122.940 123.470 -0.530 17919 43438 1 106 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.561 -0.073 17919 43439 1 106 . 1 1 51 51 GLU C C 51 175.870 175.870 177.097 -1.227 17919 43440 1 106 . 1 1 51 51 GLU CA C 51 55.960 55.960 54.865 1.095 17919 43441 1 106 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.203 -0.633 17919 43442 1 106 . 1 1 51 51 GLU H H 51 8.400 8.400 7.933 0.467 17919 43443 1 106 . 1 1 52 52 ASP N N 52 120.030 120.030 120.730 -0.700 17919 43444 1 106 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.610 -0.251 17919 43445 1 106 . 1 1 52 52 ASP C C 52 177.330 177.330 178.375 -1.045 17919 43446 1 106 . 1 1 52 52 ASP CA C 52 56.960 56.960 56.928 0.032 17919 43447 1 106 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.722 0.128 17919 43448 1 106 . 1 1 52 52 ASP H H 52 8.160 8.160 8.814 -0.654 17919 43449 1 106 . 1 1 53 53 GLY N N 53 106.660 106.660 107.314 -0.654 17919 43450 1 106 . 1 1 53 53 GLY C C 53 174.870 174.870 174.149 0.721 17919 43451 1 106 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.428 -0.258 17919 43452 1 106 . 1 1 53 53 GLY H H 53 9.390 9.390 8.640 0.750 17919 43453 1 106 . 1 1 54 54 ARG N N 54 119.050 119.050 120.643 -1.593 17919 43454 1 106 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.527 0.168 17919 43455 1 106 . 1 1 54 54 ARG C C 54 175.350 175.350 176.521 -1.171 17919 43456 1 106 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.707 -0.317 17919 43457 1 106 . 1 1 54 54 ARG CB C 54 32.650 32.650 31.273 1.377 17919 43458 1 106 . 1 1 54 54 ARG H H 54 7.460 7.460 7.480 -0.020 17919 43459 1 106 . 1 1 55 55 THR N N 55 108.400 108.400 115.347 -6.947 17919 43460 1 106 . 1 1 55 55 THR HA H 55 5.240 5.240 4.506 0.734 17919 43461 1 106 . 1 1 55 55 THR C C 55 176.560 176.560 176.106 0.454 17919 43462 1 106 . 1 1 55 55 THR CA C 55 59.690 59.690 61.647 -1.957 17919 43463 1 106 . 1 1 55 55 THR CB C 55 72.260 72.260 70.489 1.771 17919 43464 1 106 . 1 1 55 55 THR H H 55 8.730 8.730 7.996 0.734 17919 43465 1 106 . 1 1 56 56 LEU N N 56 117.920 117.920 121.676 -3.756 17919 43466 1 106 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.841 0.219 17919 43467 1 106 . 1 1 56 56 LEU C C 56 180.810 180.810 179.061 1.749 17919 43468 1 106 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.571 0.139 17919 43469 1 106 . 1 1 56 56 LEU CB C 56 40.370 40.370 40.881 -0.511 17919 43470 1 106 . 1 1 56 56 LEU H H 56 8.140 8.140 8.254 -0.114 17919 43471 1 106 . 1 1 57 57 SER N N 57 113.330 113.330 113.612 -0.282 17919 43472 1 106 . 1 1 57 57 SER HA H 57 4.370 4.370 4.244 0.126 17919 43473 1 106 . 1 1 57 57 SER C C 57 178.310 178.310 176.954 1.356 17919 43474 1 106 . 1 1 57 57 SER CA C 57 61.080 61.080 61.829 -0.749 17919 43475 1 106 . 1 1 57 57 SER CB C 57 62.530 62.530 62.817 -0.287 17919 43476 1 106 . 1 1 57 57 SER H H 57 8.470 8.470 7.828 0.642 17919 43477 1 106 . 1 1 58 58 ASP N N 58 124.190 124.190 123.349 0.841 17919 43478 1 106 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.288 0.008 17919 43479 1 106 . 1 1 58 58 ASP C C 58 177.400 177.400 178.221 -0.821 17919 43480 1 106 . 1 1 58 58 ASP CA C 58 57.180 57.180 57.207 -0.027 17919 43481 1 106 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.665 -0.565 17919 43482 1 106 . 1 1 58 58 ASP H H 58 7.930 7.930 7.884 0.046 17919 43483 1 106 . 1 1 59 59 TYR N N 59 115.510 115.510 116.045 -0.535 17919 43484 1 106 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.530 0.140 17919 43485 1 106 . 1 1 59 59 TYR C C 59 174.700 174.700 174.729 -0.029 17919 43486 1 106 . 1 1 59 59 TYR CA C 59 58.250 58.250 56.980 1.270 17919 43487 1 106 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.091 1.979 17919 43488 1 106 . 1 1 59 59 TYR H H 59 7.250 7.250 7.603 -0.353 17919 43489 1 106 . 1 1 60 60 ASN N N 60 115.900 115.900 117.169 -1.269 17919 43490 1 106 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.337 0.018 17919 43491 1 106 . 1 1 60 60 ASN C C 60 174.340 174.340 174.675 -0.335 17919 43492 1 106 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.139 -0.019 17919 43493 1 106 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.171 0.239 17919 43494 1 106 . 1 1 60 60 ASN H H 60 8.150 8.150 7.539 0.611 17919 43495 1 106 . 1 1 61 61 ILE N N 61 118.600 118.600 118.977 -0.377 17919 43496 1 106 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.425 -0.032 17919 43497 1 106 . 1 1 61 61 ILE C C 61 174.610 174.610 175.133 -0.523 17919 43498 1 106 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.691 0.729 17919 43499 1 106 . 1 1 61 61 ILE CB C 61 36.740 36.740 38.960 -2.220 17919 43500 1 106 . 1 1 61 61 ILE H H 61 7.250 7.250 8.267 -1.017 17919 43501 1 106 . 1 1 62 62 GLN N N 62 124.740 124.740 121.767 2.973 17919 43502 1 106 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.625 -0.119 17919 43503 1 106 . 1 1 62 62 GLN C C 62 175.970 175.970 174.641 1.329 17919 43504 1 106 . 1 1 62 62 GLN CA C 62 53.660 53.660 54.272 -0.612 17919 43505 1 106 . 1 1 62 62 GLN CB C 62 31.650 31.650 33.560 -1.910 17919 43506 1 106 . 1 1 62 62 GLN H H 62 7.610 7.610 8.015 -0.405 17919 43507 1 106 . 1 1 63 63 LYS N N 63 120.300 120.300 124.983 -4.683 17919 43508 1 106 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.977 0.024 17919 43509 1 106 . 1 1 63 63 LYS C C 63 175.810 175.810 176.909 -1.099 17919 43510 1 106 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.825 -0.035 17919 43511 1 106 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.124 0.526 17919 43512 1 106 . 1 1 63 63 LYS H H 63 8.490 8.490 8.856 -0.366 17919 43513 1 106 . 1 1 64 64 GLU N N 64 113.950 113.950 121.714 -7.764 17919 43514 1 106 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.279 0.186 17919 43515 1 106 . 1 1 64 64 GLU C C 64 175.250 175.250 175.734 -0.484 17919 43516 1 106 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.739 0.151 17919 43517 1 106 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.900 -3.000 17919 43518 1 106 . 1 1 64 64 GLU H H 64 9.280 9.280 8.934 0.346 17919 43519 1 106 . 1 1 65 65 SER N N 65 114.730 114.730 115.725 -0.995 17919 43520 1 106 . 1 1 65 65 SER HA H 65 4.640 4.640 4.476 0.164 17919 43521 1 106 . 1 1 65 65 SER C C 65 172.160 172.160 174.604 -2.444 17919 43522 1 106 . 1 1 65 65 SER CA C 65 60.890 60.890 58.990 1.899 17919 43523 1 106 . 1 1 65 65 SER CB C 65 64.910 64.910 63.385 1.525 17919 43524 1 106 . 1 1 65 65 SER H H 65 7.670 7.670 7.749 -0.079 17919 43525 1 106 . 1 1 66 66 THR N N 66 117.110 117.110 120.236 -3.126 17919 43526 1 106 . 1 1 66 66 THR HA H 66 5.270 5.270 4.408 0.862 17919 43527 1 106 . 1 1 66 66 THR C C 66 173.950 173.950 174.444 -0.494 17919 43528 1 106 . 1 1 66 66 THR CA C 66 62.340 62.340 63.853 -1.513 17919 43529 1 106 . 1 1 66 66 THR CB C 66 70.080 70.080 69.506 0.574 17919 43530 1 106 . 1 1 66 66 THR H H 66 8.730 8.730 8.181 0.549 17919 43531 1 106 . 1 1 67 67 LEU N N 67 127.110 127.110 128.347 -1.237 17919 43532 1 106 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.429 0.631 17919 43533 1 106 . 1 1 67 67 LEU C C 67 175.770 175.770 176.134 -0.364 17919 43534 1 106 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.950 -0.050 17919 43535 1 106 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.678 0.582 17919 43536 1 106 . 1 1 67 67 LEU H H 67 9.410 9.410 9.053 0.357 17919 43537 1 106 . 1 1 68 68 HIS N N 68 118.380 118.380 118.323 0.057 17919 43538 1 106 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.546 -0.306 17919 43539 1 106 . 1 1 68 68 HIS C C 68 173.150 173.150 174.543 -1.393 17919 43540 1 106 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.398 0.602 17919 43541 1 106 . 1 1 68 68 HIS CB C 68 30.530 30.530 31.904 -1.374 17919 43542 1 106 . 1 1 68 68 HIS H H 68 9.230 9.230 8.068 1.162 17919 43543 1 106 . 1 1 69 69 LEU N N 69 124.460 124.460 124.037 0.423 17919 43544 1 106 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.152 0.038 17919 43545 1 106 . 1 1 69 69 LEU C C 69 175.270 175.270 174.375 0.895 17919 43546 1 106 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.446 0.444 17919 43547 1 106 . 1 1 69 69 LEU CB C 69 44.380 44.380 45.778 -1.398 17919 43548 1 106 . 1 1 69 69 LEU H H 69 8.340 8.340 8.961 -0.621 17919 43549 1 106 . 1 1 70 70 VAL N N 70 126.940 126.940 123.308 3.632 17919 43550 1 106 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.550 -0.200 17919 43551 1 106 . 1 1 70 70 VAL C C 70 174.000 174.000 173.260 0.740 17919 43552 1 106 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.665 0.135 17919 43553 1 106 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.753 -0.843 17919 43554 1 106 . 1 1 70 70 VAL H H 70 9.200 9.200 8.180 1.020 17919 43555 1 106 . 1 1 71 71 LEU N N 71 123.130 123.130 126.972 -3.842 17919 43556 1 106 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.193 -0.133 17919 43557 1 106 . 1 1 71 71 LEU C C 71 177.830 177.830 177.049 0.781 17919 43558 1 106 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.057 0.883 17919 43559 1 106 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.754 -0.904 17919 43560 1 106 . 1 1 71 71 LEU H H 71 8.120 8.120 8.446 -0.326 17919 43561 1 106 . 1 1 72 72 ARG N N 72 123.490 123.490 125.418 -1.928 17919 43562 1 106 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.498 -0.197 17919 43563 1 106 . 1 1 72 72 ARG C C 72 175.350 175.350 175.584 -0.234 17919 43564 1 106 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.617 -0.007 17919 43565 1 106 . 1 1 72 72 ARG CB C 72 31.350 31.350 31.429 -0.079 17919 43566 1 106 . 1 1 72 72 ARG H H 72 8.580 8.580 8.070 0.510 17919 43567 1 107 . 1 1 2 2 GLN N N 2 123.220 123.220 120.463 2.757 17919 43568 1 107 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.356 -0.107 17919 43569 1 107 . 1 1 2 2 GLN C C 2 175.920 175.920 175.389 0.531 17919 43570 1 107 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.304 0.776 17919 43571 1 107 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.703 0.057 17919 43572 1 107 . 1 1 2 2 GLN H H 2 8.900 8.900 8.402 0.498 17919 43573 1 107 . 1 1 3 3 ILE N N 3 115.340 115.340 117.581 -2.241 17919 43574 1 107 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.371 -0.158 17919 43575 1 107 . 1 1 3 3 ILE C C 3 172.450 172.450 173.615 -1.165 17919 43576 1 107 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.362 0.208 17919 43577 1 107 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.266 0.944 17919 43578 1 107 . 1 1 3 3 ILE H H 3 8.320 8.320 7.928 0.392 17919 43579 1 107 . 1 1 4 4 PHE N N 4 118.110 118.110 120.372 -2.262 17919 43580 1 107 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.310 0.320 17919 43581 1 107 . 1 1 4 4 PHE C C 4 175.320 175.320 175.945 -0.625 17919 43582 1 107 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.964 -0.754 17919 43583 1 107 . 1 1 4 4 PHE CB C 4 41.480 41.480 40.837 0.644 17919 43584 1 107 . 1 1 4 4 PHE H H 4 8.610 8.610 8.762 -0.152 17919 43585 1 107 . 1 1 5 5 VAL N N 5 121.000 121.000 120.586 0.414 17919 43586 1 107 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.881 -0.156 17919 43587 1 107 . 1 1 5 5 VAL C C 5 174.870 174.870 174.774 0.096 17919 43588 1 107 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.470 -0.850 17919 43589 1 107 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.684 0.546 17919 43590 1 107 . 1 1 5 5 VAL H H 5 9.300 9.300 8.415 0.885 17919 43591 1 107 . 1 1 6 6 LYS N N 6 127.520 127.520 128.870 -1.350 17919 43592 1 107 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.289 0.078 17919 43593 1 107 . 1 1 6 6 LYS C C 6 177.140 177.140 176.591 0.549 17919 43594 1 107 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.679 -0.159 17919 43595 1 107 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.556 -0.506 17919 43596 1 107 . 1 1 6 6 LYS H H 6 8.820 8.820 8.795 0.025 17919 43597 1 107 . 1 1 7 7 THR N N 7 115.400 115.400 117.947 -2.547 17919 43598 1 107 . 1 1 7 7 THR HA H 7 4.970 4.970 4.711 0.259 17919 43599 1 107 . 1 1 7 7 THR C C 7 176.910 176.910 176.195 0.715 17919 43600 1 107 . 1 1 7 7 THR CA C 7 60.470 60.470 60.949 -0.479 17919 43601 1 107 . 1 1 7 7 THR CB C 7 70.630 70.630 70.538 0.092 17919 43602 1 107 . 1 1 7 7 THR H H 7 8.730 8.730 8.887 -0.157 17919 43603 1 107 . 1 1 8 8 LEU N N 8 121.330 121.330 122.438 -1.108 17919 43604 1 107 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.298 0.012 17919 43605 1 107 . 1 1 8 8 LEU C C 8 178.800 178.800 177.742 1.058 17919 43606 1 107 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.447 0.134 17919 43607 1 107 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.117 -0.146 17919 43608 1 107 . 1 1 8 8 LEU H H 8 9.100 9.100 8.398 0.702 17919 43609 1 107 . 1 1 9 9 THR N N 9 105.590 105.590 107.084 -1.494 17919 43610 1 107 . 1 1 9 9 THR HA H 9 4.428 4.428 4.236 0.192 17919 43611 1 107 . 1 1 9 9 THR C C 9 175.520 175.520 175.587 -0.067 17919 43612 1 107 . 1 1 9 9 THR CA C 9 61.400 61.400 62.545 -1.145 17919 43613 1 107 . 1 1 9 9 THR CB C 9 69.140 69.140 69.162 -0.022 17919 43614 1 107 . 1 1 9 9 THR H H 9 7.630 7.630 7.706 -0.076 17919 43615 1 107 . 1 1 10 10 GLY N N 10 108.890 108.890 111.617 -2.727 17919 43616 1 107 . 1 1 10 10 GLY C C 10 174.070 174.070 174.211 -0.141 17919 43617 1 107 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.803 0.657 17919 43618 1 107 . 1 1 10 10 GLY H H 10 7.810 7.810 7.854 -0.044 17919 43619 1 107 . 1 1 11 11 LYS N N 11 121.600 121.600 122.460 -0.860 17919 43620 1 107 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.339 0.022 17919 43621 1 107 . 1 1 11 11 LYS C C 11 175.940 175.940 175.567 0.373 17919 43622 1 107 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.887 -0.607 17919 43623 1 107 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.255 -0.055 17919 43624 1 107 . 1 1 11 11 LYS H H 11 7.280 7.280 7.775 -0.495 17919 43625 1 107 . 1 1 12 12 THR N N 12 120.440 120.440 113.815 6.625 17919 43626 1 107 . 1 1 12 12 THR HA H 12 5.046 5.046 5.573 -0.527 17919 43627 1 107 . 1 1 12 12 THR C C 12 174.320 174.320 173.898 0.422 17919 43628 1 107 . 1 1 12 12 THR CA C 12 62.390 62.390 61.286 1.104 17919 43629 1 107 . 1 1 12 12 THR CB C 12 69.910 69.910 72.197 -2.287 17919 43630 1 107 . 1 1 12 12 THR H H 12 8.650 8.650 8.199 0.451 17919 43631 1 107 . 1 1 13 13 ILE N N 13 127.110 127.110 122.932 4.178 17919 43632 1 107 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.430 0.114 17919 43633 1 107 . 1 1 13 13 ILE C C 13 175.220 175.220 174.199 1.021 17919 43634 1 107 . 1 1 13 13 ILE CA C 13 59.980 59.980 61.251 -1.271 17919 43635 1 107 . 1 1 13 13 ILE CB C 13 40.950 40.950 42.604 -1.654 17919 43636 1 107 . 1 1 13 13 ILE H H 13 9.450 9.450 8.592 0.858 17919 43637 1 107 . 1 1 14 14 THR N N 14 121.520 121.520 122.941 -1.421 17919 43638 1 107 . 1 1 14 14 THR HA H 14 4.964 4.964 4.700 0.264 17919 43639 1 107 . 1 1 14 14 THR C C 14 173.790 173.790 173.454 0.336 17919 43640 1 107 . 1 1 14 14 THR CA C 14 61.940 61.940 62.339 -0.399 17919 43641 1 107 . 1 1 14 14 THR CB C 14 69.650 69.650 69.572 0.078 17919 43642 1 107 . 1 1 14 14 THR H H 14 8.710 8.710 8.675 0.035 17919 43643 1 107 . 1 1 15 15 LEU N N 15 124.800 124.800 127.140 -2.340 17919 43644 1 107 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.790 -0.010 17919 43645 1 107 . 1 1 15 15 LEU C C 15 174.670 174.670 175.324 -0.654 17919 43646 1 107 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.817 -0.987 17919 43647 1 107 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.283 1.786 17919 43648 1 107 . 1 1 15 15 LEU H H 15 8.710 8.710 7.885 0.825 17919 43649 1 107 . 1 1 16 16 GLU N N 16 122.160 122.160 124.278 -2.118 17919 43650 1 107 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.531 0.386 17919 43651 1 107 . 1 1 16 16 GLU C C 16 175.860 175.860 175.908 -0.048 17919 43652 1 107 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.180 -0.360 17919 43653 1 107 . 1 1 16 16 GLU CB C 16 29.450 29.450 29.472 -0.022 17919 43654 1 107 . 1 1 16 16 GLU H H 16 8.140 8.140 8.619 -0.479 17919 43655 1 107 . 1 1 17 17 VAL N N 17 117.210 117.210 121.149 -3.939 17919 43656 1 107 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.810 -0.096 17919 43657 1 107 . 1 1 17 17 VAL C C 17 174.160 174.160 174.809 -0.649 17919 43658 1 107 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.368 0.062 17919 43659 1 107 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.178 1.222 17919 43660 1 107 . 1 1 17 17 VAL H H 17 8.900 8.900 8.349 0.551 17919 43661 1 107 . 1 1 18 18 GLU N N 18 118.990 118.990 119.263 -0.273 17919 43662 1 107 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.789 0.290 17919 43663 1 107 . 1 1 18 18 GLU C C 18 176.160 176.160 175.342 0.818 17919 43664 1 107 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.099 -0.379 17919 43665 1 107 . 1 1 18 18 GLU CB C 18 30.310 30.310 31.505 -1.195 17919 43666 1 107 . 1 1 18 18 GLU H H 18 8.640 8.640 7.990 0.650 17919 43667 1 107 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.189 -0.048 17919 43668 1 107 . 1 1 19 19 PRO C C 19 175.310 175.310 177.598 -2.288 17919 43669 1 107 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.563 -0.093 17919 43670 1 107 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.829 0.121 17919 43671 1 107 . 1 1 20 20 SER N N 20 103.400 103.400 110.841 -7.441 17919 43672 1 107 . 1 1 20 20 SER HA H 20 4.370 4.370 4.374 -0.004 17919 43673 1 107 . 1 1 20 20 SER C C 20 174.660 174.660 174.593 0.067 17919 43674 1 107 . 1 1 20 20 SER CA C 20 57.400 57.400 59.127 -1.727 17919 43675 1 107 . 1 1 20 20 SER CB C 20 63.370 63.370 62.668 0.702 17919 43676 1 107 . 1 1 20 20 SER H H 20 7.040 7.040 8.365 -1.325 17919 43677 1 107 . 1 1 21 21 ASP N N 21 123.480 123.480 123.316 0.164 17919 43678 1 107 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.660 0.035 17919 43679 1 107 . 1 1 21 21 ASP C C 21 176.360 176.360 175.643 0.717 17919 43680 1 107 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.445 0.255 17919 43681 1 107 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.772 -0.972 17919 43682 1 107 . 1 1 21 21 ASP H H 21 8.030 8.030 7.921 0.109 17919 43683 1 107 . 1 1 22 22 THR N N 22 108.800 108.800 112.785 -3.985 17919 43684 1 107 . 1 1 22 22 THR HA H 22 4.920 4.920 4.790 0.130 17919 43685 1 107 . 1 1 22 22 THR C C 22 176.750 176.750 175.843 0.907 17919 43686 1 107 . 1 1 22 22 THR CA C 22 59.690 59.690 60.871 -1.181 17919 43687 1 107 . 1 1 22 22 THR CB C 22 71.200 71.200 70.895 0.305 17919 43688 1 107 . 1 1 22 22 THR H H 22 7.900 7.900 8.200 -0.300 17919 43689 1 107 . 1 1 23 23 ILE N N 23 121.190 121.190 122.083 -0.893 17919 43690 1 107 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.834 -0.177 17919 43691 1 107 . 1 1 23 23 ILE C C 23 179.040 179.040 177.744 1.296 17919 43692 1 107 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.284 -0.024 17919 43693 1 107 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.501 -2.151 17919 43694 1 107 . 1 1 23 23 ILE H H 23 8.560 8.560 8.964 -0.404 17919 43695 1 107 . 1 1 24 24 GLU N N 24 120.830 120.830 119.438 1.392 17919 43696 1 107 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.987 -0.070 17919 43697 1 107 . 1 1 24 24 GLU C C 24 178.640 178.640 178.532 0.108 17919 43698 1 107 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.093 1.127 17919 43699 1 107 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.559 -1.279 17919 43700 1 107 . 1 1 24 24 GLU H H 24 9.760 9.760 7.979 1.781 17919 43701 1 107 . 1 1 25 25 ASN N N 25 120.570 120.570 118.418 2.152 17919 43702 1 107 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.470 0.055 17919 43703 1 107 . 1 1 25 25 ASN C C 25 178.380 178.380 177.904 0.476 17919 43704 1 107 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.218 -0.158 17919 43705 1 107 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.433 0.017 17919 43706 1 107 . 1 1 25 25 ASN H H 25 7.920 7.920 7.501 0.419 17919 43707 1 107 . 1 1 26 26 VAL N N 26 121.710 121.710 119.041 2.669 17919 43708 1 107 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.532 -0.135 17919 43709 1 107 . 1 1 26 26 VAL C C 26 177.950 177.950 178.033 -0.083 17919 43710 1 107 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.667 0.993 17919 43711 1 107 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.202 -0.362 17919 43712 1 107 . 1 1 26 26 VAL H H 26 8.070 8.070 7.971 0.099 17919 43713 1 107 . 1 1 27 27 LYS N N 27 118.860 118.860 119.690 -0.830 17919 43714 1 107 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.071 0.509 17919 43715 1 107 . 1 1 27 27 LYS C C 27 180.550 180.550 178.922 1.628 17919 43716 1 107 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.484 -0.234 17919 43717 1 107 . 1 1 27 27 LYS CB C 27 33.730 33.730 31.947 1.784 17919 43718 1 107 . 1 1 27 27 LYS H H 27 8.560 8.560 7.533 1.027 17919 43719 1 107 . 1 1 28 28 ALA N N 28 123.440 123.440 120.762 2.678 17919 43720 1 107 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.095 0.065 17919 43721 1 107 . 1 1 28 28 ALA C C 28 180.300 180.300 179.078 1.222 17919 43722 1 107 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.936 0.434 17919 43723 1 107 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.354 -0.644 17919 43724 1 107 . 1 1 28 28 ALA H H 28 8.060 8.060 7.798 0.262 17919 43725 1 107 . 1 1 29 29 LYS N N 29 119.940 119.940 119.947 -0.007 17919 43726 1 107 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.017 0.190 17919 43727 1 107 . 1 1 29 29 LYS C C 29 180.320 180.320 179.212 1.108 17919 43728 1 107 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.153 0.498 17919 43729 1 107 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.309 0.981 17919 43730 1 107 . 1 1 29 29 LYS H H 29 7.850 7.850 7.505 0.345 17919 43731 1 107 . 1 1 30 30 ILE N N 30 121.080 121.080 120.182 0.898 17919 43732 1 107 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.548 -0.041 17919 43733 1 107 . 1 1 30 30 ILE C C 30 178.310 178.310 177.583 0.727 17919 43734 1 107 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.323 0.827 17919 43735 1 107 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.720 -0.920 17919 43736 1 107 . 1 1 30 30 ILE H H 30 8.280 8.280 8.527 -0.247 17919 43737 1 107 . 1 1 31 31 GLN N N 31 123.490 123.490 118.796 4.694 17919 43738 1 107 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.012 -0.183 17919 43739 1 107 . 1 1 31 31 GLN C C 31 178.890 178.890 178.409 0.481 17919 43740 1 107 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.153 0.847 17919 43741 1 107 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.425 -0.706 17919 43742 1 107 . 1 1 31 31 GLN H H 31 8.580 8.580 7.979 0.601 17919 43743 1 107 . 1 1 32 32 ASP N N 32 119.360 119.360 119.256 0.104 17919 43744 1 107 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.469 -0.115 17919 43745 1 107 . 1 1 32 32 ASP C C 32 177.250 177.250 177.477 -0.227 17919 43746 1 107 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.472 0.718 17919 43747 1 107 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.738 -0.158 17919 43748 1 107 . 1 1 32 32 ASP H H 32 8.010 8.010 7.985 0.025 17919 43749 1 107 . 1 1 33 33 LYS N N 33 115.130 115.130 117.182 -2.052 17919 43750 1 107 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.459 -0.122 17919 43751 1 107 . 1 1 33 33 LYS C C 33 177.870 177.870 177.743 0.127 17919 43752 1 107 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.552 0.498 17919 43753 1 107 . 1 1 33 33 LYS CB C 33 34.170 34.170 34.457 -0.287 17919 43754 1 107 . 1 1 33 33 LYS H H 33 7.430 7.430 7.543 -0.113 17919 43755 1 107 . 1 1 34 34 GLU N N 34 113.870 113.870 116.033 -2.163 17919 43756 1 107 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.522 0.103 17919 43757 1 107 . 1 1 34 34 GLU C C 34 177.840 177.840 176.792 1.048 17919 43758 1 107 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.642 -0.472 17919 43759 1 107 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.369 1.291 17919 43760 1 107 . 1 1 34 34 GLU H H 34 8.740 8.740 7.970 0.770 17919 43761 1 107 . 1 1 35 35 GLY N N 35 108.650 108.650 109.677 -1.027 17919 43762 1 107 . 1 1 35 35 GLY C C 35 173.960 173.960 174.373 -0.413 17919 43763 1 107 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.957 0.123 17919 43764 1 107 . 1 1 35 35 GLY H H 35 8.530 8.530 8.042 0.488 17919 43765 1 107 . 1 1 36 36 ILE N N 36 119.880 119.880 120.938 -1.058 17919 43766 1 107 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.402 0.043 17919 43767 1 107 . 1 1 36 36 ILE C C 36 173.590 173.590 174.780 -1.190 17919 43768 1 107 . 1 1 36 36 ILE CA C 36 57.750 57.750 56.663 1.087 17919 43769 1 107 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.006 2.574 17919 43770 1 107 . 1 1 36 36 ILE H H 36 6.150 6.150 7.622 -1.472 17919 43771 1 107 . 1 1 37 37 PRO HA H 37 4.634 4.634 5.078 -0.444 17919 43772 1 107 . 1 1 37 37 PRO C C 37 176.940 176.940 176.100 0.840 17919 43773 1 107 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.178 0.482 17919 43774 1 107 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.394 0.456 17919 43775 1 107 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.317 -0.200 17919 43776 1 107 . 1 1 38 38 PRO C C 38 178.320 178.320 178.131 0.189 17919 43777 1 107 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.219 1.041 17919 43778 1 107 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.936 0.954 17919 43779 1 107 . 1 1 39 39 ASP N N 39 113.380 113.380 117.295 -3.915 17919 43780 1 107 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.296 0.134 17919 43781 1 107 . 1 1 39 39 ASP C C 39 177.090 177.090 177.146 -0.056 17919 43782 1 107 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.915 -1.275 17919 43783 1 107 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.032 -0.492 17919 43784 1 107 . 1 1 39 39 ASP H H 39 8.550 8.550 8.741 -0.191 17919 43785 1 107 . 1 1 40 40 GLN N N 40 116.780 116.780 116.719 0.061 17919 43786 1 107 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.327 0.137 17919 43787 1 107 . 1 1 40 40 GLN C C 40 175.380 175.380 176.044 -0.664 17919 43788 1 107 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.676 -0.036 17919 43789 1 107 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.183 0.957 17919 43790 1 107 . 1 1 40 40 GLN H H 40 7.820 7.820 7.923 -0.103 17919 43791 1 107 . 1 1 41 41 GLN N N 41 117.720 117.720 119.016 -1.296 17919 43792 1 107 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.704 -0.460 17919 43793 1 107 . 1 1 41 41 GLN C C 41 176.300 176.300 175.212 1.088 17919 43794 1 107 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.553 0.917 17919 43795 1 107 . 1 1 41 41 GLN CB C 41 31.650 31.650 31.127 0.523 17919 43796 1 107 . 1 1 41 41 GLN H H 41 7.480 7.480 7.822 -0.342 17919 43797 1 107 . 1 1 42 42 ARG N N 42 122.680 122.680 122.355 0.325 17919 43798 1 107 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.716 -0.216 17919 43799 1 107 . 1 1 42 42 ARG C C 42 174.050 174.050 174.027 0.023 17919 43800 1 107 . 1 1 42 42 ARG CA C 42 55.050 55.050 53.798 1.252 17919 43801 1 107 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.370 -1.620 17919 43802 1 107 . 1 1 42 42 ARG H H 42 8.530 8.530 8.747 -0.217 17919 43803 1 107 . 1 1 43 43 LEU N N 43 124.040 124.040 123.856 0.184 17919 43804 1 107 . 1 1 43 43 LEU C C 43 175.290 175.290 175.962 -0.672 17919 43805 1 107 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.371 -0.391 17919 43806 1 107 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.583 2.208 17919 43807 1 107 . 1 1 43 43 LEU H H 43 8.820 8.820 8.819 0.001 17919 43808 1 107 . 1 1 44 44 ILE N N 44 121.920 121.920 121.425 0.495 17919 43809 1 107 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.840 0.151 17919 43810 1 107 . 1 1 44 44 ILE C C 44 176.060 176.060 174.203 1.857 17919 43811 1 107 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.364 -0.383 17919 43812 1 107 . 1 1 44 44 ILE CB C 44 41.420 41.420 40.998 0.422 17919 43813 1 107 . 1 1 44 44 ILE H H 44 9.030 9.030 9.115 -0.085 17919 43814 1 107 . 1 1 45 45 PHE N N 45 125.390 125.390 126.875 -1.485 17919 43815 1 107 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.963 0.082 17919 43816 1 107 . 1 1 45 45 PHE C C 45 174.470 174.470 174.294 0.176 17919 43817 1 107 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.588 0.432 17919 43818 1 107 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.949 0.811 17919 43819 1 107 . 1 1 45 45 PHE H H 45 8.830 8.830 8.969 -0.139 17919 43820 1 107 . 1 1 46 46 ALA N N 46 132.200 132.200 130.054 2.146 17919 43821 1 107 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.559 0.131 17919 43822 1 107 . 1 1 46 46 ALA C C 46 177.290 177.290 177.154 0.136 17919 43823 1 107 . 1 1 46 46 ALA CA C 46 52.540 52.540 53.064 -0.524 17919 43824 1 107 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.207 0.362 17919 43825 1 107 . 1 1 46 46 ALA H H 46 8.810 8.810 8.692 0.118 17919 43826 1 107 . 1 1 47 47 GLY N N 47 102.340 102.340 103.452 -1.112 17919 43827 1 107 . 1 1 47 47 GLY C C 47 173.810 173.810 173.913 -0.103 17919 43828 1 107 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.049 0.301 17919 43829 1 107 . 1 1 47 47 GLY H H 47 8.130 8.130 8.393 -0.263 17919 43830 1 107 . 1 1 48 48 LYS N N 48 121.570 121.570 121.035 0.535 17919 43831 1 107 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.635 -0.012 17919 43832 1 107 . 1 1 48 48 LYS C C 48 174.700 174.700 175.017 -0.317 17919 43833 1 107 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.282 -0.732 17919 43834 1 107 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.740 -0.210 17919 43835 1 107 . 1 1 48 48 LYS H H 48 7.980 7.980 7.795 0.185 17919 43836 1 107 . 1 1 49 49 GLN N N 49 122.410 122.410 124.091 -1.681 17919 43837 1 107 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.658 -0.098 17919 43838 1 107 . 1 1 49 49 GLN C C 49 175.670 175.670 175.867 -0.197 17919 43839 1 107 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.495 -0.755 17919 43840 1 107 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.787 -0.787 17919 43841 1 107 . 1 1 49 49 GLN H H 49 8.600 8.600 8.516 0.084 17919 43842 1 107 . 1 1 50 50 LEU N N 50 125.520 125.520 124.390 1.130 17919 43843 1 107 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.307 -0.217 17919 43844 1 107 . 1 1 50 50 LEU C C 50 176.660 176.660 176.005 0.655 17919 43845 1 107 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.479 0.761 17919 43846 1 107 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.596 -1.026 17919 43847 1 107 . 1 1 50 50 LEU H H 50 8.530 8.530 7.940 0.590 17919 43848 1 107 . 1 1 51 51 GLU N N 51 122.940 122.940 123.446 -0.506 17919 43849 1 107 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.542 -0.054 17919 43850 1 107 . 1 1 51 51 GLU C C 51 175.870 175.870 176.772 -0.902 17919 43851 1 107 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.486 0.474 17919 43852 1 107 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.494 0.076 17919 43853 1 107 . 1 1 51 51 GLU H H 51 8.400 8.400 8.430 -0.030 17919 43854 1 107 . 1 1 52 52 ASP N N 52 120.030 120.030 124.912 -4.882 17919 43855 1 107 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.379 -0.020 17919 43856 1 107 . 1 1 52 52 ASP C C 52 177.330 177.330 178.034 -0.704 17919 43857 1 107 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.905 -0.945 17919 43858 1 107 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.798 0.052 17919 43859 1 107 . 1 1 52 52 ASP H H 52 8.160 8.160 8.881 -0.721 17919 43860 1 107 . 1 1 53 53 GLY N N 53 106.660 106.660 105.818 0.842 17919 43861 1 107 . 1 1 53 53 GLY C C 53 174.870 174.870 174.357 0.513 17919 43862 1 107 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.950 0.220 17919 43863 1 107 . 1 1 53 53 GLY H H 53 9.390 9.390 8.454 0.936 17919 43864 1 107 . 1 1 54 54 ARG N N 54 119.050 119.050 120.333 -1.283 17919 43865 1 107 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.753 -0.058 17919 43866 1 107 . 1 1 54 54 ARG C C 54 175.350 175.350 174.938 0.412 17919 43867 1 107 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.399 -0.009 17919 43868 1 107 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.306 -0.656 17919 43869 1 107 . 1 1 54 54 ARG H H 54 7.460 7.460 7.594 -0.134 17919 43870 1 107 . 1 1 55 55 THR N N 55 108.400 108.400 111.430 -3.030 17919 43871 1 107 . 1 1 55 55 THR HA H 55 5.240 5.240 5.301 -0.061 17919 43872 1 107 . 1 1 55 55 THR C C 55 176.560 176.560 176.508 0.052 17919 43873 1 107 . 1 1 55 55 THR CA C 55 59.690 59.690 59.578 0.112 17919 43874 1 107 . 1 1 55 55 THR CB C 55 72.260 72.260 71.488 0.772 17919 43875 1 107 . 1 1 55 55 THR H H 55 8.730 8.730 8.733 -0.003 17919 43876 1 107 . 1 1 56 56 LEU N N 56 117.920 117.920 121.088 -3.168 17919 43877 1 107 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.913 0.147 17919 43878 1 107 . 1 1 56 56 LEU C C 56 180.810 180.810 178.740 2.070 17919 43879 1 107 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.752 -0.042 17919 43880 1 107 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.221 -0.851 17919 43881 1 107 . 1 1 56 56 LEU H H 56 8.140 8.140 8.302 -0.162 17919 43882 1 107 . 1 1 57 57 SER N N 57 113.330 113.330 114.323 -0.993 17919 43883 1 107 . 1 1 57 57 SER HA H 57 4.370 4.370 4.124 0.246 17919 43884 1 107 . 1 1 57 57 SER C C 57 178.310 178.310 176.754 1.556 17919 43885 1 107 . 1 1 57 57 SER CA C 57 61.080 61.080 62.194 -1.114 17919 43886 1 107 . 1 1 57 57 SER CB C 57 62.530 62.530 62.767 -0.237 17919 43887 1 107 . 1 1 57 57 SER H H 57 8.470 8.470 8.063 0.407 17919 43888 1 107 . 1 1 58 58 ASP N N 58 124.190 124.190 122.606 1.584 17919 43889 1 107 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.266 0.030 17919 43890 1 107 . 1 1 58 58 ASP C C 58 177.400 177.400 177.699 -0.299 17919 43891 1 107 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.879 0.301 17919 43892 1 107 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.394 -0.294 17919 43893 1 107 . 1 1 58 58 ASP H H 58 7.930 7.930 7.614 0.316 17919 43894 1 107 . 1 1 59 59 TYR N N 59 115.510 115.510 116.032 -0.522 17919 43895 1 107 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.531 0.139 17919 43896 1 107 . 1 1 59 59 TYR C C 59 174.700 174.700 175.080 -0.380 17919 43897 1 107 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.971 0.279 17919 43898 1 107 . 1 1 59 59 TYR CB C 59 40.070 40.070 37.786 2.284 17919 43899 1 107 . 1 1 59 59 TYR H H 59 7.250 7.250 7.323 -0.073 17919 43900 1 107 . 1 1 60 60 ASN N N 60 115.900 115.900 113.375 2.525 17919 43901 1 107 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.344 0.011 17919 43902 1 107 . 1 1 60 60 ASN C C 60 174.340 174.340 174.485 -0.145 17919 43903 1 107 . 1 1 60 60 ASN CA C 60 54.120 54.120 53.961 0.159 17919 43904 1 107 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.357 0.053 17919 43905 1 107 . 1 1 60 60 ASN H H 60 8.150 8.150 7.622 0.528 17919 43906 1 107 . 1 1 61 61 ILE N N 61 118.600 118.600 119.889 -1.289 17919 43907 1 107 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.647 -0.254 17919 43908 1 107 . 1 1 61 61 ILE C C 61 174.610 174.610 176.101 -1.491 17919 43909 1 107 . 1 1 61 61 ILE CA C 61 62.420 62.420 60.910 1.510 17919 43910 1 107 . 1 1 61 61 ILE CB C 61 36.740 36.740 36.030 0.710 17919 43911 1 107 . 1 1 61 61 ILE H H 61 7.250 7.250 8.028 -0.778 17919 43912 1 107 . 1 1 62 62 GLN N N 62 124.740 124.740 127.312 -2.572 17919 43913 1 107 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.472 0.034 17919 43914 1 107 . 1 1 62 62 GLN C C 62 175.970 175.970 176.446 -0.476 17919 43915 1 107 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.586 0.074 17919 43916 1 107 . 1 1 62 62 GLN CB C 62 31.650 31.650 30.283 1.367 17919 43917 1 107 . 1 1 62 62 GLN H H 62 7.610 7.610 8.056 -0.446 17919 43918 1 107 . 1 1 63 63 LYS N N 63 120.300 120.300 122.215 -1.915 17919 43919 1 107 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.911 0.090 17919 43920 1 107 . 1 1 63 63 LYS C C 63 175.810 175.810 177.000 -1.190 17919 43921 1 107 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.581 0.209 17919 43922 1 107 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.023 0.627 17919 43923 1 107 . 1 1 63 63 LYS H H 63 8.490 8.490 8.754 -0.264 17919 43924 1 107 . 1 1 64 64 GLU N N 64 113.950 113.950 119.411 -5.461 17919 43925 1 107 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.629 -0.164 17919 43926 1 107 . 1 1 64 64 GLU C C 64 175.250 175.250 175.836 -0.586 17919 43927 1 107 . 1 1 64 64 GLU CA C 64 57.890 57.890 58.044 -0.154 17919 43928 1 107 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.722 -2.822 17919 43929 1 107 . 1 1 64 64 GLU H H 64 9.280 9.280 8.805 0.475 17919 43930 1 107 . 1 1 65 65 SER N N 65 114.730 114.730 114.500 0.230 17919 43931 1 107 . 1 1 65 65 SER HA H 65 4.640 4.640 4.476 0.164 17919 43932 1 107 . 1 1 65 65 SER C C 65 172.160 172.160 174.025 -1.865 17919 43933 1 107 . 1 1 65 65 SER CA C 65 60.890 60.890 60.021 0.869 17919 43934 1 107 . 1 1 65 65 SER CB C 65 64.910 64.910 64.088 0.822 17919 43935 1 107 . 1 1 65 65 SER H H 65 7.670 7.670 7.599 0.071 17919 43936 1 107 . 1 1 66 66 THR N N 66 117.110 117.110 116.983 0.127 17919 43937 1 107 . 1 1 66 66 THR HA H 66 5.270 5.270 4.991 0.279 17919 43938 1 107 . 1 1 66 66 THR C C 66 173.950 173.950 173.737 0.213 17919 43939 1 107 . 1 1 66 66 THR CA C 66 62.340 62.340 62.082 0.258 17919 43940 1 107 . 1 1 66 66 THR CB C 66 70.080 70.080 70.490 -0.410 17919 43941 1 107 . 1 1 66 66 THR H H 66 8.730 8.730 8.410 0.320 17919 43942 1 107 . 1 1 67 67 LEU N N 67 127.110 127.110 127.326 -0.216 17919 43943 1 107 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.774 0.286 17919 43944 1 107 . 1 1 67 67 LEU C C 67 175.770 175.770 175.765 0.005 17919 43945 1 107 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.875 0.025 17919 43946 1 107 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.576 0.684 17919 43947 1 107 . 1 1 67 67 LEU H H 67 9.410 9.410 9.072 0.338 17919 43948 1 107 . 1 1 68 68 HIS N N 68 118.380 118.380 123.960 -5.580 17919 43949 1 107 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.004 0.236 17919 43950 1 107 . 1 1 68 68 HIS C C 68 173.150 173.150 174.105 -0.955 17919 43951 1 107 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.118 0.882 17919 43952 1 107 . 1 1 68 68 HIS CB C 68 30.530 30.530 31.212 -0.682 17919 43953 1 107 . 1 1 68 68 HIS H H 68 9.230 9.230 9.118 0.112 17919 43954 1 107 . 1 1 69 69 LEU N N 69 124.460 124.460 131.004 -6.544 17919 43955 1 107 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.715 0.475 17919 43956 1 107 . 1 1 69 69 LEU C C 69 175.270 175.270 174.444 0.826 17919 43957 1 107 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.857 -0.967 17919 43958 1 107 . 1 1 69 69 LEU CB C 69 44.380 44.380 43.006 1.374 17919 43959 1 107 . 1 1 69 69 LEU H H 69 8.340 8.340 8.346 -0.006 17919 43960 1 107 . 1 1 70 70 VAL N N 70 126.940 126.940 127.004 -0.064 17919 43961 1 107 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.258 0.092 17919 43962 1 107 . 1 1 70 70 VAL C C 70 174.000 174.000 174.513 -0.513 17919 43963 1 107 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.566 0.234 17919 43964 1 107 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.226 -0.316 17919 43965 1 107 . 1 1 70 70 VAL H H 70 9.200 9.200 8.849 0.351 17919 43966 1 107 . 1 1 71 71 LEU N N 71 123.130 123.130 123.032 0.098 17919 43967 1 107 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.012 0.048 17919 43968 1 107 . 1 1 71 71 LEU C C 71 177.830 177.830 177.390 0.440 17919 43969 1 107 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.062 0.878 17919 43970 1 107 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.906 -0.056 17919 43971 1 107 . 1 1 71 71 LEU H H 71 8.120 8.120 8.290 -0.170 17919 43972 1 107 . 1 1 72 72 ARG N N 72 123.490 123.490 121.426 2.064 17919 43973 1 107 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.157 0.144 17919 43974 1 107 . 1 1 72 72 ARG C C 72 175.350 175.350 176.395 -1.045 17919 43975 1 107 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.863 -0.253 17919 43976 1 107 . 1 1 72 72 ARG CB C 72 31.350 31.350 31.288 0.062 17919 43977 1 107 . 1 1 72 72 ARG H H 72 8.580 8.580 8.101 0.479 17919 43978 1 108 . 1 1 2 2 GLN N N 2 123.220 123.220 120.656 2.564 17919 43979 1 108 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.211 0.038 17919 43980 1 108 . 1 1 2 2 GLN C C 2 175.920 175.920 174.159 1.761 17919 43981 1 108 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.270 0.810 17919 43982 1 108 . 1 1 2 2 GLN CB C 2 30.760 30.760 31.452 -0.692 17919 43983 1 108 . 1 1 2 2 GLN H H 2 8.900 8.900 8.453 0.447 17919 43984 1 108 . 1 1 3 3 ILE N N 3 115.340 115.340 118.650 -3.310 17919 43985 1 108 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.311 -0.098 17919 43986 1 108 . 1 1 3 3 ILE C C 3 172.450 172.450 173.611 -1.161 17919 43987 1 108 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.283 0.287 17919 43988 1 108 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.293 0.917 17919 43989 1 108 . 1 1 3 3 ILE H H 3 8.320 8.320 8.960 -0.640 17919 43990 1 108 . 1 1 4 4 PHE N N 4 118.110 118.110 120.171 -2.061 17919 43991 1 108 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.251 0.379 17919 43992 1 108 . 1 1 4 4 PHE C C 4 175.320 175.320 175.328 -0.008 17919 43993 1 108 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.994 -0.784 17919 43994 1 108 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.385 0.095 17919 43995 1 108 . 1 1 4 4 PHE H H 4 8.610 8.610 8.229 0.381 17919 43996 1 108 . 1 1 5 5 VAL N N 5 121.000 121.000 121.395 -0.395 17919 43997 1 108 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.609 0.116 17919 43998 1 108 . 1 1 5 5 VAL C C 5 174.870 174.870 175.041 -0.171 17919 43999 1 108 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.237 -0.617 17919 44000 1 108 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.692 -0.462 17919 44001 1 108 . 1 1 5 5 VAL H H 5 9.300 9.300 8.548 0.752 17919 44002 1 108 . 1 1 6 6 LYS N N 6 127.520 127.520 127.878 -0.358 17919 44003 1 108 . 1 1 6 6 LYS HA H 6 5.367 5.367 4.813 0.554 17919 44004 1 108 . 1 1 6 6 LYS C C 6 177.140 177.140 176.541 0.599 17919 44005 1 108 . 1 1 6 6 LYS CA C 6 54.520 54.520 53.749 0.770 17919 44006 1 108 . 1 1 6 6 LYS CB C 6 35.050 35.050 33.084 1.966 17919 44007 1 108 . 1 1 6 6 LYS H H 6 8.820 8.820 8.399 0.421 17919 44008 1 108 . 1 1 7 7 THR N N 7 115.400 115.400 116.598 -1.198 17919 44009 1 108 . 1 1 7 7 THR HA H 7 4.970 4.970 4.495 0.475 17919 44010 1 108 . 1 1 7 7 THR C C 7 176.910 176.910 176.723 0.187 17919 44011 1 108 . 1 1 7 7 THR CA C 7 60.470 60.470 60.842 -0.372 17919 44012 1 108 . 1 1 7 7 THR CB C 7 70.630 70.630 69.942 0.688 17919 44013 1 108 . 1 1 7 7 THR H H 7 8.730 8.730 7.916 0.814 17919 44014 1 108 . 1 1 8 8 LEU N N 8 121.330 121.330 120.326 1.004 17919 44015 1 108 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.120 0.190 17919 44016 1 108 . 1 1 8 8 LEU C C 8 178.800 178.800 177.670 1.130 17919 44017 1 108 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.475 0.105 17919 44018 1 108 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.730 0.240 17919 44019 1 108 . 1 1 8 8 LEU H H 8 9.100 9.100 8.846 0.254 17919 44020 1 108 . 1 1 9 9 THR N N 9 105.590 105.590 105.805 -0.215 17919 44021 1 108 . 1 1 9 9 THR HA H 9 4.428 4.428 4.315 0.113 17919 44022 1 108 . 1 1 9 9 THR C C 9 175.520 175.520 175.882 -0.362 17919 44023 1 108 . 1 1 9 9 THR CA C 9 61.400 61.400 62.074 -0.674 17919 44024 1 108 . 1 1 9 9 THR CB C 9 69.140 69.140 69.070 0.070 17919 44025 1 108 . 1 1 9 9 THR H H 9 7.630 7.630 7.313 0.317 17919 44026 1 108 . 1 1 10 10 GLY N N 10 108.890 108.890 110.381 -1.491 17919 44027 1 108 . 1 1 10 10 GLY C C 10 174.070 174.070 173.332 0.738 17919 44028 1 108 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.295 0.165 17919 44029 1 108 . 1 1 10 10 GLY H H 10 7.810 7.810 8.448 -0.638 17919 44030 1 108 . 1 1 11 11 LYS N N 11 121.600 121.600 123.346 -1.746 17919 44031 1 108 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.104 0.257 17919 44032 1 108 . 1 1 11 11 LYS C C 11 175.940 175.940 175.628 0.312 17919 44033 1 108 . 1 1 11 11 LYS CA C 11 56.280 56.280 57.167 -0.887 17919 44034 1 108 . 1 1 11 11 LYS CB C 11 33.200 33.200 32.451 0.749 17919 44035 1 108 . 1 1 11 11 LYS H H 11 7.280 7.280 7.722 -0.442 17919 44036 1 108 . 1 1 12 12 THR N N 12 120.440 120.440 119.408 1.032 17919 44037 1 108 . 1 1 12 12 THR HA H 12 5.046 5.046 5.005 0.041 17919 44038 1 108 . 1 1 12 12 THR C C 12 174.320 174.320 174.755 -0.435 17919 44039 1 108 . 1 1 12 12 THR CA C 12 62.390 62.390 61.531 0.859 17919 44040 1 108 . 1 1 12 12 THR CB C 12 69.910 69.910 69.741 0.169 17919 44041 1 108 . 1 1 12 12 THR H H 12 8.650 8.650 8.366 0.284 17919 44042 1 108 . 1 1 13 13 ILE N N 13 127.110 127.110 121.477 5.633 17919 44043 1 108 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.768 -0.224 17919 44044 1 108 . 1 1 13 13 ILE C C 13 175.220 175.220 174.290 0.930 17919 44045 1 108 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.492 0.488 17919 44046 1 108 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.148 0.802 17919 44047 1 108 . 1 1 13 13 ILE H H 13 9.450 9.450 8.560 0.890 17919 44048 1 108 . 1 1 14 14 THR N N 14 121.520 121.520 120.487 1.033 17919 44049 1 108 . 1 1 14 14 THR HA H 14 4.964 4.964 4.946 0.018 17919 44050 1 108 . 1 1 14 14 THR C C 14 173.790 173.790 173.883 -0.093 17919 44051 1 108 . 1 1 14 14 THR CA C 14 61.940 61.940 62.014 -0.074 17919 44052 1 108 . 1 1 14 14 THR CB C 14 69.650 69.650 70.168 -0.518 17919 44053 1 108 . 1 1 14 14 THR H H 14 8.710 8.710 8.305 0.405 17919 44054 1 108 . 1 1 15 15 LEU N N 15 124.800 124.800 126.548 -1.748 17919 44055 1 108 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.729 0.051 17919 44056 1 108 . 1 1 15 15 LEU C C 15 174.670 174.670 174.888 -0.218 17919 44057 1 108 . 1 1 15 15 LEU CA C 15 52.830 52.830 54.266 -1.436 17919 44058 1 108 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.934 1.136 17919 44059 1 108 . 1 1 15 15 LEU H H 15 8.710 8.710 8.764 -0.054 17919 44060 1 108 . 1 1 16 16 GLU N N 16 122.160 122.160 122.900 -0.740 17919 44061 1 108 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.319 -0.402 17919 44062 1 108 . 1 1 16 16 GLU C C 16 175.860 175.860 175.829 0.031 17919 44063 1 108 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.385 -0.565 17919 44064 1 108 . 1 1 16 16 GLU CB C 16 29.450 29.450 31.524 -2.074 17919 44065 1 108 . 1 1 16 16 GLU H H 16 8.140 8.140 8.658 -0.518 17919 44066 1 108 . 1 1 17 17 VAL N N 17 117.210 117.210 120.459 -3.249 17919 44067 1 108 . 1 1 17 17 VAL HA H 17 4.714 4.714 5.008 -0.294 17919 44068 1 108 . 1 1 17 17 VAL C C 17 174.160 174.160 174.367 -0.207 17919 44069 1 108 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.315 -0.885 17919 44070 1 108 . 1 1 17 17 VAL CB C 17 36.400 36.400 34.945 1.455 17919 44071 1 108 . 1 1 17 17 VAL H H 17 8.900 8.900 8.901 -0.001 17919 44072 1 108 . 1 1 18 18 GLU N N 18 118.990 118.990 119.340 -0.350 17919 44073 1 108 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.910 0.169 17919 44074 1 108 . 1 1 18 18 GLU C C 18 176.160 176.160 175.045 1.115 17919 44075 1 108 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.124 -0.404 17919 44076 1 108 . 1 1 18 18 GLU CB C 18 30.310 30.310 31.412 -1.102 17919 44077 1 108 . 1 1 18 18 GLU H H 18 8.640 8.640 8.683 -0.043 17919 44078 1 108 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.221 -0.080 17919 44079 1 108 . 1 1 19 19 PRO C C 19 175.310 175.310 177.731 -2.421 17919 44080 1 108 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.512 -0.042 17919 44081 1 108 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.952 -0.002 17919 44082 1 108 . 1 1 20 20 SER N N 20 103.400 103.400 109.860 -6.460 17919 44083 1 108 . 1 1 20 20 SER HA H 20 4.370 4.370 4.344 0.026 17919 44084 1 108 . 1 1 20 20 SER C C 20 174.660 174.660 174.391 0.269 17919 44085 1 108 . 1 1 20 20 SER CA C 20 57.400 57.400 59.348 -1.948 17919 44086 1 108 . 1 1 20 20 SER CB C 20 63.370 63.370 63.239 0.131 17919 44087 1 108 . 1 1 20 20 SER H H 20 7.040 7.040 7.928 -0.888 17919 44088 1 108 . 1 1 21 21 ASP N N 21 123.480 123.480 123.488 -0.008 17919 44089 1 108 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.590 0.105 17919 44090 1 108 . 1 1 21 21 ASP C C 21 176.360 176.360 175.806 0.554 17919 44091 1 108 . 1 1 21 21 ASP CA C 21 55.700 55.700 56.206 -0.506 17919 44092 1 108 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.641 -0.841 17919 44093 1 108 . 1 1 21 21 ASP H H 21 8.030 8.030 8.009 0.021 17919 44094 1 108 . 1 1 22 22 THR N N 22 108.800 108.800 112.208 -3.408 17919 44095 1 108 . 1 1 22 22 THR HA H 22 4.920 4.920 4.721 0.199 17919 44096 1 108 . 1 1 22 22 THR C C 22 176.750 176.750 176.316 0.434 17919 44097 1 108 . 1 1 22 22 THR CA C 22 59.690 59.690 61.686 -1.996 17919 44098 1 108 . 1 1 22 22 THR CB C 22 71.200 71.200 70.073 1.127 17919 44099 1 108 . 1 1 22 22 THR H H 22 7.900 7.900 8.198 -0.298 17919 44100 1 108 . 1 1 23 23 ILE N N 23 121.190 121.190 121.913 -0.723 17919 44101 1 108 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.716 -0.059 17919 44102 1 108 . 1 1 23 23 ILE C C 23 179.040 179.040 177.885 1.155 17919 44103 1 108 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.680 -1.420 17919 44104 1 108 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.478 -2.128 17919 44105 1 108 . 1 1 23 23 ILE H H 23 8.560 8.560 8.904 -0.344 17919 44106 1 108 . 1 1 24 24 GLU N N 24 120.830 120.830 119.308 1.522 17919 44107 1 108 . 1 1 24 24 GLU HA H 24 3.917 3.917 4.016 -0.099 17919 44108 1 108 . 1 1 24 24 GLU C C 24 178.640 178.640 178.302 0.338 17919 44109 1 108 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.256 0.964 17919 44110 1 108 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.480 -1.200 17919 44111 1 108 . 1 1 24 24 GLU H H 24 9.760 9.760 8.050 1.710 17919 44112 1 108 . 1 1 25 25 ASN N N 25 120.570 120.570 118.433 2.137 17919 44113 1 108 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.599 -0.074 17919 44114 1 108 . 1 1 25 25 ASN C C 25 178.380 178.380 177.934 0.446 17919 44115 1 108 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.751 0.309 17919 44116 1 108 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.249 0.201 17919 44117 1 108 . 1 1 25 25 ASN H H 25 7.920 7.920 7.802 0.118 17919 44118 1 108 . 1 1 26 26 VAL N N 26 121.710 121.710 121.039 0.671 17919 44119 1 108 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.474 -0.077 17919 44120 1 108 . 1 1 26 26 VAL C C 26 177.950 177.950 177.889 0.061 17919 44121 1 108 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.694 0.966 17919 44122 1 108 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.168 -0.328 17919 44123 1 108 . 1 1 26 26 VAL H H 26 8.070 8.070 7.959 0.111 17919 44124 1 108 . 1 1 27 27 LYS N N 27 118.860 118.860 119.915 -1.055 17919 44125 1 108 . 1 1 27 27 LYS HA H 27 4.580 4.580 3.901 0.679 17919 44126 1 108 . 1 1 27 27 LYS C C 27 180.550 180.550 179.021 1.529 17919 44127 1 108 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.550 -0.300 17919 44128 1 108 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.128 1.602 17919 44129 1 108 . 1 1 27 27 LYS H H 27 8.560 8.560 7.782 0.778 17919 44130 1 108 . 1 1 28 28 ALA N N 28 123.440 123.440 121.241 2.199 17919 44131 1 108 . 1 1 28 28 ALA HA H 28 4.160 4.160 3.950 0.210 17919 44132 1 108 . 1 1 28 28 ALA C C 28 180.300 180.300 179.211 1.089 17919 44133 1 108 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.403 -0.033 17919 44134 1 108 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.364 -0.654 17919 44135 1 108 . 1 1 28 28 ALA H H 28 8.060 8.060 8.818 -0.758 17919 44136 1 108 . 1 1 29 29 LYS N N 29 119.940 119.940 118.232 1.708 17919 44137 1 108 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.049 0.158 17919 44138 1 108 . 1 1 29 29 LYS C C 29 180.320 180.320 178.763 1.557 17919 44139 1 108 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.204 0.446 17919 44140 1 108 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.197 1.093 17919 44141 1 108 . 1 1 29 29 LYS H H 29 7.850 7.850 7.971 -0.121 17919 44142 1 108 . 1 1 30 30 ILE N N 30 121.080 121.080 120.497 0.583 17919 44143 1 108 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.613 -0.106 17919 44144 1 108 . 1 1 30 30 ILE C C 30 178.310 178.310 177.401 0.909 17919 44145 1 108 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.457 0.694 17919 44146 1 108 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.447 -0.647 17919 44147 1 108 . 1 1 30 30 ILE H H 30 8.280 8.280 7.184 1.096 17919 44148 1 108 . 1 1 31 31 GLN N N 31 123.490 123.490 120.026 3.464 17919 44149 1 108 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.054 -0.225 17919 44150 1 108 . 1 1 31 31 GLN C C 31 178.890 178.890 178.177 0.713 17919 44151 1 108 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.256 0.744 17919 44152 1 108 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.237 -0.517 17919 44153 1 108 . 1 1 31 31 GLN H H 31 8.580 8.580 7.980 0.600 17919 44154 1 108 . 1 1 32 32 ASP N N 32 119.360 119.360 119.178 0.182 17919 44155 1 108 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.418 -0.064 17919 44156 1 108 . 1 1 32 32 ASP C C 32 177.250 177.250 178.256 -1.006 17919 44157 1 108 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.894 0.296 17919 44158 1 108 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.943 -0.363 17919 44159 1 108 . 1 1 32 32 ASP H H 32 8.010 8.010 8.038 -0.028 17919 44160 1 108 . 1 1 33 33 LYS N N 33 115.130 115.130 118.532 -3.402 17919 44161 1 108 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.266 0.071 17919 44162 1 108 . 1 1 33 33 LYS C C 33 177.870 177.870 178.379 -0.509 17919 44163 1 108 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.044 0.006 17919 44164 1 108 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.294 0.876 17919 44165 1 108 . 1 1 33 33 LYS H H 33 7.430 7.430 7.651 -0.221 17919 44166 1 108 . 1 1 34 34 GLU N N 34 113.870 113.870 116.432 -2.562 17919 44167 1 108 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.497 0.128 17919 44168 1 108 . 1 1 34 34 GLU C C 34 177.840 177.840 176.573 1.267 17919 44169 1 108 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.123 -0.953 17919 44170 1 108 . 1 1 34 34 GLU CB C 34 32.660 32.660 30.940 1.720 17919 44171 1 108 . 1 1 34 34 GLU H H 34 8.740 8.740 8.465 0.275 17919 44172 1 108 . 1 1 35 35 GLY N N 35 108.650 108.650 108.904 -0.254 17919 44173 1 108 . 1 1 35 35 GLY C C 35 173.960 173.960 174.130 -0.170 17919 44174 1 108 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.439 0.641 17919 44175 1 108 . 1 1 35 35 GLY H H 35 8.530 8.530 7.888 0.642 17919 44176 1 108 . 1 1 36 36 ILE N N 36 119.880 119.880 120.097 -0.217 17919 44177 1 108 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.402 0.043 17919 44178 1 108 . 1 1 36 36 ILE C C 36 173.590 173.590 173.902 -0.312 17919 44179 1 108 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.625 0.125 17919 44180 1 108 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.806 1.774 17919 44181 1 108 . 1 1 36 36 ILE H H 36 6.150 6.150 7.517 -1.367 17919 44182 1 108 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.585 0.049 17919 44183 1 108 . 1 1 37 37 PRO C C 37 176.940 176.940 176.049 0.891 17919 44184 1 108 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.889 -0.229 17919 44185 1 108 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.127 0.723 17919 44186 1 108 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.169 -0.052 17919 44187 1 108 . 1 1 38 38 PRO C C 38 178.320 178.320 177.961 0.359 17919 44188 1 108 . 1 1 38 38 PRO CA C 38 66.260 66.260 66.013 0.247 17919 44189 1 108 . 1 1 38 38 PRO CB C 38 32.890 32.890 32.051 0.839 17919 44190 1 108 . 1 1 39 39 ASP N N 39 113.380 113.380 113.745 -0.365 17919 44191 1 108 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.526 -0.096 17919 44192 1 108 . 1 1 39 39 ASP C C 39 177.090 177.090 177.400 -0.310 17919 44193 1 108 . 1 1 39 39 ASP CA C 39 55.640 55.640 55.067 0.573 17919 44194 1 108 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.402 -0.862 17919 44195 1 108 . 1 1 39 39 ASP H H 39 8.550 8.550 8.490 0.060 17919 44196 1 108 . 1 1 40 40 GLN N N 40 116.780 116.780 117.436 -0.656 17919 44197 1 108 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.199 0.265 17919 44198 1 108 . 1 1 40 40 GLN C C 40 175.380 175.380 175.947 -0.567 17919 44199 1 108 . 1 1 40 40 GLN CA C 40 55.640 55.640 58.028 -2.388 17919 44200 1 108 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.684 0.456 17919 44201 1 108 . 1 1 40 40 GLN H H 40 7.820 7.820 7.881 -0.061 17919 44202 1 108 . 1 1 41 41 GLN N N 41 117.720 117.720 117.484 0.236 17919 44203 1 108 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.640 -0.396 17919 44204 1 108 . 1 1 41 41 GLN C C 41 176.300 176.300 175.863 0.437 17919 44205 1 108 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.926 0.544 17919 44206 1 108 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.754 1.896 17919 44207 1 108 . 1 1 41 41 GLN H H 41 7.480 7.480 7.479 0.001 17919 44208 1 108 . 1 1 42 42 ARG N N 42 122.680 122.680 122.008 0.672 17919 44209 1 108 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.768 -0.268 17919 44210 1 108 . 1 1 42 42 ARG C C 42 174.050 174.050 174.282 -0.232 17919 44211 1 108 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.810 0.240 17919 44212 1 108 . 1 1 42 42 ARG CB C 42 31.750 31.750 34.672 -2.921 17919 44213 1 108 . 1 1 42 42 ARG H H 42 8.530 8.530 8.725 -0.195 17919 44214 1 108 . 1 1 43 43 LEU N N 43 124.040 124.040 122.079 1.961 17919 44215 1 108 . 1 1 43 43 LEU C C 43 175.290 175.290 175.647 -0.357 17919 44216 1 108 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.620 -0.640 17919 44217 1 108 . 1 1 43 43 LEU CB C 43 45.790 45.790 45.252 0.538 17919 44218 1 108 . 1 1 43 43 LEU H H 43 8.820 8.820 8.777 0.043 17919 44219 1 108 . 1 1 44 44 ILE N N 44 121.920 121.920 121.430 0.490 17919 44220 1 108 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.797 0.195 17919 44221 1 108 . 1 1 44 44 ILE C C 44 176.060 176.060 174.418 1.642 17919 44222 1 108 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.987 -1.007 17919 44223 1 108 . 1 1 44 44 ILE CB C 44 41.420 41.420 42.370 -0.950 17919 44224 1 108 . 1 1 44 44 ILE H H 44 9.030 9.030 8.406 0.624 17919 44225 1 108 . 1 1 45 45 PHE N N 45 125.390 125.390 127.298 -1.908 17919 44226 1 108 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.046 -0.001 17919 44227 1 108 . 1 1 45 45 PHE C C 45 174.470 174.470 174.118 0.352 17919 44228 1 108 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.759 0.261 17919 44229 1 108 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.017 0.743 17919 44230 1 108 . 1 1 45 45 PHE H H 45 8.830 8.830 8.327 0.503 17919 44231 1 108 . 1 1 46 46 ALA N N 46 132.200 132.200 129.281 2.919 17919 44232 1 108 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.581 0.109 17919 44233 1 108 . 1 1 46 46 ALA C C 46 177.290 177.290 177.284 0.006 17919 44234 1 108 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.862 -0.322 17919 44235 1 108 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.186 0.384 17919 44236 1 108 . 1 1 46 46 ALA H H 46 8.810 8.810 9.025 -0.215 17919 44237 1 108 . 1 1 47 47 GLY N N 47 102.340 102.340 103.345 -1.005 17919 44238 1 108 . 1 1 47 47 GLY C C 47 173.810 173.810 174.549 -0.739 17919 44239 1 108 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.238 0.112 17919 44240 1 108 . 1 1 47 47 GLY H H 47 8.130 8.130 8.527 -0.397 17919 44241 1 108 . 1 1 48 48 LYS N N 48 121.570 121.570 121.753 -0.183 17919 44242 1 108 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.478 0.144 17919 44243 1 108 . 1 1 48 48 LYS C C 48 174.700 174.700 175.690 -0.990 17919 44244 1 108 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.557 -0.007 17919 44245 1 108 . 1 1 48 48 LYS CB C 48 34.530 34.530 32.749 1.781 17919 44246 1 108 . 1 1 48 48 LYS H H 48 7.980 7.980 7.761 0.219 17919 44247 1 108 . 1 1 49 49 GLN N N 49 122.410 122.410 127.038 -4.628 17919 44248 1 108 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.101 0.459 17919 44249 1 108 . 1 1 49 49 GLN C C 49 175.670 175.670 175.464 0.206 17919 44250 1 108 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.210 -0.470 17919 44251 1 108 . 1 1 49 49 GLN CB C 49 29.000 29.000 28.878 0.122 17919 44252 1 108 . 1 1 49 49 GLN H H 49 8.600 8.600 8.765 -0.165 17919 44253 1 108 . 1 1 50 50 LEU N N 50 125.520 125.520 129.952 -4.432 17919 44254 1 108 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.095 -0.005 17919 44255 1 108 . 1 1 50 50 LEU C C 50 176.660 176.660 176.472 0.188 17919 44256 1 108 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.456 -0.216 17919 44257 1 108 . 1 1 50 50 LEU CB C 50 41.570 41.570 40.623 0.947 17919 44258 1 108 . 1 1 50 50 LEU H H 50 8.530 8.530 8.593 -0.063 17919 44259 1 108 . 1 1 51 51 GLU N N 51 122.940 122.940 124.171 -1.231 17919 44260 1 108 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.291 0.197 17919 44261 1 108 . 1 1 51 51 GLU C C 51 175.870 175.870 177.674 -1.804 17919 44262 1 108 . 1 1 51 51 GLU CA C 51 55.960 55.960 56.542 -0.582 17919 44263 1 108 . 1 1 51 51 GLU CB C 51 31.570 31.570 30.182 1.388 17919 44264 1 108 . 1 1 51 51 GLU H H 51 8.400 8.400 8.031 0.369 17919 44265 1 108 . 1 1 52 52 ASP N N 52 120.030 120.030 125.090 -5.060 17919 44266 1 108 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.440 -0.081 17919 44267 1 108 . 1 1 52 52 ASP C C 52 177.330 177.330 177.426 -0.096 17919 44268 1 108 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.527 -0.567 17919 44269 1 108 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.898 -0.048 17919 44270 1 108 . 1 1 52 52 ASP H H 52 8.160 8.160 8.740 -0.580 17919 44271 1 108 . 1 1 53 53 GLY N N 53 106.660 106.660 105.068 1.592 17919 44272 1 108 . 1 1 53 53 GLY C C 53 174.870 174.870 174.366 0.504 17919 44273 1 108 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.886 0.284 17919 44274 1 108 . 1 1 53 53 GLY H H 53 9.390 9.390 8.469 0.921 17919 44275 1 108 . 1 1 54 54 ARG N N 54 119.050 119.050 121.095 -2.045 17919 44276 1 108 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.535 0.160 17919 44277 1 108 . 1 1 54 54 ARG C C 54 175.350 175.350 175.244 0.106 17919 44278 1 108 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.290 0.100 17919 44279 1 108 . 1 1 54 54 ARG CB C 54 32.650 32.650 31.915 0.735 17919 44280 1 108 . 1 1 54 54 ARG H H 54 7.460 7.460 7.591 -0.131 17919 44281 1 108 . 1 1 55 55 THR N N 55 108.400 108.400 113.493 -5.093 17919 44282 1 108 . 1 1 55 55 THR HA H 55 5.240 5.240 5.083 0.157 17919 44283 1 108 . 1 1 55 55 THR C C 55 176.560 176.560 175.855 0.705 17919 44284 1 108 . 1 1 55 55 THR CA C 55 59.690 59.690 60.249 -0.559 17919 44285 1 108 . 1 1 55 55 THR CB C 55 72.260 72.260 70.918 1.342 17919 44286 1 108 . 1 1 55 55 THR H H 55 8.730 8.730 7.857 0.873 17919 44287 1 108 . 1 1 56 56 LEU N N 56 117.920 117.920 121.069 -3.149 17919 44288 1 108 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.021 0.039 17919 44289 1 108 . 1 1 56 56 LEU C C 56 180.810 180.810 178.926 1.884 17919 44290 1 108 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.190 0.520 17919 44291 1 108 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.505 -1.135 17919 44292 1 108 . 1 1 56 56 LEU H H 56 8.140 8.140 8.486 -0.346 17919 44293 1 108 . 1 1 57 57 SER N N 57 113.330 113.330 113.193 0.137 17919 44294 1 108 . 1 1 57 57 SER HA H 57 4.370 4.370 4.123 0.247 17919 44295 1 108 . 1 1 57 57 SER C C 57 178.310 178.310 175.915 2.395 17919 44296 1 108 . 1 1 57 57 SER CA C 57 61.080 61.080 61.101 -0.021 17919 44297 1 108 . 1 1 57 57 SER CB C 57 62.530 62.530 62.612 -0.082 17919 44298 1 108 . 1 1 57 57 SER H H 57 8.470 8.470 7.867 0.603 17919 44299 1 108 . 1 1 58 58 ASP N N 58 124.190 124.190 120.628 3.562 17919 44300 1 108 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.421 -0.125 17919 44301 1 108 . 1 1 58 58 ASP C C 58 177.400 177.400 176.765 0.635 17919 44302 1 108 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.388 0.792 17919 44303 1 108 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.851 -0.751 17919 44304 1 108 . 1 1 58 58 ASP H H 58 7.930 7.930 8.006 -0.076 17919 44305 1 108 . 1 1 59 59 TYR N N 59 115.510 115.510 115.407 0.103 17919 44306 1 108 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.688 -0.018 17919 44307 1 108 . 1 1 59 59 TYR C C 59 174.700 174.700 175.713 -1.013 17919 44308 1 108 . 1 1 59 59 TYR CA C 59 58.250 58.250 56.176 2.074 17919 44309 1 108 . 1 1 59 59 TYR CB C 59 40.070 40.070 39.491 0.579 17919 44310 1 108 . 1 1 59 59 TYR H H 59 7.250 7.250 7.533 -0.283 17919 44311 1 108 . 1 1 60 60 ASN N N 60 115.900 115.900 117.999 -2.099 17919 44312 1 108 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.405 -0.050 17919 44313 1 108 . 1 1 60 60 ASN C C 60 174.340 174.340 173.849 0.491 17919 44314 1 108 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.281 -0.161 17919 44315 1 108 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.411 -0.001 17919 44316 1 108 . 1 1 60 60 ASN H H 60 8.150 8.150 8.095 0.055 17919 44317 1 108 . 1 1 61 61 ILE N N 61 118.600 118.600 119.575 -0.975 17919 44318 1 108 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.731 -0.338 17919 44319 1 108 . 1 1 61 61 ILE C C 61 174.610 174.610 175.224 -0.614 17919 44320 1 108 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.031 0.389 17919 44321 1 108 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.692 -0.952 17919 44322 1 108 . 1 1 61 61 ILE H H 61 7.250 7.250 7.656 -0.406 17919 44323 1 108 . 1 1 62 62 GLN N N 62 124.740 124.740 125.577 -0.837 17919 44324 1 108 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.744 -0.238 17919 44325 1 108 . 1 1 62 62 GLN C C 62 175.970 175.970 175.502 0.468 17919 44326 1 108 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.547 0.113 17919 44327 1 108 . 1 1 62 62 GLN CB C 62 31.650 31.650 33.126 -1.476 17919 44328 1 108 . 1 1 62 62 GLN H H 62 7.610 7.610 7.919 -0.309 17919 44329 1 108 . 1 1 63 63 LYS N N 63 120.300 120.300 120.543 -0.243 17919 44330 1 108 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.849 0.152 17919 44331 1 108 . 1 1 63 63 LYS C C 63 175.810 175.810 177.038 -1.228 17919 44332 1 108 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.959 -0.169 17919 44333 1 108 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.818 0.832 17919 44334 1 108 . 1 1 63 63 LYS H H 63 8.490 8.490 8.823 -0.333 17919 44335 1 108 . 1 1 64 64 GLU N N 64 113.950 113.950 118.163 -4.213 17919 44336 1 108 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.529 -0.064 17919 44337 1 108 . 1 1 64 64 GLU C C 64 175.250 175.250 175.429 -0.179 17919 44338 1 108 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.829 0.061 17919 44339 1 108 . 1 1 64 64 GLU CB C 64 25.900 25.900 27.793 -1.893 17919 44340 1 108 . 1 1 64 64 GLU H H 64 9.280 9.280 8.818 0.462 17919 44341 1 108 . 1 1 65 65 SER N N 65 114.730 114.730 113.906 0.824 17919 44342 1 108 . 1 1 65 65 SER HA H 65 4.640 4.640 4.566 0.074 17919 44343 1 108 . 1 1 65 65 SER C C 65 172.160 172.160 174.070 -1.910 17919 44344 1 108 . 1 1 65 65 SER CA C 65 60.890 60.890 59.330 1.560 17919 44345 1 108 . 1 1 65 65 SER CB C 65 64.910 64.910 64.197 0.713 17919 44346 1 108 . 1 1 65 65 SER H H 65 7.670 7.670 7.397 0.273 17919 44347 1 108 . 1 1 66 66 THR N N 66 117.110 117.110 121.246 -4.136 17919 44348 1 108 . 1 1 66 66 THR HA H 66 5.270 5.270 4.875 0.395 17919 44349 1 108 . 1 1 66 66 THR C C 66 173.950 173.950 173.868 0.082 17919 44350 1 108 . 1 1 66 66 THR CA C 66 62.340 62.340 62.703 -0.363 17919 44351 1 108 . 1 1 66 66 THR CB C 66 70.080 70.080 69.920 0.160 17919 44352 1 108 . 1 1 66 66 THR H H 66 8.730 8.730 8.407 0.323 17919 44353 1 108 . 1 1 67 67 LEU N N 67 127.110 127.110 126.933 0.177 17919 44354 1 108 . 1 1 67 67 LEU HA H 67 5.060 5.060 5.253 -0.193 17919 44355 1 108 . 1 1 67 67 LEU C C 67 175.770 175.770 175.741 0.029 17919 44356 1 108 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.493 0.407 17919 44357 1 108 . 1 1 67 67 LEU CB C 67 44.260 44.260 45.526 -1.266 17919 44358 1 108 . 1 1 67 67 LEU H H 67 9.410 9.410 8.831 0.579 17919 44359 1 108 . 1 1 68 68 HIS N N 68 118.380 118.380 118.801 -0.421 17919 44360 1 108 . 1 1 68 68 HIS HA H 68 5.240 5.240 4.907 0.333 17919 44361 1 108 . 1 1 68 68 HIS C C 68 173.150 173.150 174.388 -1.238 17919 44362 1 108 . 1 1 68 68 HIS CA C 68 55.000 55.000 55.941 -0.941 17919 44363 1 108 . 1 1 68 68 HIS CB C 68 30.530 30.530 31.983 -1.453 17919 44364 1 108 . 1 1 68 68 HIS H H 68 9.230 9.230 8.929 0.301 17919 44365 1 108 . 1 1 69 69 LEU N N 69 124.460 124.460 124.621 -0.161 17919 44366 1 108 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.122 0.068 17919 44367 1 108 . 1 1 69 69 LEU C C 69 175.270 175.270 174.458 0.812 17919 44368 1 108 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.158 -0.269 17919 44369 1 108 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.854 -0.474 17919 44370 1 108 . 1 1 69 69 LEU H H 69 8.340 8.340 8.262 0.078 17919 44371 1 108 . 1 1 70 70 VAL N N 70 126.940 126.940 124.272 2.668 17919 44372 1 108 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.601 -0.251 17919 44373 1 108 . 1 1 70 70 VAL C C 70 174.000 174.000 173.376 0.624 17919 44374 1 108 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.973 0.827 17919 44375 1 108 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.748 -0.838 17919 44376 1 108 . 1 1 70 70 VAL H H 70 9.200 9.200 8.347 0.853 17919 44377 1 108 . 1 1 71 71 LEU N N 71 123.130 123.130 127.216 -4.086 17919 44378 1 108 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.037 0.023 17919 44379 1 108 . 1 1 71 71 LEU C C 71 177.830 177.830 176.076 1.754 17919 44380 1 108 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.744 0.196 17919 44381 1 108 . 1 1 71 71 LEU CB C 71 42.850 42.850 44.430 -1.580 17919 44382 1 108 . 1 1 71 71 LEU H H 71 8.120 8.120 8.513 -0.393 17919 44383 1 108 . 1 1 72 72 ARG N N 72 123.490 123.490 126.684 -3.194 17919 44384 1 108 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.547 -0.246 17919 44385 1 108 . 1 1 72 72 ARG C C 72 175.350 175.350 175.448 -0.098 17919 44386 1 108 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.799 -0.189 17919 44387 1 108 . 1 1 72 72 ARG CB C 72 31.350 31.350 29.449 1.901 17919 44388 1 108 . 1 1 72 72 ARG H H 72 8.580 8.580 8.276 0.304 17919 44389 1 109 . 1 1 2 2 GLN N N 2 123.220 123.220 120.835 2.385 17919 44390 1 109 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.029 0.220 17919 44391 1 109 . 1 1 2 2 GLN C C 2 175.920 175.920 175.417 0.503 17919 44392 1 109 . 1 1 2 2 GLN CA C 2 55.080 55.080 55.700 -0.620 17919 44393 1 109 . 1 1 2 2 GLN CB C 2 30.760 30.760 29.570 1.190 17919 44394 1 109 . 1 1 2 2 GLN H H 2 8.900 8.900 8.431 0.469 17919 44395 1 109 . 1 1 3 3 ILE N N 3 115.340 115.340 117.912 -2.572 17919 44396 1 109 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.790 -0.577 17919 44397 1 109 . 1 1 3 3 ILE C C 3 172.450 172.450 173.601 -1.151 17919 44398 1 109 . 1 1 3 3 ILE CA C 3 59.570 59.570 58.637 0.933 17919 44399 1 109 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.726 0.484 17919 44400 1 109 . 1 1 3 3 ILE H H 3 8.320 8.320 8.304 0.016 17919 44401 1 109 . 1 1 4 4 PHE N N 4 118.110 118.110 119.389 -1.279 17919 44402 1 109 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.282 0.348 17919 44403 1 109 . 1 1 4 4 PHE C C 4 175.320 175.320 174.955 0.365 17919 44404 1 109 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.862 -0.652 17919 44405 1 109 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.268 -0.788 17919 44406 1 109 . 1 1 4 4 PHE H H 4 8.610 8.610 8.663 -0.053 17919 44407 1 109 . 1 1 5 5 VAL N N 5 121.000 121.000 121.628 -0.628 17919 44408 1 109 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.752 -0.027 17919 44409 1 109 . 1 1 5 5 VAL C C 5 174.870 174.870 174.585 0.285 17919 44410 1 109 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.179 -0.559 17919 44411 1 109 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.236 -0.007 17919 44412 1 109 . 1 1 5 5 VAL H H 5 9.300 9.300 9.180 0.120 17919 44413 1 109 . 1 1 6 6 LYS N N 6 127.520 127.520 129.655 -2.135 17919 44414 1 109 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.227 0.140 17919 44415 1 109 . 1 1 6 6 LYS C C 6 177.140 177.140 176.563 0.577 17919 44416 1 109 . 1 1 6 6 LYS CA C 6 54.520 54.520 55.067 -0.547 17919 44417 1 109 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.186 -0.136 17919 44418 1 109 . 1 1 6 6 LYS H H 6 8.820 8.820 9.160 -0.340 17919 44419 1 109 . 1 1 7 7 THR N N 7 115.400 115.400 117.747 -2.347 17919 44420 1 109 . 1 1 7 7 THR HA H 7 4.970 4.970 4.612 0.358 17919 44421 1 109 . 1 1 7 7 THR C C 7 176.910 176.910 176.315 0.595 17919 44422 1 109 . 1 1 7 7 THR CA C 7 60.470 60.470 60.491 -0.021 17919 44423 1 109 . 1 1 7 7 THR CB C 7 70.630 70.630 70.046 0.584 17919 44424 1 109 . 1 1 7 7 THR H H 7 8.730 8.730 8.234 0.496 17919 44425 1 109 . 1 1 8 8 LEU N N 8 121.330 121.330 121.440 -0.110 17919 44426 1 109 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.182 0.128 17919 44427 1 109 . 1 1 8 8 LEU C C 8 178.800 178.800 177.711 1.089 17919 44428 1 109 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.717 -0.137 17919 44429 1 109 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.921 0.049 17919 44430 1 109 . 1 1 8 8 LEU H H 8 9.100 9.100 9.017 0.083 17919 44431 1 109 . 1 1 9 9 THR N N 9 105.590 105.590 108.466 -2.876 17919 44432 1 109 . 1 1 9 9 THR HA H 9 4.428 4.428 4.333 0.095 17919 44433 1 109 . 1 1 9 9 THR C C 9 175.520 175.520 175.781 -0.261 17919 44434 1 109 . 1 1 9 9 THR CA C 9 61.400 61.400 62.175 -0.775 17919 44435 1 109 . 1 1 9 9 THR CB C 9 69.140 69.140 70.341 -1.201 17919 44436 1 109 . 1 1 9 9 THR H H 9 7.630 7.630 7.614 0.016 17919 44437 1 109 . 1 1 10 10 GLY N N 10 108.890 108.890 111.247 -2.357 17919 44438 1 109 . 1 1 10 10 GLY C C 10 174.070 174.070 174.599 -0.529 17919 44439 1 109 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.134 0.326 17919 44440 1 109 . 1 1 10 10 GLY H H 10 7.810 7.810 7.912 -0.102 17919 44441 1 109 . 1 1 11 11 LYS N N 11 121.600 121.600 119.836 1.764 17919 44442 1 109 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.524 -0.163 17919 44443 1 109 . 1 1 11 11 LYS C C 11 175.940 175.940 175.333 0.607 17919 44444 1 109 . 1 1 11 11 LYS CA C 11 56.280 56.280 55.950 0.330 17919 44445 1 109 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.029 0.171 17919 44446 1 109 . 1 1 11 11 LYS H H 11 7.280 7.280 7.681 -0.401 17919 44447 1 109 . 1 1 12 12 THR N N 12 120.440 120.440 115.036 5.404 17919 44448 1 109 . 1 1 12 12 THR HA H 12 5.046 5.046 5.104 -0.058 17919 44449 1 109 . 1 1 12 12 THR C C 12 174.320 174.320 173.926 0.394 17919 44450 1 109 . 1 1 12 12 THR CA C 12 62.390 62.390 61.435 0.955 17919 44451 1 109 . 1 1 12 12 THR CB C 12 69.910 69.910 70.863 -0.953 17919 44452 1 109 . 1 1 12 12 THR H H 12 8.650 8.650 8.197 0.453 17919 44453 1 109 . 1 1 13 13 ILE N N 13 127.110 127.110 125.904 1.206 17919 44454 1 109 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.480 0.064 17919 44455 1 109 . 1 1 13 13 ILE C C 13 175.220 175.220 175.427 -0.207 17919 44456 1 109 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.161 -0.181 17919 44457 1 109 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.317 -0.367 17919 44458 1 109 . 1 1 13 13 ILE H H 13 9.450 9.450 8.883 0.567 17919 44459 1 109 . 1 1 14 14 THR N N 14 121.520 121.520 123.478 -1.958 17919 44460 1 109 . 1 1 14 14 THR HA H 14 4.964 4.964 4.603 0.361 17919 44461 1 109 . 1 1 14 14 THR C C 14 173.790 173.790 173.826 -0.036 17919 44462 1 109 . 1 1 14 14 THR CA C 14 61.940 61.940 62.282 -0.342 17919 44463 1 109 . 1 1 14 14 THR CB C 14 69.650 69.650 69.191 0.459 17919 44464 1 109 . 1 1 14 14 THR H H 14 8.710 8.710 8.307 0.403 17919 44465 1 109 . 1 1 15 15 LEU N N 15 124.800 124.800 127.115 -2.315 17919 44466 1 109 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.658 0.122 17919 44467 1 109 . 1 1 15 15 LEU C C 15 174.670 174.670 175.008 -0.338 17919 44468 1 109 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.450 -0.620 17919 44469 1 109 . 1 1 15 15 LEU CB C 15 47.070 47.070 44.838 2.232 17919 44470 1 109 . 1 1 15 15 LEU H H 15 8.710 8.710 8.088 0.622 17919 44471 1 109 . 1 1 16 16 GLU N N 16 122.160 122.160 122.770 -0.610 17919 44472 1 109 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.884 0.033 17919 44473 1 109 . 1 1 16 16 GLU C C 16 175.860 175.860 175.391 0.469 17919 44474 1 109 . 1 1 16 16 GLU CA C 16 54.820 54.820 53.817 1.003 17919 44475 1 109 . 1 1 16 16 GLU CB C 16 29.450 29.450 29.300 0.150 17919 44476 1 109 . 1 1 16 16 GLU H H 16 8.140 8.140 8.531 -0.391 17919 44477 1 109 . 1 1 17 17 VAL N N 17 117.210 117.210 118.955 -1.745 17919 44478 1 109 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.678 0.036 17919 44479 1 109 . 1 1 17 17 VAL C C 17 174.160 174.160 174.612 -0.452 17919 44480 1 109 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.683 -1.253 17919 44481 1 109 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.142 1.258 17919 44482 1 109 . 1 1 17 17 VAL H H 17 8.900 8.900 8.414 0.486 17919 44483 1 109 . 1 1 18 18 GLU N N 18 118.990 118.990 123.092 -4.102 17919 44484 1 109 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.794 0.285 17919 44485 1 109 . 1 1 18 18 GLU C C 18 176.160 176.160 176.113 0.047 17919 44486 1 109 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.983 -0.263 17919 44487 1 109 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.288 0.021 17919 44488 1 109 . 1 1 18 18 GLU H H 18 8.640 8.640 8.876 -0.236 17919 44489 1 109 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.165 -0.024 17919 44490 1 109 . 1 1 19 19 PRO C C 19 175.310 175.310 178.549 -3.239 17919 44491 1 109 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.942 -0.472 17919 44492 1 109 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.916 0.034 17919 44493 1 109 . 1 1 20 20 SER N N 20 103.400 103.400 111.977 -8.577 17919 44494 1 109 . 1 1 20 20 SER HA H 20 4.370 4.370 4.137 0.233 17919 44495 1 109 . 1 1 20 20 SER C C 20 174.660 174.660 174.955 -0.295 17919 44496 1 109 . 1 1 20 20 SER CA C 20 57.400 57.400 59.953 -2.553 17919 44497 1 109 . 1 1 20 20 SER CB C 20 63.370 63.370 62.739 0.631 17919 44498 1 109 . 1 1 20 20 SER H H 20 7.040 7.040 8.199 -1.159 17919 44499 1 109 . 1 1 21 21 ASP N N 21 123.480 123.480 123.655 -0.175 17919 44500 1 109 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.740 -0.045 17919 44501 1 109 . 1 1 21 21 ASP C C 21 176.360 176.360 175.728 0.632 17919 44502 1 109 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.966 0.734 17919 44503 1 109 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.507 -0.707 17919 44504 1 109 . 1 1 21 21 ASP H H 21 8.030 8.030 7.673 0.357 17919 44505 1 109 . 1 1 22 22 THR N N 22 108.800 108.800 113.545 -4.745 17919 44506 1 109 . 1 1 22 22 THR HA H 22 4.920 4.920 4.498 0.422 17919 44507 1 109 . 1 1 22 22 THR C C 22 176.750 176.750 176.025 0.725 17919 44508 1 109 . 1 1 22 22 THR CA C 22 59.690 59.690 61.938 -2.248 17919 44509 1 109 . 1 1 22 22 THR CB C 22 71.200 71.200 69.752 1.448 17919 44510 1 109 . 1 1 22 22 THR H H 22 7.900 7.900 8.342 -0.442 17919 44511 1 109 . 1 1 23 23 ILE N N 23 121.190 121.190 123.057 -1.867 17919 44512 1 109 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.798 -0.141 17919 44513 1 109 . 1 1 23 23 ILE C C 23 179.040 179.040 177.466 1.574 17919 44514 1 109 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.717 -0.457 17919 44515 1 109 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.530 -2.180 17919 44516 1 109 . 1 1 23 23 ILE H H 23 8.560 8.560 8.439 0.121 17919 44517 1 109 . 1 1 24 24 GLU N N 24 120.830 120.830 120.982 -0.152 17919 44518 1 109 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.889 0.028 17919 44519 1 109 . 1 1 24 24 GLU C C 24 178.640 178.640 178.447 0.193 17919 44520 1 109 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.041 0.180 17919 44521 1 109 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.479 -1.199 17919 44522 1 109 . 1 1 24 24 GLU H H 24 9.760 9.760 8.639 1.121 17919 44523 1 109 . 1 1 25 25 ASN N N 25 120.570 120.570 118.230 2.340 17919 44524 1 109 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.474 0.051 17919 44525 1 109 . 1 1 25 25 ASN C C 25 178.380 178.380 177.942 0.438 17919 44526 1 109 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.254 -0.194 17919 44527 1 109 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.586 -0.136 17919 44528 1 109 . 1 1 25 25 ASN H H 25 7.920 7.920 7.504 0.416 17919 44529 1 109 . 1 1 26 26 VAL N N 26 121.710 121.710 121.007 0.703 17919 44530 1 109 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.691 -0.294 17919 44531 1 109 . 1 1 26 26 VAL C C 26 177.950 177.950 177.606 0.344 17919 44532 1 109 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.091 1.569 17919 44533 1 109 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.330 -0.490 17919 44534 1 109 . 1 1 26 26 VAL H H 26 8.070 8.070 7.968 0.102 17919 44535 1 109 . 1 1 27 27 LYS N N 27 118.860 118.860 119.723 -0.863 17919 44536 1 109 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.163 0.417 17919 44537 1 109 . 1 1 27 27 LYS C C 27 180.550 180.550 179.153 1.397 17919 44538 1 109 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.777 -0.527 17919 44539 1 109 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.192 1.538 17919 44540 1 109 . 1 1 27 27 LYS H H 27 8.560 8.560 8.465 0.095 17919 44541 1 109 . 1 1 28 28 ALA N N 28 123.440 123.440 122.455 0.985 17919 44542 1 109 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.025 0.135 17919 44543 1 109 . 1 1 28 28 ALA C C 28 180.300 180.300 179.038 1.262 17919 44544 1 109 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.103 0.267 17919 44545 1 109 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.346 -0.636 17919 44546 1 109 . 1 1 28 28 ALA H H 28 8.060 8.060 8.481 -0.421 17919 44547 1 109 . 1 1 29 29 LYS N N 29 119.940 119.940 120.124 -0.184 17919 44548 1 109 . 1 1 29 29 LYS HA H 29 4.207 4.207 3.870 0.337 17919 44549 1 109 . 1 1 29 29 LYS C C 29 180.320 180.320 179.184 1.136 17919 44550 1 109 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.547 0.103 17919 44551 1 109 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.270 1.020 17919 44552 1 109 . 1 1 29 29 LYS H H 29 7.850 7.850 7.880 -0.030 17919 44553 1 109 . 1 1 30 30 ILE N N 30 121.080 121.080 119.435 1.645 17919 44554 1 109 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.556 -0.049 17919 44555 1 109 . 1 1 30 30 ILE C C 30 178.310 178.310 177.531 0.779 17919 44556 1 109 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.490 0.660 17919 44557 1 109 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.776 -0.976 17919 44558 1 109 . 1 1 30 30 ILE H H 30 8.280 8.280 8.326 -0.046 17919 44559 1 109 . 1 1 31 31 GLN N N 31 123.490 123.490 119.798 3.692 17919 44560 1 109 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.025 -0.196 17919 44561 1 109 . 1 1 31 31 GLN C C 31 178.890 178.890 178.385 0.505 17919 44562 1 109 . 1 1 31 31 GLN CA C 31 60.000 60.000 58.965 1.035 17919 44563 1 109 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.431 -0.711 17919 44564 1 109 . 1 1 31 31 GLN H H 31 8.580 8.580 7.968 0.612 17919 44565 1 109 . 1 1 32 32 ASP N N 32 119.360 119.360 118.620 0.740 17919 44566 1 109 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.463 -0.109 17919 44567 1 109 . 1 1 32 32 ASP C C 32 177.250 177.250 177.453 -0.203 17919 44568 1 109 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.343 0.847 17919 44569 1 109 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.835 -0.255 17919 44570 1 109 . 1 1 32 32 ASP H H 32 8.010 8.010 8.327 -0.317 17919 44571 1 109 . 1 1 33 33 LYS N N 33 115.130 115.130 117.870 -2.740 17919 44572 1 109 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.445 -0.108 17919 44573 1 109 . 1 1 33 33 LYS C C 33 177.870 177.870 177.564 0.306 17919 44574 1 109 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.501 0.549 17919 44575 1 109 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.602 0.568 17919 44576 1 109 . 1 1 33 33 LYS H H 33 7.430 7.430 7.614 -0.184 17919 44577 1 109 . 1 1 34 34 GLU N N 34 113.870 113.870 116.023 -2.153 17919 44578 1 109 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.492 0.133 17919 44579 1 109 . 1 1 34 34 GLU C C 34 177.840 177.840 176.955 0.885 17919 44580 1 109 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.223 -1.053 17919 44581 1 109 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.866 0.794 17919 44582 1 109 . 1 1 34 34 GLU H H 34 8.740 8.740 7.966 0.774 17919 44583 1 109 . 1 1 35 35 GLY N N 35 108.650 108.650 108.136 0.514 17919 44584 1 109 . 1 1 35 35 GLY C C 35 173.960 173.960 173.913 0.047 17919 44585 1 109 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.155 0.925 17919 44586 1 109 . 1 1 35 35 GLY H H 35 8.530 8.530 7.947 0.583 17919 44587 1 109 . 1 1 36 36 ILE N N 36 119.880 119.880 121.268 -1.388 17919 44588 1 109 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.361 0.084 17919 44589 1 109 . 1 1 36 36 ILE C C 36 173.590 173.590 173.834 -0.244 17919 44590 1 109 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.813 -0.063 17919 44591 1 109 . 1 1 36 36 ILE CB C 36 40.580 40.580 39.258 1.322 17919 44592 1 109 . 1 1 36 36 ILE H H 36 6.150 6.150 7.444 -1.294 17919 44593 1 109 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.535 0.099 17919 44594 1 109 . 1 1 37 37 PRO C C 37 176.940 176.940 176.145 0.795 17919 44595 1 109 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.972 -0.312 17919 44596 1 109 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.397 0.453 17919 44597 1 109 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.080 0.037 17919 44598 1 109 . 1 1 38 38 PRO C C 38 178.320 178.320 178.398 -0.078 17919 44599 1 109 . 1 1 38 38 PRO CA C 38 66.260 66.260 66.036 0.224 17919 44600 1 109 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.827 1.063 17919 44601 1 109 . 1 1 39 39 ASP N N 39 113.380 113.380 114.945 -1.565 17919 44602 1 109 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.332 0.098 17919 44603 1 109 . 1 1 39 39 ASP C C 39 177.090 177.090 177.490 -0.400 17919 44604 1 109 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.900 -1.260 17919 44605 1 109 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.351 -0.811 17919 44606 1 109 . 1 1 39 39 ASP H H 39 8.550 8.550 8.722 -0.172 17919 44607 1 109 . 1 1 40 40 GLN N N 40 116.780 116.780 116.399 0.381 17919 44608 1 109 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.439 0.025 17919 44609 1 109 . 1 1 40 40 GLN C C 40 175.380 175.380 175.098 0.282 17919 44610 1 109 . 1 1 40 40 GLN CA C 40 55.640 55.640 54.979 0.661 17919 44611 1 109 . 1 1 40 40 GLN CB C 40 30.140 30.140 28.689 1.451 17919 44612 1 109 . 1 1 40 40 GLN H H 40 7.820 7.820 7.666 0.154 17919 44613 1 109 . 1 1 41 41 GLN N N 41 117.720 117.720 118.832 -1.112 17919 44614 1 109 . 1 1 41 41 GLN HA H 41 4.244 4.244 5.227 -0.983 17919 44615 1 109 . 1 1 41 41 GLN C C 41 176.300 176.300 175.044 1.256 17919 44616 1 109 . 1 1 41 41 GLN CA C 41 56.470 56.470 54.821 1.649 17919 44617 1 109 . 1 1 41 41 GLN CB C 41 31.650 31.650 31.754 -0.104 17919 44618 1 109 . 1 1 41 41 GLN H H 41 7.480 7.480 7.441 0.039 17919 44619 1 109 . 1 1 42 42 ARG N N 42 122.680 122.680 122.501 0.179 17919 44620 1 109 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.692 -0.192 17919 44621 1 109 . 1 1 42 42 ARG C C 42 174.050 174.050 174.524 -0.474 17919 44622 1 109 . 1 1 42 42 ARG CA C 42 55.050 55.050 53.810 1.240 17919 44623 1 109 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.017 -1.267 17919 44624 1 109 . 1 1 42 42 ARG H H 42 8.530 8.530 8.573 -0.043 17919 44625 1 109 . 1 1 43 43 LEU N N 43 124.040 124.040 123.010 1.030 17919 44626 1 109 . 1 1 43 43 LEU C C 43 175.290 175.290 175.390 -0.100 17919 44627 1 109 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.378 -1.398 17919 44628 1 109 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.929 0.861 17919 44629 1 109 . 1 1 43 43 LEU H H 43 8.820 8.820 8.677 0.143 17919 44630 1 109 . 1 1 44 44 ILE N N 44 121.920 121.920 121.289 0.631 17919 44631 1 109 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.003 -0.011 17919 44632 1 109 . 1 1 44 44 ILE C C 44 176.060 176.060 174.312 1.748 17919 44633 1 109 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.333 -1.353 17919 44634 1 109 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.390 0.030 17919 44635 1 109 . 1 1 44 44 ILE H H 44 9.030 9.030 7.892 1.138 17919 44636 1 109 . 1 1 45 45 PHE N N 45 125.390 125.390 127.973 -2.583 17919 44637 1 109 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.846 0.199 17919 44638 1 109 . 1 1 45 45 PHE C C 45 174.470 174.470 174.760 -0.290 17919 44639 1 109 . 1 1 45 45 PHE CA C 45 57.020 57.020 55.521 1.499 17919 44640 1 109 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.873 0.887 17919 44641 1 109 . 1 1 45 45 PHE H H 45 8.830 8.830 8.319 0.511 17919 44642 1 109 . 1 1 46 46 ALA N N 46 132.200 132.200 130.054 2.146 17919 44643 1 109 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.684 0.006 17919 44644 1 109 . 1 1 46 46 ALA C C 46 177.290 177.290 177.480 -0.190 17919 44645 1 109 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.865 -0.325 17919 44646 1 109 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.650 -0.080 17919 44647 1 109 . 1 1 46 46 ALA H H 46 8.810 8.810 8.728 0.082 17919 44648 1 109 . 1 1 47 47 GLY N N 47 102.340 102.340 104.453 -2.113 17919 44649 1 109 . 1 1 47 47 GLY C C 47 173.810 173.810 174.071 -0.261 17919 44650 1 109 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.540 -0.190 17919 44651 1 109 . 1 1 47 47 GLY H H 47 8.130 8.130 8.508 -0.378 17919 44652 1 109 . 1 1 48 48 LYS N N 48 121.570 121.570 119.734 1.836 17919 44653 1 109 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.592 0.030 17919 44654 1 109 . 1 1 48 48 LYS C C 48 174.700 174.700 175.715 -1.015 17919 44655 1 109 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.849 -0.299 17919 44656 1 109 . 1 1 48 48 LYS CB C 48 34.530 34.530 35.073 -0.543 17919 44657 1 109 . 1 1 48 48 LYS H H 48 7.980 7.980 7.822 0.158 17919 44658 1 109 . 1 1 49 49 GLN N N 49 122.410 122.410 121.518 0.892 17919 44659 1 109 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.633 -0.073 17919 44660 1 109 . 1 1 49 49 GLN C C 49 175.670 175.670 175.880 -0.210 17919 44661 1 109 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.320 -0.580 17919 44662 1 109 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.753 -0.753 17919 44663 1 109 . 1 1 49 49 GLN H H 49 8.600 8.600 8.515 0.085 17919 44664 1 109 . 1 1 50 50 LEU N N 50 125.520 125.520 125.239 0.281 17919 44665 1 109 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.059 0.031 17919 44666 1 109 . 1 1 50 50 LEU C C 50 176.660 176.660 175.387 1.273 17919 44667 1 109 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.775 0.465 17919 44668 1 109 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.209 -0.639 17919 44669 1 109 . 1 1 50 50 LEU H H 50 8.530 8.530 8.368 0.162 17919 44670 1 109 . 1 1 51 51 GLU N N 51 122.940 122.940 123.763 -0.823 17919 44671 1 109 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.431 0.057 17919 44672 1 109 . 1 1 51 51 GLU C C 51 175.870 175.870 177.364 -1.494 17919 44673 1 109 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.743 0.217 17919 44674 1 109 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.273 0.297 17919 44675 1 109 . 1 1 51 51 GLU H H 51 8.400 8.400 8.083 0.317 17919 44676 1 109 . 1 1 52 52 ASP N N 52 120.030 120.030 125.572 -5.542 17919 44677 1 109 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.355 0.004 17919 44678 1 109 . 1 1 52 52 ASP C C 52 177.330 177.330 177.789 -0.459 17919 44679 1 109 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.907 -0.947 17919 44680 1 109 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.659 0.191 17919 44681 1 109 . 1 1 52 52 ASP H H 52 8.160 8.160 8.753 -0.593 17919 44682 1 109 . 1 1 53 53 GLY N N 53 106.660 106.660 104.339 2.321 17919 44683 1 109 . 1 1 53 53 GLY C C 53 174.870 174.870 174.219 0.651 17919 44684 1 109 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.815 0.355 17919 44685 1 109 . 1 1 53 53 GLY H H 53 9.390 9.390 8.539 0.851 17919 44686 1 109 . 1 1 54 54 ARG N N 54 119.050 119.050 121.093 -2.043 17919 44687 1 109 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.739 -0.044 17919 44688 1 109 . 1 1 54 54 ARG C C 54 175.350 175.350 175.815 -0.465 17919 44689 1 109 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.646 -0.256 17919 44690 1 109 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.113 0.537 17919 44691 1 109 . 1 1 54 54 ARG H H 54 7.460 7.460 7.400 0.060 17919 44692 1 109 . 1 1 55 55 THR N N 55 108.400 108.400 115.374 -6.974 17919 44693 1 109 . 1 1 55 55 THR HA H 55 5.240 5.240 4.498 0.742 17919 44694 1 109 . 1 1 55 55 THR C C 55 176.560 176.560 175.782 0.778 17919 44695 1 109 . 1 1 55 55 THR CA C 55 59.690 59.690 62.034 -2.344 17919 44696 1 109 . 1 1 55 55 THR CB C 55 72.260 72.260 69.888 2.372 17919 44697 1 109 . 1 1 55 55 THR H H 55 8.730 8.730 8.837 -0.107 17919 44698 1 109 . 1 1 56 56 LEU N N 56 117.920 117.920 121.833 -3.913 17919 44699 1 109 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.073 -0.013 17919 44700 1 109 . 1 1 56 56 LEU C C 56 180.810 180.810 178.353 2.457 17919 44701 1 109 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.832 -0.122 17919 44702 1 109 . 1 1 56 56 LEU CB C 56 40.370 40.370 42.054 -1.684 17919 44703 1 109 . 1 1 56 56 LEU H H 56 8.140 8.140 8.932 -0.792 17919 44704 1 109 . 1 1 57 57 SER N N 57 113.330 113.330 113.495 -0.165 17919 44705 1 109 . 1 1 57 57 SER HA H 57 4.370 4.370 4.290 0.080 17919 44706 1 109 . 1 1 57 57 SER C C 57 178.310 178.310 176.602 1.708 17919 44707 1 109 . 1 1 57 57 SER CA C 57 61.080 61.080 61.636 -0.556 17919 44708 1 109 . 1 1 57 57 SER CB C 57 62.530 62.530 62.700 -0.170 17919 44709 1 109 . 1 1 57 57 SER H H 57 8.470 8.470 7.925 0.545 17919 44710 1 109 . 1 1 58 58 ASP N N 58 124.190 124.190 122.886 1.304 17919 44711 1 109 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.231 0.065 17919 44712 1 109 . 1 1 58 58 ASP C C 58 177.400 177.400 177.390 0.010 17919 44713 1 109 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.966 0.214 17919 44714 1 109 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.437 -0.337 17919 44715 1 109 . 1 1 58 58 ASP H H 58 7.930 7.930 7.700 0.230 17919 44716 1 109 . 1 1 59 59 TYR N N 59 115.510 115.510 115.605 -0.095 17919 44717 1 109 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.650 0.020 17919 44718 1 109 . 1 1 59 59 TYR C C 59 174.700 174.700 175.051 -0.351 17919 44719 1 109 . 1 1 59 59 TYR CA C 59 58.250 58.250 56.949 1.301 17919 44720 1 109 . 1 1 59 59 TYR CB C 59 40.070 40.070 37.534 2.536 17919 44721 1 109 . 1 1 59 59 TYR H H 59 7.250 7.250 7.307 -0.057 17919 44722 1 109 . 1 1 60 60 ASN N N 60 115.900 115.900 117.323 -1.423 17919 44723 1 109 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.315 0.040 17919 44724 1 109 . 1 1 60 60 ASN C C 60 174.340 174.340 174.704 -0.364 17919 44725 1 109 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.306 -0.186 17919 44726 1 109 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.725 -0.315 17919 44727 1 109 . 1 1 60 60 ASN H H 60 8.150 8.150 7.781 0.369 17919 44728 1 109 . 1 1 61 61 ILE N N 61 118.600 118.600 119.938 -1.338 17919 44729 1 109 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.782 -0.389 17919 44730 1 109 . 1 1 61 61 ILE C C 61 174.610 174.610 175.339 -0.729 17919 44731 1 109 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.310 0.110 17919 44732 1 109 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.355 -0.615 17919 44733 1 109 . 1 1 61 61 ILE H H 61 7.250 7.250 7.536 -0.286 17919 44734 1 109 . 1 1 62 62 GLN N N 62 124.740 124.740 127.043 -2.303 17919 44735 1 109 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.487 0.019 17919 44736 1 109 . 1 1 62 62 GLN C C 62 175.970 175.970 176.026 -0.056 17919 44737 1 109 . 1 1 62 62 GLN CA C 62 53.660 53.660 54.421 -0.761 17919 44738 1 109 . 1 1 62 62 GLN CB C 62 31.650 31.650 30.294 1.356 17919 44739 1 109 . 1 1 62 62 GLN H H 62 7.610 7.610 8.231 -0.621 17919 44740 1 109 . 1 1 63 63 LYS N N 63 120.300 120.300 126.697 -6.397 17919 44741 1 109 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.760 0.241 17919 44742 1 109 . 1 1 63 63 LYS C C 63 175.810 175.810 176.519 -0.709 17919 44743 1 109 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.273 -0.483 17919 44744 1 109 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.630 1.020 17919 44745 1 109 . 1 1 63 63 LYS H H 63 8.490 8.490 8.835 -0.345 17919 44746 1 109 . 1 1 64 64 GLU N N 64 113.950 113.950 118.132 -4.182 17919 44747 1 109 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.966 -0.501 17919 44748 1 109 . 1 1 64 64 GLU C C 64 175.250 175.250 175.516 -0.266 17919 44749 1 109 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.842 0.048 17919 44750 1 109 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.433 -2.533 17919 44751 1 109 . 1 1 64 64 GLU H H 64 9.280 9.280 8.821 0.459 17919 44752 1 109 . 1 1 65 65 SER N N 65 114.730 114.730 114.213 0.517 17919 44753 1 109 . 1 1 65 65 SER HA H 65 4.640 4.640 4.422 0.218 17919 44754 1 109 . 1 1 65 65 SER C C 65 172.160 172.160 173.710 -1.550 17919 44755 1 109 . 1 1 65 65 SER CA C 65 60.890 60.890 60.164 0.726 17919 44756 1 109 . 1 1 65 65 SER CB C 65 64.910 64.910 63.960 0.950 17919 44757 1 109 . 1 1 65 65 SER H H 65 7.670 7.670 7.730 -0.060 17919 44758 1 109 . 1 1 66 66 THR N N 66 117.110 117.110 116.225 0.885 17919 44759 1 109 . 1 1 66 66 THR HA H 66 5.270 5.270 5.125 0.145 17919 44760 1 109 . 1 1 66 66 THR C C 66 173.950 173.950 173.308 0.642 17919 44761 1 109 . 1 1 66 66 THR CA C 66 62.340 62.340 61.537 0.803 17919 44762 1 109 . 1 1 66 66 THR CB C 66 70.080 70.080 71.257 -1.177 17919 44763 1 109 . 1 1 66 66 THR H H 66 8.730 8.730 8.232 0.498 17919 44764 1 109 . 1 1 67 67 LEU N N 67 127.110 127.110 125.489 1.621 17919 44765 1 109 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.843 0.217 17919 44766 1 109 . 1 1 67 67 LEU C C 67 175.770 175.770 175.876 -0.106 17919 44767 1 109 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.145 0.755 17919 44768 1 109 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.591 -0.331 17919 44769 1 109 . 1 1 67 67 LEU H H 67 9.410 9.410 8.559 0.851 17919 44770 1 109 . 1 1 68 68 HIS N N 68 118.380 118.380 119.889 -1.509 17919 44771 1 109 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.238 0.002 17919 44772 1 109 . 1 1 68 68 HIS C C 68 173.150 173.150 175.426 -2.276 17919 44773 1 109 . 1 1 68 68 HIS CA C 68 55.000 55.000 53.722 1.278 17919 44774 1 109 . 1 1 68 68 HIS CB C 68 30.530 30.530 29.250 1.280 17919 44775 1 109 . 1 1 68 68 HIS H H 68 9.230 9.230 8.238 0.992 17919 44776 1 109 . 1 1 69 69 LEU N N 69 124.460 124.460 126.733 -2.273 17919 44777 1 109 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.248 0.942 17919 44778 1 109 . 1 1 69 69 LEU C C 69 175.270 175.270 175.175 0.095 17919 44779 1 109 . 1 1 69 69 LEU CA C 69 53.890 53.890 55.834 -1.944 17919 44780 1 109 . 1 1 69 69 LEU CB C 69 44.380 44.380 41.855 2.525 17919 44781 1 109 . 1 1 69 69 LEU H H 69 8.340 8.340 7.905 0.435 17919 44782 1 109 . 1 1 70 70 VAL N N 70 126.940 126.940 127.475 -0.535 17919 44783 1 109 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.336 0.014 17919 44784 1 109 . 1 1 70 70 VAL C C 70 174.000 174.000 174.823 -0.823 17919 44785 1 109 . 1 1 70 70 VAL CA C 70 60.800 60.800 61.940 -1.140 17919 44786 1 109 . 1 1 70 70 VAL CB C 70 34.910 34.910 33.442 1.468 17919 44787 1 109 . 1 1 70 70 VAL H H 70 9.200 9.200 8.538 0.662 17919 44788 1 109 . 1 1 71 71 LEU N N 71 123.130 123.130 126.592 -3.462 17919 44789 1 109 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.105 -0.045 17919 44790 1 109 . 1 1 71 71 LEU C C 71 177.830 177.830 176.718 1.112 17919 44791 1 109 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.561 0.379 17919 44792 1 109 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.357 -0.507 17919 44793 1 109 . 1 1 71 71 LEU H H 71 8.120 8.120 8.510 -0.390 17919 44794 1 109 . 1 1 72 72 ARG N N 72 123.490 123.490 125.942 -2.452 17919 44795 1 109 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.660 -0.359 17919 44796 1 109 . 1 1 72 72 ARG C C 72 175.350 175.350 175.336 0.014 17919 44797 1 109 . 1 1 72 72 ARG CA C 72 55.610 55.610 54.028 1.582 17919 44798 1 109 . 1 1 72 72 ARG CB C 72 31.350 31.350 32.732 -1.382 17919 44799 1 109 . 1 1 72 72 ARG H H 72 8.580 8.580 8.324 0.256 17919 44800 1 110 . 1 1 2 2 GLN N N 2 123.220 123.220 124.142 -0.922 17919 44801 1 110 . 1 1 2 2 GLN HA H 2 5.249 5.249 4.434 0.815 17919 44802 1 110 . 1 1 2 2 GLN C C 2 175.920 175.920 174.786 1.134 17919 44803 1 110 . 1 1 2 2 GLN CA C 2 55.080 55.080 56.082 -1.002 17919 44804 1 110 . 1 1 2 2 GLN CB C 2 30.760 30.760 29.534 1.226 17919 44805 1 110 . 1 1 2 2 GLN H H 2 8.900 8.900 8.522 0.378 17919 44806 1 110 . 1 1 3 3 ILE N N 3 115.340 115.340 118.733 -3.393 17919 44807 1 110 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.056 0.157 17919 44808 1 110 . 1 1 3 3 ILE C C 3 172.450 172.450 173.253 -0.803 17919 44809 1 110 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.739 -0.169 17919 44810 1 110 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.628 0.582 17919 44811 1 110 . 1 1 3 3 ILE H H 3 8.320 8.320 7.331 0.989 17919 44812 1 110 . 1 1 4 4 PHE N N 4 118.110 118.110 118.821 -0.711 17919 44813 1 110 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.288 0.342 17919 44814 1 110 . 1 1 4 4 PHE C C 4 175.320 175.320 174.995 0.325 17919 44815 1 110 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.594 -0.384 17919 44816 1 110 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.830 -1.350 17919 44817 1 110 . 1 1 4 4 PHE H H 4 8.610 8.610 7.740 0.870 17919 44818 1 110 . 1 1 5 5 VAL N N 5 121.000 121.000 120.779 0.221 17919 44819 1 110 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.592 0.133 17919 44820 1 110 . 1 1 5 5 VAL C C 5 174.870 174.870 174.748 0.122 17919 44821 1 110 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.306 -0.686 17919 44822 1 110 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.955 0.275 17919 44823 1 110 . 1 1 5 5 VAL H H 5 9.300 9.300 8.676 0.624 17919 44824 1 110 . 1 1 6 6 LYS N N 6 127.520 127.520 129.770 -2.250 17919 44825 1 110 . 1 1 6 6 LYS HA H 6 5.367 5.367 4.621 0.746 17919 44826 1 110 . 1 1 6 6 LYS C C 6 177.140 177.140 176.015 1.125 17919 44827 1 110 . 1 1 6 6 LYS CA C 6 54.520 54.520 55.946 -1.426 17919 44828 1 110 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.518 0.532 17919 44829 1 110 . 1 1 6 6 LYS H H 6 8.820 8.820 8.903 -0.083 17919 44830 1 110 . 1 1 7 7 THR N N 7 115.400 115.400 116.666 -1.266 17919 44831 1 110 . 1 1 7 7 THR HA H 7 4.970 4.970 4.508 0.462 17919 44832 1 110 . 1 1 7 7 THR C C 7 176.910 176.910 175.902 1.008 17919 44833 1 110 . 1 1 7 7 THR CA C 7 60.470 60.470 60.511 -0.042 17919 44834 1 110 . 1 1 7 7 THR CB C 7 70.630 70.630 70.700 -0.070 17919 44835 1 110 . 1 1 7 7 THR H H 7 8.730 8.730 8.404 0.326 17919 44836 1 110 . 1 1 8 8 LEU N N 8 121.330 121.330 123.038 -1.708 17919 44837 1 110 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.240 0.070 17919 44838 1 110 . 1 1 8 8 LEU C C 8 178.800 178.800 177.735 1.065 17919 44839 1 110 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.486 0.094 17919 44840 1 110 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.837 0.133 17919 44841 1 110 . 1 1 8 8 LEU H H 8 9.100 9.100 8.342 0.758 17919 44842 1 110 . 1 1 9 9 THR N N 9 105.590 105.590 109.029 -3.439 17919 44843 1 110 . 1 1 9 9 THR HA H 9 4.428 4.428 4.246 0.182 17919 44844 1 110 . 1 1 9 9 THR C C 9 175.520 175.520 175.447 0.073 17919 44845 1 110 . 1 1 9 9 THR CA C 9 61.400 61.400 63.083 -1.683 17919 44846 1 110 . 1 1 9 9 THR CB C 9 69.140 69.140 69.019 0.121 17919 44847 1 110 . 1 1 9 9 THR H H 9 7.630 7.630 8.006 -0.376 17919 44848 1 110 . 1 1 10 10 GLY N N 10 108.890 108.890 110.774 -1.884 17919 44849 1 110 . 1 1 10 10 GLY C C 10 174.070 174.070 173.827 0.243 17919 44850 1 110 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.606 0.854 17919 44851 1 110 . 1 1 10 10 GLY H H 10 7.810 7.810 7.924 -0.114 17919 44852 1 110 . 1 1 11 11 LYS N N 11 121.600 121.600 122.598 -0.998 17919 44853 1 110 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.496 -0.135 17919 44854 1 110 . 1 1 11 11 LYS C C 11 175.940 175.940 176.274 -0.334 17919 44855 1 110 . 1 1 11 11 LYS CA C 11 56.280 56.280 55.392 0.888 17919 44856 1 110 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.451 -0.251 17919 44857 1 110 . 1 1 11 11 LYS H H 11 7.280 7.280 7.970 -0.690 17919 44858 1 110 . 1 1 12 12 THR N N 12 120.440 120.440 118.986 1.454 17919 44859 1 110 . 1 1 12 12 THR HA H 12 5.046 5.046 4.830 0.216 17919 44860 1 110 . 1 1 12 12 THR C C 12 174.320 174.320 174.173 0.147 17919 44861 1 110 . 1 1 12 12 THR CA C 12 62.390 62.390 62.346 0.044 17919 44862 1 110 . 1 1 12 12 THR CB C 12 69.910 69.910 70.097 -0.188 17919 44863 1 110 . 1 1 12 12 THR H H 12 8.650 8.650 8.579 0.071 17919 44864 1 110 . 1 1 13 13 ILE N N 13 127.110 127.110 126.247 0.863 17919 44865 1 110 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.446 0.098 17919 44866 1 110 . 1 1 13 13 ILE C C 13 175.220 175.220 174.778 0.442 17919 44867 1 110 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.726 -0.746 17919 44868 1 110 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.843 0.107 17919 44869 1 110 . 1 1 13 13 ILE H H 13 9.450 9.450 9.109 0.341 17919 44870 1 110 . 1 1 14 14 THR N N 14 121.520 121.520 123.261 -1.741 17919 44871 1 110 . 1 1 14 14 THR HA H 14 4.964 4.964 4.750 0.214 17919 44872 1 110 . 1 1 14 14 THR C C 14 173.790 173.790 174.137 -0.347 17919 44873 1 110 . 1 1 14 14 THR CA C 14 61.940 61.940 62.097 -0.157 17919 44874 1 110 . 1 1 14 14 THR CB C 14 69.650 69.650 69.662 -0.012 17919 44875 1 110 . 1 1 14 14 THR H H 14 8.710 8.710 8.529 0.181 17919 44876 1 110 . 1 1 15 15 LEU N N 15 124.800 124.800 126.909 -2.109 17919 44877 1 110 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.668 0.112 17919 44878 1 110 . 1 1 15 15 LEU C C 15 174.670 174.670 175.712 -1.042 17919 44879 1 110 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.685 -0.855 17919 44880 1 110 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.205 1.865 17919 44881 1 110 . 1 1 15 15 LEU H H 15 8.710 8.710 8.328 0.382 17919 44882 1 110 . 1 1 16 16 GLU N N 16 122.160 122.160 123.125 -0.965 17919 44883 1 110 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.487 0.430 17919 44884 1 110 . 1 1 16 16 GLU C C 16 175.860 175.860 175.800 0.060 17919 44885 1 110 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.377 -0.557 17919 44886 1 110 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.453 -1.002 17919 44887 1 110 . 1 1 16 16 GLU H H 16 8.140 8.140 8.551 -0.411 17919 44888 1 110 . 1 1 17 17 VAL N N 17 117.210 117.210 120.724 -3.514 17919 44889 1 110 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.973 -0.259 17919 44890 1 110 . 1 1 17 17 VAL C C 17 174.160 174.160 175.291 -1.131 17919 44891 1 110 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.725 -0.295 17919 44892 1 110 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.583 0.818 17919 44893 1 110 . 1 1 17 17 VAL H H 17 8.900 8.900 7.998 0.902 17919 44894 1 110 . 1 1 18 18 GLU N N 18 118.990 118.990 119.988 -0.998 17919 44895 1 110 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.840 0.239 17919 44896 1 110 . 1 1 18 18 GLU C C 18 176.160 176.160 174.849 1.311 17919 44897 1 110 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.629 0.091 17919 44898 1 110 . 1 1 18 18 GLU CB C 18 30.310 30.310 31.097 -0.787 17919 44899 1 110 . 1 1 18 18 GLU H H 18 8.640 8.640 8.178 0.462 17919 44900 1 110 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.225 -0.084 17919 44901 1 110 . 1 1 19 19 PRO C C 19 175.310 175.310 177.832 -2.522 17919 44902 1 110 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.391 0.078 17919 44903 1 110 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.896 0.054 17919 44904 1 110 . 1 1 20 20 SER N N 20 103.400 103.400 109.478 -6.078 17919 44905 1 110 . 1 1 20 20 SER HA H 20 4.370 4.370 4.335 0.035 17919 44906 1 110 . 1 1 20 20 SER C C 20 174.660 174.660 174.741 -0.081 17919 44907 1 110 . 1 1 20 20 SER CA C 20 57.400 57.400 58.503 -1.103 17919 44908 1 110 . 1 1 20 20 SER CB C 20 63.370 63.370 63.145 0.225 17919 44909 1 110 . 1 1 20 20 SER H H 20 7.040 7.040 7.824 -0.784 17919 44910 1 110 . 1 1 21 21 ASP N N 21 123.480 123.480 125.176 -1.696 17919 44911 1 110 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.656 0.039 17919 44912 1 110 . 1 1 21 21 ASP C C 21 176.360 176.360 176.008 0.352 17919 44913 1 110 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.529 0.171 17919 44914 1 110 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.620 -0.820 17919 44915 1 110 . 1 1 21 21 ASP H H 21 8.030 8.030 8.170 -0.140 17919 44916 1 110 . 1 1 22 22 THR N N 22 108.800 108.800 112.828 -4.028 17919 44917 1 110 . 1 1 22 22 THR HA H 22 4.920 4.920 4.388 0.532 17919 44918 1 110 . 1 1 22 22 THR C C 22 176.750 176.750 175.615 1.135 17919 44919 1 110 . 1 1 22 22 THR CA C 22 59.690 59.690 61.691 -2.001 17919 44920 1 110 . 1 1 22 22 THR CB C 22 71.200 71.200 69.965 1.235 17919 44921 1 110 . 1 1 22 22 THR H H 22 7.900 7.900 8.266 -0.366 17919 44922 1 110 . 1 1 23 23 ILE N N 23 121.190 121.190 121.812 -0.622 17919 44923 1 110 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.949 -0.292 17919 44924 1 110 . 1 1 23 23 ILE C C 23 179.040 179.040 177.703 1.337 17919 44925 1 110 . 1 1 23 23 ILE CA C 23 62.260 62.260 61.298 0.962 17919 44926 1 110 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.630 -2.280 17919 44927 1 110 . 1 1 23 23 ILE H H 23 8.560 8.560 8.976 -0.416 17919 44928 1 110 . 1 1 24 24 GLU N N 24 120.830 120.830 120.965 -0.135 17919 44929 1 110 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.862 0.055 17919 44930 1 110 . 1 1 24 24 GLU C C 24 178.640 178.640 178.529 0.111 17919 44931 1 110 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.223 -0.003 17919 44932 1 110 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.446 -1.166 17919 44933 1 110 . 1 1 24 24 GLU H H 24 9.760 9.760 8.653 1.107 17919 44934 1 110 . 1 1 25 25 ASN N N 25 120.570 120.570 117.416 3.154 17919 44935 1 110 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.523 0.002 17919 44936 1 110 . 1 1 25 25 ASN C C 25 178.380 178.380 177.860 0.520 17919 44937 1 110 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.843 0.217 17919 44938 1 110 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.702 -0.252 17919 44939 1 110 . 1 1 25 25 ASN H H 25 7.920 7.920 7.539 0.381 17919 44940 1 110 . 1 1 26 26 VAL N N 26 121.710 121.710 120.343 1.367 17919 44941 1 110 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.787 -0.390 17919 44942 1 110 . 1 1 26 26 VAL C C 26 177.950 177.950 177.261 0.689 17919 44943 1 110 . 1 1 26 26 VAL CA C 26 67.660 67.660 64.824 2.836 17919 44944 1 110 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.619 -0.778 17919 44945 1 110 . 1 1 26 26 VAL H H 26 8.070 8.070 7.690 0.380 17919 44946 1 110 . 1 1 27 27 LYS N N 27 118.860 118.860 120.342 -1.482 17919 44947 1 110 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.298 0.282 17919 44948 1 110 . 1 1 27 27 LYS C C 27 180.550 180.550 178.829 1.721 17919 44949 1 110 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.450 -0.200 17919 44950 1 110 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.367 1.363 17919 44951 1 110 . 1 1 27 27 LYS H H 27 8.560 8.560 7.860 0.700 17919 44952 1 110 . 1 1 28 28 ALA N N 28 123.440 123.440 122.415 1.025 17919 44953 1 110 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.006 0.153 17919 44954 1 110 . 1 1 28 28 ALA C C 28 180.300 180.300 178.967 1.333 17919 44955 1 110 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.152 0.218 17919 44956 1 110 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.196 -0.486 17919 44957 1 110 . 1 1 28 28 ALA H H 28 8.060 8.060 8.069 -0.009 17919 44958 1 110 . 1 1 29 29 LYS N N 29 119.940 119.940 119.140 0.800 17919 44959 1 110 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.031 0.176 17919 44960 1 110 . 1 1 29 29 LYS C C 29 180.320 180.320 179.013 1.307 17919 44961 1 110 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.444 0.206 17919 44962 1 110 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.303 0.987 17919 44963 1 110 . 1 1 29 29 LYS H H 29 7.850 7.850 7.610 0.240 17919 44964 1 110 . 1 1 30 30 ILE N N 30 121.080 121.080 119.990 1.090 17919 44965 1 110 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.621 -0.114 17919 44966 1 110 . 1 1 30 30 ILE C C 30 178.310 178.310 177.643 0.667 17919 44967 1 110 . 1 1 30 30 ILE CA C 30 66.150 66.150 64.939 1.211 17919 44968 1 110 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.032 -0.232 17919 44969 1 110 . 1 1 30 30 ILE H H 30 8.280 8.280 7.605 0.675 17919 44970 1 110 . 1 1 31 31 GLN N N 31 123.490 123.490 119.494 3.996 17919 44971 1 110 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.988 -0.159 17919 44972 1 110 . 1 1 31 31 GLN C C 31 178.890 178.890 178.728 0.162 17919 44973 1 110 . 1 1 31 31 GLN CA C 31 60.000 60.000 58.850 1.150 17919 44974 1 110 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.426 -0.706 17919 44975 1 110 . 1 1 31 31 GLN H H 31 8.580 8.580 8.168 0.412 17919 44976 1 110 . 1 1 32 32 ASP N N 32 119.360 119.360 119.816 -0.456 17919 44977 1 110 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.437 -0.083 17919 44978 1 110 . 1 1 32 32 ASP C C 32 177.250 177.250 177.640 -0.390 17919 44979 1 110 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.681 0.509 17919 44980 1 110 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.828 -0.248 17919 44981 1 110 . 1 1 32 32 ASP H H 32 8.010 8.010 8.390 -0.380 17919 44982 1 110 . 1 1 33 33 LYS N N 33 115.130 115.130 117.698 -2.568 17919 44983 1 110 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.409 -0.072 17919 44984 1 110 . 1 1 33 33 LYS C C 33 177.870 177.870 178.001 -0.131 17919 44985 1 110 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.641 0.409 17919 44986 1 110 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.957 0.213 17919 44987 1 110 . 1 1 33 33 LYS H H 33 7.430 7.430 7.575 -0.145 17919 44988 1 110 . 1 1 34 34 GLU N N 34 113.870 113.870 115.152 -1.282 17919 44989 1 110 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.478 0.147 17919 44990 1 110 . 1 1 34 34 GLU C C 34 177.840 177.840 177.517 0.323 17919 44991 1 110 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.991 -0.821 17919 44992 1 110 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.240 1.420 17919 44993 1 110 . 1 1 34 34 GLU H H 34 8.740 8.740 8.339 0.401 17919 44994 1 110 . 1 1 35 35 GLY N N 35 108.650 108.650 108.842 -0.192 17919 44995 1 110 . 1 1 35 35 GLY C C 35 173.960 173.960 174.581 -0.621 17919 44996 1 110 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.900 0.180 17919 44997 1 110 . 1 1 35 35 GLY H H 35 8.530 8.530 7.793 0.737 17919 44998 1 110 . 1 1 36 36 ILE N N 36 119.880 119.880 117.532 2.348 17919 44999 1 110 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.476 -0.031 17919 45000 1 110 . 1 1 36 36 ILE C C 36 173.590 173.590 173.977 -0.387 17919 45001 1 110 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.767 -0.017 17919 45002 1 110 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.340 2.240 17919 45003 1 110 . 1 1 36 36 ILE H H 36 6.150 6.150 7.492 -1.342 17919 45004 1 110 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.680 -0.046 17919 45005 1 110 . 1 1 37 37 PRO C C 37 176.940 176.940 176.266 0.674 17919 45006 1 110 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.590 0.070 17919 45007 1 110 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.267 0.583 17919 45008 1 110 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.136 -0.019 17919 45009 1 110 . 1 1 38 38 PRO C C 38 178.320 178.320 178.413 -0.093 17919 45010 1 110 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.945 0.315 17919 45011 1 110 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.938 0.952 17919 45012 1 110 . 1 1 39 39 ASP N N 39 113.380 113.380 114.428 -1.048 17919 45013 1 110 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.330 0.100 17919 45014 1 110 . 1 1 39 39 ASP C C 39 177.090 177.090 177.306 -0.216 17919 45015 1 110 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.622 -0.982 17919 45016 1 110 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.362 -0.822 17919 45017 1 110 . 1 1 39 39 ASP H H 39 8.550 8.550 8.796 -0.246 17919 45018 1 110 . 1 1 40 40 GLN N N 40 116.780 116.780 115.934 0.846 17919 45019 1 110 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.335 0.129 17919 45020 1 110 . 1 1 40 40 GLN C C 40 175.380 175.380 175.938 -0.558 17919 45021 1 110 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.863 -0.223 17919 45022 1 110 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.238 0.902 17919 45023 1 110 . 1 1 40 40 GLN H H 40 7.820 7.820 7.619 0.201 17919 45024 1 110 . 1 1 41 41 GLN N N 41 117.720 117.720 119.503 -1.783 17919 45025 1 110 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.232 0.012 17919 45026 1 110 . 1 1 41 41 GLN C C 41 176.300 176.300 175.930 0.370 17919 45027 1 110 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.229 0.241 17919 45028 1 110 . 1 1 41 41 GLN CB C 41 31.650 31.650 28.026 3.624 17919 45029 1 110 . 1 1 41 41 GLN H H 41 7.480 7.480 7.249 0.231 17919 45030 1 110 . 1 1 42 42 ARG N N 42 122.680 122.680 125.772 -3.092 17919 45031 1 110 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.337 0.163 17919 45032 1 110 . 1 1 42 42 ARG C C 42 174.050 174.050 174.955 -0.905 17919 45033 1 110 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.175 -0.126 17919 45034 1 110 . 1 1 42 42 ARG CB C 42 31.750 31.750 29.525 2.225 17919 45035 1 110 . 1 1 42 42 ARG H H 42 8.530 8.530 8.197 0.333 17919 45036 1 110 . 1 1 43 43 LEU N N 43 124.040 124.040 125.547 -1.507 17919 45037 1 110 . 1 1 43 43 LEU C C 43 175.290 175.290 175.723 -0.433 17919 45038 1 110 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.758 -1.778 17919 45039 1 110 . 1 1 43 43 LEU CB C 43 45.790 45.790 41.682 4.108 17919 45040 1 110 . 1 1 43 43 LEU H H 43 8.820 8.820 8.089 0.731 17919 45041 1 110 . 1 1 44 44 ILE N N 44 121.920 121.920 126.056 -4.136 17919 45042 1 110 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.071 -0.079 17919 45043 1 110 . 1 1 44 44 ILE C C 44 176.060 176.060 174.384 1.676 17919 45044 1 110 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.056 -1.075 17919 45045 1 110 . 1 1 44 44 ILE CB C 44 41.420 41.420 42.176 -0.756 17919 45046 1 110 . 1 1 44 44 ILE H H 44 9.030 9.030 8.375 0.655 17919 45047 1 110 . 1 1 45 45 PHE N N 45 125.390 125.390 123.798 1.592 17919 45048 1 110 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.925 0.120 17919 45049 1 110 . 1 1 45 45 PHE C C 45 174.470 174.470 173.959 0.511 17919 45050 1 110 . 1 1 45 45 PHE CA C 45 57.020 57.020 57.498 -0.478 17919 45051 1 110 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.581 1.179 17919 45052 1 110 . 1 1 45 45 PHE H H 45 8.830 8.830 9.151 -0.321 17919 45053 1 110 . 1 1 46 46 ALA N N 46 132.200 132.200 128.262 3.938 17919 45054 1 110 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.575 0.115 17919 45055 1 110 . 1 1 46 46 ALA C C 46 177.290 177.290 177.532 -0.242 17919 45056 1 110 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.674 -0.134 17919 45057 1 110 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.421 0.149 17919 45058 1 110 . 1 1 46 46 ALA H H 46 8.810 8.810 8.959 -0.149 17919 45059 1 110 . 1 1 47 47 GLY N N 47 102.340 102.340 103.508 -1.168 17919 45060 1 110 . 1 1 47 47 GLY C C 47 173.810 173.810 174.129 -0.319 17919 45061 1 110 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.723 0.627 17919 45062 1 110 . 1 1 47 47 GLY H H 47 8.130 8.130 8.471 -0.341 17919 45063 1 110 . 1 1 48 48 LYS N N 48 121.570 121.570 120.874 0.696 17919 45064 1 110 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.635 -0.013 17919 45065 1 110 . 1 1 48 48 LYS C C 48 174.700 174.700 175.138 -0.438 17919 45066 1 110 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.575 -0.026 17919 45067 1 110 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.379 0.151 17919 45068 1 110 . 1 1 48 48 LYS H H 48 7.980 7.980 7.770 0.210 17919 45069 1 110 . 1 1 49 49 GLN N N 49 122.410 122.410 123.433 -1.023 17919 45070 1 110 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.681 -0.121 17919 45071 1 110 . 1 1 49 49 GLN C C 49 175.670 175.670 175.285 0.385 17919 45072 1 110 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.711 0.029 17919 45073 1 110 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.832 -0.832 17919 45074 1 110 . 1 1 49 49 GLN H H 49 8.600 8.600 8.574 0.026 17919 45075 1 110 . 1 1 50 50 LEU N N 50 125.520 125.520 126.431 -0.911 17919 45076 1 110 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.265 -0.175 17919 45077 1 110 . 1 1 50 50 LEU C C 50 176.660 176.660 175.028 1.632 17919 45078 1 110 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.197 1.044 17919 45079 1 110 . 1 1 50 50 LEU CB C 50 41.570 41.570 43.900 -2.330 17919 45080 1 110 . 1 1 50 50 LEU H H 50 8.530 8.530 8.547 -0.017 17919 45081 1 110 . 1 1 51 51 GLU N N 51 122.940 122.940 120.657 2.283 17919 45082 1 110 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.536 -0.048 17919 45083 1 110 . 1 1 51 51 GLU C C 51 175.870 175.870 176.311 -0.441 17919 45084 1 110 . 1 1 51 51 GLU CA C 51 55.960 55.960 54.965 0.995 17919 45085 1 110 . 1 1 51 51 GLU CB C 51 31.570 31.570 33.356 -1.786 17919 45086 1 110 . 1 1 51 51 GLU H H 51 8.400 8.400 8.093 0.307 17919 45087 1 110 . 1 1 52 52 ASP N N 52 120.030 120.030 126.630 -6.600 17919 45088 1 110 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.450 -0.091 17919 45089 1 110 . 1 1 52 52 ASP C C 52 177.330 177.330 178.257 -0.927 17919 45090 1 110 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.010 -0.050 17919 45091 1 110 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.648 0.202 17919 45092 1 110 . 1 1 52 52 ASP H H 52 8.160 8.160 8.854 -0.694 17919 45093 1 110 . 1 1 53 53 GLY N N 53 106.660 106.660 107.615 -0.955 17919 45094 1 110 . 1 1 53 53 GLY C C 53 174.870 174.870 174.802 0.068 17919 45095 1 110 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.741 -0.571 17919 45096 1 110 . 1 1 53 53 GLY H H 53 9.390 9.390 8.629 0.761 17919 45097 1 110 . 1 1 54 54 ARG N N 54 119.050 119.050 120.408 -1.358 17919 45098 1 110 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.604 0.092 17919 45099 1 110 . 1 1 54 54 ARG C C 54 175.350 175.350 175.542 -0.192 17919 45100 1 110 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.586 -0.196 17919 45101 1 110 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.972 -0.322 17919 45102 1 110 . 1 1 54 54 ARG H H 54 7.460 7.460 7.548 -0.088 17919 45103 1 110 . 1 1 55 55 THR N N 55 108.400 108.400 113.007 -4.607 17919 45104 1 110 . 1 1 55 55 THR HA H 55 5.240 5.240 4.841 0.399 17919 45105 1 110 . 1 1 55 55 THR C C 55 176.560 176.560 176.497 0.063 17919 45106 1 110 . 1 1 55 55 THR CA C 55 59.690 59.690 60.386 -0.696 17919 45107 1 110 . 1 1 55 55 THR CB C 55 72.260 72.260 71.002 1.258 17919 45108 1 110 . 1 1 55 55 THR H H 55 8.730 8.730 8.765 -0.035 17919 45109 1 110 . 1 1 56 56 LEU N N 56 117.920 117.920 121.687 -3.767 17919 45110 1 110 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.862 0.198 17919 45111 1 110 . 1 1 56 56 LEU C C 56 180.810 180.810 179.042 1.768 17919 45112 1 110 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.864 -0.154 17919 45113 1 110 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.073 -0.703 17919 45114 1 110 . 1 1 56 56 LEU H H 56 8.140 8.140 8.192 -0.052 17919 45115 1 110 . 1 1 57 57 SER N N 57 113.330 113.330 113.701 -0.371 17919 45116 1 110 . 1 1 57 57 SER HA H 57 4.370 4.370 4.147 0.223 17919 45117 1 110 . 1 1 57 57 SER C C 57 178.310 178.310 175.888 2.422 17919 45118 1 110 . 1 1 57 57 SER CA C 57 61.080 61.080 61.592 -0.512 17919 45119 1 110 . 1 1 57 57 SER CB C 57 62.530 62.530 62.877 -0.347 17919 45120 1 110 . 1 1 57 57 SER H H 57 8.470 8.470 8.044 0.426 17919 45121 1 110 . 1 1 58 58 ASP N N 58 124.190 124.190 119.702 4.488 17919 45122 1 110 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.334 -0.038 17919 45123 1 110 . 1 1 58 58 ASP C C 58 177.400 177.400 177.304 0.096 17919 45124 1 110 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.631 0.549 17919 45125 1 110 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.723 -0.623 17919 45126 1 110 . 1 1 58 58 ASP H H 58 7.930 7.930 7.606 0.324 17919 45127 1 110 . 1 1 59 59 TYR N N 59 115.510 115.510 115.250 0.260 17919 45128 1 110 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.674 -0.004 17919 45129 1 110 . 1 1 59 59 TYR C C 59 174.700 174.700 175.816 -1.116 17919 45130 1 110 . 1 1 59 59 TYR CA C 59 58.250 58.250 56.045 2.205 17919 45131 1 110 . 1 1 59 59 TYR CB C 59 40.070 40.070 39.011 1.059 17919 45132 1 110 . 1 1 59 59 TYR H H 59 7.250 7.250 7.313 -0.063 17919 45133 1 110 . 1 1 60 60 ASN N N 60 115.900 115.900 118.532 -2.632 17919 45134 1 110 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.403 -0.048 17919 45135 1 110 . 1 1 60 60 ASN C C 60 174.340 174.340 174.447 -0.107 17919 45136 1 110 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.190 -0.070 17919 45137 1 110 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.826 -0.416 17919 45138 1 110 . 1 1 60 60 ASN H H 60 8.150 8.150 8.069 0.081 17919 45139 1 110 . 1 1 61 61 ILE N N 61 118.600 118.600 120.389 -1.789 17919 45140 1 110 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.749 -0.356 17919 45141 1 110 . 1 1 61 61 ILE C C 61 174.610 174.610 175.479 -0.869 17919 45142 1 110 . 1 1 61 61 ILE CA C 61 62.420 62.420 60.548 1.872 17919 45143 1 110 . 1 1 61 61 ILE CB C 61 36.740 36.740 35.546 1.194 17919 45144 1 110 . 1 1 61 61 ILE H H 61 7.250 7.250 8.019 -0.769 17919 45145 1 110 . 1 1 62 62 GLN N N 62 124.740 124.740 126.267 -1.527 17919 45146 1 110 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.590 -0.084 17919 45147 1 110 . 1 1 62 62 GLN C C 62 175.970 175.970 175.675 0.295 17919 45148 1 110 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.716 -0.056 17919 45149 1 110 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.768 -0.118 17919 45150 1 110 . 1 1 62 62 GLN H H 62 7.610 7.610 8.212 -0.602 17919 45151 1 110 . 1 1 63 63 LYS N N 63 120.300 120.300 122.482 -2.182 17919 45152 1 110 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.951 0.050 17919 45153 1 110 . 1 1 63 63 LYS C C 63 175.810 175.810 176.819 -1.009 17919 45154 1 110 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.033 0.757 17919 45155 1 110 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.913 0.737 17919 45156 1 110 . 1 1 63 63 LYS H H 63 8.490 8.490 8.622 -0.132 17919 45157 1 110 . 1 1 64 64 GLU N N 64 113.950 113.950 117.503 -3.553 17919 45158 1 110 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.723 -0.258 17919 45159 1 110 . 1 1 64 64 GLU C C 64 175.250 175.250 175.592 -0.342 17919 45160 1 110 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.771 0.119 17919 45161 1 110 . 1 1 64 64 GLU CB C 64 25.900 25.900 27.821 -1.921 17919 45162 1 110 . 1 1 64 64 GLU H H 64 9.280 9.280 8.778 0.502 17919 45163 1 110 . 1 1 65 65 SER N N 65 114.730 114.730 114.953 -0.223 17919 45164 1 110 . 1 1 65 65 SER HA H 65 4.640 4.640 4.475 0.165 17919 45165 1 110 . 1 1 65 65 SER C C 65 172.160 172.160 174.019 -1.859 17919 45166 1 110 . 1 1 65 65 SER CA C 65 60.890 60.890 58.185 2.705 17919 45167 1 110 . 1 1 65 65 SER CB C 65 64.910 64.910 64.050 0.860 17919 45168 1 110 . 1 1 65 65 SER H H 65 7.670 7.670 7.481 0.189 17919 45169 1 110 . 1 1 66 66 THR N N 66 117.110 117.110 121.336 -4.226 17919 45170 1 110 . 1 1 66 66 THR HA H 66 5.270 5.270 4.849 0.421 17919 45171 1 110 . 1 1 66 66 THR C C 66 173.950 173.950 174.587 -0.637 17919 45172 1 110 . 1 1 66 66 THR CA C 66 62.340 62.340 63.380 -1.040 17919 45173 1 110 . 1 1 66 66 THR CB C 66 70.080 70.080 69.417 0.663 17919 45174 1 110 . 1 1 66 66 THR H H 66 8.730 8.730 8.569 0.161 17919 45175 1 110 . 1 1 67 67 LEU N N 67 127.110 127.110 127.120 -0.010 17919 45176 1 110 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.983 0.077 17919 45177 1 110 . 1 1 67 67 LEU C C 67 175.770 175.770 175.517 0.253 17919 45178 1 110 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.917 -0.017 17919 45179 1 110 . 1 1 67 67 LEU CB C 67 44.260 44.260 45.230 -0.970 17919 45180 1 110 . 1 1 67 67 LEU H H 67 9.410 9.410 9.037 0.373 17919 45181 1 110 . 1 1 68 68 HIS N N 68 118.380 118.380 118.889 -0.509 17919 45182 1 110 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.496 -0.256 17919 45183 1 110 . 1 1 68 68 HIS C C 68 173.150 173.150 173.880 -0.730 17919 45184 1 110 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.261 0.739 17919 45185 1 110 . 1 1 68 68 HIS CB C 68 30.530 30.530 34.041 -3.511 17919 45186 1 110 . 1 1 68 68 HIS H H 68 9.230 9.230 9.121 0.109 17919 45187 1 110 . 1 1 69 69 LEU N N 69 124.460 124.460 121.562 2.898 17919 45188 1 110 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.788 0.402 17919 45189 1 110 . 1 1 69 69 LEU C C 69 175.270 175.270 173.688 1.582 17919 45190 1 110 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.602 -0.712 17919 45191 1 110 . 1 1 69 69 LEU CB C 69 44.380 44.380 46.571 -2.191 17919 45192 1 110 . 1 1 69 69 LEU H H 69 8.340 8.340 7.380 0.960 17919 45193 1 110 . 1 1 70 70 VAL N N 70 126.940 126.940 121.292 5.648 17919 45194 1 110 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.526 -0.176 17919 45195 1 110 . 1 1 70 70 VAL C C 70 174.000 174.000 173.288 0.712 17919 45196 1 110 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.436 0.364 17919 45197 1 110 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.583 -0.673 17919 45198 1 110 . 1 1 70 70 VAL H H 70 9.200 9.200 8.166 1.034 17919 45199 1 110 . 1 1 71 71 LEU N N 71 123.130 123.130 126.025 -2.895 17919 45200 1 110 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.883 0.177 17919 45201 1 110 . 1 1 71 71 LEU C C 71 177.830 177.830 176.934 0.896 17919 45202 1 110 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.417 0.522 17919 45203 1 110 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.482 -0.632 17919 45204 1 110 . 1 1 71 71 LEU H H 71 8.120 8.120 8.275 -0.155 17919 45205 1 110 . 1 1 72 72 ARG N N 72 123.490 123.490 124.624 -1.134 17919 45206 1 110 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.644 -0.343 17919 45207 1 110 . 1 1 72 72 ARG C C 72 175.350 175.350 174.861 0.489 17919 45208 1 110 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.331 0.279 17919 45209 1 110 . 1 1 72 72 ARG CB C 72 31.350 31.350 31.617 -0.267 17919 45210 1 110 . 1 1 72 72 ARG H H 72 8.580 8.580 8.329 0.251 17919 45211 1 111 . 1 1 2 2 GLN N N 2 123.220 123.220 120.671 2.549 17919 45212 1 111 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.151 0.098 17919 45213 1 111 . 1 1 2 2 GLN C C 2 175.920 175.920 175.722 0.198 17919 45214 1 111 . 1 1 2 2 GLN CA C 2 55.080 55.080 55.166 -0.086 17919 45215 1 111 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.193 0.567 17919 45216 1 111 . 1 1 2 2 GLN H H 2 8.900 8.900 8.427 0.473 17919 45217 1 111 . 1 1 3 3 ILE N N 3 115.340 115.340 114.783 0.557 17919 45218 1 111 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.493 -0.280 17919 45219 1 111 . 1 1 3 3 ILE C C 3 172.450 172.450 173.854 -1.404 17919 45220 1 111 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.608 -0.038 17919 45221 1 111 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.613 0.597 17919 45222 1 111 . 1 1 3 3 ILE H H 3 8.320 8.320 8.447 -0.127 17919 45223 1 111 . 1 1 4 4 PHE N N 4 118.110 118.110 119.168 -1.058 17919 45224 1 111 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.420 0.210 17919 45225 1 111 . 1 1 4 4 PHE C C 4 175.320 175.320 175.247 0.073 17919 45226 1 111 . 1 1 4 4 PHE CA C 4 55.210 55.210 56.173 -0.963 17919 45227 1 111 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.969 -0.489 17919 45228 1 111 . 1 1 4 4 PHE H H 4 8.610 8.610 8.477 0.133 17919 45229 1 111 . 1 1 5 5 VAL N N 5 121.000 121.000 123.269 -2.269 17919 45230 1 111 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.933 -0.208 17919 45231 1 111 . 1 1 5 5 VAL C C 5 174.870 174.870 174.898 -0.028 17919 45232 1 111 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.056 -0.436 17919 45233 1 111 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.543 0.687 17919 45234 1 111 . 1 1 5 5 VAL H H 5 9.300 9.300 9.096 0.204 17919 45235 1 111 . 1 1 6 6 LYS N N 6 127.520 127.520 129.926 -2.406 17919 45236 1 111 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.249 0.118 17919 45237 1 111 . 1 1 6 6 LYS C C 6 177.140 177.140 176.151 0.989 17919 45238 1 111 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.950 -0.430 17919 45239 1 111 . 1 1 6 6 LYS CB C 6 35.050 35.050 33.743 1.307 17919 45240 1 111 . 1 1 6 6 LYS H H 6 8.820 8.820 9.130 -0.310 17919 45241 1 111 . 1 1 7 7 THR N N 7 115.400 115.400 118.869 -3.469 17919 45242 1 111 . 1 1 7 7 THR HA H 7 4.970 4.970 4.749 0.221 17919 45243 1 111 . 1 1 7 7 THR C C 7 176.910 176.910 175.451 1.459 17919 45244 1 111 . 1 1 7 7 THR CA C 7 60.470 60.470 59.850 0.620 17919 45245 1 111 . 1 1 7 7 THR CB C 7 70.630 70.630 70.972 -0.342 17919 45246 1 111 . 1 1 7 7 THR H H 7 8.730 8.730 8.713 0.017 17919 45247 1 111 . 1 1 8 8 LEU N N 8 121.330 121.330 124.117 -2.787 17919 45248 1 111 . 1 1 8 8 LEU HA H 8 4.310 4.310 3.996 0.314 17919 45249 1 111 . 1 1 8 8 LEU C C 8 178.800 178.800 177.902 0.898 17919 45250 1 111 . 1 1 8 8 LEU CA C 8 57.580 57.580 58.114 -0.534 17919 45251 1 111 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.020 -0.050 17919 45252 1 111 . 1 1 8 8 LEU H H 8 9.100 9.100 9.115 -0.015 17919 45253 1 111 . 1 1 9 9 THR N N 9 105.590 105.590 107.287 -1.697 17919 45254 1 111 . 1 1 9 9 THR HA H 9 4.428 4.428 4.216 0.212 17919 45255 1 111 . 1 1 9 9 THR C C 9 175.520 175.520 175.649 -0.129 17919 45256 1 111 . 1 1 9 9 THR CA C 9 61.400 61.400 62.426 -1.026 17919 45257 1 111 . 1 1 9 9 THR CB C 9 69.140 69.140 68.344 0.796 17919 45258 1 111 . 1 1 9 9 THR H H 9 7.630 7.630 7.817 -0.187 17919 45259 1 111 . 1 1 10 10 GLY N N 10 108.890 108.890 111.072 -2.182 17919 45260 1 111 . 1 1 10 10 GLY C C 10 174.070 174.070 173.746 0.324 17919 45261 1 111 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.734 0.726 17919 45262 1 111 . 1 1 10 10 GLY H H 10 7.810 7.810 7.854 -0.044 17919 45263 1 111 . 1 1 11 11 LYS N N 11 121.600 121.600 121.333 0.267 17919 45264 1 111 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.497 -0.136 17919 45265 1 111 . 1 1 11 11 LYS C C 11 175.940 175.940 175.735 0.205 17919 45266 1 111 . 1 1 11 11 LYS CA C 11 56.280 56.280 55.906 0.374 17919 45267 1 111 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.955 -0.755 17919 45268 1 111 . 1 1 11 11 LYS H H 11 7.280 7.280 7.607 -0.327 17919 45269 1 111 . 1 1 12 12 THR N N 12 120.440 120.440 116.329 4.111 17919 45270 1 111 . 1 1 12 12 THR HA H 12 5.046 5.046 4.761 0.285 17919 45271 1 111 . 1 1 12 12 THR C C 12 174.320 174.320 173.697 0.623 17919 45272 1 111 . 1 1 12 12 THR CA C 12 62.390 62.390 60.713 1.677 17919 45273 1 111 . 1 1 12 12 THR CB C 12 69.910 69.910 68.969 0.942 17919 45274 1 111 . 1 1 12 12 THR H H 12 8.650 8.650 8.429 0.221 17919 45275 1 111 . 1 1 13 13 ILE N N 13 127.110 127.110 126.751 0.359 17919 45276 1 111 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.280 0.264 17919 45277 1 111 . 1 1 13 13 ILE C C 13 175.220 175.220 175.663 -0.443 17919 45278 1 111 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.005 -0.025 17919 45279 1 111 . 1 1 13 13 ILE CB C 13 40.950 40.950 38.288 2.662 17919 45280 1 111 . 1 1 13 13 ILE H H 13 9.450 9.450 8.831 0.619 17919 45281 1 111 . 1 1 14 14 THR N N 14 121.520 121.520 122.094 -0.574 17919 45282 1 111 . 1 1 14 14 THR HA H 14 4.964 4.964 4.796 0.168 17919 45283 1 111 . 1 1 14 14 THR C C 14 173.790 173.790 174.025 -0.235 17919 45284 1 111 . 1 1 14 14 THR CA C 14 61.940 61.940 62.680 -0.740 17919 45285 1 111 . 1 1 14 14 THR CB C 14 69.650 69.650 69.629 0.021 17919 45286 1 111 . 1 1 14 14 THR H H 14 8.710 8.710 8.455 0.255 17919 45287 1 111 . 1 1 15 15 LEU N N 15 124.800 124.800 126.131 -1.331 17919 45288 1 111 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.777 0.003 17919 45289 1 111 . 1 1 15 15 LEU C C 15 174.670 174.670 174.764 -0.094 17919 45290 1 111 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.399 -0.569 17919 45291 1 111 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.924 1.146 17919 45292 1 111 . 1 1 15 15 LEU H H 15 8.710 8.710 8.345 0.365 17919 45293 1 111 . 1 1 16 16 GLU N N 16 122.160 122.160 123.187 -1.027 17919 45294 1 111 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.793 0.124 17919 45295 1 111 . 1 1 16 16 GLU C C 16 175.860 175.860 174.937 0.923 17919 45296 1 111 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.225 -0.405 17919 45297 1 111 . 1 1 16 16 GLU CB C 16 29.450 29.450 29.609 -0.159 17919 45298 1 111 . 1 1 16 16 GLU H H 16 8.140 8.140 8.627 -0.487 17919 45299 1 111 . 1 1 17 17 VAL N N 17 117.210 117.210 120.653 -3.443 17919 45300 1 111 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.574 0.140 17919 45301 1 111 . 1 1 17 17 VAL C C 17 174.160 174.160 174.892 -0.732 17919 45302 1 111 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.802 -0.372 17919 45303 1 111 . 1 1 17 17 VAL CB C 17 36.400 36.400 34.836 1.564 17919 45304 1 111 . 1 1 17 17 VAL H H 17 8.900 8.900 8.052 0.848 17919 45305 1 111 . 1 1 18 18 GLU N N 18 118.990 118.990 122.857 -3.867 17919 45306 1 111 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.687 0.392 17919 45307 1 111 . 1 1 18 18 GLU C C 18 176.160 176.160 175.962 0.198 17919 45308 1 111 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.974 -0.254 17919 45309 1 111 . 1 1 18 18 GLU CB C 18 30.310 30.310 29.180 1.130 17919 45310 1 111 . 1 1 18 18 GLU H H 18 8.640 8.640 8.355 0.285 17919 45311 1 111 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.226 -0.085 17919 45312 1 111 . 1 1 19 19 PRO C C 19 175.310 175.310 177.947 -2.637 17919 45313 1 111 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.636 -0.166 17919 45314 1 111 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.922 0.028 17919 45315 1 111 . 1 1 20 20 SER N N 20 103.400 103.400 108.605 -5.205 17919 45316 1 111 . 1 1 20 20 SER HA H 20 4.370 4.370 4.346 0.024 17919 45317 1 111 . 1 1 20 20 SER C C 20 174.660 174.660 173.956 0.704 17919 45318 1 111 . 1 1 20 20 SER CA C 20 57.400 57.400 57.383 0.017 17919 45319 1 111 . 1 1 20 20 SER CB C 20 63.370 63.370 62.543 0.827 17919 45320 1 111 . 1 1 20 20 SER H H 20 7.040 7.040 8.020 -0.980 17919 45321 1 111 . 1 1 21 21 ASP N N 21 123.480 123.480 124.106 -0.626 17919 45322 1 111 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.375 0.320 17919 45323 1 111 . 1 1 21 21 ASP C C 21 176.360 176.360 176.783 -0.423 17919 45324 1 111 . 1 1 21 21 ASP CA C 21 55.700 55.700 56.128 -0.428 17919 45325 1 111 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.381 -0.581 17919 45326 1 111 . 1 1 21 21 ASP H H 21 8.030 8.030 7.296 0.734 17919 45327 1 111 . 1 1 22 22 THR N N 22 108.800 108.800 116.909 -8.109 17919 45328 1 111 . 1 1 22 22 THR HA H 22 4.920 4.920 4.484 0.436 17919 45329 1 111 . 1 1 22 22 THR C C 22 176.750 176.750 176.127 0.623 17919 45330 1 111 . 1 1 22 22 THR CA C 22 59.690 59.690 62.193 -2.503 17919 45331 1 111 . 1 1 22 22 THR CB C 22 71.200 71.200 70.084 1.116 17919 45332 1 111 . 1 1 22 22 THR H H 22 7.900 7.900 8.485 -0.585 17919 45333 1 111 . 1 1 23 23 ILE N N 23 121.190 121.190 121.990 -0.800 17919 45334 1 111 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.851 -0.194 17919 45335 1 111 . 1 1 23 23 ILE C C 23 179.040 179.040 177.093 1.947 17919 45336 1 111 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.839 -0.579 17919 45337 1 111 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.307 -1.957 17919 45338 1 111 . 1 1 23 23 ILE H H 23 8.560 8.560 8.679 -0.119 17919 45339 1 111 . 1 1 24 24 GLU N N 24 120.830 120.830 119.164 1.666 17919 45340 1 111 . 1 1 24 24 GLU HA H 24 3.917 3.917 4.265 -0.348 17919 45341 1 111 . 1 1 24 24 GLU C C 24 178.640 178.640 178.458 0.182 17919 45342 1 111 . 1 1 24 24 GLU CA C 24 60.220 60.220 58.501 1.720 17919 45343 1 111 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.572 -1.292 17919 45344 1 111 . 1 1 24 24 GLU H H 24 9.760 9.760 7.783 1.977 17919 45345 1 111 . 1 1 25 25 ASN N N 25 120.570 120.570 120.296 0.274 17919 45346 1 111 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.474 0.051 17919 45347 1 111 . 1 1 25 25 ASN C C 25 178.380 178.380 177.726 0.654 17919 45348 1 111 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.630 -0.570 17919 45349 1 111 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.334 0.116 17919 45350 1 111 . 1 1 25 25 ASN H H 25 7.920 7.920 7.749 0.171 17919 45351 1 111 . 1 1 26 26 VAL N N 26 121.710 121.710 121.233 0.477 17919 45352 1 111 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.550 -0.153 17919 45353 1 111 . 1 1 26 26 VAL C C 26 177.950 177.950 177.905 0.045 17919 45354 1 111 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.735 0.925 17919 45355 1 111 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.524 -0.684 17919 45356 1 111 . 1 1 26 26 VAL H H 26 8.070 8.070 7.768 0.302 17919 45357 1 111 . 1 1 27 27 LYS N N 27 118.860 118.860 119.402 -0.542 17919 45358 1 111 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.129 0.451 17919 45359 1 111 . 1 1 27 27 LYS C C 27 180.550 180.550 179.063 1.487 17919 45360 1 111 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.622 -0.372 17919 45361 1 111 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.102 1.628 17919 45362 1 111 . 1 1 27 27 LYS H H 27 8.560 8.560 8.134 0.426 17919 45363 1 111 . 1 1 28 28 ALA N N 28 123.440 123.440 121.161 2.279 17919 45364 1 111 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.092 0.068 17919 45365 1 111 . 1 1 28 28 ALA C C 28 180.300 180.300 179.057 1.243 17919 45366 1 111 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.170 0.200 17919 45367 1 111 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.514 -0.804 17919 45368 1 111 . 1 1 28 28 ALA H H 28 8.060 8.060 8.112 -0.052 17919 45369 1 111 . 1 1 29 29 LYS N N 29 119.940 119.940 119.891 0.049 17919 45370 1 111 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.000 0.207 17919 45371 1 111 . 1 1 29 29 LYS C C 29 180.320 180.320 179.071 1.249 17919 45372 1 111 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.318 0.333 17919 45373 1 111 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.222 1.068 17919 45374 1 111 . 1 1 29 29 LYS H H 29 7.850 7.850 7.371 0.479 17919 45375 1 111 . 1 1 30 30 ILE N N 30 121.080 121.080 120.397 0.683 17919 45376 1 111 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.598 -0.091 17919 45377 1 111 . 1 1 30 30 ILE C C 30 178.310 178.310 177.405 0.905 17919 45378 1 111 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.882 0.268 17919 45379 1 111 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.767 -0.967 17919 45380 1 111 . 1 1 30 30 ILE H H 30 8.280 8.280 8.564 -0.284 17919 45381 1 111 . 1 1 31 31 GLN N N 31 123.490 123.490 119.204 4.286 17919 45382 1 111 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.927 -0.098 17919 45383 1 111 . 1 1 31 31 GLN C C 31 178.890 178.890 178.255 0.635 17919 45384 1 111 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.385 0.615 17919 45385 1 111 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.408 -0.688 17919 45386 1 111 . 1 1 31 31 GLN H H 31 8.580 8.580 7.993 0.587 17919 45387 1 111 . 1 1 32 32 ASP N N 32 119.360 119.360 120.452 -1.092 17919 45388 1 111 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.420 -0.066 17919 45389 1 111 . 1 1 32 32 ASP C C 32 177.250 177.250 177.967 -0.717 17919 45390 1 111 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.887 0.303 17919 45391 1 111 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.815 -0.235 17919 45392 1 111 . 1 1 32 32 ASP H H 32 8.010 8.010 7.804 0.206 17919 45393 1 111 . 1 1 33 33 LYS N N 33 115.130 115.130 119.826 -4.696 17919 45394 1 111 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.146 0.191 17919 45395 1 111 . 1 1 33 33 LYS C C 33 177.870 177.870 178.770 -0.900 17919 45396 1 111 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.109 -0.059 17919 45397 1 111 . 1 1 33 33 LYS CB C 33 34.170 34.170 32.611 1.559 17919 45398 1 111 . 1 1 33 33 LYS H H 33 7.430 7.430 7.679 -0.249 17919 45399 1 111 . 1 1 34 34 GLU N N 34 113.870 113.870 114.347 -0.477 17919 45400 1 111 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.539 0.086 17919 45401 1 111 . 1 1 34 34 GLU C C 34 177.840 177.840 177.031 0.809 17919 45402 1 111 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.678 -0.509 17919 45403 1 111 . 1 1 34 34 GLU CB C 34 32.660 32.660 30.393 2.267 17919 45404 1 111 . 1 1 34 34 GLU H H 34 8.740 8.740 7.903 0.837 17919 45405 1 111 . 1 1 35 35 GLY N N 35 108.650 108.650 109.101 -0.451 17919 45406 1 111 . 1 1 35 35 GLY C C 35 173.960 173.960 174.935 -0.975 17919 45407 1 111 . 1 1 35 35 GLY CA C 35 46.080 46.080 46.134 -0.054 17919 45408 1 111 . 1 1 35 35 GLY H H 35 8.530 8.530 8.163 0.367 17919 45409 1 111 . 1 1 36 36 ILE N N 36 119.880 119.880 121.062 -1.182 17919 45410 1 111 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.029 0.416 17919 45411 1 111 . 1 1 36 36 ILE C C 36 173.590 173.590 174.283 -0.693 17919 45412 1 111 . 1 1 36 36 ILE CA C 36 57.750 57.750 59.168 -1.418 17919 45413 1 111 . 1 1 36 36 ILE CB C 36 40.580 40.580 37.568 3.012 17919 45414 1 111 . 1 1 36 36 ILE H H 36 6.150 6.150 7.727 -1.577 17919 45415 1 111 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.607 0.027 17919 45416 1 111 . 1 1 37 37 PRO C C 37 176.940 176.940 176.323 0.617 17919 45417 1 111 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.688 -0.028 17919 45418 1 111 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.536 0.314 17919 45419 1 111 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.278 -0.161 17919 45420 1 111 . 1 1 38 38 PRO C C 38 178.320 178.320 178.270 0.050 17919 45421 1 111 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.638 0.622 17919 45422 1 111 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.998 0.892 17919 45423 1 111 . 1 1 39 39 ASP N N 39 113.380 113.380 117.836 -4.456 17919 45424 1 111 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.448 -0.018 17919 45425 1 111 . 1 1 39 39 ASP C C 39 177.090 177.090 177.359 -0.269 17919 45426 1 111 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.822 -1.183 17919 45427 1 111 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.522 -0.982 17919 45428 1 111 . 1 1 39 39 ASP H H 39 8.550 8.550 8.628 -0.078 17919 45429 1 111 . 1 1 40 40 GLN N N 40 116.780 116.780 118.466 -1.686 17919 45430 1 111 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.273 0.191 17919 45431 1 111 . 1 1 40 40 GLN C C 40 175.380 175.380 176.148 -0.768 17919 45432 1 111 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.569 -0.929 17919 45433 1 111 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.657 0.483 17919 45434 1 111 . 1 1 40 40 GLN H H 40 7.820 7.820 7.707 0.113 17919 45435 1 111 . 1 1 41 41 GLN N N 41 117.720 117.720 119.414 -1.694 17919 45436 1 111 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.157 0.087 17919 45437 1 111 . 1 1 41 41 GLN C C 41 176.300 176.300 175.123 1.177 17919 45438 1 111 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.936 -0.466 17919 45439 1 111 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.452 2.198 17919 45440 1 111 . 1 1 41 41 GLN H H 41 7.480 7.480 7.682 -0.202 17919 45441 1 111 . 1 1 42 42 ARG N N 42 122.680 122.680 122.733 -0.053 17919 45442 1 111 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.600 -0.100 17919 45443 1 111 . 1 1 42 42 ARG C C 42 174.050 174.050 174.873 -0.823 17919 45444 1 111 . 1 1 42 42 ARG CA C 42 55.050 55.050 53.861 1.189 17919 45445 1 111 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.288 -0.538 17919 45446 1 111 . 1 1 42 42 ARG H H 42 8.530 8.530 8.148 0.382 17919 45447 1 111 . 1 1 43 43 LEU N N 43 124.040 124.040 127.072 -3.032 17919 45448 1 111 . 1 1 43 43 LEU C C 43 175.290 175.290 176.193 -0.903 17919 45449 1 111 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.743 -1.763 17919 45450 1 111 . 1 1 43 43 LEU CB C 43 45.790 45.790 42.487 3.303 17919 45451 1 111 . 1 1 43 43 LEU H H 43 8.820 8.820 8.825 -0.005 17919 45452 1 111 . 1 1 44 44 ILE N N 44 121.920 121.920 122.288 -0.368 17919 45453 1 111 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.104 -0.112 17919 45454 1 111 . 1 1 44 44 ILE C C 44 176.060 176.060 174.488 1.572 17919 45455 1 111 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.096 -1.116 17919 45456 1 111 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.013 0.407 17919 45457 1 111 . 1 1 44 44 ILE H H 44 9.030 9.030 9.092 -0.062 17919 45458 1 111 . 1 1 45 45 PHE N N 45 125.390 125.390 128.153 -2.763 17919 45459 1 111 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.127 -0.082 17919 45460 1 111 . 1 1 45 45 PHE C C 45 174.470 174.470 174.398 0.072 17919 45461 1 111 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.984 0.035 17919 45462 1 111 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.283 0.477 17919 45463 1 111 . 1 1 45 45 PHE H H 45 8.830 8.830 9.235 -0.405 17919 45464 1 111 . 1 1 46 46 ALA N N 46 132.200 132.200 130.272 1.928 17919 45465 1 111 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.710 -0.020 17919 45466 1 111 . 1 1 46 46 ALA C C 46 177.290 177.290 177.681 -0.391 17919 45467 1 111 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.683 -0.143 17919 45468 1 111 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.599 -0.029 17919 45469 1 111 . 1 1 46 46 ALA H H 46 8.810 8.810 8.617 0.193 17919 45470 1 111 . 1 1 47 47 GLY N N 47 102.340 102.340 103.451 -1.111 17919 45471 1 111 . 1 1 47 47 GLY C C 47 173.810 173.810 174.258 -0.448 17919 45472 1 111 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.228 0.122 17919 45473 1 111 . 1 1 47 47 GLY H H 47 8.130 8.130 8.587 -0.457 17919 45474 1 111 . 1 1 48 48 LYS N N 48 121.570 121.570 121.383 0.187 17919 45475 1 111 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.603 0.019 17919 45476 1 111 . 1 1 48 48 LYS C C 48 174.700 174.700 175.781 -1.081 17919 45477 1 111 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.627 -0.077 17919 45478 1 111 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.465 0.065 17919 45479 1 111 . 1 1 48 48 LYS H H 48 7.980 7.980 7.894 0.086 17919 45480 1 111 . 1 1 49 49 GLN N N 49 122.410 122.410 122.331 0.079 17919 45481 1 111 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.500 0.060 17919 45482 1 111 . 1 1 49 49 GLN C C 49 175.670 175.670 175.860 -0.190 17919 45483 1 111 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.597 -0.857 17919 45484 1 111 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.329 -0.329 17919 45485 1 111 . 1 1 49 49 GLN H H 49 8.600 8.600 8.564 0.036 17919 45486 1 111 . 1 1 50 50 LEU N N 50 125.520 125.520 125.780 -0.260 17919 45487 1 111 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.227 -0.137 17919 45488 1 111 . 1 1 50 50 LEU C C 50 176.660 176.660 175.711 0.949 17919 45489 1 111 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.765 0.475 17919 45490 1 111 . 1 1 50 50 LEU CB C 50 41.570 41.570 43.166 -1.596 17919 45491 1 111 . 1 1 50 50 LEU H H 50 8.530 8.530 8.546 -0.016 17919 45492 1 111 . 1 1 51 51 GLU N N 51 122.940 122.940 123.539 -0.599 17919 45493 1 111 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.484 0.004 17919 45494 1 111 . 1 1 51 51 GLU C C 51 175.870 175.870 176.353 -0.483 17919 45495 1 111 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.940 0.020 17919 45496 1 111 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.564 0.006 17919 45497 1 111 . 1 1 51 51 GLU H H 51 8.400 8.400 8.108 0.292 17919 45498 1 111 . 1 1 52 52 ASP N N 52 120.030 120.030 124.262 -4.232 17919 45499 1 111 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.602 -0.243 17919 45500 1 111 . 1 1 52 52 ASP C C 52 177.330 177.330 177.377 -0.047 17919 45501 1 111 . 1 1 52 52 ASP CA C 52 56.960 56.960 56.361 0.599 17919 45502 1 111 . 1 1 52 52 ASP CB C 52 40.850 40.850 41.067 -0.217 17919 45503 1 111 . 1 1 52 52 ASP H H 52 8.160 8.160 8.773 -0.613 17919 45504 1 111 . 1 1 53 53 GLY N N 53 106.660 106.660 106.030 0.630 17919 45505 1 111 . 1 1 53 53 GLY C C 53 174.870 174.870 174.465 0.405 17919 45506 1 111 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.120 0.050 17919 45507 1 111 . 1 1 53 53 GLY H H 53 9.390 9.390 8.190 1.200 17919 45508 1 111 . 1 1 54 54 ARG N N 54 119.050 119.050 119.565 -0.515 17919 45509 1 111 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.625 0.070 17919 45510 1 111 . 1 1 54 54 ARG C C 54 175.350 175.350 175.701 -0.351 17919 45511 1 111 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.181 0.209 17919 45512 1 111 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.233 -0.583 17919 45513 1 111 . 1 1 54 54 ARG H H 54 7.460 7.460 7.284 0.176 17919 45514 1 111 . 1 1 55 55 THR N N 55 108.400 108.400 113.145 -4.745 17919 45515 1 111 . 1 1 55 55 THR HA H 55 5.240 5.240 4.685 0.555 17919 45516 1 111 . 1 1 55 55 THR C C 55 176.560 176.560 175.666 0.894 17919 45517 1 111 . 1 1 55 55 THR CA C 55 59.690 59.690 61.681 -1.991 17919 45518 1 111 . 1 1 55 55 THR CB C 55 72.260 72.260 70.489 1.771 17919 45519 1 111 . 1 1 55 55 THR H H 55 8.730 8.730 8.876 -0.146 17919 45520 1 111 . 1 1 56 56 LEU N N 56 117.920 117.920 123.284 -5.364 17919 45521 1 111 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.041 0.019 17919 45522 1 111 . 1 1 56 56 LEU C C 56 180.810 180.810 178.477 2.333 17919 45523 1 111 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.832 -0.122 17919 45524 1 111 . 1 1 56 56 LEU CB C 56 40.370 40.370 42.110 -1.740 17919 45525 1 111 . 1 1 56 56 LEU H H 56 8.140 8.140 8.531 -0.391 17919 45526 1 111 . 1 1 57 57 SER N N 57 113.330 113.330 113.402 -0.072 17919 45527 1 111 . 1 1 57 57 SER HA H 57 4.370 4.370 4.070 0.300 17919 45528 1 111 . 1 1 57 57 SER C C 57 178.310 178.310 176.751 1.559 17919 45529 1 111 . 1 1 57 57 SER CA C 57 61.080 61.080 61.878 -0.798 17919 45530 1 111 . 1 1 57 57 SER CB C 57 62.530 62.530 62.648 -0.118 17919 45531 1 111 . 1 1 57 57 SER H H 57 8.470 8.470 8.009 0.461 17919 45532 1 111 . 1 1 58 58 ASP N N 58 124.190 124.190 122.009 2.181 17919 45533 1 111 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.277 0.019 17919 45534 1 111 . 1 1 58 58 ASP C C 58 177.400 177.400 177.695 -0.295 17919 45535 1 111 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.748 0.432 17919 45536 1 111 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.300 -0.200 17919 45537 1 111 . 1 1 58 58 ASP H H 58 7.930 7.930 7.506 0.424 17919 45538 1 111 . 1 1 59 59 TYR N N 59 115.510 115.510 115.686 -0.176 17919 45539 1 111 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.534 0.136 17919 45540 1 111 . 1 1 59 59 TYR C C 59 174.700 174.700 175.244 -0.544 17919 45541 1 111 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.455 0.795 17919 45542 1 111 . 1 1 59 59 TYR CB C 59 40.070 40.070 37.581 2.489 17919 45543 1 111 . 1 1 59 59 TYR H H 59 7.250 7.250 7.306 -0.056 17919 45544 1 111 . 1 1 60 60 ASN N N 60 115.900 115.900 116.661 -0.761 17919 45545 1 111 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.332 0.023 17919 45546 1 111 . 1 1 60 60 ASN C C 60 174.340 174.340 174.670 -0.330 17919 45547 1 111 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.191 -0.070 17919 45548 1 111 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.511 -0.101 17919 45549 1 111 . 1 1 60 60 ASN H H 60 8.150 8.150 7.690 0.460 17919 45550 1 111 . 1 1 61 61 ILE N N 61 118.600 118.600 119.619 -1.019 17919 45551 1 111 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.768 -0.375 17919 45552 1 111 . 1 1 61 61 ILE C C 61 174.610 174.610 175.323 -0.713 17919 45553 1 111 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.123 0.297 17919 45554 1 111 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.434 -0.694 17919 45555 1 111 . 1 1 61 61 ILE H H 61 7.250 7.250 7.445 -0.195 17919 45556 1 111 . 1 1 62 62 GLN N N 62 124.740 124.740 123.700 1.040 17919 45557 1 111 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.559 -0.053 17919 45558 1 111 . 1 1 62 62 GLN C C 62 175.970 175.970 174.583 1.387 17919 45559 1 111 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.595 0.065 17919 45560 1 111 . 1 1 62 62 GLN CB C 62 31.650 31.650 32.748 -1.097 17919 45561 1 111 . 1 1 62 62 GLN H H 62 7.610 7.610 8.049 -0.439 17919 45562 1 111 . 1 1 63 63 LYS N N 63 120.300 120.300 122.188 -1.888 17919 45563 1 111 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.895 0.106 17919 45564 1 111 . 1 1 63 63 LYS C C 63 175.810 175.810 176.742 -0.932 17919 45565 1 111 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.392 -0.602 17919 45566 1 111 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.963 0.687 17919 45567 1 111 . 1 1 63 63 LYS H H 63 8.490 8.490 8.634 -0.144 17919 45568 1 111 . 1 1 64 64 GLU N N 64 113.950 113.950 120.741 -6.791 17919 45569 1 111 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.886 -0.421 17919 45570 1 111 . 1 1 64 64 GLU C C 64 175.250 175.250 176.453 -1.203 17919 45571 1 111 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.952 -0.062 17919 45572 1 111 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.787 -2.887 17919 45573 1 111 . 1 1 64 64 GLU H H 64 9.280 9.280 8.782 0.498 17919 45574 1 111 . 1 1 65 65 SER N N 65 114.730 114.730 115.474 -0.744 17919 45575 1 111 . 1 1 65 65 SER HA H 65 4.640 4.640 4.506 0.134 17919 45576 1 111 . 1 1 65 65 SER C C 65 172.160 172.160 174.807 -2.647 17919 45577 1 111 . 1 1 65 65 SER CA C 65 60.890 60.890 59.357 1.533 17919 45578 1 111 . 1 1 65 65 SER CB C 65 64.910 64.910 63.527 1.383 17919 45579 1 111 . 1 1 65 65 SER H H 65 7.670 7.670 7.963 -0.293 17919 45580 1 111 . 1 1 66 66 THR N N 66 117.110 117.110 122.574 -5.464 17919 45581 1 111 . 1 1 66 66 THR HA H 66 5.270 5.270 4.752 0.518 17919 45582 1 111 . 1 1 66 66 THR C C 66 173.950 173.950 174.015 -0.065 17919 45583 1 111 . 1 1 66 66 THR CA C 66 62.340 62.340 62.672 -0.332 17919 45584 1 111 . 1 1 66 66 THR CB C 66 70.080 70.080 69.446 0.634 17919 45585 1 111 . 1 1 66 66 THR H H 66 8.730 8.730 8.398 0.332 17919 45586 1 111 . 1 1 67 67 LEU N N 67 127.110 127.110 128.004 -0.894 17919 45587 1 111 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.866 0.194 17919 45588 1 111 . 1 1 67 67 LEU C C 67 175.770 175.770 176.288 -0.518 17919 45589 1 111 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.726 0.174 17919 45590 1 111 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.133 1.127 17919 45591 1 111 . 1 1 67 67 LEU H H 67 9.410 9.410 9.222 0.188 17919 45592 1 111 . 1 1 68 68 HIS N N 68 118.380 118.380 120.490 -2.110 17919 45593 1 111 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.014 0.226 17919 45594 1 111 . 1 1 68 68 HIS C C 68 173.150 173.150 174.562 -1.412 17919 45595 1 111 . 1 1 68 68 HIS CA C 68 55.000 55.000 55.438 -0.438 17919 45596 1 111 . 1 1 68 68 HIS CB C 68 30.530 30.530 30.930 -0.400 17919 45597 1 111 . 1 1 68 68 HIS H H 68 9.230 9.230 9.345 -0.115 17919 45598 1 111 . 1 1 69 69 LEU N N 69 124.460 124.460 125.347 -0.887 17919 45599 1 111 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.218 -0.028 17919 45600 1 111 . 1 1 69 69 LEU C C 69 175.270 175.270 174.910 0.360 17919 45601 1 111 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.578 0.312 17919 45602 1 111 . 1 1 69 69 LEU CB C 69 44.380 44.380 43.695 0.685 17919 45603 1 111 . 1 1 69 69 LEU H H 69 8.340 8.340 8.421 -0.081 17919 45604 1 111 . 1 1 70 70 VAL N N 70 126.940 126.940 121.359 5.581 17919 45605 1 111 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.606 -0.256 17919 45606 1 111 . 1 1 70 70 VAL C C 70 174.000 174.000 174.386 -0.386 17919 45607 1 111 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.815 0.985 17919 45608 1 111 . 1 1 70 70 VAL CB C 70 34.910 34.910 34.249 0.661 17919 45609 1 111 . 1 1 70 70 VAL H H 70 9.200 9.200 8.637 0.563 17919 45610 1 111 . 1 1 71 71 LEU N N 71 123.130 123.130 123.334 -0.204 17919 45611 1 111 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.808 0.252 17919 45612 1 111 . 1 1 71 71 LEU C C 71 177.830 177.830 177.161 0.669 17919 45613 1 111 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.800 0.140 17919 45614 1 111 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.595 -0.745 17919 45615 1 111 . 1 1 71 71 LEU H H 71 8.120 8.120 8.469 -0.349 17919 45616 1 111 . 1 1 72 72 ARG N N 72 123.490 123.490 123.612 -0.122 17919 45617 1 111 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.603 -0.302 17919 45618 1 111 . 1 1 72 72 ARG C C 72 175.350 175.350 175.189 0.161 17919 45619 1 111 . 1 1 72 72 ARG CA C 72 55.610 55.610 54.955 0.655 17919 45620 1 111 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.094 1.256 17919 45621 1 111 . 1 1 72 72 ARG H H 72 8.580 8.580 8.223 0.357 17919 45622 1 112 . 1 1 2 2 GLN N N 2 123.220 123.220 121.161 2.059 17919 45623 1 112 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.147 0.102 17919 45624 1 112 . 1 1 2 2 GLN C C 2 175.920 175.920 175.738 0.182 17919 45625 1 112 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.731 0.349 17919 45626 1 112 . 1 1 2 2 GLN CB C 2 30.760 30.760 29.453 1.307 17919 45627 1 112 . 1 1 2 2 GLN H H 2 8.900 8.900 8.381 0.519 17919 45628 1 112 . 1 1 3 3 ILE N N 3 115.340 115.340 116.996 -1.656 17919 45629 1 112 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.067 0.146 17919 45630 1 112 . 1 1 3 3 ILE C C 3 172.450 172.450 173.278 -0.828 17919 45631 1 112 . 1 1 3 3 ILE CA C 3 59.570 59.570 60.060 -0.490 17919 45632 1 112 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.382 0.828 17919 45633 1 112 . 1 1 3 3 ILE H H 3 8.320 8.320 7.799 0.521 17919 45634 1 112 . 1 1 4 4 PHE N N 4 118.110 118.110 120.340 -2.230 17919 45635 1 112 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.426 0.204 17919 45636 1 112 . 1 1 4 4 PHE C C 4 175.320 175.320 175.623 -0.303 17919 45637 1 112 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.299 -0.089 17919 45638 1 112 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.037 -0.557 17919 45639 1 112 . 1 1 4 4 PHE H H 4 8.610 8.610 7.707 0.903 17919 45640 1 112 . 1 1 5 5 VAL N N 5 121.000 121.000 119.786 1.214 17919 45641 1 112 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.752 -0.027 17919 45642 1 112 . 1 1 5 5 VAL C C 5 174.870 174.870 174.442 0.428 17919 45643 1 112 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.320 -0.700 17919 45644 1 112 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.475 -0.245 17919 45645 1 112 . 1 1 5 5 VAL H H 5 9.300 9.300 8.414 0.886 17919 45646 1 112 . 1 1 6 6 LYS N N 6 127.520 127.520 128.130 -0.610 17919 45647 1 112 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.169 0.198 17919 45648 1 112 . 1 1 6 6 LYS C C 6 177.140 177.140 175.780 1.360 17919 45649 1 112 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.761 -0.241 17919 45650 1 112 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.746 -0.696 17919 45651 1 112 . 1 1 6 6 LYS H H 6 8.820 8.820 8.883 -0.063 17919 45652 1 112 . 1 1 7 7 THR N N 7 115.400 115.400 118.184 -2.784 17919 45653 1 112 . 1 1 7 7 THR HA H 7 4.970 4.970 4.844 0.126 17919 45654 1 112 . 1 1 7 7 THR C C 7 176.910 176.910 176.283 0.627 17919 45655 1 112 . 1 1 7 7 THR CA C 7 60.470 60.470 59.718 0.752 17919 45656 1 112 . 1 1 7 7 THR CB C 7 70.630 70.630 71.124 -0.494 17919 45657 1 112 . 1 1 7 7 THR H H 7 8.730 8.730 8.232 0.498 17919 45658 1 112 . 1 1 8 8 LEU N N 8 121.330 121.330 126.614 -5.284 17919 45659 1 112 . 1 1 8 8 LEU HA H 8 4.310 4.310 3.980 0.330 17919 45660 1 112 . 1 1 8 8 LEU C C 8 178.800 178.800 178.202 0.598 17919 45661 1 112 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.613 -0.033 17919 45662 1 112 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.458 0.512 17919 45663 1 112 . 1 1 8 8 LEU H H 8 9.100 9.100 9.131 -0.031 17919 45664 1 112 . 1 1 9 9 THR N N 9 105.590 105.590 108.694 -3.104 17919 45665 1 112 . 1 1 9 9 THR HA H 9 4.428 4.428 4.254 0.174 17919 45666 1 112 . 1 1 9 9 THR C C 9 175.520 175.520 175.842 -0.322 17919 45667 1 112 . 1 1 9 9 THR CA C 9 61.400 61.400 62.770 -1.370 17919 45668 1 112 . 1 1 9 9 THR CB C 9 69.140 69.140 69.288 -0.148 17919 45669 1 112 . 1 1 9 9 THR H H 9 7.630 7.630 7.819 -0.189 17919 45670 1 112 . 1 1 10 10 GLY N N 10 108.890 108.890 110.014 -1.124 17919 45671 1 112 . 1 1 10 10 GLY C C 10 174.070 174.070 173.660 0.410 17919 45672 1 112 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.685 0.775 17919 45673 1 112 . 1 1 10 10 GLY H H 10 7.810 7.810 8.176 -0.366 17919 45674 1 112 . 1 1 11 11 LYS N N 11 121.600 121.600 121.655 -0.055 17919 45675 1 112 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.603 -0.242 17919 45676 1 112 . 1 1 11 11 LYS C C 11 175.940 175.940 174.918 1.022 17919 45677 1 112 . 1 1 11 11 LYS CA C 11 56.280 56.280 55.901 0.379 17919 45678 1 112 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.714 -0.514 17919 45679 1 112 . 1 1 11 11 LYS H H 11 7.280 7.280 8.154 -0.874 17919 45680 1 112 . 1 1 12 12 THR N N 12 120.440 120.440 118.065 2.375 17919 45681 1 112 . 1 1 12 12 THR HA H 12 5.046 5.046 5.352 -0.306 17919 45682 1 112 . 1 1 12 12 THR C C 12 174.320 174.320 174.238 0.082 17919 45683 1 112 . 1 1 12 12 THR CA C 12 62.390 62.390 60.945 1.445 17919 45684 1 112 . 1 1 12 12 THR CB C 12 69.910 69.910 71.200 -1.290 17919 45685 1 112 . 1 1 12 12 THR H H 12 8.650 8.650 8.225 0.425 17919 45686 1 112 . 1 1 13 13 ILE N N 13 127.110 127.110 123.116 3.994 17919 45687 1 112 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.455 0.089 17919 45688 1 112 . 1 1 13 13 ILE C C 13 175.220 175.220 174.669 0.551 17919 45689 1 112 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.482 -0.502 17919 45690 1 112 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.792 -0.842 17919 45691 1 112 . 1 1 13 13 ILE H H 13 9.450 9.450 8.770 0.680 17919 45692 1 112 . 1 1 14 14 THR N N 14 121.520 121.520 122.461 -0.941 17919 45693 1 112 . 1 1 14 14 THR HA H 14 4.964 4.964 4.759 0.205 17919 45694 1 112 . 1 1 14 14 THR C C 14 173.790 173.790 173.755 0.035 17919 45695 1 112 . 1 1 14 14 THR CA C 14 61.940 61.940 62.266 -0.326 17919 45696 1 112 . 1 1 14 14 THR CB C 14 69.650 69.650 69.233 0.417 17919 45697 1 112 . 1 1 14 14 THR H H 14 8.710 8.710 8.575 0.135 17919 45698 1 112 . 1 1 15 15 LEU N N 15 124.800 124.800 126.421 -1.621 17919 45699 1 112 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.580 0.200 17919 45700 1 112 . 1 1 15 15 LEU C C 15 174.670 174.670 175.984 -1.314 17919 45701 1 112 . 1 1 15 15 LEU CA C 15 52.830 52.830 54.218 -1.388 17919 45702 1 112 . 1 1 15 15 LEU CB C 15 47.070 47.070 42.728 4.342 17919 45703 1 112 . 1 1 15 15 LEU H H 15 8.710 8.710 8.258 0.452 17919 45704 1 112 . 1 1 16 16 GLU N N 16 122.160 122.160 123.408 -1.248 17919 45705 1 112 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.996 -0.079 17919 45706 1 112 . 1 1 16 16 GLU C C 16 175.860 175.860 176.037 -0.177 17919 45707 1 112 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.498 -0.678 17919 45708 1 112 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.200 -0.750 17919 45709 1 112 . 1 1 16 16 GLU H H 16 8.140 8.140 8.539 -0.399 17919 45710 1 112 . 1 1 17 17 VAL N N 17 117.210 117.210 119.834 -2.624 17919 45711 1 112 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.460 0.254 17919 45712 1 112 . 1 1 17 17 VAL C C 17 174.160 174.160 174.688 -0.528 17919 45713 1 112 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.103 -0.673 17919 45714 1 112 . 1 1 17 17 VAL CB C 17 36.400 36.400 34.423 1.977 17919 45715 1 112 . 1 1 17 17 VAL H H 17 8.900 8.900 8.840 0.060 17919 45716 1 112 . 1 1 18 18 GLU N N 18 118.990 118.990 119.734 -0.744 17919 45717 1 112 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.941 0.138 17919 45718 1 112 . 1 1 18 18 GLU C C 18 176.160 176.160 175.414 0.746 17919 45719 1 112 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.296 0.424 17919 45720 1 112 . 1 1 18 18 GLU CB C 18 30.310 30.310 32.425 -2.115 17919 45721 1 112 . 1 1 18 18 GLU H H 18 8.640 8.640 8.063 0.577 17919 45722 1 112 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.134 0.007 17919 45723 1 112 . 1 1 19 19 PRO C C 19 175.310 175.310 178.118 -2.808 17919 45724 1 112 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.590 -0.120 17919 45725 1 112 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.838 0.112 17919 45726 1 112 . 1 1 20 20 SER N N 20 103.400 103.400 111.990 -8.590 17919 45727 1 112 . 1 1 20 20 SER HA H 20 4.370 4.370 4.201 0.169 17919 45728 1 112 . 1 1 20 20 SER C C 20 174.660 174.660 175.015 -0.355 17919 45729 1 112 . 1 1 20 20 SER CA C 20 57.400 57.400 59.976 -2.576 17919 45730 1 112 . 1 1 20 20 SER CB C 20 63.370 63.370 62.776 0.594 17919 45731 1 112 . 1 1 20 20 SER H H 20 7.040 7.040 8.066 -1.026 17919 45732 1 112 . 1 1 21 21 ASP N N 21 123.480 123.480 123.035 0.445 17919 45733 1 112 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.620 0.075 17919 45734 1 112 . 1 1 21 21 ASP C C 21 176.360 176.360 175.606 0.754 17919 45735 1 112 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.969 -0.269 17919 45736 1 112 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.470 -0.670 17919 45737 1 112 . 1 1 21 21 ASP H H 21 8.030 8.030 8.005 0.025 17919 45738 1 112 . 1 1 22 22 THR N N 22 108.800 108.800 113.788 -4.988 17919 45739 1 112 . 1 1 22 22 THR HA H 22 4.920 4.920 4.994 -0.074 17919 45740 1 112 . 1 1 22 22 THR C C 22 176.750 176.750 175.769 0.981 17919 45741 1 112 . 1 1 22 22 THR CA C 22 59.690 59.690 61.027 -1.337 17919 45742 1 112 . 1 1 22 22 THR CB C 22 71.200 71.200 70.958 0.242 17919 45743 1 112 . 1 1 22 22 THR H H 22 7.900 7.900 8.220 -0.320 17919 45744 1 112 . 1 1 23 23 ILE N N 23 121.190 121.190 122.118 -0.928 17919 45745 1 112 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.947 -0.290 17919 45746 1 112 . 1 1 23 23 ILE C C 23 179.040 179.040 177.704 1.336 17919 45747 1 112 . 1 1 23 23 ILE CA C 23 62.260 62.260 61.607 0.653 17919 45748 1 112 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.074 -1.724 17919 45749 1 112 . 1 1 23 23 ILE H H 23 8.560 8.560 9.021 -0.461 17919 45750 1 112 . 1 1 24 24 GLU N N 24 120.830 120.830 121.264 -0.434 17919 45751 1 112 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.874 0.043 17919 45752 1 112 . 1 1 24 24 GLU C C 24 178.640 178.640 178.681 -0.041 17919 45753 1 112 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.920 0.299 17919 45754 1 112 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.469 -1.189 17919 45755 1 112 . 1 1 24 24 GLU H H 24 9.760 9.760 7.945 1.815 17919 45756 1 112 . 1 1 25 25 ASN N N 25 120.570 120.570 117.431 3.139 17919 45757 1 112 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.619 -0.094 17919 45758 1 112 . 1 1 25 25 ASN C C 25 178.380 178.380 178.336 0.044 17919 45759 1 112 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.498 0.562 17919 45760 1 112 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.393 0.057 17919 45761 1 112 . 1 1 25 25 ASN H H 25 7.920 7.920 7.770 0.150 17919 45762 1 112 . 1 1 26 26 VAL N N 26 121.710 121.710 121.658 0.052 17919 45763 1 112 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.582 -0.185 17919 45764 1 112 . 1 1 26 26 VAL C C 26 177.950 177.950 177.928 0.022 17919 45765 1 112 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.745 0.915 17919 45766 1 112 . 1 1 26 26 VAL CB C 26 30.840 30.840 30.981 -0.141 17919 45767 1 112 . 1 1 26 26 VAL H H 26 8.070 8.070 8.335 -0.265 17919 45768 1 112 . 1 1 27 27 LYS N N 27 118.860 118.860 119.107 -0.247 17919 45769 1 112 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.266 0.314 17919 45770 1 112 . 1 1 27 27 LYS C C 27 180.550 180.550 179.204 1.346 17919 45771 1 112 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.403 -0.153 17919 45772 1 112 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.168 1.562 17919 45773 1 112 . 1 1 27 27 LYS H H 27 8.560 8.560 8.291 0.269 17919 45774 1 112 . 1 1 28 28 ALA N N 28 123.440 123.440 121.129 2.311 17919 45775 1 112 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.140 0.020 17919 45776 1 112 . 1 1 28 28 ALA C C 28 180.300 180.300 178.709 1.591 17919 45777 1 112 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.871 0.499 17919 45778 1 112 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.487 -0.777 17919 45779 1 112 . 1 1 28 28 ALA H H 28 8.060 8.060 7.768 0.292 17919 45780 1 112 . 1 1 29 29 LYS N N 29 119.940 119.940 119.981 -0.041 17919 45781 1 112 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.053 0.154 17919 45782 1 112 . 1 1 29 29 LYS C C 29 180.320 180.320 178.970 1.350 17919 45783 1 112 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.311 0.339 17919 45784 1 112 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.352 0.938 17919 45785 1 112 . 1 1 29 29 LYS H H 29 7.850 7.850 7.503 0.347 17919 45786 1 112 . 1 1 30 30 ILE N N 30 121.080 121.080 120.025 1.055 17919 45787 1 112 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.580 -0.073 17919 45788 1 112 . 1 1 30 30 ILE C C 30 178.310 178.310 177.524 0.786 17919 45789 1 112 . 1 1 30 30 ILE CA C 30 66.150 66.150 64.814 1.336 17919 45790 1 112 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.470 -0.670 17919 45791 1 112 . 1 1 30 30 ILE H H 30 8.280 8.280 8.105 0.175 17919 45792 1 112 . 1 1 31 31 GLN N N 31 123.490 123.490 120.754 2.736 17919 45793 1 112 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.046 -0.217 17919 45794 1 112 . 1 1 31 31 GLN C C 31 178.890 178.890 177.915 0.975 17919 45795 1 112 . 1 1 31 31 GLN CA C 31 60.000 60.000 58.815 1.185 17919 45796 1 112 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.053 -0.333 17919 45797 1 112 . 1 1 31 31 GLN H H 31 8.580 8.580 7.942 0.638 17919 45798 1 112 . 1 1 32 32 ASP N N 32 119.360 119.360 118.267 1.093 17919 45799 1 112 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.428 -0.074 17919 45800 1 112 . 1 1 32 32 ASP C C 32 177.250 177.250 178.455 -1.205 17919 45801 1 112 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.622 0.568 17919 45802 1 112 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.923 -0.343 17919 45803 1 112 . 1 1 32 32 ASP H H 32 8.010 8.010 7.718 0.292 17919 45804 1 112 . 1 1 33 33 LYS N N 33 115.130 115.130 117.494 -2.364 17919 45805 1 112 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.297 0.040 17919 45806 1 112 . 1 1 33 33 LYS C C 33 177.870 177.870 177.830 0.040 17919 45807 1 112 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.749 0.301 17919 45808 1 112 . 1 1 33 33 LYS CB C 33 34.170 34.170 32.951 1.219 17919 45809 1 112 . 1 1 33 33 LYS H H 33 7.430 7.430 7.745 -0.315 17919 45810 1 112 . 1 1 34 34 GLU N N 34 113.870 113.870 114.082 -0.212 17919 45811 1 112 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.494 0.131 17919 45812 1 112 . 1 1 34 34 GLU C C 34 177.840 177.840 177.187 0.653 17919 45813 1 112 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.336 -1.166 17919 45814 1 112 . 1 1 34 34 GLU CB C 34 32.660 32.660 32.731 -0.071 17919 45815 1 112 . 1 1 34 34 GLU H H 34 8.740 8.740 8.395 0.345 17919 45816 1 112 . 1 1 35 35 GLY N N 35 108.650 108.650 108.779 -0.129 17919 45817 1 112 . 1 1 35 35 GLY C C 35 173.960 173.960 174.387 -0.427 17919 45818 1 112 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.703 0.377 17919 45819 1 112 . 1 1 35 35 GLY H H 35 8.530 8.530 7.924 0.606 17919 45820 1 112 . 1 1 36 36 ILE N N 36 119.880 119.880 122.706 -2.826 17919 45821 1 112 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.263 0.182 17919 45822 1 112 . 1 1 36 36 ILE C C 36 173.590 173.590 174.545 -0.955 17919 45823 1 112 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.483 -0.733 17919 45824 1 112 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.394 2.186 17919 45825 1 112 . 1 1 36 36 ILE H H 36 6.150 6.150 7.738 -1.588 17919 45826 1 112 . 1 1 37 37 PRO HA H 37 4.634 4.634 5.063 -0.429 17919 45827 1 112 . 1 1 37 37 PRO C C 37 176.940 176.940 176.520 0.420 17919 45828 1 112 . 1 1 37 37 PRO CA C 37 61.660 61.660 60.888 0.772 17919 45829 1 112 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.496 0.354 17919 45830 1 112 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.230 -0.113 17919 45831 1 112 . 1 1 38 38 PRO C C 38 178.320 178.320 178.420 -0.100 17919 45832 1 112 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.249 1.011 17919 45833 1 112 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.564 1.327 17919 45834 1 112 . 1 1 39 39 ASP N N 39 113.380 113.380 117.440 -4.060 17919 45835 1 112 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.347 0.083 17919 45836 1 112 . 1 1 39 39 ASP C C 39 177.090 177.090 176.867 0.223 17919 45837 1 112 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.118 -0.478 17919 45838 1 112 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.190 -0.650 17919 45839 1 112 . 1 1 39 39 ASP H H 39 8.550 8.550 8.659 -0.109 17919 45840 1 112 . 1 1 40 40 GLN N N 40 116.780 116.780 116.913 -0.133 17919 45841 1 112 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.296 0.168 17919 45842 1 112 . 1 1 40 40 GLN C C 40 175.380 175.380 175.983 -0.603 17919 45843 1 112 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.366 -0.726 17919 45844 1 112 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.328 0.812 17919 45845 1 112 . 1 1 40 40 GLN H H 40 7.820 7.820 7.650 0.170 17919 45846 1 112 . 1 1 41 41 GLN N N 41 117.720 117.720 119.825 -2.105 17919 45847 1 112 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.205 0.039 17919 45848 1 112 . 1 1 41 41 GLN C C 41 176.300 176.300 174.730 1.570 17919 45849 1 112 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.965 0.505 17919 45850 1 112 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.041 2.609 17919 45851 1 112 . 1 1 41 41 GLN H H 41 7.480 7.480 7.533 -0.053 17919 45852 1 112 . 1 1 42 42 ARG N N 42 122.680 122.680 125.389 -2.709 17919 45853 1 112 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.534 -0.034 17919 45854 1 112 . 1 1 42 42 ARG C C 42 174.050 174.050 174.268 -0.218 17919 45855 1 112 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.100 -0.050 17919 45856 1 112 . 1 1 42 42 ARG CB C 42 31.750 31.750 31.721 0.029 17919 45857 1 112 . 1 1 42 42 ARG H H 42 8.530 8.530 8.185 0.345 17919 45858 1 112 . 1 1 43 43 LEU N N 43 124.040 124.040 127.875 -3.835 17919 45859 1 112 . 1 1 43 43 LEU C C 43 175.290 175.290 175.721 -0.431 17919 45860 1 112 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.202 -0.222 17919 45861 1 112 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.620 2.170 17919 45862 1 112 . 1 1 43 43 LEU H H 43 8.820 8.820 8.760 0.060 17919 45863 1 112 . 1 1 44 44 ILE N N 44 121.920 121.920 119.622 2.298 17919 45864 1 112 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.490 -0.498 17919 45865 1 112 . 1 1 44 44 ILE C C 44 176.060 176.060 174.157 1.903 17919 45866 1 112 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.299 -0.319 17919 45867 1 112 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.154 0.266 17919 45868 1 112 . 1 1 44 44 ILE H H 44 9.030 9.030 8.030 1.000 17919 45869 1 112 . 1 1 45 45 PHE N N 45 125.390 125.390 128.057 -2.667 17919 45870 1 112 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.993 0.052 17919 45871 1 112 . 1 1 45 45 PHE C C 45 174.470 174.470 174.796 -0.326 17919 45872 1 112 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.935 0.085 17919 45873 1 112 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.863 0.897 17919 45874 1 112 . 1 1 45 45 PHE H H 45 8.830 8.830 8.646 0.184 17919 45875 1 112 . 1 1 46 46 ALA N N 46 132.200 132.200 130.578 1.622 17919 45876 1 112 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.700 -0.010 17919 45877 1 112 . 1 1 46 46 ALA C C 46 177.290 177.290 177.460 -0.170 17919 45878 1 112 . 1 1 46 46 ALA CA C 46 52.540 52.540 53.166 -0.626 17919 45879 1 112 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.777 -0.207 17919 45880 1 112 . 1 1 46 46 ALA H H 46 8.810 8.810 8.914 -0.104 17919 45881 1 112 . 1 1 47 47 GLY N N 47 102.340 102.340 102.426 -0.086 17919 45882 1 112 . 1 1 47 47 GLY C C 47 173.810 173.810 174.652 -0.842 17919 45883 1 112 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.074 0.276 17919 45884 1 112 . 1 1 47 47 GLY H H 47 8.130 8.130 8.431 -0.301 17919 45885 1 112 . 1 1 48 48 LYS N N 48 121.570 121.570 120.441 1.129 17919 45886 1 112 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.586 0.036 17919 45887 1 112 . 1 1 48 48 LYS C C 48 174.700 174.700 175.594 -0.894 17919 45888 1 112 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.670 -0.120 17919 45889 1 112 . 1 1 48 48 LYS CB C 48 34.530 34.530 35.450 -0.920 17919 45890 1 112 . 1 1 48 48 LYS H H 48 7.980 7.980 7.917 0.063 17919 45891 1 112 . 1 1 49 49 GLN N N 49 122.410 122.410 120.807 1.603 17919 45892 1 112 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.385 0.175 17919 45893 1 112 . 1 1 49 49 GLN C C 49 175.670 175.670 175.998 -0.328 17919 45894 1 112 . 1 1 49 49 GLN CA C 49 55.740 55.740 57.362 -1.622 17919 45895 1 112 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.406 -0.406 17919 45896 1 112 . 1 1 49 49 GLN H H 49 8.600 8.600 8.592 0.008 17919 45897 1 112 . 1 1 50 50 LEU N N 50 125.520 125.520 124.419 1.101 17919 45898 1 112 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.024 0.066 17919 45899 1 112 . 1 1 50 50 LEU C C 50 176.660 176.660 175.601 1.059 17919 45900 1 112 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.319 0.921 17919 45901 1 112 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.199 0.371 17919 45902 1 112 . 1 1 50 50 LEU H H 50 8.530 8.530 8.364 0.166 17919 45903 1 112 . 1 1 51 51 GLU N N 51 122.940 122.940 124.113 -1.173 17919 45904 1 112 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.174 0.314 17919 45905 1 112 . 1 1 51 51 GLU C C 51 175.870 175.870 176.778 -0.908 17919 45906 1 112 . 1 1 51 51 GLU CA C 51 55.960 55.960 56.954 -0.994 17919 45907 1 112 . 1 1 51 51 GLU CB C 51 31.570 31.570 29.969 1.601 17919 45908 1 112 . 1 1 51 51 GLU H H 51 8.400 8.400 8.623 -0.223 17919 45909 1 112 . 1 1 52 52 ASP N N 52 120.030 120.030 124.640 -4.610 17919 45910 1 112 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.494 -0.135 17919 45911 1 112 . 1 1 52 52 ASP C C 52 177.330 177.330 178.572 -1.242 17919 45912 1 112 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.883 -0.923 17919 45913 1 112 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.795 0.055 17919 45914 1 112 . 1 1 52 52 ASP H H 52 8.160 8.160 8.793 -0.633 17919 45915 1 112 . 1 1 53 53 GLY N N 53 106.660 106.660 105.488 1.172 17919 45916 1 112 . 1 1 53 53 GLY C C 53 174.870 174.870 174.865 0.005 17919 45917 1 112 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.505 -0.335 17919 45918 1 112 . 1 1 53 53 GLY H H 53 9.390 9.390 8.380 1.010 17919 45919 1 112 . 1 1 54 54 ARG N N 54 119.050 119.050 120.462 -1.412 17919 45920 1 112 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.528 0.167 17919 45921 1 112 . 1 1 54 54 ARG C C 54 175.350 175.350 175.816 -0.466 17919 45922 1 112 . 1 1 54 54 ARG CA C 54 54.390 54.390 55.576 -1.186 17919 45923 1 112 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.113 0.537 17919 45924 1 112 . 1 1 54 54 ARG H H 54 7.460 7.460 7.580 -0.120 17919 45925 1 112 . 1 1 55 55 THR N N 55 108.400 108.400 111.932 -3.532 17919 45926 1 112 . 1 1 55 55 THR HA H 55 5.240 5.240 4.964 0.276 17919 45927 1 112 . 1 1 55 55 THR C C 55 176.560 176.560 176.396 0.164 17919 45928 1 112 . 1 1 55 55 THR CA C 55 59.690 59.690 60.529 -0.839 17919 45929 1 112 . 1 1 55 55 THR CB C 55 72.260 72.260 70.534 1.726 17919 45930 1 112 . 1 1 55 55 THR H H 55 8.730 8.730 8.872 -0.142 17919 45931 1 112 . 1 1 56 56 LEU N N 56 117.920 117.920 121.019 -3.099 17919 45932 1 112 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.907 0.153 17919 45933 1 112 . 1 1 56 56 LEU C C 56 180.810 180.810 179.086 1.724 17919 45934 1 112 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.637 0.073 17919 45935 1 112 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.386 -1.016 17919 45936 1 112 . 1 1 56 56 LEU H H 56 8.140 8.140 8.587 -0.447 17919 45937 1 112 . 1 1 57 57 SER N N 57 113.330 113.330 114.510 -1.180 17919 45938 1 112 . 1 1 57 57 SER HA H 57 4.370 4.370 4.109 0.261 17919 45939 1 112 . 1 1 57 57 SER C C 57 178.310 178.310 176.882 1.428 17919 45940 1 112 . 1 1 57 57 SER CA C 57 61.080 61.080 62.050 -0.970 17919 45941 1 112 . 1 1 57 57 SER CB C 57 62.530 62.530 62.623 -0.093 17919 45942 1 112 . 1 1 57 57 SER H H 57 8.470 8.470 7.988 0.482 17919 45943 1 112 . 1 1 58 58 ASP N N 58 124.190 124.190 120.906 3.284 17919 45944 1 112 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.288 0.008 17919 45945 1 112 . 1 1 58 58 ASP C C 58 177.400 177.400 177.280 0.120 17919 45946 1 112 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.782 0.398 17919 45947 1 112 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.462 -0.362 17919 45948 1 112 . 1 1 58 58 ASP H H 58 7.930 7.930 7.870 0.060 17919 45949 1 112 . 1 1 59 59 TYR N N 59 115.510 115.510 116.063 -0.553 17919 45950 1 112 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.520 0.150 17919 45951 1 112 . 1 1 59 59 TYR C C 59 174.700 174.700 175.428 -0.728 17919 45952 1 112 . 1 1 59 59 TYR CA C 59 58.250 58.250 58.041 0.209 17919 45953 1 112 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.513 1.558 17919 45954 1 112 . 1 1 59 59 TYR H H 59 7.250 7.250 7.221 0.029 17919 45955 1 112 . 1 1 60 60 ASN N N 60 115.900 115.900 115.500 0.400 17919 45956 1 112 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.369 -0.014 17919 45957 1 112 . 1 1 60 60 ASN C C 60 174.340 174.340 174.349 -0.009 17919 45958 1 112 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.119 0.001 17919 45959 1 112 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.112 0.298 17919 45960 1 112 . 1 1 60 60 ASN H H 60 8.150 8.150 7.984 0.166 17919 45961 1 112 . 1 1 61 61 ILE N N 61 118.600 118.600 121.082 -2.482 17919 45962 1 112 . 1 1 61 61 ILE HA H 61 3.393 3.393 4.056 -0.663 17919 45963 1 112 . 1 1 61 61 ILE C C 61 174.610 174.610 174.943 -0.333 17919 45964 1 112 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.476 0.944 17919 45965 1 112 . 1 1 61 61 ILE CB C 61 36.740 36.740 36.191 0.548 17919 45966 1 112 . 1 1 61 61 ILE H H 61 7.250 7.250 7.692 -0.442 17919 45967 1 112 . 1 1 62 62 GLN N N 62 124.740 124.740 126.506 -1.766 17919 45968 1 112 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.392 0.114 17919 45969 1 112 . 1 1 62 62 GLN C C 62 175.970 175.970 175.881 0.089 17919 45970 1 112 . 1 1 62 62 GLN CA C 62 53.660 53.660 54.717 -1.056 17919 45971 1 112 . 1 1 62 62 GLN CB C 62 31.650 31.650 29.468 2.182 17919 45972 1 112 . 1 1 62 62 GLN H H 62 7.610 7.610 7.884 -0.274 17919 45973 1 112 . 1 1 63 63 LYS N N 63 120.300 120.300 118.300 2.000 17919 45974 1 112 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.789 0.212 17919 45975 1 112 . 1 1 63 63 LYS C C 63 175.810 175.810 176.943 -1.133 17919 45976 1 112 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.087 -0.297 17919 45977 1 112 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.652 0.998 17919 45978 1 112 . 1 1 63 63 LYS H H 63 8.490 8.490 8.500 -0.010 17919 45979 1 112 . 1 1 64 64 GLU N N 64 113.950 113.950 118.794 -4.844 17919 45980 1 112 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.471 -0.006 17919 45981 1 112 . 1 1 64 64 GLU C C 64 175.250 175.250 175.419 -0.169 17919 45982 1 112 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.565 0.325 17919 45983 1 112 . 1 1 64 64 GLU CB C 64 25.900 25.900 29.030 -3.131 17919 45984 1 112 . 1 1 64 64 GLU H H 64 9.280 9.280 8.950 0.330 17919 45985 1 112 . 1 1 65 65 SER N N 65 114.730 114.730 116.188 -1.458 17919 45986 1 112 . 1 1 65 65 SER HA H 65 4.640 4.640 4.506 0.134 17919 45987 1 112 . 1 1 65 65 SER C C 65 172.160 172.160 174.612 -2.452 17919 45988 1 112 . 1 1 65 65 SER CA C 65 60.890 60.890 59.488 1.402 17919 45989 1 112 . 1 1 65 65 SER CB C 65 64.910 64.910 63.453 1.458 17919 45990 1 112 . 1 1 65 65 SER H H 65 7.670 7.670 7.468 0.202 17919 45991 1 112 . 1 1 66 66 THR N N 66 117.110 117.110 122.582 -5.472 17919 45992 1 112 . 1 1 66 66 THR HA H 66 5.270 5.270 4.167 1.103 17919 45993 1 112 . 1 1 66 66 THR C C 66 173.950 173.950 174.138 -0.188 17919 45994 1 112 . 1 1 66 66 THR CA C 66 62.340 62.340 64.081 -1.741 17919 45995 1 112 . 1 1 66 66 THR CB C 66 70.080 70.080 69.107 0.973 17919 45996 1 112 . 1 1 66 66 THR H H 66 8.730 8.730 8.303 0.427 17919 45997 1 112 . 1 1 67 67 LEU N N 67 127.110 127.110 128.179 -1.069 17919 45998 1 112 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.287 0.773 17919 45999 1 112 . 1 1 67 67 LEU C C 67 175.770 175.770 176.061 -0.291 17919 46000 1 112 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.748 0.152 17919 46001 1 112 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.589 0.671 17919 46002 1 112 . 1 1 67 67 LEU H H 67 9.410 9.410 8.469 0.941 17919 46003 1 112 . 1 1 68 68 HIS N N 68 118.380 118.380 117.547 0.833 17919 46004 1 112 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.534 -0.294 17919 46005 1 112 . 1 1 68 68 HIS C C 68 173.150 173.150 174.667 -1.517 17919 46006 1 112 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.748 0.252 17919 46007 1 112 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.368 -1.838 17919 46008 1 112 . 1 1 68 68 HIS H H 68 9.230 9.230 8.483 0.747 17919 46009 1 112 . 1 1 69 69 LEU N N 69 124.460 124.460 120.252 4.208 17919 46010 1 112 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.371 -0.181 17919 46011 1 112 . 1 1 69 69 LEU C C 69 175.270 175.270 174.720 0.550 17919 46012 1 112 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.294 -0.404 17919 46013 1 112 . 1 1 69 69 LEU CB C 69 44.380 44.380 46.085 -1.705 17919 46014 1 112 . 1 1 69 69 LEU H H 69 8.340 8.340 8.007 0.333 17919 46015 1 112 . 1 1 70 70 VAL N N 70 126.940 126.940 124.785 2.155 17919 46016 1 112 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.428 -0.078 17919 46017 1 112 . 1 1 70 70 VAL C C 70 174.000 174.000 174.892 -0.892 17919 46018 1 112 . 1 1 70 70 VAL CA C 70 60.800 60.800 61.029 -0.229 17919 46019 1 112 . 1 1 70 70 VAL CB C 70 34.910 34.910 33.871 1.039 17919 46020 1 112 . 1 1 70 70 VAL H H 70 9.200 9.200 8.098 1.102 17919 46021 1 112 . 1 1 71 71 LEU N N 71 123.130 123.130 126.120 -2.990 17919 46022 1 112 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.537 0.522 17919 46023 1 112 . 1 1 71 71 LEU C C 71 177.830 177.830 176.846 0.984 17919 46024 1 112 . 1 1 71 71 LEU CA C 71 53.940 53.940 54.670 -0.730 17919 46025 1 112 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.035 -0.185 17919 46026 1 112 . 1 1 71 71 LEU H H 71 8.120 8.120 8.457 -0.337 17919 46027 1 112 . 1 1 72 72 ARG N N 72 123.490 123.490 120.640 2.850 17919 46028 1 112 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.578 -0.277 17919 46029 1 112 . 1 1 72 72 ARG C C 72 175.350 175.350 175.284 0.066 17919 46030 1 112 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.318 0.292 17919 46031 1 112 . 1 1 72 72 ARG CB C 72 31.350 31.350 31.962 -0.612 17919 46032 1 112 . 1 1 72 72 ARG H H 72 8.580 8.580 8.453 0.127 17919 46033 1 113 . 1 1 2 2 GLN N N 2 123.220 123.220 117.698 5.522 17919 46034 1 113 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.451 -0.202 17919 46035 1 113 . 1 1 2 2 GLN C C 2 175.920 175.920 174.571 1.349 17919 46036 1 113 . 1 1 2 2 GLN CA C 2 55.080 55.080 53.803 1.277 17919 46037 1 113 . 1 1 2 2 GLN CB C 2 30.760 30.760 32.179 -1.419 17919 46038 1 113 . 1 1 2 2 GLN H H 2 8.900 8.900 8.314 0.586 17919 46039 1 113 . 1 1 3 3 ILE N N 3 115.340 115.340 115.225 0.115 17919 46040 1 113 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.214 -0.001 17919 46041 1 113 . 1 1 3 3 ILE C C 3 172.450 172.450 173.486 -1.036 17919 46042 1 113 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.526 0.044 17919 46043 1 113 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.268 0.942 17919 46044 1 113 . 1 1 3 3 ILE H H 3 8.320 8.320 8.580 -0.260 17919 46045 1 113 . 1 1 4 4 PHE N N 4 118.110 118.110 119.559 -1.449 17919 46046 1 113 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.226 0.404 17919 46047 1 113 . 1 1 4 4 PHE C C 4 175.320 175.320 175.304 0.016 17919 46048 1 113 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.284 -0.074 17919 46049 1 113 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.126 0.354 17919 46050 1 113 . 1 1 4 4 PHE H H 4 8.610 8.610 7.829 0.781 17919 46051 1 113 . 1 1 5 5 VAL N N 5 121.000 121.000 124.406 -3.406 17919 46052 1 113 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.555 0.170 17919 46053 1 113 . 1 1 5 5 VAL C C 5 174.870 174.870 174.829 0.041 17919 46054 1 113 . 1 1 5 5 VAL CA C 5 60.620 60.620 62.170 -1.550 17919 46055 1 113 . 1 1 5 5 VAL CB C 5 34.230 34.230 32.980 1.250 17919 46056 1 113 . 1 1 5 5 VAL H H 5 9.300 9.300 9.164 0.136 17919 46057 1 113 . 1 1 6 6 LYS N N 6 127.520 127.520 128.508 -0.988 17919 46058 1 113 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.450 -0.083 17919 46059 1 113 . 1 1 6 6 LYS C C 6 177.140 177.140 176.576 0.564 17919 46060 1 113 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.009 0.511 17919 46061 1 113 . 1 1 6 6 LYS CB C 6 35.050 35.050 36.171 -1.121 17919 46062 1 113 . 1 1 6 6 LYS H H 6 8.820 8.820 9.158 -0.338 17919 46063 1 113 . 1 1 7 7 THR N N 7 115.400 115.400 116.421 -1.021 17919 46064 1 113 . 1 1 7 7 THR HA H 7 4.970 4.970 4.545 0.425 17919 46065 1 113 . 1 1 7 7 THR C C 7 176.910 176.910 176.625 0.285 17919 46066 1 113 . 1 1 7 7 THR CA C 7 60.470 60.470 61.373 -0.903 17919 46067 1 113 . 1 1 7 7 THR CB C 7 70.630 70.630 70.303 0.327 17919 46068 1 113 . 1 1 7 7 THR H H 7 8.730 8.730 8.399 0.331 17919 46069 1 113 . 1 1 8 8 LEU N N 8 121.330 121.330 121.213 0.117 17919 46070 1 113 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.232 0.078 17919 46071 1 113 . 1 1 8 8 LEU C C 8 178.800 178.800 177.106 1.694 17919 46072 1 113 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.752 -0.172 17919 46073 1 113 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.156 -0.186 17919 46074 1 113 . 1 1 8 8 LEU H H 8 9.100 9.100 8.453 0.647 17919 46075 1 113 . 1 1 9 9 THR N N 9 105.590 105.590 107.532 -1.942 17919 46076 1 113 . 1 1 9 9 THR HA H 9 4.428 4.428 4.239 0.189 17919 46077 1 113 . 1 1 9 9 THR C C 9 175.520 175.520 175.517 0.003 17919 46078 1 113 . 1 1 9 9 THR CA C 9 61.400 61.400 62.570 -1.170 17919 46079 1 113 . 1 1 9 9 THR CB C 9 69.140 69.140 68.855 0.285 17919 46080 1 113 . 1 1 9 9 THR H H 9 7.630 7.630 7.777 -0.147 17919 46081 1 113 . 1 1 10 10 GLY N N 10 108.890 108.890 110.624 -1.734 17919 46082 1 113 . 1 1 10 10 GLY C C 10 174.070 174.070 173.974 0.096 17919 46083 1 113 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.709 0.751 17919 46084 1 113 . 1 1 10 10 GLY H H 10 7.810 7.810 7.577 0.233 17919 46085 1 113 . 1 1 11 11 LYS N N 11 121.600 121.600 122.047 -0.447 17919 46086 1 113 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.249 0.112 17919 46087 1 113 . 1 1 11 11 LYS C C 11 175.940 175.940 175.641 0.299 17919 46088 1 113 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.959 -0.679 17919 46089 1 113 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.496 -0.296 17919 46090 1 113 . 1 1 11 11 LYS H H 11 7.280 7.280 7.933 -0.653 17919 46091 1 113 . 1 1 12 12 THR N N 12 120.440 120.440 118.654 1.786 17919 46092 1 113 . 1 1 12 12 THR HA H 12 5.046 5.046 5.192 -0.146 17919 46093 1 113 . 1 1 12 12 THR C C 12 174.320 174.320 174.540 -0.220 17919 46094 1 113 . 1 1 12 12 THR CA C 12 62.390 62.390 61.989 0.401 17919 46095 1 113 . 1 1 12 12 THR CB C 12 69.910 69.910 69.905 0.005 17919 46096 1 113 . 1 1 12 12 THR H H 12 8.650 8.650 8.229 0.421 17919 46097 1 113 . 1 1 13 13 ILE N N 13 127.110 127.110 126.740 0.370 17919 46098 1 113 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.503 0.041 17919 46099 1 113 . 1 1 13 13 ILE C C 13 175.220 175.220 174.480 0.740 17919 46100 1 113 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.483 -0.504 17919 46101 1 113 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.969 -1.019 17919 46102 1 113 . 1 1 13 13 ILE H H 13 9.450 9.450 8.858 0.592 17919 46103 1 113 . 1 1 14 14 THR N N 14 121.520 121.520 124.003 -2.483 17919 46104 1 113 . 1 1 14 14 THR HA H 14 4.964 4.964 4.909 0.055 17919 46105 1 113 . 1 1 14 14 THR C C 14 173.790 173.790 173.925 -0.135 17919 46106 1 113 . 1 1 14 14 THR CA C 14 61.940 61.940 62.689 -0.749 17919 46107 1 113 . 1 1 14 14 THR CB C 14 69.650 69.650 69.513 0.137 17919 46108 1 113 . 1 1 14 14 THR H H 14 8.710 8.710 8.487 0.223 17919 46109 1 113 . 1 1 15 15 LEU N N 15 124.800 124.800 128.548 -3.748 17919 46110 1 113 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.668 0.112 17919 46111 1 113 . 1 1 15 15 LEU C C 15 174.670 174.670 175.238 -0.568 17919 46112 1 113 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.670 -0.840 17919 46113 1 113 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.706 1.363 17919 46114 1 113 . 1 1 15 15 LEU H H 15 8.710 8.710 8.767 -0.057 17919 46115 1 113 . 1 1 16 16 GLU N N 16 122.160 122.160 125.189 -3.029 17919 46116 1 113 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.079 -0.162 17919 46117 1 113 . 1 1 16 16 GLU C C 16 175.860 175.860 175.405 0.455 17919 46118 1 113 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.527 -0.707 17919 46119 1 113 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.679 -1.229 17919 46120 1 113 . 1 1 16 16 GLU H H 16 8.140 8.140 8.751 -0.611 17919 46121 1 113 . 1 1 17 17 VAL N N 17 117.210 117.210 119.282 -2.072 17919 46122 1 113 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.688 0.026 17919 46123 1 113 . 1 1 17 17 VAL C C 17 174.160 174.160 174.561 -0.401 17919 46124 1 113 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.021 -0.591 17919 46125 1 113 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.449 0.951 17919 46126 1 113 . 1 1 17 17 VAL H H 17 8.900 8.900 8.983 -0.083 17919 46127 1 113 . 1 1 18 18 GLU N N 18 118.990 118.990 122.895 -3.905 17919 46128 1 113 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.937 0.142 17919 46129 1 113 . 1 1 18 18 GLU C C 18 176.160 176.160 175.936 0.224 17919 46130 1 113 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.570 0.150 17919 46131 1 113 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.623 -0.313 17919 46132 1 113 . 1 1 18 18 GLU H H 18 8.640 8.640 8.359 0.281 17919 46133 1 113 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.105 0.036 17919 46134 1 113 . 1 1 19 19 PRO C C 19 175.310 175.310 178.161 -2.851 17919 46135 1 113 . 1 1 19 19 PRO CA C 19 65.470 65.470 66.045 -0.575 17919 46136 1 113 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.974 -0.024 17919 46137 1 113 . 1 1 20 20 SER N N 20 103.400 103.400 109.591 -6.191 17919 46138 1 113 . 1 1 20 20 SER HA H 20 4.370 4.370 4.236 0.134 17919 46139 1 113 . 1 1 20 20 SER C C 20 174.660 174.660 174.379 0.281 17919 46140 1 113 . 1 1 20 20 SER CA C 20 57.400 57.400 58.926 -1.526 17919 46141 1 113 . 1 1 20 20 SER CB C 20 63.370 63.370 62.889 0.481 17919 46142 1 113 . 1 1 20 20 SER H H 20 7.040 7.040 7.968 -0.928 17919 46143 1 113 . 1 1 21 21 ASP N N 21 123.480 123.480 123.302 0.178 17919 46144 1 113 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.606 0.089 17919 46145 1 113 . 1 1 21 21 ASP C C 21 176.360 176.360 176.045 0.315 17919 46146 1 113 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.708 -0.008 17919 46147 1 113 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.441 -0.641 17919 46148 1 113 . 1 1 21 21 ASP H H 21 8.030 8.030 7.646 0.384 17919 46149 1 113 . 1 1 22 22 THR N N 22 108.800 108.800 113.837 -5.037 17919 46150 1 113 . 1 1 22 22 THR HA H 22 4.920 4.920 4.511 0.409 17919 46151 1 113 . 1 1 22 22 THR C C 22 176.750 176.750 175.902 0.848 17919 46152 1 113 . 1 1 22 22 THR CA C 22 59.690 59.690 62.178 -2.488 17919 46153 1 113 . 1 1 22 22 THR CB C 22 71.200 71.200 70.511 0.689 17919 46154 1 113 . 1 1 22 22 THR H H 22 7.900 7.900 8.205 -0.305 17919 46155 1 113 . 1 1 23 23 ILE N N 23 121.190 121.190 121.874 -0.684 17919 46156 1 113 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.819 -0.162 17919 46157 1 113 . 1 1 23 23 ILE C C 23 179.040 179.040 177.612 1.428 17919 46158 1 113 . 1 1 23 23 ILE CA C 23 62.260 62.260 60.841 1.419 17919 46159 1 113 . 1 1 23 23 ILE CB C 23 34.350 34.350 35.881 -1.531 17919 46160 1 113 . 1 1 23 23 ILE H H 23 8.560 8.560 9.023 -0.463 17919 46161 1 113 . 1 1 24 24 GLU N N 24 120.830 120.830 120.899 -0.069 17919 46162 1 113 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.871 0.046 17919 46163 1 113 . 1 1 24 24 GLU C C 24 178.640 178.640 178.512 0.128 17919 46164 1 113 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.071 0.149 17919 46165 1 113 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.435 -1.155 17919 46166 1 113 . 1 1 24 24 GLU H H 24 9.760 9.760 8.031 1.729 17919 46167 1 113 . 1 1 25 25 ASN N N 25 120.570 120.570 117.675 2.895 17919 46168 1 113 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.562 -0.037 17919 46169 1 113 . 1 1 25 25 ASN C C 25 178.380 178.380 178.018 0.362 17919 46170 1 113 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.687 0.373 17919 46171 1 113 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.045 0.405 17919 46172 1 113 . 1 1 25 25 ASN H H 25 7.920 7.920 8.131 -0.211 17919 46173 1 113 . 1 1 26 26 VAL N N 26 121.710 121.710 120.590 1.120 17919 46174 1 113 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.473 -0.076 17919 46175 1 113 . 1 1 26 26 VAL C C 26 177.950 177.950 177.722 0.228 17919 46176 1 113 . 1 1 26 26 VAL CA C 26 67.660 67.660 67.019 0.641 17919 46177 1 113 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.419 -0.580 17919 46178 1 113 . 1 1 26 26 VAL H H 26 8.070 8.070 8.135 -0.065 17919 46179 1 113 . 1 1 27 27 LYS N N 27 118.860 118.860 119.253 -0.393 17919 46180 1 113 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.234 0.346 17919 46181 1 113 . 1 1 27 27 LYS C C 27 180.550 180.550 179.101 1.449 17919 46182 1 113 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.424 -0.174 17919 46183 1 113 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.172 1.558 17919 46184 1 113 . 1 1 27 27 LYS H H 27 8.560 8.560 7.798 0.762 17919 46185 1 113 . 1 1 28 28 ALA N N 28 123.440 123.440 121.044 2.396 17919 46186 1 113 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.072 0.088 17919 46187 1 113 . 1 1 28 28 ALA C C 28 180.300 180.300 178.980 1.320 17919 46188 1 113 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.163 0.207 17919 46189 1 113 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.320 -0.610 17919 46190 1 113 . 1 1 28 28 ALA H H 28 8.060 8.060 8.244 -0.184 17919 46191 1 113 . 1 1 29 29 LYS N N 29 119.940 119.940 119.433 0.507 17919 46192 1 113 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.115 0.092 17919 46193 1 113 . 1 1 29 29 LYS C C 29 180.320 180.320 179.168 1.152 17919 46194 1 113 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.063 0.587 17919 46195 1 113 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.426 0.864 17919 46196 1 113 . 1 1 29 29 LYS H H 29 7.850 7.850 7.574 0.276 17919 46197 1 113 . 1 1 30 30 ILE N N 30 121.080 121.080 120.639 0.441 17919 46198 1 113 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.629 -0.122 17919 46199 1 113 . 1 1 30 30 ILE C C 30 178.310 178.310 177.251 1.059 17919 46200 1 113 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.364 0.786 17919 46201 1 113 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.618 -0.818 17919 46202 1 113 . 1 1 30 30 ILE H H 30 8.280 8.280 8.449 -0.169 17919 46203 1 113 . 1 1 31 31 GLN N N 31 123.490 123.490 119.992 3.498 17919 46204 1 113 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.919 -0.090 17919 46205 1 113 . 1 1 31 31 GLN C C 31 178.890 178.890 178.362 0.528 17919 46206 1 113 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.530 0.470 17919 46207 1 113 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.332 -0.612 17919 46208 1 113 . 1 1 31 31 GLN H H 31 8.580 8.580 8.094 0.486 17919 46209 1 113 . 1 1 32 32 ASP N N 32 119.360 119.360 119.928 -0.568 17919 46210 1 113 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.362 -0.008 17919 46211 1 113 . 1 1 32 32 ASP C C 32 177.250 177.250 177.754 -0.504 17919 46212 1 113 . 1 1 32 32 ASP CA C 32 57.190 57.190 57.058 0.132 17919 46213 1 113 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.771 -0.191 17919 46214 1 113 . 1 1 32 32 ASP H H 32 8.010 8.010 8.282 -0.272 17919 46215 1 113 . 1 1 33 33 LYS N N 33 115.130 115.130 116.452 -1.322 17919 46216 1 113 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.466 -0.129 17919 46217 1 113 . 1 1 33 33 LYS C C 33 177.870 177.870 178.073 -0.203 17919 46218 1 113 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.132 0.918 17919 46219 1 113 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.384 0.786 17919 46220 1 113 . 1 1 33 33 LYS H H 33 7.430 7.430 7.513 -0.083 17919 46221 1 113 . 1 1 34 34 GLU N N 34 113.870 113.870 115.915 -2.045 17919 46222 1 113 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.492 0.133 17919 46223 1 113 . 1 1 34 34 GLU C C 34 177.840 177.840 177.523 0.317 17919 46224 1 113 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.430 -0.260 17919 46225 1 113 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.406 1.254 17919 46226 1 113 . 1 1 34 34 GLU H H 34 8.740 8.740 8.284 0.456 17919 46227 1 113 . 1 1 35 35 GLY N N 35 108.650 108.650 109.343 -0.693 17919 46228 1 113 . 1 1 35 35 GLY C C 35 173.960 173.960 174.529 -0.569 17919 46229 1 113 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.839 0.242 17919 46230 1 113 . 1 1 35 35 GLY H H 35 8.530 8.530 8.182 0.348 17919 46231 1 113 . 1 1 36 36 ILE N N 36 119.880 119.880 122.415 -2.535 17919 46232 1 113 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.274 0.171 17919 46233 1 113 . 1 1 36 36 ILE C C 36 173.590 173.590 174.234 -0.644 17919 46234 1 113 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.866 -0.116 17919 46235 1 113 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.662 1.918 17919 46236 1 113 . 1 1 36 36 ILE H H 36 6.150 6.150 7.595 -1.445 17919 46237 1 113 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.806 -0.172 17919 46238 1 113 . 1 1 37 37 PRO C C 37 176.940 176.940 176.104 0.836 17919 46239 1 113 . 1 1 37 37 PRO CA C 37 61.660 61.660 60.860 0.800 17919 46240 1 113 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.177 0.673 17919 46241 1 113 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.087 0.030 17919 46242 1 113 . 1 1 38 38 PRO C C 38 178.320 178.320 178.331 -0.011 17919 46243 1 113 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.980 0.281 17919 46244 1 113 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.840 1.050 17919 46245 1 113 . 1 1 39 39 ASP N N 39 113.380 113.380 114.703 -1.323 17919 46246 1 113 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.321 0.109 17919 46247 1 113 . 1 1 39 39 ASP C C 39 177.090 177.090 177.703 -0.613 17919 46248 1 113 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.739 -1.099 17919 46249 1 113 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.323 -0.783 17919 46250 1 113 . 1 1 39 39 ASP H H 39 8.550 8.550 8.673 -0.123 17919 46251 1 113 . 1 1 40 40 GLN N N 40 116.780 116.780 116.450 0.330 17919 46252 1 113 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.391 0.073 17919 46253 1 113 . 1 1 40 40 GLN C C 40 175.380 175.380 176.710 -1.330 17919 46254 1 113 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.215 -0.575 17919 46255 1 113 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.679 0.461 17919 46256 1 113 . 1 1 40 40 GLN H H 40 7.820 7.820 8.111 -0.291 17919 46257 1 113 . 1 1 41 41 GLN N N 41 117.720 117.720 120.000 -2.280 17919 46258 1 113 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.136 0.108 17919 46259 1 113 . 1 1 41 41 GLN C C 41 176.300 176.300 175.747 0.553 17919 46260 1 113 . 1 1 41 41 GLN CA C 41 56.470 56.470 57.120 -0.650 17919 46261 1 113 . 1 1 41 41 GLN CB C 41 31.650 31.650 28.933 2.716 17919 46262 1 113 . 1 1 41 41 GLN H H 41 7.480 7.480 7.388 0.092 17919 46263 1 113 . 1 1 42 42 ARG N N 42 122.680 122.680 123.229 -0.549 17919 46264 1 113 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.510 -0.010 17919 46265 1 113 . 1 1 42 42 ARG C C 42 174.050 174.050 174.615 -0.565 17919 46266 1 113 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.202 -0.152 17919 46267 1 113 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.702 -0.952 17919 46268 1 113 . 1 1 42 42 ARG H H 42 8.530 8.530 8.393 0.137 17919 46269 1 113 . 1 1 43 43 LEU N N 43 124.040 124.040 125.123 -1.083 17919 46270 1 113 . 1 1 43 43 LEU C C 43 175.290 175.290 175.421 -0.131 17919 46271 1 113 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.746 -0.766 17919 46272 1 113 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.580 1.210 17919 46273 1 113 . 1 1 43 43 LEU H H 43 8.820 8.820 8.687 0.133 17919 46274 1 113 . 1 1 44 44 ILE N N 44 121.920 121.920 122.524 -0.604 17919 46275 1 113 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.871 0.121 17919 46276 1 113 . 1 1 44 44 ILE C C 44 176.060 176.060 174.411 1.649 17919 46277 1 113 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.096 -1.116 17919 46278 1 113 . 1 1 44 44 ILE CB C 44 41.420 41.420 42.495 -1.075 17919 46279 1 113 . 1 1 44 44 ILE H H 44 9.030 9.030 8.242 0.788 17919 46280 1 113 . 1 1 45 45 PHE N N 45 125.390 125.390 125.393 -0.003 17919 46281 1 113 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.972 0.073 17919 46282 1 113 . 1 1 45 45 PHE C C 45 174.470 174.470 174.431 0.039 17919 46283 1 113 . 1 1 45 45 PHE CA C 45 57.020 57.020 57.115 -0.095 17919 46284 1 113 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.797 0.963 17919 46285 1 113 . 1 1 45 45 PHE H H 45 8.830 8.830 8.228 0.602 17919 46286 1 113 . 1 1 46 46 ALA N N 46 132.200 132.200 127.642 4.558 17919 46287 1 113 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.601 0.089 17919 46288 1 113 . 1 1 46 46 ALA C C 46 177.290 177.290 177.691 -0.401 17919 46289 1 113 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.607 -0.067 17919 46290 1 113 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.618 -0.048 17919 46291 1 113 . 1 1 46 46 ALA H H 46 8.810 8.810 8.569 0.241 17919 46292 1 113 . 1 1 47 47 GLY N N 47 102.340 102.340 104.065 -1.725 17919 46293 1 113 . 1 1 47 47 GLY C C 47 173.810 173.810 174.234 -0.424 17919 46294 1 113 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.053 0.297 17919 46295 1 113 . 1 1 47 47 GLY H H 47 8.130 8.130 8.567 -0.437 17919 46296 1 113 . 1 1 48 48 LYS N N 48 121.570 121.570 122.027 -0.457 17919 46297 1 113 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.639 -0.017 17919 46298 1 113 . 1 1 48 48 LYS C C 48 174.700 174.700 175.752 -1.052 17919 46299 1 113 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.123 -0.573 17919 46300 1 113 . 1 1 48 48 LYS CB C 48 34.530 34.530 33.877 0.653 17919 46301 1 113 . 1 1 48 48 LYS H H 48 7.980 7.980 7.818 0.162 17919 46302 1 113 . 1 1 49 49 GLN N N 49 122.410 122.410 125.696 -3.286 17919 46303 1 113 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.254 0.306 17919 46304 1 113 . 1 1 49 49 GLN C C 49 175.670 175.670 175.416 0.254 17919 46305 1 113 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.169 -0.428 17919 46306 1 113 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.587 -0.587 17919 46307 1 113 . 1 1 49 49 GLN H H 49 8.600 8.600 8.589 0.011 17919 46308 1 113 . 1 1 50 50 LEU N N 50 125.520 125.520 125.573 -0.053 17919 46309 1 113 . 1 1 50 50 LEU HA H 50 4.090 4.090 3.961 0.129 17919 46310 1 113 . 1 1 50 50 LEU C C 50 176.660 176.660 175.957 0.703 17919 46311 1 113 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.073 0.167 17919 46312 1 113 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.427 -0.857 17919 46313 1 113 . 1 1 50 50 LEU H H 50 8.530 8.530 8.250 0.280 17919 46314 1 113 . 1 1 51 51 GLU N N 51 122.940 122.940 123.545 -0.605 17919 46315 1 113 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.362 0.126 17919 46316 1 113 . 1 1 51 51 GLU C C 51 175.870 175.870 176.486 -0.616 17919 46317 1 113 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.119 0.841 17919 46318 1 113 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.567 0.003 17919 46319 1 113 . 1 1 51 51 GLU H H 51 8.400 8.400 7.941 0.459 17919 46320 1 113 . 1 1 52 52 ASP N N 52 120.030 120.030 126.869 -6.839 17919 46321 1 113 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.407 -0.048 17919 46322 1 113 . 1 1 52 52 ASP C C 52 177.330 177.330 177.685 -0.355 17919 46323 1 113 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.634 -0.674 17919 46324 1 113 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.710 0.140 17919 46325 1 113 . 1 1 52 52 ASP H H 52 8.160 8.160 8.784 -0.624 17919 46326 1 113 . 1 1 53 53 GLY N N 53 106.660 106.660 104.965 1.695 17919 46327 1 113 . 1 1 53 53 GLY C C 53 174.870 174.870 174.259 0.611 17919 46328 1 113 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.807 0.363 17919 46329 1 113 . 1 1 53 53 GLY H H 53 9.390 9.390 8.338 1.052 17919 46330 1 113 . 1 1 54 54 ARG N N 54 119.050 119.050 120.693 -1.643 17919 46331 1 113 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.831 -0.136 17919 46332 1 113 . 1 1 54 54 ARG C C 54 175.350 175.350 174.930 0.420 17919 46333 1 113 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.163 0.227 17919 46334 1 113 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.821 -1.171 17919 46335 1 113 . 1 1 54 54 ARG H H 54 7.460 7.460 7.647 -0.187 17919 46336 1 113 . 1 1 55 55 THR N N 55 108.400 108.400 111.729 -3.329 17919 46337 1 113 . 1 1 55 55 THR HA H 55 5.240 5.240 4.797 0.443 17919 46338 1 113 . 1 1 55 55 THR C C 55 176.560 176.560 176.474 0.086 17919 46339 1 113 . 1 1 55 55 THR CA C 55 59.690 59.690 60.567 -0.877 17919 46340 1 113 . 1 1 55 55 THR CB C 55 72.260 72.260 71.159 1.101 17919 46341 1 113 . 1 1 55 55 THR H H 55 8.730 8.730 8.601 0.129 17919 46342 1 113 . 1 1 56 56 LEU N N 56 117.920 117.920 121.368 -3.448 17919 46343 1 113 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.857 0.203 17919 46344 1 113 . 1 1 56 56 LEU C C 56 180.810 180.810 178.924 1.886 17919 46345 1 113 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.526 0.184 17919 46346 1 113 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.314 -0.944 17919 46347 1 113 . 1 1 56 56 LEU H H 56 8.140 8.140 8.480 -0.340 17919 46348 1 113 . 1 1 57 57 SER N N 57 113.330 113.330 114.003 -0.673 17919 46349 1 113 . 1 1 57 57 SER HA H 57 4.370 4.370 4.266 0.104 17919 46350 1 113 . 1 1 57 57 SER C C 57 178.310 178.310 176.985 1.325 17919 46351 1 113 . 1 1 57 57 SER CA C 57 61.080 61.080 61.440 -0.360 17919 46352 1 113 . 1 1 57 57 SER CB C 57 62.530 62.530 62.768 -0.238 17919 46353 1 113 . 1 1 57 57 SER H H 57 8.470 8.470 7.990 0.480 17919 46354 1 113 . 1 1 58 58 ASP N N 58 124.190 124.190 124.913 -0.723 17919 46355 1 113 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.437 -0.141 17919 46356 1 113 . 1 1 58 58 ASP C C 58 177.400 177.400 177.852 -0.452 17919 46357 1 113 . 1 1 58 58 ASP CA C 58 57.180 57.180 57.587 -0.406 17919 46358 1 113 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.933 -0.833 17919 46359 1 113 . 1 1 58 58 ASP H H 58 7.930 7.930 7.763 0.167 17919 46360 1 113 . 1 1 59 59 TYR N N 59 115.510 115.510 116.072 -0.562 17919 46361 1 113 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.520 0.150 17919 46362 1 113 . 1 1 59 59 TYR C C 59 174.700 174.700 175.359 -0.659 17919 46363 1 113 . 1 1 59 59 TYR CA C 59 58.250 58.250 58.499 -0.249 17919 46364 1 113 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.432 1.638 17919 46365 1 113 . 1 1 59 59 TYR H H 59 7.250 7.250 7.861 -0.611 17919 46366 1 113 . 1 1 60 60 ASN N N 60 115.900 115.900 118.348 -2.448 17919 46367 1 113 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.360 -0.005 17919 46368 1 113 . 1 1 60 60 ASN C C 60 174.340 174.340 174.439 -0.099 17919 46369 1 113 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.176 -0.056 17919 46370 1 113 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.186 0.224 17919 46371 1 113 . 1 1 60 60 ASN H H 60 8.150 8.150 7.581 0.569 17919 46372 1 113 . 1 1 61 61 ILE N N 61 118.600 118.600 120.364 -1.764 17919 46373 1 113 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.835 -0.442 17919 46374 1 113 . 1 1 61 61 ILE C C 61 174.610 174.610 175.269 -0.659 17919 46375 1 113 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.106 1.314 17919 46376 1 113 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.765 -1.025 17919 46377 1 113 . 1 1 61 61 ILE H H 61 7.250 7.250 8.026 -0.776 17919 46378 1 113 . 1 1 62 62 GLN N N 62 124.740 124.740 125.025 -0.285 17919 46379 1 113 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.602 -0.096 17919 46380 1 113 . 1 1 62 62 GLN C C 62 175.970 175.970 175.893 0.077 17919 46381 1 113 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.760 -0.100 17919 46382 1 113 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.456 0.194 17919 46383 1 113 . 1 1 62 62 GLN H H 62 7.610 7.610 7.880 -0.270 17919 46384 1 113 . 1 1 63 63 LYS N N 63 120.300 120.300 119.870 0.430 17919 46385 1 113 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.127 -0.126 17919 46386 1 113 . 1 1 63 63 LYS C C 63 175.810 175.810 177.200 -1.390 17919 46387 1 113 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.486 0.304 17919 46388 1 113 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.090 0.560 17919 46389 1 113 . 1 1 63 63 LYS H H 63 8.490 8.490 8.528 -0.038 17919 46390 1 113 . 1 1 64 64 GLU N N 64 113.950 113.950 119.719 -5.769 17919 46391 1 113 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.435 0.030 17919 46392 1 113 . 1 1 64 64 GLU C C 64 175.250 175.250 175.802 -0.552 17919 46393 1 113 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.953 -0.063 17919 46394 1 113 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.552 -2.652 17919 46395 1 113 . 1 1 64 64 GLU H H 64 9.280 9.280 9.113 0.167 17919 46396 1 113 . 1 1 65 65 SER N N 65 114.730 114.730 115.667 -0.937 17919 46397 1 113 . 1 1 65 65 SER HA H 65 4.640 4.640 4.447 0.193 17919 46398 1 113 . 1 1 65 65 SER C C 65 172.160 172.160 174.479 -2.319 17919 46399 1 113 . 1 1 65 65 SER CA C 65 60.890 60.890 59.221 1.669 17919 46400 1 113 . 1 1 65 65 SER CB C 65 64.910 64.910 63.340 1.570 17919 46401 1 113 . 1 1 65 65 SER H H 65 7.670 7.670 7.714 -0.044 17919 46402 1 113 . 1 1 66 66 THR N N 66 117.110 117.110 122.255 -5.145 17919 46403 1 113 . 1 1 66 66 THR HA H 66 5.270 5.270 4.696 0.574 17919 46404 1 113 . 1 1 66 66 THR C C 66 173.950 173.950 174.595 -0.645 17919 46405 1 113 . 1 1 66 66 THR CA C 66 62.340 62.340 63.450 -1.110 17919 46406 1 113 . 1 1 66 66 THR CB C 66 70.080 70.080 69.152 0.928 17919 46407 1 113 . 1 1 66 66 THR H H 66 8.730 8.730 8.358 0.372 17919 46408 1 113 . 1 1 67 67 LEU N N 67 127.110 127.110 126.742 0.368 17919 46409 1 113 . 1 1 67 67 LEU HA H 67 5.060 5.060 5.124 -0.064 17919 46410 1 113 . 1 1 67 67 LEU C C 67 175.770 175.770 175.582 0.188 17919 46411 1 113 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.454 0.446 17919 46412 1 113 . 1 1 67 67 LEU CB C 67 44.260 44.260 45.299 -1.039 17919 46413 1 113 . 1 1 67 67 LEU H H 67 9.410 9.410 8.962 0.448 17919 46414 1 113 . 1 1 68 68 HIS N N 68 118.380 118.380 121.200 -2.820 17919 46415 1 113 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.554 -0.314 17919 46416 1 113 . 1 1 68 68 HIS C C 68 173.150 173.150 173.537 -0.387 17919 46417 1 113 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.446 0.554 17919 46418 1 113 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.903 -2.373 17919 46419 1 113 . 1 1 68 68 HIS H H 68 9.230 9.230 8.324 0.906 17919 46420 1 113 . 1 1 69 69 LEU N N 69 124.460 124.460 129.071 -4.611 17919 46421 1 113 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.344 -0.154 17919 46422 1 113 . 1 1 69 69 LEU C C 69 175.270 175.270 173.849 1.421 17919 46423 1 113 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.146 0.744 17919 46424 1 113 . 1 1 69 69 LEU CB C 69 44.380 44.380 45.242 -0.862 17919 46425 1 113 . 1 1 69 69 LEU H H 69 8.340 8.340 8.163 0.177 17919 46426 1 113 . 1 1 70 70 VAL N N 70 126.940 126.940 124.425 2.515 17919 46427 1 113 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.473 -0.123 17919 46428 1 113 . 1 1 70 70 VAL C C 70 174.000 174.000 173.155 0.845 17919 46429 1 113 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.895 0.905 17919 46430 1 113 . 1 1 70 70 VAL CB C 70 34.910 34.910 36.153 -1.243 17919 46431 1 113 . 1 1 70 70 VAL H H 70 9.200 9.200 8.177 1.024 17919 46432 1 113 . 1 1 71 71 LEU N N 71 123.130 123.130 124.798 -1.668 17919 46433 1 113 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.044 0.016 17919 46434 1 113 . 1 1 71 71 LEU C C 71 177.830 177.830 177.735 0.095 17919 46435 1 113 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.237 0.703 17919 46436 1 113 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.638 0.212 17919 46437 1 113 . 1 1 71 71 LEU H H 71 8.120 8.120 8.438 -0.318 17919 46438 1 113 . 1 1 72 72 ARG N N 72 123.490 123.490 122.159 1.331 17919 46439 1 113 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.324 -0.023 17919 46440 1 113 . 1 1 72 72 ARG C C 72 175.350 175.350 175.981 -0.631 17919 46441 1 113 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.303 -0.693 17919 46442 1 113 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.876 0.474 17919 46443 1 113 . 1 1 72 72 ARG H H 72 8.580 8.580 8.457 0.123 17919 46444 1 114 . 1 1 2 2 GLN N N 2 123.220 123.220 119.687 3.533 17919 46445 1 114 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.107 0.142 17919 46446 1 114 . 1 1 2 2 GLN C C 2 175.920 175.920 175.155 0.765 17919 46447 1 114 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.003 1.077 17919 46448 1 114 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.381 0.379 17919 46449 1 114 . 1 1 2 2 GLN H H 2 8.900 8.900 8.475 0.425 17919 46450 1 114 . 1 1 3 3 ILE N N 3 115.340 115.340 117.957 -2.617 17919 46451 1 114 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.087 0.126 17919 46452 1 114 . 1 1 3 3 ILE C C 3 172.450 172.450 173.517 -1.067 17919 46453 1 114 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.783 -0.213 17919 46454 1 114 . 1 1 3 3 ILE CB C 3 42.210 42.210 39.993 2.217 17919 46455 1 114 . 1 1 3 3 ILE H H 3 8.320 8.320 8.290 0.030 17919 46456 1 114 . 1 1 4 4 PHE N N 4 118.110 118.110 122.601 -4.491 17919 46457 1 114 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.171 0.459 17919 46458 1 114 . 1 1 4 4 PHE C C 4 175.320 175.320 176.017 -0.697 17919 46459 1 114 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.876 -0.666 17919 46460 1 114 . 1 1 4 4 PHE CB C 4 41.480 41.480 38.828 2.652 17919 46461 1 114 . 1 1 4 4 PHE H H 4 8.610 8.610 7.716 0.894 17919 46462 1 114 . 1 1 5 5 VAL N N 5 121.000 121.000 125.172 -4.172 17919 46463 1 114 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.558 0.167 17919 46464 1 114 . 1 1 5 5 VAL C C 5 174.870 174.870 175.037 -0.167 17919 46465 1 114 . 1 1 5 5 VAL CA C 5 60.620 60.620 62.234 -1.614 17919 46466 1 114 . 1 1 5 5 VAL CB C 5 34.230 34.230 32.758 1.472 17919 46467 1 114 . 1 1 5 5 VAL H H 5 9.300 9.300 8.899 0.401 17919 46468 1 114 . 1 1 6 6 LYS N N 6 127.520 127.520 128.982 -1.462 17919 46469 1 114 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.353 0.014 17919 46470 1 114 . 1 1 6 6 LYS C C 6 177.140 177.140 176.331 0.809 17919 46471 1 114 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.484 0.036 17919 46472 1 114 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.461 -0.411 17919 46473 1 114 . 1 1 6 6 LYS H H 6 8.820 8.820 8.965 -0.145 17919 46474 1 114 . 1 1 7 7 THR N N 7 115.400 115.400 117.100 -1.700 17919 46475 1 114 . 1 1 7 7 THR HA H 7 4.970 4.970 4.435 0.535 17919 46476 1 114 . 1 1 7 7 THR C C 7 176.910 176.910 176.184 0.726 17919 46477 1 114 . 1 1 7 7 THR CA C 7 60.470 60.470 60.488 -0.018 17919 46478 1 114 . 1 1 7 7 THR CB C 7 70.630 70.630 70.685 -0.055 17919 46479 1 114 . 1 1 7 7 THR H H 7 8.730 8.730 8.796 -0.067 17919 46480 1 114 . 1 1 8 8 LEU N N 8 121.330 121.330 122.309 -0.979 17919 46481 1 114 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.222 0.088 17919 46482 1 114 . 1 1 8 8 LEU C C 8 178.800 178.800 177.887 0.913 17919 46483 1 114 . 1 1 8 8 LEU CA C 8 57.580 57.580 58.062 -0.481 17919 46484 1 114 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.097 -0.127 17919 46485 1 114 . 1 1 8 8 LEU H H 8 9.100 9.100 8.300 0.800 17919 46486 1 114 . 1 1 9 9 THR N N 9 105.590 105.590 108.410 -2.820 17919 46487 1 114 . 1 1 9 9 THR HA H 9 4.428 4.428 4.280 0.148 17919 46488 1 114 . 1 1 9 9 THR C C 9 175.520 175.520 176.053 -0.533 17919 46489 1 114 . 1 1 9 9 THR CA C 9 61.400 61.400 62.478 -1.078 17919 46490 1 114 . 1 1 9 9 THR CB C 9 69.140 69.140 68.324 0.816 17919 46491 1 114 . 1 1 9 9 THR H H 9 7.630 7.630 8.143 -0.513 17919 46492 1 114 . 1 1 10 10 GLY N N 10 108.890 108.890 110.693 -1.803 17919 46493 1 114 . 1 1 10 10 GLY C C 10 174.070 174.070 174.179 -0.109 17919 46494 1 114 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.155 0.305 17919 46495 1 114 . 1 1 10 10 GLY H H 10 7.810 7.810 7.862 -0.052 17919 46496 1 114 . 1 1 11 11 LYS N N 11 121.600 121.600 121.775 -0.175 17919 46497 1 114 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.206 0.155 17919 46498 1 114 . 1 1 11 11 LYS C C 11 175.940 175.940 175.669 0.271 17919 46499 1 114 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.882 -0.602 17919 46500 1 114 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.012 0.188 17919 46501 1 114 . 1 1 11 11 LYS H H 11 7.280 7.280 7.604 -0.324 17919 46502 1 114 . 1 1 12 12 THR N N 12 120.440 120.440 121.817 -1.377 17919 46503 1 114 . 1 1 12 12 THR HA H 12 5.046 5.046 4.816 0.230 17919 46504 1 114 . 1 1 12 12 THR C C 12 174.320 174.320 174.541 -0.221 17919 46505 1 114 . 1 1 12 12 THR CA C 12 62.390 62.390 62.604 -0.214 17919 46506 1 114 . 1 1 12 12 THR CB C 12 69.910 69.910 68.969 0.941 17919 46507 1 114 . 1 1 12 12 THR H H 12 8.650 8.650 8.299 0.351 17919 46508 1 114 . 1 1 13 13 ILE N N 13 127.110 127.110 126.072 1.038 17919 46509 1 114 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.820 -0.276 17919 46510 1 114 . 1 1 13 13 ILE C C 13 175.220 175.220 173.514 1.706 17919 46511 1 114 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.150 0.830 17919 46512 1 114 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.518 -0.568 17919 46513 1 114 . 1 1 13 13 ILE H H 13 9.450 9.450 9.165 0.285 17919 46514 1 114 . 1 1 14 14 THR N N 14 121.520 121.520 121.852 -0.332 17919 46515 1 114 . 1 1 14 14 THR HA H 14 4.964 4.964 5.090 -0.126 17919 46516 1 114 . 1 1 14 14 THR C C 14 173.790 173.790 174.029 -0.239 17919 46517 1 114 . 1 1 14 14 THR CA C 14 61.940 61.940 62.072 -0.132 17919 46518 1 114 . 1 1 14 14 THR CB C 14 69.650 69.650 69.951 -0.301 17919 46519 1 114 . 1 1 14 14 THR H H 14 8.710 8.710 8.291 0.419 17919 46520 1 114 . 1 1 15 15 LEU N N 15 124.800 124.800 125.371 -0.571 17919 46521 1 114 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.821 -0.041 17919 46522 1 114 . 1 1 15 15 LEU C C 15 174.670 174.670 175.035 -0.365 17919 46523 1 114 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.423 -0.593 17919 46524 1 114 . 1 1 15 15 LEU CB C 15 47.070 47.070 44.136 2.934 17919 46525 1 114 . 1 1 15 15 LEU H H 15 8.710 8.710 8.536 0.174 17919 46526 1 114 . 1 1 16 16 GLU N N 16 122.160 122.160 123.905 -1.745 17919 46527 1 114 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.729 0.188 17919 46528 1 114 . 1 1 16 16 GLU C C 16 175.860 175.860 176.661 -0.801 17919 46529 1 114 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.081 -0.261 17919 46530 1 114 . 1 1 16 16 GLU CB C 16 29.450 29.450 28.522 0.928 17919 46531 1 114 . 1 1 16 16 GLU H H 16 8.140 8.140 8.633 -0.493 17919 46532 1 114 . 1 1 17 17 VAL N N 17 117.210 117.210 119.708 -2.498 17919 46533 1 114 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.364 0.350 17919 46534 1 114 . 1 1 17 17 VAL C C 17 174.160 174.160 174.340 -0.180 17919 46535 1 114 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.531 -1.101 17919 46536 1 114 . 1 1 17 17 VAL CB C 17 36.400 36.400 34.286 2.114 17919 46537 1 114 . 1 1 17 17 VAL H H 17 8.900 8.900 8.156 0.744 17919 46538 1 114 . 1 1 18 18 GLU N N 18 118.990 118.990 119.023 -0.033 17919 46539 1 114 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.798 0.281 17919 46540 1 114 . 1 1 18 18 GLU C C 18 176.160 176.160 175.156 1.004 17919 46541 1 114 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.143 -0.423 17919 46542 1 114 . 1 1 18 18 GLU CB C 18 30.310 30.310 31.703 -1.393 17919 46543 1 114 . 1 1 18 18 GLU H H 18 8.640 8.640 8.149 0.491 17919 46544 1 114 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.198 -0.057 17919 46545 1 114 . 1 1 19 19 PRO C C 19 175.310 175.310 178.014 -2.704 17919 46546 1 114 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.821 -0.351 17919 46547 1 114 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.954 -0.004 17919 46548 1 114 . 1 1 20 20 SER N N 20 103.400 103.400 108.837 -5.437 17919 46549 1 114 . 1 1 20 20 SER HA H 20 4.370 4.370 4.291 0.079 17919 46550 1 114 . 1 1 20 20 SER C C 20 174.660 174.660 174.258 0.402 17919 46551 1 114 . 1 1 20 20 SER CA C 20 57.400 57.400 58.298 -0.898 17919 46552 1 114 . 1 1 20 20 SER CB C 20 63.370 63.370 62.700 0.670 17919 46553 1 114 . 1 1 20 20 SER H H 20 7.040 7.040 8.300 -1.260 17919 46554 1 114 . 1 1 21 21 ASP N N 21 123.480 123.480 124.818 -1.338 17919 46555 1 114 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.607 0.088 17919 46556 1 114 . 1 1 21 21 ASP C C 21 176.360 176.360 175.667 0.693 17919 46557 1 114 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.715 -0.015 17919 46558 1 114 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.797 -0.997 17919 46559 1 114 . 1 1 21 21 ASP H H 21 8.030 8.030 8.217 -0.187 17919 46560 1 114 . 1 1 22 22 THR N N 22 108.800 108.800 113.071 -4.271 17919 46561 1 114 . 1 1 22 22 THR HA H 22 4.920 4.920 4.649 0.271 17919 46562 1 114 . 1 1 22 22 THR C C 22 176.750 176.750 176.167 0.583 17919 46563 1 114 . 1 1 22 22 THR CA C 22 59.690 59.690 60.562 -0.872 17919 46564 1 114 . 1 1 22 22 THR CB C 22 71.200 71.200 71.069 0.131 17919 46565 1 114 . 1 1 22 22 THR H H 22 7.900 7.900 8.106 -0.206 17919 46566 1 114 . 1 1 23 23 ILE N N 23 121.190 121.190 123.957 -2.767 17919 46567 1 114 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.647 0.010 17919 46568 1 114 . 1 1 23 23 ILE C C 23 179.040 179.040 177.757 1.283 17919 46569 1 114 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.978 -1.718 17919 46570 1 114 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.044 -1.694 17919 46571 1 114 . 1 1 23 23 ILE H H 23 8.560 8.560 8.427 0.133 17919 46572 1 114 . 1 1 24 24 GLU N N 24 120.830 120.830 117.047 3.783 17919 46573 1 114 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.961 -0.044 17919 46574 1 114 . 1 1 24 24 GLU C C 24 178.640 178.640 178.902 -0.262 17919 46575 1 114 . 1 1 24 24 GLU CA C 24 60.220 60.220 58.825 1.395 17919 46576 1 114 . 1 1 24 24 GLU CB C 24 28.280 28.280 28.893 -0.613 17919 46577 1 114 . 1 1 24 24 GLU H H 24 9.760 9.760 8.137 1.623 17919 46578 1 114 . 1 1 25 25 ASN N N 25 120.570 120.570 118.400 2.170 17919 46579 1 114 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.565 -0.040 17919 46580 1 114 . 1 1 25 25 ASN C C 25 178.380 178.380 177.601 0.779 17919 46581 1 114 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.115 0.945 17919 46582 1 114 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.559 -0.110 17919 46583 1 114 . 1 1 25 25 ASN H H 25 7.920 7.920 7.517 0.403 17919 46584 1 114 . 1 1 26 26 VAL N N 26 121.710 121.710 122.066 -0.356 17919 46585 1 114 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.706 -0.309 17919 46586 1 114 . 1 1 26 26 VAL C C 26 177.950 177.950 177.774 0.176 17919 46587 1 114 . 1 1 26 26 VAL CA C 26 67.660 67.660 65.175 2.485 17919 46588 1 114 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.451 -0.611 17919 46589 1 114 . 1 1 26 26 VAL H H 26 8.070 8.070 8.200 -0.130 17919 46590 1 114 . 1 1 27 27 LYS N N 27 118.860 118.860 119.089 -0.229 17919 46591 1 114 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.119 0.461 17919 46592 1 114 . 1 1 27 27 LYS C C 27 180.550 180.550 178.879 1.671 17919 46593 1 114 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.681 -0.431 17919 46594 1 114 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.044 1.686 17919 46595 1 114 . 1 1 27 27 LYS H H 27 8.560 8.560 8.335 0.225 17919 46596 1 114 . 1 1 28 28 ALA N N 28 123.440 123.440 121.611 1.829 17919 46597 1 114 . 1 1 28 28 ALA HA H 28 4.160 4.160 3.998 0.162 17919 46598 1 114 . 1 1 28 28 ALA C C 28 180.300 180.300 179.159 1.141 17919 46599 1 114 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.404 -0.034 17919 46600 1 114 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.035 -0.325 17919 46601 1 114 . 1 1 28 28 ALA H H 28 8.060 8.060 7.711 0.349 17919 46602 1 114 . 1 1 29 29 LYS N N 29 119.940 119.940 119.048 0.892 17919 46603 1 114 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.139 0.068 17919 46604 1 114 . 1 1 29 29 LYS C C 29 180.320 180.320 179.250 1.070 17919 46605 1 114 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.129 0.521 17919 46606 1 114 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.174 1.116 17919 46607 1 114 . 1 1 29 29 LYS H H 29 7.850 7.850 7.609 0.241 17919 46608 1 114 . 1 1 30 30 ILE N N 30 121.080 121.080 119.813 1.267 17919 46609 1 114 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.584 -0.077 17919 46610 1 114 . 1 1 30 30 ILE C C 30 178.310 178.310 177.690 0.620 17919 46611 1 114 . 1 1 30 30 ILE CA C 30 66.150 66.150 64.805 1.345 17919 46612 1 114 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.361 -0.561 17919 46613 1 114 . 1 1 30 30 ILE H H 30 8.280 8.280 7.739 0.541 17919 46614 1 114 . 1 1 31 31 GLN N N 31 123.490 123.490 120.780 2.710 17919 46615 1 114 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.899 -0.070 17919 46616 1 114 . 1 1 31 31 GLN C C 31 178.890 178.890 178.576 0.314 17919 46617 1 114 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.330 0.670 17919 46618 1 114 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.424 -0.704 17919 46619 1 114 . 1 1 31 31 GLN H H 31 8.580 8.580 8.551 0.029 17919 46620 1 114 . 1 1 32 32 ASP N N 32 119.360 119.360 119.119 0.241 17919 46621 1 114 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.465 -0.111 17919 46622 1 114 . 1 1 32 32 ASP C C 32 177.250 177.250 177.897 -0.647 17919 46623 1 114 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.674 0.516 17919 46624 1 114 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.593 -0.013 17919 46625 1 114 . 1 1 32 32 ASP H H 32 8.010 8.010 8.460 -0.450 17919 46626 1 114 . 1 1 33 33 LYS N N 33 115.130 115.130 117.532 -2.402 17919 46627 1 114 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.411 -0.074 17919 46628 1 114 . 1 1 33 33 LYS C C 33 177.870 177.870 177.744 0.126 17919 46629 1 114 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.614 0.436 17919 46630 1 114 . 1 1 33 33 LYS CB C 33 34.170 34.170 34.289 -0.119 17919 46631 1 114 . 1 1 33 33 LYS H H 33 7.430 7.430 7.865 -0.435 17919 46632 1 114 . 1 1 34 34 GLU N N 34 113.870 113.870 115.542 -1.672 17919 46633 1 114 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.472 0.153 17919 46634 1 114 . 1 1 34 34 GLU C C 34 177.840 177.840 177.611 0.229 17919 46635 1 114 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.324 -0.154 17919 46636 1 114 . 1 1 34 34 GLU CB C 34 32.660 32.660 30.883 1.777 17919 46637 1 114 . 1 1 34 34 GLU H H 34 8.740 8.740 8.214 0.526 17919 46638 1 114 . 1 1 35 35 GLY N N 35 108.650 108.650 109.957 -1.307 17919 46639 1 114 . 1 1 35 35 GLY C C 35 173.960 173.960 174.232 -0.272 17919 46640 1 114 . 1 1 35 35 GLY CA C 35 46.080 46.080 46.145 -0.065 17919 46641 1 114 . 1 1 35 35 GLY H H 35 8.530 8.530 8.451 0.079 17919 46642 1 114 . 1 1 36 36 ILE N N 36 119.880 119.880 120.535 -0.655 17919 46643 1 114 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.303 0.142 17919 46644 1 114 . 1 1 36 36 ILE C C 36 173.590 173.590 174.317 -0.727 17919 46645 1 114 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.758 -0.008 17919 46646 1 114 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.410 2.170 17919 46647 1 114 . 1 1 36 36 ILE H H 36 6.150 6.150 7.433 -1.283 17919 46648 1 114 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.845 -0.211 17919 46649 1 114 . 1 1 37 37 PRO C C 37 176.940 176.940 175.886 1.054 17919 46650 1 114 . 1 1 37 37 PRO CA C 37 61.660 61.660 60.817 0.843 17919 46651 1 114 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.376 0.474 17919 46652 1 114 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.283 -0.166 17919 46653 1 114 . 1 1 38 38 PRO C C 38 178.320 178.320 178.621 -0.301 17919 46654 1 114 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.456 0.804 17919 46655 1 114 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.906 0.984 17919 46656 1 114 . 1 1 39 39 ASP N N 39 113.380 113.380 116.757 -3.377 17919 46657 1 114 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.332 0.098 17919 46658 1 114 . 1 1 39 39 ASP C C 39 177.090 177.090 177.555 -0.465 17919 46659 1 114 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.920 -1.280 17919 46660 1 114 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.520 -0.980 17919 46661 1 114 . 1 1 39 39 ASP H H 39 8.550 8.550 8.819 -0.269 17919 46662 1 114 . 1 1 40 40 GLN N N 40 116.780 116.780 115.911 0.869 17919 46663 1 114 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.405 0.059 17919 46664 1 114 . 1 1 40 40 GLN C C 40 175.380 175.380 175.867 -0.487 17919 46665 1 114 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.784 -0.144 17919 46666 1 114 . 1 1 40 40 GLN CB C 40 30.140 30.140 30.088 0.052 17919 46667 1 114 . 1 1 40 40 GLN H H 40 7.820 7.820 7.676 0.144 17919 46668 1 114 . 1 1 41 41 GLN N N 41 117.720 117.720 119.805 -2.085 17919 46669 1 114 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.425 -0.181 17919 46670 1 114 . 1 1 41 41 GLN C C 41 176.300 176.300 174.595 1.705 17919 46671 1 114 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.894 0.576 17919 46672 1 114 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.805 1.845 17919 46673 1 114 . 1 1 41 41 GLN H H 41 7.480 7.480 7.479 0.001 17919 46674 1 114 . 1 1 42 42 ARG N N 42 122.680 122.680 125.544 -2.864 17919 46675 1 114 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.571 -0.071 17919 46676 1 114 . 1 1 42 42 ARG C C 42 174.050 174.050 174.662 -0.612 17919 46677 1 114 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.736 0.314 17919 46678 1 114 . 1 1 42 42 ARG CB C 42 31.750 31.750 31.815 -0.065 17919 46679 1 114 . 1 1 42 42 ARG H H 42 8.530 8.530 7.873 0.657 17919 46680 1 114 . 1 1 43 43 LEU N N 43 124.040 124.040 126.344 -2.304 17919 46681 1 114 . 1 1 43 43 LEU C C 43 175.290 175.290 176.404 -1.114 17919 46682 1 114 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.669 -0.689 17919 46683 1 114 . 1 1 43 43 LEU CB C 43 45.790 45.790 42.852 2.938 17919 46684 1 114 . 1 1 43 43 LEU H H 43 8.820 8.820 8.671 0.149 17919 46685 1 114 . 1 1 44 44 ILE N N 44 121.920 121.920 120.424 1.496 17919 46686 1 114 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.038 -0.046 17919 46687 1 114 . 1 1 44 44 ILE C C 44 176.060 176.060 174.742 1.318 17919 46688 1 114 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.238 -1.258 17919 46689 1 114 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.677 -0.257 17919 46690 1 114 . 1 1 44 44 ILE H H 44 9.030 9.030 9.044 -0.014 17919 46691 1 114 . 1 1 45 45 PHE N N 45 125.390 125.390 126.854 -1.464 17919 46692 1 114 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.002 0.043 17919 46693 1 114 . 1 1 45 45 PHE C C 45 174.470 174.470 174.479 -0.009 17919 46694 1 114 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.599 0.421 17919 46695 1 114 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.264 0.496 17919 46696 1 114 . 1 1 45 45 PHE H H 45 8.830 8.830 9.062 -0.232 17919 46697 1 114 . 1 1 46 46 ALA N N 46 132.200 132.200 128.869 3.331 17919 46698 1 114 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.664 0.026 17919 46699 1 114 . 1 1 46 46 ALA C C 46 177.290 177.290 177.706 -0.416 17919 46700 1 114 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.713 -0.173 17919 46701 1 114 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.262 0.307 17919 46702 1 114 . 1 1 46 46 ALA H H 46 8.810 8.810 8.938 -0.128 17919 46703 1 114 . 1 1 47 47 GLY N N 47 102.340 102.340 104.134 -1.794 17919 46704 1 114 . 1 1 47 47 GLY C C 47 173.810 173.810 173.924 -0.114 17919 46705 1 114 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.842 0.508 17919 46706 1 114 . 1 1 47 47 GLY H H 47 8.130 8.130 8.532 -0.402 17919 46707 1 114 . 1 1 48 48 LYS N N 48 121.570 121.570 121.482 0.088 17919 46708 1 114 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.645 -0.023 17919 46709 1 114 . 1 1 48 48 LYS C C 48 174.700 174.700 175.191 -0.491 17919 46710 1 114 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.850 -0.300 17919 46711 1 114 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.661 -0.131 17919 46712 1 114 . 1 1 48 48 LYS H H 48 7.980 7.980 7.888 0.092 17919 46713 1 114 . 1 1 49 49 GLN N N 49 122.410 122.410 125.412 -3.002 17919 46714 1 114 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.408 0.152 17919 46715 1 114 . 1 1 49 49 GLN C C 49 175.670 175.670 175.561 0.109 17919 46716 1 114 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.486 -0.746 17919 46717 1 114 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.169 -0.169 17919 46718 1 114 . 1 1 49 49 GLN H H 49 8.600 8.600 8.638 -0.038 17919 46719 1 114 . 1 1 50 50 LEU N N 50 125.520 125.520 127.792 -2.272 17919 46720 1 114 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.092 -0.002 17919 46721 1 114 . 1 1 50 50 LEU C C 50 176.660 176.660 176.667 -0.007 17919 46722 1 114 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.496 -0.256 17919 46723 1 114 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.762 -0.192 17919 46724 1 114 . 1 1 50 50 LEU H H 50 8.530 8.530 8.465 0.065 17919 46725 1 114 . 1 1 51 51 GLU N N 51 122.940 122.940 125.730 -2.790 17919 46726 1 114 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.355 0.133 17919 46727 1 114 . 1 1 51 51 GLU C C 51 175.870 175.870 176.976 -1.106 17919 46728 1 114 . 1 1 51 51 GLU CA C 51 55.960 55.960 56.186 -0.226 17919 46729 1 114 . 1 1 51 51 GLU CB C 51 31.570 31.570 30.963 0.607 17919 46730 1 114 . 1 1 51 51 GLU H H 51 8.400 8.400 8.423 -0.023 17919 46731 1 114 . 1 1 52 52 ASP N N 52 120.030 120.030 125.251 -5.221 17919 46732 1 114 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.407 -0.048 17919 46733 1 114 . 1 1 52 52 ASP C C 52 177.330 177.330 178.235 -0.905 17919 46734 1 114 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.723 -0.763 17919 46735 1 114 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.762 0.088 17919 46736 1 114 . 1 1 52 52 ASP H H 52 8.160 8.160 8.811 -0.651 17919 46737 1 114 . 1 1 53 53 GLY N N 53 106.660 106.660 108.284 -1.624 17919 46738 1 114 . 1 1 53 53 GLY C C 53 174.870 174.870 173.517 1.353 17919 46739 1 114 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.060 0.110 17919 46740 1 114 . 1 1 53 53 GLY H H 53 9.390 9.390 8.669 0.721 17919 46741 1 114 . 1 1 54 54 ARG N N 54 119.050 119.050 117.875 1.175 17919 46742 1 114 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.582 0.113 17919 46743 1 114 . 1 1 54 54 ARG C C 54 175.350 175.350 174.566 0.784 17919 46744 1 114 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.252 0.138 17919 46745 1 114 . 1 1 54 54 ARG CB C 54 32.650 32.650 31.971 0.679 17919 46746 1 114 . 1 1 54 54 ARG H H 54 7.460 7.460 7.570 -0.110 17919 46747 1 114 . 1 1 55 55 THR N N 55 108.400 108.400 112.506 -4.106 17919 46748 1 114 . 1 1 55 55 THR HA H 55 5.240 5.240 4.851 0.389 17919 46749 1 114 . 1 1 55 55 THR C C 55 176.560 176.560 176.328 0.232 17919 46750 1 114 . 1 1 55 55 THR CA C 55 59.690 59.690 60.856 -1.166 17919 46751 1 114 . 1 1 55 55 THR CB C 55 72.260 72.260 70.735 1.525 17919 46752 1 114 . 1 1 55 55 THR H H 55 8.730 8.730 8.203 0.527 17919 46753 1 114 . 1 1 56 56 LEU N N 56 117.920 117.920 122.417 -4.497 17919 46754 1 114 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.977 0.083 17919 46755 1 114 . 1 1 56 56 LEU C C 56 180.810 180.810 179.040 1.770 17919 46756 1 114 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.822 -0.112 17919 46757 1 114 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.020 -0.650 17919 46758 1 114 . 1 1 56 56 LEU H H 56 8.140 8.140 8.169 -0.029 17919 46759 1 114 . 1 1 57 57 SER N N 57 113.330 113.330 113.894 -0.564 17919 46760 1 114 . 1 1 57 57 SER HA H 57 4.370 4.370 4.150 0.220 17919 46761 1 114 . 1 1 57 57 SER C C 57 178.310 178.310 176.697 1.613 17919 46762 1 114 . 1 1 57 57 SER CA C 57 61.080 61.080 61.666 -0.586 17919 46763 1 114 . 1 1 57 57 SER CB C 57 62.530 62.530 62.670 -0.140 17919 46764 1 114 . 1 1 57 57 SER H H 57 8.470 8.470 8.004 0.466 17919 46765 1 114 . 1 1 58 58 ASP N N 58 124.190 124.190 121.634 2.556 17919 46766 1 114 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.331 -0.035 17919 46767 1 114 . 1 1 58 58 ASP C C 58 177.400 177.400 176.758 0.642 17919 46768 1 114 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.451 0.729 17919 46769 1 114 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.207 -0.107 17919 46770 1 114 . 1 1 58 58 ASP H H 58 7.930 7.930 7.764 0.166 17919 46771 1 114 . 1 1 59 59 TYR N N 59 115.510 115.510 115.409 0.101 17919 46772 1 114 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.670 -0.000 17919 46773 1 114 . 1 1 59 59 TYR C C 59 174.700 174.700 175.517 -0.817 17919 46774 1 114 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.228 1.022 17919 46775 1 114 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.271 1.799 17919 46776 1 114 . 1 1 59 59 TYR H H 59 7.250 7.250 7.118 0.132 17919 46777 1 114 . 1 1 60 60 ASN N N 60 115.900 115.900 115.864 0.036 17919 46778 1 114 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.327 0.028 17919 46779 1 114 . 1 1 60 60 ASN C C 60 174.340 174.340 174.290 0.050 17919 46780 1 114 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.167 -0.047 17919 46781 1 114 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.529 -0.119 17919 46782 1 114 . 1 1 60 60 ASN H H 60 8.150 8.150 7.795 0.355 17919 46783 1 114 . 1 1 61 61 ILE N N 61 118.600 118.600 120.234 -1.634 17919 46784 1 114 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.791 -0.398 17919 46785 1 114 . 1 1 61 61 ILE C C 61 174.610 174.610 174.556 0.054 17919 46786 1 114 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.028 0.392 17919 46787 1 114 . 1 1 61 61 ILE CB C 61 36.740 36.740 36.711 0.029 17919 46788 1 114 . 1 1 61 61 ILE H H 61 7.250 7.250 7.693 -0.443 17919 46789 1 114 . 1 1 62 62 GLN N N 62 124.740 124.740 126.149 -1.409 17919 46790 1 114 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.664 -0.158 17919 46791 1 114 . 1 1 62 62 GLN C C 62 175.970 175.970 176.018 -0.048 17919 46792 1 114 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.786 -0.126 17919 46793 1 114 . 1 1 62 62 GLN CB C 62 31.650 31.650 30.654 0.996 17919 46794 1 114 . 1 1 62 62 GLN H H 62 7.610 7.610 7.703 -0.093 17919 46795 1 114 . 1 1 63 63 LYS N N 63 120.300 120.300 119.951 0.349 17919 46796 1 114 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.975 0.026 17919 46797 1 114 . 1 1 63 63 LYS C C 63 175.810 175.810 176.399 -0.589 17919 46798 1 114 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.700 0.090 17919 46799 1 114 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.738 0.912 17919 46800 1 114 . 1 1 63 63 LYS H H 63 8.490 8.490 8.428 0.062 17919 46801 1 114 . 1 1 64 64 GLU N N 64 113.950 113.950 117.585 -3.635 17919 46802 1 114 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.724 -0.259 17919 46803 1 114 . 1 1 64 64 GLU C C 64 175.250 175.250 175.657 -0.407 17919 46804 1 114 . 1 1 64 64 GLU CA C 64 57.890 57.890 58.146 -0.256 17919 46805 1 114 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.291 -2.391 17919 46806 1 114 . 1 1 64 64 GLU H H 64 9.280 9.280 8.448 0.832 17919 46807 1 114 . 1 1 65 65 SER N N 65 114.730 114.730 114.605 0.125 17919 46808 1 114 . 1 1 65 65 SER HA H 65 4.640 4.640 4.540 0.100 17919 46809 1 114 . 1 1 65 65 SER C C 65 172.160 172.160 174.829 -2.669 17919 46810 1 114 . 1 1 65 65 SER CA C 65 60.890 60.890 59.751 1.139 17919 46811 1 114 . 1 1 65 65 SER CB C 65 64.910 64.910 63.649 1.261 17919 46812 1 114 . 1 1 65 65 SER H H 65 7.670 7.670 7.393 0.277 17919 46813 1 114 . 1 1 66 66 THR N N 66 117.110 117.110 123.196 -6.086 17919 46814 1 114 . 1 1 66 66 THR HA H 66 5.270 5.270 4.636 0.634 17919 46815 1 114 . 1 1 66 66 THR C C 66 173.950 173.950 174.184 -0.234 17919 46816 1 114 . 1 1 66 66 THR CA C 66 62.340 62.340 62.972 -0.632 17919 46817 1 114 . 1 1 66 66 THR CB C 66 70.080 70.080 69.592 0.488 17919 46818 1 114 . 1 1 66 66 THR H H 66 8.730 8.730 8.528 0.202 17919 46819 1 114 . 1 1 67 67 LEU N N 67 127.110 127.110 128.029 -0.919 17919 46820 1 114 . 1 1 67 67 LEU HA H 67 5.060 5.060 5.035 0.025 17919 46821 1 114 . 1 1 67 67 LEU C C 67 175.770 175.770 175.831 -0.061 17919 46822 1 114 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.815 0.086 17919 46823 1 114 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.454 0.806 17919 46824 1 114 . 1 1 67 67 LEU H H 67 9.410 9.410 8.354 1.056 17919 46825 1 114 . 1 1 68 68 HIS N N 68 118.380 118.380 121.916 -3.536 17919 46826 1 114 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.857 -0.617 17919 46827 1 114 . 1 1 68 68 HIS C C 68 173.150 173.150 173.858 -0.708 17919 46828 1 114 . 1 1 68 68 HIS CA C 68 55.000 55.000 53.627 1.373 17919 46829 1 114 . 1 1 68 68 HIS CB C 68 30.530 30.530 33.904 -3.374 17919 46830 1 114 . 1 1 68 68 HIS H H 68 9.230 9.230 8.789 0.441 17919 46831 1 114 . 1 1 69 69 LEU N N 69 124.460 124.460 122.265 2.195 17919 46832 1 114 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.200 -0.011 17919 46833 1 114 . 1 1 69 69 LEU C C 69 175.270 175.270 174.058 1.212 17919 46834 1 114 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.362 -0.472 17919 46835 1 114 . 1 1 69 69 LEU CB C 69 44.380 44.380 45.527 -1.147 17919 46836 1 114 . 1 1 69 69 LEU H H 69 8.340 8.340 6.806 1.534 17919 46837 1 114 . 1 1 70 70 VAL N N 70 126.940 126.940 124.542 2.398 17919 46838 1 114 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.579 -0.229 17919 46839 1 114 . 1 1 70 70 VAL C C 70 174.000 174.000 174.188 -0.188 17919 46840 1 114 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.088 0.712 17919 46841 1 114 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.183 -0.273 17919 46842 1 114 . 1 1 70 70 VAL H H 70 9.200 9.200 8.130 1.070 17919 46843 1 114 . 1 1 71 71 LEU N N 71 123.130 123.130 123.658 -0.528 17919 46844 1 114 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.166 -0.106 17919 46845 1 114 . 1 1 71 71 LEU C C 71 177.830 177.830 175.477 2.353 17919 46846 1 114 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.127 0.813 17919 46847 1 114 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.281 0.569 17919 46848 1 114 . 1 1 71 71 LEU H H 71 8.120 8.120 8.445 -0.325 17919 46849 1 114 . 1 1 72 72 ARG N N 72 123.490 123.490 127.950 -4.460 17919 46850 1 114 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.496 -0.195 17919 46851 1 114 . 1 1 72 72 ARG C C 72 175.350 175.350 174.934 0.416 17919 46852 1 114 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.015 -0.405 17919 46853 1 114 . 1 1 72 72 ARG CB C 72 31.350 31.350 31.452 -0.102 17919 46854 1 114 . 1 1 72 72 ARG H H 72 8.580 8.580 8.797 -0.217 17919 46855 1 115 . 1 1 2 2 GLN N N 2 123.220 123.220 122.223 0.997 17919 46856 1 115 . 1 1 2 2 GLN HA H 2 5.249 5.249 4.987 0.262 17919 46857 1 115 . 1 1 2 2 GLN C C 2 175.920 175.920 175.414 0.506 17919 46858 1 115 . 1 1 2 2 GLN CA C 2 55.080 55.080 55.192 -0.112 17919 46859 1 115 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.037 0.723 17919 46860 1 115 . 1 1 2 2 GLN H H 2 8.900 8.900 8.428 0.472 17919 46861 1 115 . 1 1 3 3 ILE N N 3 115.340 115.340 119.425 -4.085 17919 46862 1 115 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.283 -0.070 17919 46863 1 115 . 1 1 3 3 ILE C C 3 172.450 172.450 173.786 -1.336 17919 46864 1 115 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.126 0.445 17919 46865 1 115 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.051 1.159 17919 46866 1 115 . 1 1 3 3 ILE H H 3 8.320 8.320 8.136 0.184 17919 46867 1 115 . 1 1 4 4 PHE N N 4 118.110 118.110 118.012 0.098 17919 46868 1 115 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.025 0.605 17919 46869 1 115 . 1 1 4 4 PHE C C 4 175.320 175.320 174.786 0.534 17919 46870 1 115 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.639 -0.429 17919 46871 1 115 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.230 -0.750 17919 46872 1 115 . 1 1 4 4 PHE H H 4 8.610 8.610 8.765 -0.155 17919 46873 1 115 . 1 1 5 5 VAL N N 5 121.000 121.000 121.604 -0.604 17919 46874 1 115 . 1 1 5 5 VAL HA H 5 4.725 4.725 5.061 -0.336 17919 46875 1 115 . 1 1 5 5 VAL C C 5 174.870 174.870 175.031 -0.161 17919 46876 1 115 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.244 -0.624 17919 46877 1 115 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.257 -0.027 17919 46878 1 115 . 1 1 5 5 VAL H H 5 9.300 9.300 8.621 0.679 17919 46879 1 115 . 1 1 6 6 LYS N N 6 127.520 127.520 128.881 -1.361 17919 46880 1 115 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.156 0.211 17919 46881 1 115 . 1 1 6 6 LYS C C 6 177.140 177.140 176.778 0.362 17919 46882 1 115 . 1 1 6 6 LYS CA C 6 54.520 54.520 55.213 -0.693 17919 46883 1 115 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.047 1.003 17919 46884 1 115 . 1 1 6 6 LYS H H 6 8.820 8.820 8.266 0.554 17919 46885 1 115 . 1 1 7 7 THR N N 7 115.400 115.400 116.884 -1.484 17919 46886 1 115 . 1 1 7 7 THR HA H 7 4.970 4.970 4.645 0.325 17919 46887 1 115 . 1 1 7 7 THR C C 7 176.910 176.910 176.621 0.289 17919 46888 1 115 . 1 1 7 7 THR CA C 7 60.470 60.470 59.834 0.636 17919 46889 1 115 . 1 1 7 7 THR CB C 7 70.630 70.630 69.915 0.715 17919 46890 1 115 . 1 1 7 7 THR H H 7 8.730 8.730 8.754 -0.024 17919 46891 1 115 . 1 1 8 8 LEU N N 8 121.330 121.330 119.628 1.702 17919 46892 1 115 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.155 0.155 17919 46893 1 115 . 1 1 8 8 LEU C C 8 178.800 178.800 177.879 0.921 17919 46894 1 115 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.368 0.212 17919 46895 1 115 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.481 0.489 17919 46896 1 115 . 1 1 8 8 LEU H H 8 9.100 9.100 8.514 0.586 17919 46897 1 115 . 1 1 9 9 THR N N 9 105.590 105.590 106.536 -0.946 17919 46898 1 115 . 1 1 9 9 THR HA H 9 4.428 4.428 4.320 0.108 17919 46899 1 115 . 1 1 9 9 THR C C 9 175.520 175.520 175.669 -0.149 17919 46900 1 115 . 1 1 9 9 THR CA C 9 61.400 61.400 61.662 -0.262 17919 46901 1 115 . 1 1 9 9 THR CB C 9 69.140 69.140 69.127 0.013 17919 46902 1 115 . 1 1 9 9 THR H H 9 7.630 7.630 7.812 -0.182 17919 46903 1 115 . 1 1 10 10 GLY N N 10 108.890 108.890 111.161 -2.271 17919 46904 1 115 . 1 1 10 10 GLY C C 10 174.070 174.070 173.976 0.094 17919 46905 1 115 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.559 -0.099 17919 46906 1 115 . 1 1 10 10 GLY H H 10 7.810 7.810 8.025 -0.215 17919 46907 1 115 . 1 1 11 11 LYS N N 11 121.600 121.600 121.409 0.191 17919 46908 1 115 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.179 0.182 17919 46909 1 115 . 1 1 11 11 LYS C C 11 175.940 175.940 176.061 -0.121 17919 46910 1 115 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.372 -0.092 17919 46911 1 115 . 1 1 11 11 LYS CB C 11 33.200 33.200 32.854 0.346 17919 46912 1 115 . 1 1 11 11 LYS H H 11 7.280 7.280 7.765 -0.485 17919 46913 1 115 . 1 1 12 12 THR N N 12 120.440 120.440 118.303 2.137 17919 46914 1 115 . 1 1 12 12 THR HA H 12 5.046 5.046 5.134 -0.088 17919 46915 1 115 . 1 1 12 12 THR C C 12 174.320 174.320 174.772 -0.452 17919 46916 1 115 . 1 1 12 12 THR CA C 12 62.390 62.390 61.230 1.160 17919 46917 1 115 . 1 1 12 12 THR CB C 12 69.910 69.910 69.867 0.043 17919 46918 1 115 . 1 1 12 12 THR H H 12 8.650 8.650 8.325 0.325 17919 46919 1 115 . 1 1 13 13 ILE N N 13 127.110 127.110 126.253 0.857 17919 46920 1 115 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.553 -0.009 17919 46921 1 115 . 1 1 13 13 ILE C C 13 175.220 175.220 176.101 -0.881 17919 46922 1 115 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.132 -0.152 17919 46923 1 115 . 1 1 13 13 ILE CB C 13 40.950 40.950 38.632 2.318 17919 46924 1 115 . 1 1 13 13 ILE H H 13 9.450 9.450 9.102 0.348 17919 46925 1 115 . 1 1 14 14 THR N N 14 121.520 121.520 122.951 -1.431 17919 46926 1 115 . 1 1 14 14 THR HA H 14 4.964 4.964 4.766 0.198 17919 46927 1 115 . 1 1 14 14 THR C C 14 173.790 173.790 173.861 -0.071 17919 46928 1 115 . 1 1 14 14 THR CA C 14 61.940 61.940 63.173 -1.233 17919 46929 1 115 . 1 1 14 14 THR CB C 14 69.650 69.650 69.658 -0.008 17919 46930 1 115 . 1 1 14 14 THR H H 14 8.710 8.710 8.429 0.281 17919 46931 1 115 . 1 1 15 15 LEU N N 15 124.800 124.800 126.800 -2.000 17919 46932 1 115 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.869 -0.089 17919 46933 1 115 . 1 1 15 15 LEU C C 15 174.670 174.670 175.027 -0.357 17919 46934 1 115 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.673 -0.843 17919 46935 1 115 . 1 1 15 15 LEU CB C 15 47.070 47.070 46.473 0.597 17919 46936 1 115 . 1 1 15 15 LEU H H 15 8.710 8.710 8.323 0.387 17919 46937 1 115 . 1 1 16 16 GLU N N 16 122.160 122.160 122.000 0.160 17919 46938 1 115 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.956 -0.039 17919 46939 1 115 . 1 1 16 16 GLU C C 16 175.860 175.860 175.054 0.806 17919 46940 1 115 . 1 1 16 16 GLU CA C 16 54.820 54.820 54.797 0.022 17919 46941 1 115 . 1 1 16 16 GLU CB C 16 29.450 29.450 32.361 -2.911 17919 46942 1 115 . 1 1 16 16 GLU H H 16 8.140 8.140 8.404 -0.264 17919 46943 1 115 . 1 1 17 17 VAL N N 17 117.210 117.210 115.663 1.547 17919 46944 1 115 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.769 -0.055 17919 46945 1 115 . 1 1 17 17 VAL C C 17 174.160 174.160 174.260 -0.100 17919 46946 1 115 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.928 -1.498 17919 46947 1 115 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.385 1.016 17919 46948 1 115 . 1 1 17 17 VAL H H 17 8.900 8.900 8.693 0.207 17919 46949 1 115 . 1 1 18 18 GLU N N 18 118.990 118.990 120.942 -1.952 17919 46950 1 115 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.985 0.094 17919 46951 1 115 . 1 1 18 18 GLU C C 18 176.160 176.160 174.898 1.262 17919 46952 1 115 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.467 0.253 17919 46953 1 115 . 1 1 18 18 GLU CB C 18 30.310 30.310 31.864 -1.554 17919 46954 1 115 . 1 1 18 18 GLU H H 18 8.640 8.640 8.791 -0.151 17919 46955 1 115 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.488 -0.347 17919 46956 1 115 . 1 1 19 19 PRO C C 19 175.310 175.310 176.729 -1.419 17919 46957 1 115 . 1 1 19 19 PRO CA C 19 65.470 65.470 64.628 0.842 17919 46958 1 115 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.078 -0.128 17919 46959 1 115 . 1 1 20 20 SER N N 20 103.400 103.400 109.425 -6.025 17919 46960 1 115 . 1 1 20 20 SER HA H 20 4.370 4.370 4.403 -0.033 17919 46961 1 115 . 1 1 20 20 SER C C 20 174.660 174.660 174.187 0.473 17919 46962 1 115 . 1 1 20 20 SER CA C 20 57.400 57.400 58.034 -0.634 17919 46963 1 115 . 1 1 20 20 SER CB C 20 63.370 63.370 63.054 0.316 17919 46964 1 115 . 1 1 20 20 SER H H 20 7.040 7.040 7.945 -0.905 17919 46965 1 115 . 1 1 21 21 ASP N N 21 123.480 123.480 124.237 -0.757 17919 46966 1 115 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.573 0.122 17919 46967 1 115 . 1 1 21 21 ASP C C 21 176.360 176.360 176.451 -0.091 17919 46968 1 115 . 1 1 21 21 ASP CA C 21 55.700 55.700 56.052 -0.352 17919 46969 1 115 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.882 -1.081 17919 46970 1 115 . 1 1 21 21 ASP H H 21 8.030 8.030 8.232 -0.202 17919 46971 1 115 . 1 1 22 22 THR N N 22 108.800 108.800 112.374 -3.574 17919 46972 1 115 . 1 1 22 22 THR HA H 22 4.920 4.920 4.843 0.077 17919 46973 1 115 . 1 1 22 22 THR C C 22 176.750 176.750 176.467 0.283 17919 46974 1 115 . 1 1 22 22 THR CA C 22 59.690 59.690 61.167 -1.477 17919 46975 1 115 . 1 1 22 22 THR CB C 22 71.200 71.200 70.526 0.674 17919 46976 1 115 . 1 1 22 22 THR H H 22 7.900 7.900 8.098 -0.199 17919 46977 1 115 . 1 1 23 23 ILE N N 23 121.190 121.190 122.463 -1.273 17919 46978 1 115 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.794 -0.137 17919 46979 1 115 . 1 1 23 23 ILE C C 23 179.040 179.040 177.727 1.313 17919 46980 1 115 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.430 -0.170 17919 46981 1 115 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.176 -1.826 17919 46982 1 115 . 1 1 23 23 ILE H H 23 8.560 8.560 9.150 -0.590 17919 46983 1 115 . 1 1 24 24 GLU N N 24 120.830 120.830 121.188 -0.358 17919 46984 1 115 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.996 -0.079 17919 46985 1 115 . 1 1 24 24 GLU C C 24 178.640 178.640 178.025 0.615 17919 46986 1 115 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.636 0.584 17919 46987 1 115 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.444 -1.164 17919 46988 1 115 . 1 1 24 24 GLU H H 24 9.760 9.760 8.534 1.226 17919 46989 1 115 . 1 1 25 25 ASN N N 25 120.570 120.570 118.730 1.840 17919 46990 1 115 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.512 0.013 17919 46991 1 115 . 1 1 25 25 ASN C C 25 178.380 178.380 177.864 0.516 17919 46992 1 115 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.423 -0.363 17919 46993 1 115 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.530 -0.080 17919 46994 1 115 . 1 1 25 25 ASN H H 25 7.920 7.920 8.128 -0.208 17919 46995 1 115 . 1 1 26 26 VAL N N 26 121.710 121.710 121.115 0.595 17919 46996 1 115 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.509 -0.112 17919 46997 1 115 . 1 1 26 26 VAL C C 26 177.950 177.950 177.543 0.407 17919 46998 1 115 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.879 0.781 17919 46999 1 115 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.241 -0.401 17919 47000 1 115 . 1 1 26 26 VAL H H 26 8.070 8.070 8.266 -0.196 17919 47001 1 115 . 1 1 27 27 LYS N N 27 118.860 118.860 120.021 -1.161 17919 47002 1 115 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.149 0.431 17919 47003 1 115 . 1 1 27 27 LYS C C 27 180.550 180.550 179.114 1.436 17919 47004 1 115 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.556 -0.306 17919 47005 1 115 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.143 1.587 17919 47006 1 115 . 1 1 27 27 LYS H H 27 8.560 8.560 7.669 0.891 17919 47007 1 115 . 1 1 28 28 ALA N N 28 123.440 123.440 121.131 2.309 17919 47008 1 115 . 1 1 28 28 ALA HA H 28 4.160 4.160 3.902 0.258 17919 47009 1 115 . 1 1 28 28 ALA C C 28 180.300 180.300 179.339 0.961 17919 47010 1 115 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.518 -0.148 17919 47011 1 115 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.247 -0.537 17919 47012 1 115 . 1 1 28 28 ALA H H 28 8.060 8.060 8.401 -0.341 17919 47013 1 115 . 1 1 29 29 LYS N N 29 119.940 119.940 119.207 0.733 17919 47014 1 115 . 1 1 29 29 LYS HA H 29 4.207 4.207 3.935 0.272 17919 47015 1 115 . 1 1 29 29 LYS C C 29 180.320 180.320 179.178 1.142 17919 47016 1 115 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.300 0.350 17919 47017 1 115 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.127 1.163 17919 47018 1 115 . 1 1 29 29 LYS H H 29 7.850 7.850 7.487 0.363 17919 47019 1 115 . 1 1 30 30 ILE N N 30 121.080 121.080 119.557 1.523 17919 47020 1 115 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.605 -0.098 17919 47021 1 115 . 1 1 30 30 ILE C C 30 178.310 178.310 177.572 0.738 17919 47022 1 115 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.096 1.054 17919 47023 1 115 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.353 -0.553 17919 47024 1 115 . 1 1 30 30 ILE H H 30 8.280 8.280 7.778 0.502 17919 47025 1 115 . 1 1 31 31 GLN N N 31 123.490 123.490 119.985 3.505 17919 47026 1 115 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.967 -0.138 17919 47027 1 115 . 1 1 31 31 GLN C C 31 178.890 178.890 178.117 0.773 17919 47028 1 115 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.251 0.749 17919 47029 1 115 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.498 -0.778 17919 47030 1 115 . 1 1 31 31 GLN H H 31 8.580 8.580 8.485 0.095 17919 47031 1 115 . 1 1 32 32 ASP N N 32 119.360 119.360 119.358 0.002 17919 47032 1 115 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.469 -0.115 17919 47033 1 115 . 1 1 32 32 ASP C C 32 177.250 177.250 177.030 0.220 17919 47034 1 115 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.261 0.929 17919 47035 1 115 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.408 0.172 17919 47036 1 115 . 1 1 32 32 ASP H H 32 8.010 8.010 7.955 0.055 17919 47037 1 115 . 1 1 33 33 LYS N N 33 115.130 115.130 118.568 -3.438 17919 47038 1 115 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.421 -0.084 17919 47039 1 115 . 1 1 33 33 LYS C C 33 177.870 177.870 177.292 0.578 17919 47040 1 115 . 1 1 33 33 LYS CA C 33 58.050 58.050 56.680 1.370 17919 47041 1 115 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.758 0.412 17919 47042 1 115 . 1 1 33 33 LYS H H 33 7.430 7.430 7.513 -0.083 17919 47043 1 115 . 1 1 34 34 GLU N N 34 113.870 113.870 116.240 -2.370 17919 47044 1 115 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.576 0.049 17919 47045 1 115 . 1 1 34 34 GLU C C 34 177.840 177.840 176.710 1.130 17919 47046 1 115 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.853 -0.683 17919 47047 1 115 . 1 1 34 34 GLU CB C 34 32.660 32.660 30.403 2.257 17919 47048 1 115 . 1 1 34 34 GLU H H 34 8.740 8.740 8.112 0.628 17919 47049 1 115 . 1 1 35 35 GLY N N 35 108.650 108.650 109.816 -1.166 17919 47050 1 115 . 1 1 35 35 GLY C C 35 173.960 173.960 174.474 -0.514 17919 47051 1 115 . 1 1 35 35 GLY CA C 35 46.080 46.080 46.323 -0.243 17919 47052 1 115 . 1 1 35 35 GLY H H 35 8.530 8.530 8.138 0.392 17919 47053 1 115 . 1 1 36 36 ILE N N 36 119.880 119.880 121.490 -1.610 17919 47054 1 115 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.235 0.210 17919 47055 1 115 . 1 1 36 36 ILE C C 36 173.590 173.590 174.009 -0.419 17919 47056 1 115 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.253 -0.503 17919 47057 1 115 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.639 1.941 17919 47058 1 115 . 1 1 36 36 ILE H H 36 6.150 6.150 7.750 -1.600 17919 47059 1 115 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.766 -0.132 17919 47060 1 115 . 1 1 37 37 PRO C C 37 176.940 176.940 175.927 1.013 17919 47061 1 115 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.243 0.417 17919 47062 1 115 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.309 0.541 17919 47063 1 115 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.266 -0.149 17919 47064 1 115 . 1 1 38 38 PRO C C 38 178.320 178.320 177.752 0.568 17919 47065 1 115 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.634 0.626 17919 47066 1 115 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.829 1.061 17919 47067 1 115 . 1 1 39 39 ASP N N 39 113.380 113.380 114.239 -0.859 17919 47068 1 115 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.349 0.081 17919 47069 1 115 . 1 1 39 39 ASP C C 39 177.090 177.090 176.719 0.371 17919 47070 1 115 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.406 -0.766 17919 47071 1 115 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.179 -0.639 17919 47072 1 115 . 1 1 39 39 ASP H H 39 8.550 8.550 8.660 -0.110 17919 47073 1 115 . 1 1 40 40 GLN N N 40 116.780 116.780 116.158 0.622 17919 47074 1 115 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.372 0.092 17919 47075 1 115 . 1 1 40 40 GLN C C 40 175.380 175.380 176.697 -1.317 17919 47076 1 115 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.904 -0.264 17919 47077 1 115 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.905 0.235 17919 47078 1 115 . 1 1 40 40 GLN H H 40 7.820 7.820 7.802 0.018 17919 47079 1 115 . 1 1 41 41 GLN N N 41 117.720 117.720 120.392 -2.672 17919 47080 1 115 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.102 0.142 17919 47081 1 115 . 1 1 41 41 GLN C C 41 176.300 176.300 175.493 0.807 17919 47082 1 115 . 1 1 41 41 GLN CA C 41 56.470 56.470 57.394 -0.924 17919 47083 1 115 . 1 1 41 41 GLN CB C 41 31.650 31.650 28.385 3.265 17919 47084 1 115 . 1 1 41 41 GLN H H 41 7.480 7.480 7.619 -0.139 17919 47085 1 115 . 1 1 42 42 ARG N N 42 122.680 122.680 124.080 -1.400 17919 47086 1 115 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.578 -0.078 17919 47087 1 115 . 1 1 42 42 ARG C C 42 174.050 174.050 174.682 -0.632 17919 47088 1 115 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.343 -0.293 17919 47089 1 115 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.863 -1.113 17919 47090 1 115 . 1 1 42 42 ARG H H 42 8.530 8.530 7.953 0.577 17919 47091 1 115 . 1 1 43 43 LEU N N 43 124.040 124.040 123.625 0.415 17919 47092 1 115 . 1 1 43 43 LEU C C 43 175.290 175.290 175.471 -0.181 17919 47093 1 115 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.637 -0.657 17919 47094 1 115 . 1 1 43 43 LEU CB C 43 45.790 45.790 45.575 0.215 17919 47095 1 115 . 1 1 43 43 LEU H H 43 8.820 8.820 8.659 0.161 17919 47096 1 115 . 1 1 44 44 ILE N N 44 121.920 121.920 121.623 0.297 17919 47097 1 115 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.600 0.392 17919 47098 1 115 . 1 1 44 44 ILE C C 44 176.060 176.060 174.210 1.850 17919 47099 1 115 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.096 -0.116 17919 47100 1 115 . 1 1 44 44 ILE CB C 44 41.420 41.420 39.100 2.320 17919 47101 1 115 . 1 1 44 44 ILE H H 44 9.030 9.030 8.410 0.620 17919 47102 1 115 . 1 1 45 45 PHE N N 45 125.390 125.390 128.815 -3.425 17919 47103 1 115 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.915 0.130 17919 47104 1 115 . 1 1 45 45 PHE C C 45 174.470 174.470 175.355 -0.885 17919 47105 1 115 . 1 1 45 45 PHE CA C 45 57.020 57.020 54.902 2.118 17919 47106 1 115 . 1 1 45 45 PHE CB C 45 43.760 43.760 41.767 1.993 17919 47107 1 115 . 1 1 45 45 PHE H H 45 8.830 8.830 8.460 0.370 17919 47108 1 115 . 1 1 46 46 ALA N N 46 132.200 132.200 131.608 0.592 17919 47109 1 115 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.811 -0.121 17919 47110 1 115 . 1 1 46 46 ALA C C 46 177.290 177.290 177.260 0.030 17919 47111 1 115 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.804 -0.264 17919 47112 1 115 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.251 0.319 17919 47113 1 115 . 1 1 46 46 ALA H H 46 8.810 8.810 9.264 -0.454 17919 47114 1 115 . 1 1 47 47 GLY N N 47 102.340 102.340 103.693 -1.353 17919 47115 1 115 . 1 1 47 47 GLY C C 47 173.810 173.810 173.872 -0.062 17919 47116 1 115 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.243 0.107 17919 47117 1 115 . 1 1 47 47 GLY H H 47 8.130 8.130 8.489 -0.359 17919 47118 1 115 . 1 1 48 48 LYS N N 48 121.570 121.570 120.909 0.661 17919 47119 1 115 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.539 0.083 17919 47120 1 115 . 1 1 48 48 LYS C C 48 174.700 174.700 175.125 -0.425 17919 47121 1 115 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.997 -0.447 17919 47122 1 115 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.831 -0.301 17919 47123 1 115 . 1 1 48 48 LYS H H 48 7.980 7.980 7.819 0.161 17919 47124 1 115 . 1 1 49 49 GLN N N 49 122.410 122.410 126.794 -4.384 17919 47125 1 115 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.474 0.086 17919 47126 1 115 . 1 1 49 49 GLN C C 49 175.670 175.670 175.326 0.344 17919 47127 1 115 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.242 -0.502 17919 47128 1 115 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.505 -0.505 17919 47129 1 115 . 1 1 49 49 GLN H H 49 8.600 8.600 8.707 -0.107 17919 47130 1 115 . 1 1 50 50 LEU N N 50 125.520 125.520 127.378 -1.858 17919 47131 1 115 . 1 1 50 50 LEU HA H 50 4.090 4.090 3.864 0.226 17919 47132 1 115 . 1 1 50 50 LEU C C 50 176.660 176.660 175.422 1.238 17919 47133 1 115 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.122 0.118 17919 47134 1 115 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.181 -0.612 17919 47135 1 115 . 1 1 50 50 LEU H H 50 8.530 8.530 7.825 0.705 17919 47136 1 115 . 1 1 51 51 GLU N N 51 122.940 122.940 122.994 -0.054 17919 47137 1 115 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.502 -0.014 17919 47138 1 115 . 1 1 51 51 GLU C C 51 175.870 175.870 176.330 -0.460 17919 47139 1 115 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.049 0.911 17919 47140 1 115 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.775 -1.205 17919 47141 1 115 . 1 1 51 51 GLU H H 51 8.400 8.400 7.837 0.563 17919 47142 1 115 . 1 1 52 52 ASP N N 52 120.030 120.030 125.734 -5.704 17919 47143 1 115 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.528 -0.169 17919 47144 1 115 . 1 1 52 52 ASP C C 52 177.330 177.330 177.898 -0.568 17919 47145 1 115 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.209 -0.249 17919 47146 1 115 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.662 0.188 17919 47147 1 115 . 1 1 52 52 ASP H H 52 8.160 8.160 8.810 -0.650 17919 47148 1 115 . 1 1 53 53 GLY N N 53 106.660 106.660 106.239 0.421 17919 47149 1 115 . 1 1 53 53 GLY C C 53 174.870 174.870 174.576 0.294 17919 47150 1 115 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.990 0.180 17919 47151 1 115 . 1 1 53 53 GLY H H 53 9.390 9.390 8.406 0.984 17919 47152 1 115 . 1 1 54 54 ARG N N 54 119.050 119.050 121.058 -2.008 17919 47153 1 115 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.519 0.176 17919 47154 1 115 . 1 1 54 54 ARG C C 54 175.350 175.350 175.279 0.071 17919 47155 1 115 . 1 1 54 54 ARG CA C 54 54.390 54.390 55.583 -1.193 17919 47156 1 115 . 1 1 54 54 ARG CB C 54 32.650 32.650 31.726 0.924 17919 47157 1 115 . 1 1 54 54 ARG H H 54 7.460 7.460 7.699 -0.239 17919 47158 1 115 . 1 1 55 55 THR N N 55 108.400 108.400 109.722 -1.322 17919 47159 1 115 . 1 1 55 55 THR HA H 55 5.240 5.240 5.202 0.038 17919 47160 1 115 . 1 1 55 55 THR C C 55 176.560 176.560 176.350 0.210 17919 47161 1 115 . 1 1 55 55 THR CA C 55 59.690 59.690 59.492 0.198 17919 47162 1 115 . 1 1 55 55 THR CB C 55 72.260 72.260 72.022 0.238 17919 47163 1 115 . 1 1 55 55 THR H H 55 8.730 8.730 9.005 -0.275 17919 47164 1 115 . 1 1 56 56 LEU N N 56 117.920 117.920 121.527 -3.607 17919 47165 1 115 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.951 0.109 17919 47166 1 115 . 1 1 56 56 LEU C C 56 180.810 180.810 179.224 1.586 17919 47167 1 115 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.084 0.626 17919 47168 1 115 . 1 1 56 56 LEU CB C 56 40.370 40.370 40.202 0.168 17919 47169 1 115 . 1 1 56 56 LEU H H 56 8.140 8.140 8.449 -0.309 17919 47170 1 115 . 1 1 57 57 SER N N 57 113.330 113.330 115.020 -1.690 17919 47171 1 115 . 1 1 57 57 SER HA H 57 4.370 4.370 4.251 0.119 17919 47172 1 115 . 1 1 57 57 SER C C 57 178.310 178.310 176.988 1.322 17919 47173 1 115 . 1 1 57 57 SER CA C 57 61.080 61.080 61.989 -0.909 17919 47174 1 115 . 1 1 57 57 SER CB C 57 62.530 62.530 62.767 -0.237 17919 47175 1 115 . 1 1 57 57 SER H H 57 8.470 8.470 8.001 0.469 17919 47176 1 115 . 1 1 58 58 ASP N N 58 124.190 124.190 124.103 0.087 17919 47177 1 115 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.313 -0.017 17919 47178 1 115 . 1 1 58 58 ASP C C 58 177.400 177.400 177.424 -0.024 17919 47179 1 115 . 1 1 58 58 ASP CA C 58 57.180 57.180 57.154 0.026 17919 47180 1 115 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.484 -0.384 17919 47181 1 115 . 1 1 58 58 ASP H H 58 7.930 7.930 7.713 0.217 17919 47182 1 115 . 1 1 59 59 TYR N N 59 115.510 115.510 114.531 0.979 17919 47183 1 115 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.615 0.055 17919 47184 1 115 . 1 1 59 59 TYR C C 59 174.700 174.700 175.140 -0.440 17919 47185 1 115 . 1 1 59 59 TYR CA C 59 58.250 58.250 58.067 0.183 17919 47186 1 115 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.648 1.422 17919 47187 1 115 . 1 1 59 59 TYR H H 59 7.250 7.250 7.461 -0.211 17919 47188 1 115 . 1 1 60 60 ASN N N 60 115.900 115.900 117.737 -1.837 17919 47189 1 115 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.428 -0.073 17919 47190 1 115 . 1 1 60 60 ASN C C 60 174.340 174.340 174.532 -0.192 17919 47191 1 115 . 1 1 60 60 ASN CA C 60 54.120 54.120 53.878 0.242 17919 47192 1 115 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.791 -0.381 17919 47193 1 115 . 1 1 60 60 ASN H H 60 8.150 8.150 7.764 0.386 17919 47194 1 115 . 1 1 61 61 ILE N N 61 118.600 118.600 120.180 -1.580 17919 47195 1 115 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.674 -0.281 17919 47196 1 115 . 1 1 61 61 ILE C C 61 174.610 174.610 175.423 -0.813 17919 47197 1 115 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.009 0.411 17919 47198 1 115 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.367 -0.627 17919 47199 1 115 . 1 1 61 61 ILE H H 61 7.250 7.250 8.250 -1.000 17919 47200 1 115 . 1 1 62 62 GLN N N 62 124.740 124.740 125.983 -1.243 17919 47201 1 115 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.658 -0.152 17919 47202 1 115 . 1 1 62 62 GLN C C 62 175.970 175.970 176.173 -0.203 17919 47203 1 115 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.404 0.256 17919 47204 1 115 . 1 1 62 62 GLN CB C 62 31.650 31.650 32.087 -0.437 17919 47205 1 115 . 1 1 62 62 GLN H H 62 7.610 7.610 8.060 -0.450 17919 47206 1 115 . 1 1 63 63 LYS N N 63 120.300 120.300 121.645 -1.345 17919 47207 1 115 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.904 0.097 17919 47208 1 115 . 1 1 63 63 LYS C C 63 175.810 175.810 176.785 -0.975 17919 47209 1 115 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.785 0.005 17919 47210 1 115 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.502 1.148 17919 47211 1 115 . 1 1 63 63 LYS H H 63 8.490 8.490 8.821 -0.331 17919 47212 1 115 . 1 1 64 64 GLU N N 64 113.950 113.950 121.024 -7.074 17919 47213 1 115 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.517 -0.052 17919 47214 1 115 . 1 1 64 64 GLU C C 64 175.250 175.250 175.913 -0.663 17919 47215 1 115 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.203 0.687 17919 47216 1 115 . 1 1 64 64 GLU CB C 64 25.900 25.900 27.950 -2.050 17919 47217 1 115 . 1 1 64 64 GLU H H 64 9.280 9.280 8.718 0.562 17919 47218 1 115 . 1 1 65 65 SER N N 65 114.730 114.730 114.451 0.279 17919 47219 1 115 . 1 1 65 65 SER HA H 65 4.640 4.640 4.639 0.000 17919 47220 1 115 . 1 1 65 65 SER C C 65 172.160 172.160 173.794 -1.634 17919 47221 1 115 . 1 1 65 65 SER CA C 65 60.890 60.890 59.503 1.387 17919 47222 1 115 . 1 1 65 65 SER CB C 65 64.910 64.910 64.308 0.602 17919 47223 1 115 . 1 1 65 65 SER H H 65 7.670 7.670 7.535 0.135 17919 47224 1 115 . 1 1 66 66 THR N N 66 117.110 117.110 119.443 -2.333 17919 47225 1 115 . 1 1 66 66 THR HA H 66 5.270 5.270 4.986 0.284 17919 47226 1 115 . 1 1 66 66 THR C C 66 173.950 173.950 174.010 -0.060 17919 47227 1 115 . 1 1 66 66 THR CA C 66 62.340 62.340 62.185 0.155 17919 47228 1 115 . 1 1 66 66 THR CB C 66 70.080 70.080 69.835 0.245 17919 47229 1 115 . 1 1 66 66 THR H H 66 8.730 8.730 8.615 0.115 17919 47230 1 115 . 1 1 67 67 LEU N N 67 127.110 127.110 127.703 -0.593 17919 47231 1 115 . 1 1 67 67 LEU HA H 67 5.060 5.060 5.039 0.021 17919 47232 1 115 . 1 1 67 67 LEU C C 67 175.770 175.770 176.071 -0.301 17919 47233 1 115 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.318 0.582 17919 47234 1 115 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.027 1.233 17919 47235 1 115 . 1 1 67 67 LEU H H 67 9.410 9.410 8.824 0.586 17919 47236 1 115 . 1 1 68 68 HIS N N 68 118.380 118.380 119.839 -1.459 17919 47237 1 115 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.096 0.144 17919 47238 1 115 . 1 1 68 68 HIS C C 68 173.150 173.150 173.869 -0.719 17919 47239 1 115 . 1 1 68 68 HIS CA C 68 55.000 55.000 53.454 1.546 17919 47240 1 115 . 1 1 68 68 HIS CB C 68 30.530 30.530 30.907 -0.377 17919 47241 1 115 . 1 1 68 68 HIS H H 68 9.230 9.230 8.904 0.326 17919 47242 1 115 . 1 1 69 69 LEU N N 69 124.460 124.460 128.590 -4.130 17919 47243 1 115 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.507 0.683 17919 47244 1 115 . 1 1 69 69 LEU C C 69 175.270 175.270 175.496 -0.226 17919 47245 1 115 . 1 1 69 69 LEU CA C 69 53.890 53.890 55.865 -1.975 17919 47246 1 115 . 1 1 69 69 LEU CB C 69 44.380 44.380 42.810 1.570 17919 47247 1 115 . 1 1 69 69 LEU H H 69 8.340 8.340 7.930 0.410 17919 47248 1 115 . 1 1 70 70 VAL N N 70 126.940 126.940 122.809 4.131 17919 47249 1 115 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.510 -0.160 17919 47250 1 115 . 1 1 70 70 VAL C C 70 174.000 174.000 173.782 0.218 17919 47251 1 115 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.863 0.937 17919 47252 1 115 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.687 -0.777 17919 47253 1 115 . 1 1 70 70 VAL H H 70 9.200 9.200 8.271 0.929 17919 47254 1 115 . 1 1 71 71 LEU N N 71 123.130 123.130 125.746 -2.616 17919 47255 1 115 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.544 0.516 17919 47256 1 115 . 1 1 71 71 LEU C C 71 177.830 177.830 176.094 1.736 17919 47257 1 115 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.838 0.102 17919 47258 1 115 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.581 -0.731 17919 47259 1 115 . 1 1 71 71 LEU H H 71 8.120 8.120 8.532 -0.412 17919 47260 1 115 . 1 1 72 72 ARG N N 72 123.490 123.490 126.178 -2.688 17919 47261 1 115 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.374 -0.073 17919 47262 1 115 . 1 1 72 72 ARG C C 72 175.350 175.350 174.834 0.516 17919 47263 1 115 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.172 -0.562 17919 47264 1 115 . 1 1 72 72 ARG CB C 72 31.350 31.350 31.343 0.007 17919 47265 1 115 . 1 1 72 72 ARG H H 72 8.580 8.580 7.949 0.631 17919 47266 1 116 . 1 1 2 2 GLN N N 2 123.220 123.220 121.087 2.133 17919 47267 1 116 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.529 -0.280 17919 47268 1 116 . 1 1 2 2 GLN C C 2 175.920 175.920 175.618 0.302 17919 47269 1 116 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.373 0.707 17919 47270 1 116 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.773 -0.013 17919 47271 1 116 . 1 1 2 2 GLN H H 2 8.900 8.900 8.538 0.362 17919 47272 1 116 . 1 1 3 3 ILE N N 3 115.340 115.340 115.742 -0.402 17919 47273 1 116 . 1 1 3 3 ILE HA H 3 4.213 4.213 3.963 0.250 17919 47274 1 116 . 1 1 3 3 ILE C C 3 172.450 172.450 173.376 -0.926 17919 47275 1 116 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.596 -0.027 17919 47276 1 116 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.588 0.622 17919 47277 1 116 . 1 1 3 3 ILE H H 3 8.320 8.320 8.345 -0.025 17919 47278 1 116 . 1 1 4 4 PHE N N 4 118.110 118.110 119.302 -1.192 17919 47279 1 116 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.224 0.406 17919 47280 1 116 . 1 1 4 4 PHE C C 4 175.320 175.320 175.460 -0.140 17919 47281 1 116 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.572 -0.362 17919 47282 1 116 . 1 1 4 4 PHE CB C 4 41.480 41.480 40.691 0.789 17919 47283 1 116 . 1 1 4 4 PHE H H 4 8.610 8.610 8.450 0.160 17919 47284 1 116 . 1 1 5 5 VAL N N 5 121.000 121.000 123.445 -2.445 17919 47285 1 116 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.600 0.125 17919 47286 1 116 . 1 1 5 5 VAL C C 5 174.870 174.870 175.296 -0.426 17919 47287 1 116 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.601 -0.981 17919 47288 1 116 . 1 1 5 5 VAL CB C 5 34.230 34.230 32.761 1.469 17919 47289 1 116 . 1 1 5 5 VAL H H 5 9.300 9.300 8.328 0.972 17919 47290 1 116 . 1 1 6 6 LYS N N 6 127.520 127.520 128.360 -0.840 17919 47291 1 116 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.444 -0.077 17919 47292 1 116 . 1 1 6 6 LYS C C 6 177.140 177.140 176.717 0.423 17919 47293 1 116 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.648 -0.128 17919 47294 1 116 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.704 0.346 17919 47295 1 116 . 1 1 6 6 LYS H H 6 8.820 8.820 9.042 -0.222 17919 47296 1 116 . 1 1 7 7 THR N N 7 115.400 115.400 114.958 0.442 17919 47297 1 116 . 1 1 7 7 THR HA H 7 4.970 4.970 4.840 0.130 17919 47298 1 116 . 1 1 7 7 THR C C 7 176.910 176.910 176.686 0.224 17919 47299 1 116 . 1 1 7 7 THR CA C 7 60.470 60.470 59.899 0.571 17919 47300 1 116 . 1 1 7 7 THR CB C 7 70.630 70.630 70.744 -0.114 17919 47301 1 116 . 1 1 7 7 THR H H 7 8.730 8.730 8.044 0.686 17919 47302 1 116 . 1 1 8 8 LEU N N 8 121.330 121.330 121.888 -0.558 17919 47303 1 116 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.014 0.296 17919 47304 1 116 . 1 1 8 8 LEU C C 8 178.800 178.800 177.747 1.053 17919 47305 1 116 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.606 -0.026 17919 47306 1 116 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.314 0.656 17919 47307 1 116 . 1 1 8 8 LEU H H 8 9.100 9.100 9.192 -0.092 17919 47308 1 116 . 1 1 9 9 THR N N 9 105.590 105.590 105.974 -0.384 17919 47309 1 116 . 1 1 9 9 THR HA H 9 4.428 4.428 4.220 0.208 17919 47310 1 116 . 1 1 9 9 THR C C 9 175.520 175.520 175.696 -0.176 17919 47311 1 116 . 1 1 9 9 THR CA C 9 61.400 61.400 62.481 -1.081 17919 47312 1 116 . 1 1 9 9 THR CB C 9 69.140 69.140 68.275 0.866 17919 47313 1 116 . 1 1 9 9 THR H H 9 7.630 7.630 7.720 -0.090 17919 47314 1 116 . 1 1 10 10 GLY N N 10 108.890 108.890 110.754 -1.864 17919 47315 1 116 . 1 1 10 10 GLY C C 10 174.070 174.070 173.368 0.702 17919 47316 1 116 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.697 0.763 17919 47317 1 116 . 1 1 10 10 GLY H H 10 7.810 7.810 7.702 0.108 17919 47318 1 116 . 1 1 11 11 LYS N N 11 121.600 121.600 122.546 -0.946 17919 47319 1 116 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.650 -0.289 17919 47320 1 116 . 1 1 11 11 LYS C C 11 175.940 175.940 175.138 0.802 17919 47321 1 116 . 1 1 11 11 LYS CA C 11 56.280 56.280 54.828 1.452 17919 47322 1 116 . 1 1 11 11 LYS CB C 11 33.200 33.200 34.124 -0.924 17919 47323 1 116 . 1 1 11 11 LYS H H 11 7.280 7.280 7.649 -0.369 17919 47324 1 116 . 1 1 12 12 THR N N 12 120.440 120.440 121.845 -1.405 17919 47325 1 116 . 1 1 12 12 THR HA H 12 5.046 5.046 4.651 0.395 17919 47326 1 116 . 1 1 12 12 THR C C 12 174.320 174.320 174.538 -0.218 17919 47327 1 116 . 1 1 12 12 THR CA C 12 62.390 62.390 63.089 -0.699 17919 47328 1 116 . 1 1 12 12 THR CB C 12 69.910 69.910 69.230 0.680 17919 47329 1 116 . 1 1 12 12 THR H H 12 8.650 8.650 8.607 0.043 17919 47330 1 116 . 1 1 13 13 ILE N N 13 127.110 127.110 128.924 -1.814 17919 47331 1 116 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.456 0.088 17919 47332 1 116 . 1 1 13 13 ILE C C 13 175.220 175.220 175.282 -0.062 17919 47333 1 116 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.291 -0.311 17919 47334 1 116 . 1 1 13 13 ILE CB C 13 40.950 40.950 39.224 1.726 17919 47335 1 116 . 1 1 13 13 ILE H H 13 9.450 9.450 8.645 0.805 17919 47336 1 116 . 1 1 14 14 THR N N 14 121.520 121.520 124.004 -2.484 17919 47337 1 116 . 1 1 14 14 THR HA H 14 4.964 4.964 4.666 0.298 17919 47338 1 116 . 1 1 14 14 THR C C 14 173.790 173.790 173.856 -0.066 17919 47339 1 116 . 1 1 14 14 THR CA C 14 61.940 61.940 62.985 -1.045 17919 47340 1 116 . 1 1 14 14 THR CB C 14 69.650 69.650 69.604 0.046 17919 47341 1 116 . 1 1 14 14 THR H H 14 8.710 8.710 8.726 -0.016 17919 47342 1 116 . 1 1 15 15 LEU N N 15 124.800 124.800 125.857 -1.057 17919 47343 1 116 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.751 0.029 17919 47344 1 116 . 1 1 15 15 LEU C C 15 174.670 174.670 175.177 -0.507 17919 47345 1 116 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.772 -0.942 17919 47346 1 116 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.077 1.993 17919 47347 1 116 . 1 1 15 15 LEU H H 15 8.710 8.710 8.124 0.586 17919 47348 1 116 . 1 1 16 16 GLU N N 16 122.160 122.160 124.497 -2.337 17919 47349 1 116 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.071 -0.154 17919 47350 1 116 . 1 1 16 16 GLU C C 16 175.860 175.860 176.118 -0.258 17919 47351 1 116 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.300 -0.479 17919 47352 1 116 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.314 -0.864 17919 47353 1 116 . 1 1 16 16 GLU H H 16 8.140 8.140 8.677 -0.537 17919 47354 1 116 . 1 1 17 17 VAL N N 17 117.210 117.210 120.617 -3.407 17919 47355 1 116 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.798 -0.084 17919 47356 1 116 . 1 1 17 17 VAL C C 17 174.160 174.160 175.611 -1.451 17919 47357 1 116 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.830 -0.400 17919 47358 1 116 . 1 1 17 17 VAL CB C 17 36.400 36.400 34.261 2.139 17919 47359 1 116 . 1 1 17 17 VAL H H 17 8.900 8.900 8.677 0.223 17919 47360 1 116 . 1 1 18 18 GLU N N 18 118.990 118.990 120.678 -1.688 17919 47361 1 116 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.835 0.244 17919 47362 1 116 . 1 1 18 18 GLU C C 18 176.160 176.160 175.349 0.811 17919 47363 1 116 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.711 0.009 17919 47364 1 116 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.613 -0.304 17919 47365 1 116 . 1 1 18 18 GLU H H 18 8.640 8.640 8.757 -0.117 17919 47366 1 116 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.280 -0.139 17919 47367 1 116 . 1 1 19 19 PRO C C 19 175.310 175.310 177.615 -2.305 17919 47368 1 116 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.199 0.271 17919 47369 1 116 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.962 -0.012 17919 47370 1 116 . 1 1 20 20 SER N N 20 103.400 103.400 109.540 -6.140 17919 47371 1 116 . 1 1 20 20 SER HA H 20 4.370 4.370 4.334 0.036 17919 47372 1 116 . 1 1 20 20 SER C C 20 174.660 174.660 174.507 0.153 17919 47373 1 116 . 1 1 20 20 SER CA C 20 57.400 57.400 58.680 -1.280 17919 47374 1 116 . 1 1 20 20 SER CB C 20 63.370 63.370 63.062 0.308 17919 47375 1 116 . 1 1 20 20 SER H H 20 7.040 7.040 7.937 -0.897 17919 47376 1 116 . 1 1 21 21 ASP N N 21 123.480 123.480 124.689 -1.209 17919 47377 1 116 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.571 0.124 17919 47378 1 116 . 1 1 21 21 ASP C C 21 176.360 176.360 175.402 0.958 17919 47379 1 116 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.886 -0.186 17919 47380 1 116 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.820 -1.020 17919 47381 1 116 . 1 1 21 21 ASP H H 21 8.030 8.030 7.629 0.401 17919 47382 1 116 . 1 1 22 22 THR N N 22 108.800 108.800 112.680 -3.880 17919 47383 1 116 . 1 1 22 22 THR HA H 22 4.920 4.920 4.841 0.079 17919 47384 1 116 . 1 1 22 22 THR C C 22 176.750 176.750 175.756 0.994 17919 47385 1 116 . 1 1 22 22 THR CA C 22 59.690 59.690 61.114 -1.425 17919 47386 1 116 . 1 1 22 22 THR CB C 22 71.200 71.200 70.886 0.314 17919 47387 1 116 . 1 1 22 22 THR H H 22 7.900 7.900 8.265 -0.365 17919 47388 1 116 . 1 1 23 23 ILE N N 23 121.190 121.190 122.371 -1.181 17919 47389 1 116 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.901 -0.244 17919 47390 1 116 . 1 1 23 23 ILE C C 23 179.040 179.040 177.641 1.399 17919 47391 1 116 . 1 1 23 23 ILE CA C 23 62.260 62.260 61.948 0.312 17919 47392 1 116 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.344 -1.994 17919 47393 1 116 . 1 1 23 23 ILE H H 23 8.560 8.560 9.027 -0.467 17919 47394 1 116 . 1 1 24 24 GLU N N 24 120.830 120.830 121.001 -0.171 17919 47395 1 116 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.969 -0.052 17919 47396 1 116 . 1 1 24 24 GLU C C 24 178.640 178.640 178.497 0.143 17919 47397 1 116 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.791 0.429 17919 47398 1 116 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.573 -1.293 17919 47399 1 116 . 1 1 24 24 GLU H H 24 9.760 9.760 7.873 1.887 17919 47400 1 116 . 1 1 25 25 ASN N N 25 120.570 120.570 118.061 2.509 17919 47401 1 116 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.577 -0.052 17919 47402 1 116 . 1 1 25 25 ASN C C 25 178.380 178.380 178.064 0.316 17919 47403 1 116 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.378 0.682 17919 47404 1 116 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.522 -0.072 17919 47405 1 116 . 1 1 25 25 ASN H H 25 7.920 7.920 7.590 0.330 17919 47406 1 116 . 1 1 26 26 VAL N N 26 121.710 121.710 120.435 1.275 17919 47407 1 116 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.579 -0.182 17919 47408 1 116 . 1 1 26 26 VAL C C 26 177.950 177.950 177.496 0.454 17919 47409 1 116 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.534 1.126 17919 47410 1 116 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.403 -0.563 17919 47411 1 116 . 1 1 26 26 VAL H H 26 8.070 8.070 8.415 -0.345 17919 47412 1 116 . 1 1 27 27 LYS N N 27 118.860 118.860 119.871 -1.011 17919 47413 1 116 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.280 0.300 17919 47414 1 116 . 1 1 27 27 LYS C C 27 180.550 180.550 178.990 1.560 17919 47415 1 116 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.342 -0.092 17919 47416 1 116 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.141 1.589 17919 47417 1 116 . 1 1 27 27 LYS H H 27 8.560 8.560 8.383 0.177 17919 47418 1 116 . 1 1 28 28 ALA N N 28 123.440 123.440 121.553 1.887 17919 47419 1 116 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.083 0.077 17919 47420 1 116 . 1 1 28 28 ALA C C 28 180.300 180.300 178.958 1.342 17919 47421 1 116 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.194 0.176 17919 47422 1 116 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.386 -0.676 17919 47423 1 116 . 1 1 28 28 ALA H H 28 8.060 8.060 8.504 -0.444 17919 47424 1 116 . 1 1 29 29 LYS N N 29 119.940 119.940 119.748 0.192 17919 47425 1 116 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.095 0.112 17919 47426 1 116 . 1 1 29 29 LYS C C 29 180.320 180.320 179.035 1.285 17919 47427 1 116 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.208 0.443 17919 47428 1 116 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.393 0.897 17919 47429 1 116 . 1 1 29 29 LYS H H 29 7.850 7.850 7.503 0.347 17919 47430 1 116 . 1 1 30 30 ILE N N 30 121.080 121.080 120.904 0.176 17919 47431 1 116 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.609 -0.102 17919 47432 1 116 . 1 1 30 30 ILE C C 30 178.310 178.310 177.512 0.798 17919 47433 1 116 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.577 0.573 17919 47434 1 116 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.460 -0.660 17919 47435 1 116 . 1 1 30 30 ILE H H 30 8.280 8.280 8.181 0.099 17919 47436 1 116 . 1 1 31 31 GLN N N 31 123.490 123.490 119.732 3.758 17919 47437 1 116 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.883 -0.054 17919 47438 1 116 . 1 1 31 31 GLN C C 31 178.890 178.890 178.098 0.792 17919 47439 1 116 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.325 0.675 17919 47440 1 116 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.410 -0.690 17919 47441 1 116 . 1 1 31 31 GLN H H 31 8.580 8.580 8.191 0.389 17919 47442 1 116 . 1 1 32 32 ASP N N 32 119.360 119.360 119.304 0.056 17919 47443 1 116 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.391 -0.037 17919 47444 1 116 . 1 1 32 32 ASP C C 32 177.250 177.250 178.186 -0.936 17919 47445 1 116 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.916 0.274 17919 47446 1 116 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.894 -0.314 17919 47447 1 116 . 1 1 32 32 ASP H H 32 8.010 8.010 8.176 -0.166 17919 47448 1 116 . 1 1 33 33 LYS N N 33 115.130 115.130 118.035 -2.905 17919 47449 1 116 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.257 0.080 17919 47450 1 116 . 1 1 33 33 LYS C C 33 177.870 177.870 177.788 0.082 17919 47451 1 116 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.029 0.021 17919 47452 1 116 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.496 0.674 17919 47453 1 116 . 1 1 33 33 LYS H H 33 7.430 7.430 7.834 -0.404 17919 47454 1 116 . 1 1 34 34 GLU N N 34 113.870 113.870 114.255 -0.385 17919 47455 1 116 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.539 0.086 17919 47456 1 116 . 1 1 34 34 GLU C C 34 177.840 177.840 176.624 1.216 17919 47457 1 116 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.802 -0.632 17919 47458 1 116 . 1 1 34 34 GLU CB C 34 32.660 32.660 32.081 0.579 17919 47459 1 116 . 1 1 34 34 GLU H H 34 8.740 8.740 8.067 0.673 17919 47460 1 116 . 1 1 35 35 GLY N N 35 108.650 108.650 107.994 0.656 17919 47461 1 116 . 1 1 35 35 GLY C C 35 173.960 173.960 174.925 -0.965 17919 47462 1 116 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.551 0.529 17919 47463 1 116 . 1 1 35 35 GLY H H 35 8.530 8.530 7.820 0.710 17919 47464 1 116 . 1 1 36 36 ILE N N 36 119.880 119.880 122.882 -3.002 17919 47465 1 116 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.399 0.046 17919 47466 1 116 . 1 1 36 36 ILE C C 36 173.590 173.590 174.538 -0.948 17919 47467 1 116 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.811 -0.061 17919 47468 1 116 . 1 1 36 36 ILE CB C 36 40.580 40.580 36.869 3.711 17919 47469 1 116 . 1 1 36 36 ILE H H 36 6.150 6.150 7.704 -1.554 17919 47470 1 116 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.787 -0.153 17919 47471 1 116 . 1 1 37 37 PRO C C 37 176.940 176.940 176.265 0.675 17919 47472 1 116 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.480 0.180 17919 47473 1 116 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.468 0.382 17919 47474 1 116 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.284 -0.167 17919 47475 1 116 . 1 1 38 38 PRO C C 38 178.320 178.320 178.822 -0.502 17919 47476 1 116 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.510 0.750 17919 47477 1 116 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.900 0.990 17919 47478 1 116 . 1 1 39 39 ASP N N 39 113.380 113.380 117.138 -3.758 17919 47479 1 116 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.313 0.117 17919 47480 1 116 . 1 1 39 39 ASP C C 39 177.090 177.090 177.799 -0.709 17919 47481 1 116 . 1 1 39 39 ASP CA C 39 55.640 55.640 57.171 -1.531 17919 47482 1 116 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.466 -0.926 17919 47483 1 116 . 1 1 39 39 ASP H H 39 8.550 8.550 8.639 -0.089 17919 47484 1 116 . 1 1 40 40 GLN N N 40 116.780 116.780 116.882 -0.102 17919 47485 1 116 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.150 0.314 17919 47486 1 116 . 1 1 40 40 GLN C C 40 175.380 175.380 176.083 -0.703 17919 47487 1 116 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.882 -1.242 17919 47488 1 116 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.348 0.792 17919 47489 1 116 . 1 1 40 40 GLN H H 40 7.820 7.820 7.632 0.188 17919 47490 1 116 . 1 1 41 41 GLN N N 41 117.720 117.720 119.315 -1.595 17919 47491 1 116 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.724 -0.480 17919 47492 1 116 . 1 1 41 41 GLN C C 41 176.300 176.300 175.464 0.836 17919 47493 1 116 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.407 0.063 17919 47494 1 116 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.693 1.957 17919 47495 1 116 . 1 1 41 41 GLN H H 41 7.480 7.480 7.346 0.134 17919 47496 1 116 . 1 1 42 42 ARG N N 42 122.680 122.680 122.294 0.386 17919 47497 1 116 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.706 -0.206 17919 47498 1 116 . 1 1 42 42 ARG C C 42 174.050 174.050 174.261 -0.211 17919 47499 1 116 . 1 1 42 42 ARG CA C 42 55.050 55.050 53.710 1.340 17919 47500 1 116 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.691 -0.941 17919 47501 1 116 . 1 1 42 42 ARG H H 42 8.530 8.530 8.234 0.296 17919 47502 1 116 . 1 1 43 43 LEU N N 43 124.040 124.040 126.055 -2.015 17919 47503 1 116 . 1 1 43 43 LEU C C 43 175.290 175.290 175.258 0.032 17919 47504 1 116 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.413 -1.433 17919 47505 1 116 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.606 2.184 17919 47506 1 116 . 1 1 43 43 LEU H H 43 8.820 8.820 8.954 -0.134 17919 47507 1 116 . 1 1 44 44 ILE N N 44 121.920 121.920 122.858 -0.938 17919 47508 1 116 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.315 -0.323 17919 47509 1 116 . 1 1 44 44 ILE C C 44 176.060 176.060 174.669 1.391 17919 47510 1 116 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.818 -0.838 17919 47511 1 116 . 1 1 44 44 ILE CB C 44 41.420 41.420 40.901 0.519 17919 47512 1 116 . 1 1 44 44 ILE H H 44 9.030 9.030 8.901 0.129 17919 47513 1 116 . 1 1 45 45 PHE N N 45 125.390 125.390 127.393 -2.003 17919 47514 1 116 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.954 0.091 17919 47515 1 116 . 1 1 45 45 PHE C C 45 174.470 174.470 174.113 0.357 17919 47516 1 116 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.495 0.525 17919 47517 1 116 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.142 0.618 17919 47518 1 116 . 1 1 45 45 PHE H H 45 8.830 8.830 9.018 -0.188 17919 47519 1 116 . 1 1 46 46 ALA N N 46 132.200 132.200 128.198 4.002 17919 47520 1 116 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.614 0.076 17919 47521 1 116 . 1 1 46 46 ALA C C 46 177.290 177.290 177.852 -0.562 17919 47522 1 116 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.638 -0.098 17919 47523 1 116 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.599 -0.029 17919 47524 1 116 . 1 1 46 46 ALA H H 46 8.810 8.810 8.772 0.038 17919 47525 1 116 . 1 1 47 47 GLY N N 47 102.340 102.340 103.043 -0.703 17919 47526 1 116 . 1 1 47 47 GLY C C 47 173.810 173.810 174.208 -0.398 17919 47527 1 116 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.086 0.265 17919 47528 1 116 . 1 1 47 47 GLY H H 47 8.130 8.130 8.517 -0.387 17919 47529 1 116 . 1 1 48 48 LYS N N 48 121.570 121.570 120.133 1.437 17919 47530 1 116 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.688 -0.066 17919 47531 1 116 . 1 1 48 48 LYS C C 48 174.700 174.700 175.056 -0.356 17919 47532 1 116 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.331 0.219 17919 47533 1 116 . 1 1 48 48 LYS CB C 48 34.530 34.530 35.302 -0.772 17919 47534 1 116 . 1 1 48 48 LYS H H 48 7.980 7.980 7.779 0.201 17919 47535 1 116 . 1 1 49 49 GLN N N 49 122.410 122.410 122.389 0.021 17919 47536 1 116 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.475 0.085 17919 47537 1 116 . 1 1 49 49 GLN C C 49 175.670 175.670 175.457 0.213 17919 47538 1 116 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.377 -0.637 17919 47539 1 116 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.412 -0.412 17919 47540 1 116 . 1 1 49 49 GLN H H 49 8.600 8.600 8.499 0.101 17919 47541 1 116 . 1 1 50 50 LEU N N 50 125.520 125.520 129.195 -3.675 17919 47542 1 116 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.062 0.028 17919 47543 1 116 . 1 1 50 50 LEU C C 50 176.660 176.660 175.485 1.175 17919 47544 1 116 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.272 -0.032 17919 47545 1 116 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.570 -1.000 17919 47546 1 116 . 1 1 50 50 LEU H H 50 8.530 8.530 8.734 -0.204 17919 47547 1 116 . 1 1 51 51 GLU N N 51 122.940 122.940 123.432 -0.492 17919 47548 1 116 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.536 -0.048 17919 47549 1 116 . 1 1 51 51 GLU C C 51 175.870 175.870 176.580 -0.710 17919 47550 1 116 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.111 0.849 17919 47551 1 116 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.752 -0.182 17919 47552 1 116 . 1 1 51 51 GLU H H 51 8.400 8.400 8.838 -0.438 17919 47553 1 116 . 1 1 52 52 ASP N N 52 120.030 120.030 121.787 -1.757 17919 47554 1 116 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.520 -0.161 17919 47555 1 116 . 1 1 52 52 ASP C C 52 177.330 177.330 177.948 -0.618 17919 47556 1 116 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.221 -0.262 17919 47557 1 116 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.908 -0.058 17919 47558 1 116 . 1 1 52 52 ASP H H 52 8.160 8.160 8.868 -0.708 17919 47559 1 116 . 1 1 53 53 GLY N N 53 106.660 106.660 105.981 0.679 17919 47560 1 116 . 1 1 53 53 GLY C C 53 174.870 174.870 174.281 0.589 17919 47561 1 116 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.856 0.314 17919 47562 1 116 . 1 1 53 53 GLY H H 53 9.390 9.390 8.392 0.998 17919 47563 1 116 . 1 1 54 54 ARG N N 54 119.050 119.050 120.339 -1.289 17919 47564 1 116 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.717 -0.022 17919 47565 1 116 . 1 1 54 54 ARG C C 54 175.350 175.350 175.022 0.328 17919 47566 1 116 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.260 0.130 17919 47567 1 116 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.356 -0.706 17919 47568 1 116 . 1 1 54 54 ARG H H 54 7.460 7.460 7.639 -0.179 17919 47569 1 116 . 1 1 55 55 THR N N 55 108.400 108.400 110.413 -2.013 17919 47570 1 116 . 1 1 55 55 THR HA H 55 5.240 5.240 5.141 0.099 17919 47571 1 116 . 1 1 55 55 THR C C 55 176.560 176.560 175.886 0.674 17919 47572 1 116 . 1 1 55 55 THR CA C 55 59.690 59.690 59.518 0.172 17919 47573 1 116 . 1 1 55 55 THR CB C 55 72.260 72.260 71.954 0.307 17919 47574 1 116 . 1 1 55 55 THR H H 55 8.730 8.730 8.595 0.135 17919 47575 1 116 . 1 1 56 56 LEU N N 56 117.920 117.920 121.005 -3.085 17919 47576 1 116 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.111 -0.051 17919 47577 1 116 . 1 1 56 56 LEU C C 56 180.810 180.810 178.809 2.001 17919 47578 1 116 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.212 0.498 17919 47579 1 116 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.672 -1.302 17919 47580 1 116 . 1 1 56 56 LEU H H 56 8.140 8.140 8.479 -0.339 17919 47581 1 116 . 1 1 57 57 SER N N 57 113.330 113.330 114.882 -1.552 17919 47582 1 116 . 1 1 57 57 SER HA H 57 4.370 4.370 4.022 0.348 17919 47583 1 116 . 1 1 57 57 SER C C 57 178.310 178.310 176.928 1.382 17919 47584 1 116 . 1 1 57 57 SER CA C 57 61.080 61.080 61.823 -0.743 17919 47585 1 116 . 1 1 57 57 SER CB C 57 62.530 62.530 62.851 -0.321 17919 47586 1 116 . 1 1 57 57 SER H H 57 8.470 8.470 7.855 0.615 17919 47587 1 116 . 1 1 58 58 ASP N N 58 124.190 124.190 121.229 2.961 17919 47588 1 116 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.304 -0.008 17919 47589 1 116 . 1 1 58 58 ASP C C 58 177.400 177.400 177.660 -0.260 17919 47590 1 116 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.767 0.413 17919 47591 1 116 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.651 -0.551 17919 47592 1 116 . 1 1 58 58 ASP H H 58 7.930 7.930 7.610 0.320 17919 47593 1 116 . 1 1 59 59 TYR N N 59 115.510 115.510 114.982 0.528 17919 47594 1 116 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.696 -0.026 17919 47595 1 116 . 1 1 59 59 TYR C C 59 174.700 174.700 174.916 -0.216 17919 47596 1 116 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.178 1.072 17919 47597 1 116 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.363 1.707 17919 47598 1 116 . 1 1 59 59 TYR H H 59 7.250 7.250 7.487 -0.237 17919 47599 1 116 . 1 1 60 60 ASN N N 60 115.900 115.900 115.586 0.314 17919 47600 1 116 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.411 -0.056 17919 47601 1 116 . 1 1 60 60 ASN C C 60 174.340 174.340 174.502 -0.162 17919 47602 1 116 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.130 -0.010 17919 47603 1 116 . 1 1 60 60 ASN CB C 60 37.410 37.410 38.026 -0.617 17919 47604 1 116 . 1 1 60 60 ASN H H 60 8.150 8.150 7.736 0.414 17919 47605 1 116 . 1 1 61 61 ILE N N 61 118.600 118.600 119.832 -1.232 17919 47606 1 116 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.762 -0.369 17919 47607 1 116 . 1 1 61 61 ILE C C 61 174.610 174.610 175.653 -1.043 17919 47608 1 116 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.256 1.164 17919 47609 1 116 . 1 1 61 61 ILE CB C 61 36.740 36.740 36.623 0.117 17919 47610 1 116 . 1 1 61 61 ILE H H 61 7.250 7.250 7.767 -0.517 17919 47611 1 116 . 1 1 62 62 GLN N N 62 124.740 124.740 124.095 0.645 17919 47612 1 116 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.612 -0.106 17919 47613 1 116 . 1 1 62 62 GLN C C 62 175.970 175.970 175.232 0.738 17919 47614 1 116 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.833 -0.173 17919 47615 1 116 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.860 -0.210 17919 47616 1 116 . 1 1 62 62 GLN H H 62 7.610 7.610 8.383 -0.773 17919 47617 1 116 . 1 1 63 63 LYS N N 63 120.300 120.300 120.202 0.098 17919 47618 1 116 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.034 -0.033 17919 47619 1 116 . 1 1 63 63 LYS C C 63 175.810 175.810 176.791 -0.981 17919 47620 1 116 . 1 1 63 63 LYS CA C 63 57.790 57.790 56.927 0.863 17919 47621 1 116 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.970 0.680 17919 47622 1 116 . 1 1 63 63 LYS H H 63 8.490 8.490 8.512 -0.022 17919 47623 1 116 . 1 1 64 64 GLU N N 64 113.950 113.950 119.021 -5.071 17919 47624 1 116 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.775 -0.310 17919 47625 1 116 . 1 1 64 64 GLU C C 64 175.250 175.250 175.713 -0.463 17919 47626 1 116 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.729 0.161 17919 47627 1 116 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.110 -2.210 17919 47628 1 116 . 1 1 64 64 GLU H H 64 9.280 9.280 8.691 0.589 17919 47629 1 116 . 1 1 65 65 SER N N 65 114.730 114.730 113.788 0.942 17919 47630 1 116 . 1 1 65 65 SER HA H 65 4.640 4.640 4.689 -0.049 17919 47631 1 116 . 1 1 65 65 SER C C 65 172.160 172.160 173.293 -1.133 17919 47632 1 116 . 1 1 65 65 SER CA C 65 60.890 60.890 57.498 3.392 17919 47633 1 116 . 1 1 65 65 SER CB C 65 64.910 64.910 64.368 0.542 17919 47634 1 116 . 1 1 65 65 SER H H 65 7.670 7.670 7.690 -0.020 17919 47635 1 116 . 1 1 66 66 THR N N 66 117.110 117.110 118.845 -1.735 17919 47636 1 116 . 1 1 66 66 THR HA H 66 5.270 5.270 5.226 0.044 17919 47637 1 116 . 1 1 66 66 THR C C 66 173.950 173.950 173.883 0.067 17919 47638 1 116 . 1 1 66 66 THR CA C 66 62.340 62.340 61.688 0.652 17919 47639 1 116 . 1 1 66 66 THR CB C 66 70.080 70.080 70.321 -0.241 17919 47640 1 116 . 1 1 66 66 THR H H 66 8.730 8.730 8.279 0.451 17919 47641 1 116 . 1 1 67 67 LEU N N 67 127.110 127.110 127.591 -0.481 17919 47642 1 116 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.951 0.109 17919 47643 1 116 . 1 1 67 67 LEU C C 67 175.770 175.770 175.003 0.767 17919 47644 1 116 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.712 0.188 17919 47645 1 116 . 1 1 67 67 LEU CB C 67 44.260 44.260 45.427 -1.167 17919 47646 1 116 . 1 1 67 67 LEU H H 67 9.410 9.410 8.750 0.660 17919 47647 1 116 . 1 1 68 68 HIS N N 68 118.380 118.380 121.437 -3.057 17919 47648 1 116 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.205 0.035 17919 47649 1 116 . 1 1 68 68 HIS C C 68 173.150 173.150 173.987 -0.837 17919 47650 1 116 . 1 1 68 68 HIS CA C 68 55.000 55.000 53.312 1.688 17919 47651 1 116 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.109 -1.579 17919 47652 1 116 . 1 1 68 68 HIS H H 68 9.230 9.230 9.007 0.223 17919 47653 1 116 . 1 1 69 69 LEU N N 69 124.460 124.460 130.658 -6.198 17919 47654 1 116 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.766 0.423 17919 47655 1 116 . 1 1 69 69 LEU C C 69 175.270 175.270 175.150 0.120 17919 47656 1 116 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.481 -0.591 17919 47657 1 116 . 1 1 69 69 LEU CB C 69 44.380 44.380 43.165 1.215 17919 47658 1 116 . 1 1 69 69 LEU H H 69 8.340 8.340 8.035 0.305 17919 47659 1 116 . 1 1 70 70 VAL N N 70 126.940 126.940 121.624 5.316 17919 47660 1 116 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.458 -0.108 17919 47661 1 116 . 1 1 70 70 VAL C C 70 174.000 174.000 174.327 -0.327 17919 47662 1 116 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.367 0.433 17919 47663 1 116 . 1 1 70 70 VAL CB C 70 34.910 34.910 34.375 0.535 17919 47664 1 116 . 1 1 70 70 VAL H H 70 9.200 9.200 8.899 0.301 17919 47665 1 116 . 1 1 71 71 LEU N N 71 123.130 123.130 121.961 1.169 17919 47666 1 116 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.918 0.142 17919 47667 1 116 . 1 1 71 71 LEU C C 71 177.830 177.830 177.308 0.522 17919 47668 1 116 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.334 0.605 17919 47669 1 116 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.052 -0.202 17919 47670 1 116 . 1 1 71 71 LEU H H 71 8.120 8.120 8.343 -0.223 17919 47671 1 116 . 1 1 72 72 ARG N N 72 123.490 123.490 124.630 -1.140 17919 47672 1 116 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.396 -0.095 17919 47673 1 116 . 1 1 72 72 ARG C C 72 175.350 175.350 176.170 -0.820 17919 47674 1 116 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.767 -0.158 17919 47675 1 116 . 1 1 72 72 ARG CB C 72 31.350 31.350 31.059 0.291 17919 47676 1 116 . 1 1 72 72 ARG H H 72 8.580 8.580 8.270 0.310 17919 47677 1 117 . 1 1 2 2 GLN N N 2 123.220 123.220 123.025 0.195 17919 47678 1 117 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.057 0.192 17919 47679 1 117 . 1 1 2 2 GLN C C 2 175.920 175.920 175.247 0.673 17919 47680 1 117 . 1 1 2 2 GLN CA C 2 55.080 55.080 55.574 -0.494 17919 47681 1 117 . 1 1 2 2 GLN CB C 2 30.760 30.760 29.838 0.922 17919 47682 1 117 . 1 1 2 2 GLN H H 2 8.900 8.900 8.485 0.415 17919 47683 1 117 . 1 1 3 3 ILE N N 3 115.340 115.340 119.555 -4.215 17919 47684 1 117 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.249 -0.036 17919 47685 1 117 . 1 1 3 3 ILE C C 3 172.450 172.450 173.398 -0.948 17919 47686 1 117 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.592 -0.022 17919 47687 1 117 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.504 0.706 17919 47688 1 117 . 1 1 3 3 ILE H H 3 8.320 8.320 8.703 -0.383 17919 47689 1 117 . 1 1 4 4 PHE N N 4 118.110 118.110 120.188 -2.078 17919 47690 1 117 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.259 0.371 17919 47691 1 117 . 1 1 4 4 PHE C C 4 175.320 175.320 175.253 0.067 17919 47692 1 117 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.903 -0.693 17919 47693 1 117 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.940 -0.460 17919 47694 1 117 . 1 1 4 4 PHE H H 4 8.610 8.610 8.387 0.223 17919 47695 1 117 . 1 1 5 5 VAL N N 5 121.000 121.000 122.155 -1.155 17919 47696 1 117 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.680 0.045 17919 47697 1 117 . 1 1 5 5 VAL C C 5 174.870 174.870 174.424 0.446 17919 47698 1 117 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.261 -0.642 17919 47699 1 117 . 1 1 5 5 VAL CB C 5 34.230 34.230 35.103 -0.873 17919 47700 1 117 . 1 1 5 5 VAL H H 5 9.300 9.300 8.777 0.523 17919 47701 1 117 . 1 1 6 6 LYS N N 6 127.520 127.520 129.373 -1.853 17919 47702 1 117 . 1 1 6 6 LYS HA H 6 5.367 5.367 4.682 0.685 17919 47703 1 117 . 1 1 6 6 LYS C C 6 177.140 177.140 176.245 0.895 17919 47704 1 117 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.395 0.125 17919 47705 1 117 . 1 1 6 6 LYS CB C 6 35.050 35.050 33.730 1.320 17919 47706 1 117 . 1 1 6 6 LYS H H 6 8.820 8.820 8.936 -0.116 17919 47707 1 117 . 1 1 7 7 THR N N 7 115.400 115.400 117.957 -2.557 17919 47708 1 117 . 1 1 7 7 THR HA H 7 4.970 4.970 4.539 0.431 17919 47709 1 117 . 1 1 7 7 THR C C 7 176.910 176.910 175.819 1.091 17919 47710 1 117 . 1 1 7 7 THR CA C 7 60.470 60.470 60.503 -0.033 17919 47711 1 117 . 1 1 7 7 THR CB C 7 70.630 70.630 70.344 0.286 17919 47712 1 117 . 1 1 7 7 THR H H 7 8.730 8.730 8.137 0.593 17919 47713 1 117 . 1 1 8 8 LEU N N 8 121.330 121.330 119.167 2.163 17919 47714 1 117 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.182 0.128 17919 47715 1 117 . 1 1 8 8 LEU C C 8 178.800 178.800 178.171 0.629 17919 47716 1 117 . 1 1 8 8 LEU CA C 8 57.580 57.580 56.700 0.880 17919 47717 1 117 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.269 -0.299 17919 47718 1 117 . 1 1 8 8 LEU H H 8 9.100 9.100 8.853 0.247 17919 47719 1 117 . 1 1 9 9 THR N N 9 105.590 105.590 108.253 -2.663 17919 47720 1 117 . 1 1 9 9 THR HA H 9 4.428 4.428 4.353 0.075 17919 47721 1 117 . 1 1 9 9 THR C C 9 175.520 175.520 175.645 -0.125 17919 47722 1 117 . 1 1 9 9 THR CA C 9 61.400 61.400 61.761 -0.361 17919 47723 1 117 . 1 1 9 9 THR CB C 9 69.140 69.140 69.265 -0.125 17919 47724 1 117 . 1 1 9 9 THR H H 9 7.630 7.630 7.500 0.130 17919 47725 1 117 . 1 1 10 10 GLY N N 10 108.890 108.890 111.376 -2.486 17919 47726 1 117 . 1 1 10 10 GLY C C 10 174.070 174.070 174.316 -0.246 17919 47727 1 117 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.525 -0.065 17919 47728 1 117 . 1 1 10 10 GLY H H 10 7.810 7.810 8.039 -0.229 17919 47729 1 117 . 1 1 11 11 LYS N N 11 121.600 121.600 122.711 -1.111 17919 47730 1 117 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.206 0.155 17919 47731 1 117 . 1 1 11 11 LYS C C 11 175.940 175.940 175.207 0.733 17919 47732 1 117 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.906 -0.626 17919 47733 1 117 . 1 1 11 11 LYS CB C 11 33.200 33.200 32.623 0.577 17919 47734 1 117 . 1 1 11 11 LYS H H 11 7.280 7.280 7.930 -0.650 17919 47735 1 117 . 1 1 12 12 THR N N 12 120.440 120.440 120.001 0.439 17919 47736 1 117 . 1 1 12 12 THR HA H 12 5.046 5.046 5.242 -0.196 17919 47737 1 117 . 1 1 12 12 THR C C 12 174.320 174.320 174.745 -0.425 17919 47738 1 117 . 1 1 12 12 THR CA C 12 62.390 62.390 61.503 0.887 17919 47739 1 117 . 1 1 12 12 THR CB C 12 69.910 69.910 69.675 0.235 17919 47740 1 117 . 1 1 12 12 THR H H 12 8.650 8.650 8.443 0.207 17919 47741 1 117 . 1 1 13 13 ILE N N 13 127.110 127.110 124.272 2.838 17919 47742 1 117 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.909 -0.365 17919 47743 1 117 . 1 1 13 13 ILE C C 13 175.220 175.220 174.981 0.239 17919 47744 1 117 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.482 0.498 17919 47745 1 117 . 1 1 13 13 ILE CB C 13 40.950 40.950 39.309 1.641 17919 47746 1 117 . 1 1 13 13 ILE H H 13 9.450 9.450 8.724 0.726 17919 47747 1 117 . 1 1 14 14 THR N N 14 121.520 121.520 113.266 8.254 17919 47748 1 117 . 1 1 14 14 THR HA H 14 4.964 4.964 5.216 -0.252 17919 47749 1 117 . 1 1 14 14 THR C C 14 173.790 173.790 173.412 0.378 17919 47750 1 117 . 1 1 14 14 THR CA C 14 61.940 61.940 60.159 1.781 17919 47751 1 117 . 1 1 14 14 THR CB C 14 69.650 69.650 71.542 -1.892 17919 47752 1 117 . 1 1 14 14 THR H H 14 8.710 8.710 8.302 0.408 17919 47753 1 117 . 1 1 15 15 LEU N N 15 124.800 124.800 122.435 2.365 17919 47754 1 117 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.639 0.141 17919 47755 1 117 . 1 1 15 15 LEU C C 15 174.670 174.670 175.547 -0.877 17919 47756 1 117 . 1 1 15 15 LEU CA C 15 52.830 52.830 54.215 -1.385 17919 47757 1 117 . 1 1 15 15 LEU CB C 15 47.070 47.070 46.284 0.786 17919 47758 1 117 . 1 1 15 15 LEU H H 15 8.710 8.710 8.588 0.122 17919 47759 1 117 . 1 1 16 16 GLU N N 16 122.160 122.160 124.734 -2.574 17919 47760 1 117 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.732 0.185 17919 47761 1 117 . 1 1 16 16 GLU C C 16 175.860 175.860 176.334 -0.474 17919 47762 1 117 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.303 -0.483 17919 47763 1 117 . 1 1 16 16 GLU CB C 16 29.450 29.450 29.698 -0.248 17919 47764 1 117 . 1 1 16 16 GLU H H 16 8.140 8.140 8.710 -0.570 17919 47765 1 117 . 1 1 17 17 VAL N N 17 117.210 117.210 120.634 -3.424 17919 47766 1 117 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.395 0.319 17919 47767 1 117 . 1 1 17 17 VAL C C 17 174.160 174.160 174.790 -0.630 17919 47768 1 117 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.885 -0.455 17919 47769 1 117 . 1 1 17 17 VAL CB C 17 36.400 36.400 33.807 2.593 17919 47770 1 117 . 1 1 17 17 VAL H H 17 8.900 8.900 8.650 0.250 17919 47771 1 117 . 1 1 18 18 GLU N N 18 118.990 118.990 119.926 -0.936 17919 47772 1 117 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.832 0.247 17919 47773 1 117 . 1 1 18 18 GLU C C 18 176.160 176.160 176.023 0.137 17919 47774 1 117 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.197 -0.477 17919 47775 1 117 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.852 -0.543 17919 47776 1 117 . 1 1 18 18 GLU H H 18 8.640 8.640 8.522 0.118 17919 47777 1 117 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.296 -0.155 17919 47778 1 117 . 1 1 19 19 PRO C C 19 175.310 175.310 177.137 -1.827 17919 47779 1 117 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.242 0.228 17919 47780 1 117 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.063 -0.113 17919 47781 1 117 . 1 1 20 20 SER N N 20 103.400 103.400 111.570 -8.170 17919 47782 1 117 . 1 1 20 20 SER HA H 20 4.370 4.370 4.373 -0.003 17919 47783 1 117 . 1 1 20 20 SER C C 20 174.660 174.660 173.924 0.736 17919 47784 1 117 . 1 1 20 20 SER CA C 20 57.400 57.400 59.043 -1.643 17919 47785 1 117 . 1 1 20 20 SER CB C 20 63.370 63.370 62.315 1.055 17919 47786 1 117 . 1 1 20 20 SER H H 20 7.040 7.040 7.982 -0.942 17919 47787 1 117 . 1 1 21 21 ASP N N 21 123.480 123.480 123.678 -0.198 17919 47788 1 117 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.521 0.174 17919 47789 1 117 . 1 1 21 21 ASP C C 21 176.360 176.360 175.371 0.989 17919 47790 1 117 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.143 0.557 17919 47791 1 117 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.488 -0.688 17919 47792 1 117 . 1 1 21 21 ASP H H 21 8.030 8.030 7.558 0.472 17919 47793 1 117 . 1 1 22 22 THR N N 22 108.800 108.800 118.179 -9.379 17919 47794 1 117 . 1 1 22 22 THR HA H 22 4.920 4.920 4.630 0.290 17919 47795 1 117 . 1 1 22 22 THR C C 22 176.750 176.750 175.754 0.996 17919 47796 1 117 . 1 1 22 22 THR CA C 22 59.690 59.690 61.968 -2.278 17919 47797 1 117 . 1 1 22 22 THR CB C 22 71.200 71.200 69.370 1.830 17919 47798 1 117 . 1 1 22 22 THR H H 22 7.900 7.900 8.289 -0.389 17919 47799 1 117 . 1 1 23 23 ILE N N 23 121.190 121.190 122.675 -1.485 17919 47800 1 117 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.756 -0.099 17919 47801 1 117 . 1 1 23 23 ILE C C 23 179.040 179.040 177.881 1.159 17919 47802 1 117 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.530 -0.270 17919 47803 1 117 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.460 -2.110 17919 47804 1 117 . 1 1 23 23 ILE H H 23 8.560 8.560 8.889 -0.329 17919 47805 1 117 . 1 1 24 24 GLU N N 24 120.830 120.830 119.910 0.920 17919 47806 1 117 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.929 -0.012 17919 47807 1 117 . 1 1 24 24 GLU C C 24 178.640 178.640 178.284 0.356 17919 47808 1 117 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.246 0.974 17919 47809 1 117 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.118 -0.838 17919 47810 1 117 . 1 1 24 24 GLU H H 24 9.760 9.760 8.039 1.721 17919 47811 1 117 . 1 1 25 25 ASN N N 25 120.570 120.570 117.365 3.205 17919 47812 1 117 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.499 0.026 17919 47813 1 117 . 1 1 25 25 ASN C C 25 178.380 178.380 178.019 0.361 17919 47814 1 117 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.036 0.024 17919 47815 1 117 . 1 1 25 25 ASN CB C 25 38.450 38.450 37.861 0.589 17919 47816 1 117 . 1 1 25 25 ASN H H 25 7.920 7.920 8.256 -0.336 17919 47817 1 117 . 1 1 26 26 VAL N N 26 121.710 121.710 121.668 0.042 17919 47818 1 117 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.583 -0.186 17919 47819 1 117 . 1 1 26 26 VAL C C 26 177.950 177.950 177.748 0.202 17919 47820 1 117 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.866 0.794 17919 47821 1 117 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.372 -0.531 17919 47822 1 117 . 1 1 26 26 VAL H H 26 8.070 8.070 7.974 0.096 17919 47823 1 117 . 1 1 27 27 LYS N N 27 118.860 118.860 118.945 -0.085 17919 47824 1 117 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.320 0.260 17919 47825 1 117 . 1 1 27 27 LYS C C 27 180.550 180.550 178.665 1.885 17919 47826 1 117 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.247 0.003 17919 47827 1 117 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.307 1.423 17919 47828 1 117 . 1 1 27 27 LYS H H 27 8.560 8.560 7.637 0.923 17919 47829 1 117 . 1 1 28 28 ALA N N 28 123.440 123.440 120.400 3.040 17919 47830 1 117 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.215 -0.055 17919 47831 1 117 . 1 1 28 28 ALA C C 28 180.300 180.300 178.729 1.571 17919 47832 1 117 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.227 1.143 17919 47833 1 117 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.453 -0.744 17919 47834 1 117 . 1 1 28 28 ALA H H 28 8.060 8.060 7.707 0.353 17919 47835 1 117 . 1 1 29 29 LYS N N 29 119.940 119.940 120.694 -0.754 17919 47836 1 117 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.009 0.198 17919 47837 1 117 . 1 1 29 29 LYS C C 29 180.320 180.320 179.191 1.129 17919 47838 1 117 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.310 0.340 17919 47839 1 117 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.236 1.054 17919 47840 1 117 . 1 1 29 29 LYS H H 29 7.850 7.850 7.537 0.313 17919 47841 1 117 . 1 1 30 30 ILE N N 30 121.080 121.080 120.063 1.017 17919 47842 1 117 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.525 -0.018 17919 47843 1 117 . 1 1 30 30 ILE C C 30 178.310 178.310 177.447 0.863 17919 47844 1 117 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.052 1.097 17919 47845 1 117 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.429 -0.629 17919 47846 1 117 . 1 1 30 30 ILE H H 30 8.280 8.280 8.152 0.128 17919 47847 1 117 . 1 1 31 31 GLN N N 31 123.490 123.490 119.085 4.405 17919 47848 1 117 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.892 -0.063 17919 47849 1 117 . 1 1 31 31 GLN C C 31 178.890 178.890 178.007 0.883 17919 47850 1 117 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.528 0.472 17919 47851 1 117 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.377 -0.657 17919 47852 1 117 . 1 1 31 31 GLN H H 31 8.580 8.580 7.854 0.726 17919 47853 1 117 . 1 1 32 32 ASP N N 32 119.360 119.360 118.588 0.772 17919 47854 1 117 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.543 -0.189 17919 47855 1 117 . 1 1 32 32 ASP C C 32 177.250 177.250 177.319 -0.069 17919 47856 1 117 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.071 1.119 17919 47857 1 117 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.306 0.275 17919 47858 1 117 . 1 1 32 32 ASP H H 32 8.010 8.010 7.824 0.186 17919 47859 1 117 . 1 1 33 33 LYS N N 33 115.130 115.130 119.215 -4.085 17919 47860 1 117 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.334 0.003 17919 47861 1 117 . 1 1 33 33 LYS C C 33 177.870 177.870 178.307 -0.437 17919 47862 1 117 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.976 0.074 17919 47863 1 117 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.727 0.443 17919 47864 1 117 . 1 1 33 33 LYS H H 33 7.430 7.430 7.565 -0.135 17919 47865 1 117 . 1 1 34 34 GLU N N 34 113.870 113.870 116.822 -2.952 17919 47866 1 117 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.388 0.237 17919 47867 1 117 . 1 1 34 34 GLU C C 34 177.840 177.840 177.664 0.176 17919 47868 1 117 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.602 -1.431 17919 47869 1 117 . 1 1 34 34 GLU CB C 34 32.660 32.660 30.662 1.998 17919 47870 1 117 . 1 1 34 34 GLU H H 34 8.740 8.740 7.942 0.798 17919 47871 1 117 . 1 1 35 35 GLY N N 35 108.650 108.650 109.321 -0.671 17919 47872 1 117 . 1 1 35 35 GLY C C 35 173.960 173.960 174.266 -0.306 17919 47873 1 117 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.961 0.119 17919 47874 1 117 . 1 1 35 35 GLY H H 35 8.530 8.530 8.330 0.200 17919 47875 1 117 . 1 1 36 36 ILE N N 36 119.880 119.880 122.265 -2.385 17919 47876 1 117 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.311 0.134 17919 47877 1 117 . 1 1 36 36 ILE C C 36 173.590 173.590 174.371 -0.781 17919 47878 1 117 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.988 -0.238 17919 47879 1 117 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.569 2.011 17919 47880 1 117 . 1 1 36 36 ILE H H 36 6.150 6.150 7.659 -1.509 17919 47881 1 117 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.835 -0.201 17919 47882 1 117 . 1 1 37 37 PRO C C 37 176.940 176.940 176.354 0.586 17919 47883 1 117 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.034 0.626 17919 47884 1 117 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.605 0.245 17919 47885 1 117 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.278 -0.161 17919 47886 1 117 . 1 1 38 38 PRO C C 38 178.320 178.320 177.109 1.211 17919 47887 1 117 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.347 0.914 17919 47888 1 117 . 1 1 38 38 PRO CB C 38 32.890 32.890 32.031 0.859 17919 47889 1 117 . 1 1 39 39 ASP N N 39 113.380 113.380 115.990 -2.610 17919 47890 1 117 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.388 0.042 17919 47891 1 117 . 1 1 39 39 ASP C C 39 177.090 177.090 177.282 -0.192 17919 47892 1 117 . 1 1 39 39 ASP CA C 39 55.640 55.640 55.995 -0.354 17919 47893 1 117 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.565 -1.025 17919 47894 1 117 . 1 1 39 39 ASP H H 39 8.550 8.550 8.228 0.322 17919 47895 1 117 . 1 1 40 40 GLN N N 40 116.780 116.780 116.450 0.330 17919 47896 1 117 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.301 0.163 17919 47897 1 117 . 1 1 40 40 GLN C C 40 175.380 175.380 175.835 -0.455 17919 47898 1 117 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.748 -1.108 17919 47899 1 117 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.834 0.306 17919 47900 1 117 . 1 1 40 40 GLN H H 40 7.820 7.820 7.869 -0.049 17919 47901 1 117 . 1 1 41 41 GLN N N 41 117.720 117.720 119.900 -2.180 17919 47902 1 117 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.365 -0.121 17919 47903 1 117 . 1 1 41 41 GLN C C 41 176.300 176.300 175.583 0.717 17919 47904 1 117 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.135 0.335 17919 47905 1 117 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.165 2.485 17919 47906 1 117 . 1 1 41 41 GLN H H 41 7.480 7.480 7.223 0.257 17919 47907 1 117 . 1 1 42 42 ARG N N 42 122.680 122.680 126.749 -4.069 17919 47908 1 117 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.632 -0.132 17919 47909 1 117 . 1 1 42 42 ARG C C 42 174.050 174.050 174.573 -0.523 17919 47910 1 117 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.902 0.148 17919 47911 1 117 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.868 -1.118 17919 47912 1 117 . 1 1 42 42 ARG H H 42 8.530 8.530 8.084 0.446 17919 47913 1 117 . 1 1 43 43 LEU N N 43 124.040 124.040 123.048 0.992 17919 47914 1 117 . 1 1 43 43 LEU C C 43 175.290 175.290 175.160 0.130 17919 47915 1 117 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.534 -0.554 17919 47916 1 117 . 1 1 43 43 LEU CB C 43 45.790 45.790 45.706 0.084 17919 47917 1 117 . 1 1 43 43 LEU H H 43 8.820 8.820 8.621 0.199 17919 47918 1 117 . 1 1 44 44 ILE N N 44 121.920 121.920 120.808 1.112 17919 47919 1 117 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.149 -0.157 17919 47920 1 117 . 1 1 44 44 ILE C C 44 176.060 176.060 174.918 1.142 17919 47921 1 117 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.057 -0.077 17919 47922 1 117 . 1 1 44 44 ILE CB C 44 41.420 41.420 40.407 1.013 17919 47923 1 117 . 1 1 44 44 ILE H H 44 9.030 9.030 8.185 0.845 17919 47924 1 117 . 1 1 45 45 PHE N N 45 125.390 125.390 127.102 -1.712 17919 47925 1 117 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.913 0.132 17919 47926 1 117 . 1 1 45 45 PHE C C 45 174.470 174.470 174.308 0.162 17919 47927 1 117 . 1 1 45 45 PHE CA C 45 57.020 57.020 57.077 -0.057 17919 47928 1 117 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.361 0.399 17919 47929 1 117 . 1 1 45 45 PHE H H 45 8.830 8.830 9.064 -0.234 17919 47930 1 117 . 1 1 46 46 ALA N N 46 132.200 132.200 127.602 4.598 17919 47931 1 117 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.729 -0.039 17919 47932 1 117 . 1 1 46 46 ALA C C 46 177.290 177.290 178.448 -1.158 17919 47933 1 117 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.791 -0.251 17919 47934 1 117 . 1 1 46 46 ALA CB C 46 16.570 16.570 17.203 -0.633 17919 47935 1 117 . 1 1 46 46 ALA H H 46 8.810 8.810 8.524 0.286 17919 47936 1 117 . 1 1 47 47 GLY N N 47 102.340 102.340 102.967 -0.627 17919 47937 1 117 . 1 1 47 47 GLY C C 47 173.810 173.810 174.383 -0.573 17919 47938 1 117 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.333 0.017 17919 47939 1 117 . 1 1 47 47 GLY H H 47 8.130 8.130 8.605 -0.475 17919 47940 1 117 . 1 1 48 48 LYS N N 48 121.570 121.570 120.434 1.136 17919 47941 1 117 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.676 -0.054 17919 47942 1 117 . 1 1 48 48 LYS C C 48 174.700 174.700 175.321 -0.621 17919 47943 1 117 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.874 -0.324 17919 47944 1 117 . 1 1 48 48 LYS CB C 48 34.530 34.530 35.084 -0.554 17919 47945 1 117 . 1 1 48 48 LYS H H 48 7.980 7.980 7.939 0.041 17919 47946 1 117 . 1 1 49 49 GLN N N 49 122.410 122.410 122.441 -0.031 17919 47947 1 117 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.665 -0.105 17919 47948 1 117 . 1 1 49 49 GLN C C 49 175.670 175.670 175.890 -0.220 17919 47949 1 117 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.777 -0.037 17919 47950 1 117 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.892 -0.892 17919 47951 1 117 . 1 1 49 49 GLN H H 49 8.600 8.600 8.761 -0.161 17919 47952 1 117 . 1 1 50 50 LEU N N 50 125.520 125.520 126.415 -0.895 17919 47953 1 117 . 1 1 50 50 LEU HA H 50 4.090 4.090 3.545 0.545 17919 47954 1 117 . 1 1 50 50 LEU C C 50 176.660 176.660 175.970 0.690 17919 47955 1 117 . 1 1 50 50 LEU CA C 50 54.240 54.240 55.909 -1.669 17919 47956 1 117 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.357 -0.787 17919 47957 1 117 . 1 1 50 50 LEU H H 50 8.530 8.530 8.153 0.377 17919 47958 1 117 . 1 1 51 51 GLU N N 51 122.940 122.940 120.781 2.159 17919 47959 1 117 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.481 0.007 17919 47960 1 117 . 1 1 51 51 GLU C C 51 175.870 175.870 176.528 -0.658 17919 47961 1 117 . 1 1 51 51 GLU CA C 51 55.960 55.960 54.842 1.118 17919 47962 1 117 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.150 -0.580 17919 47963 1 117 . 1 1 51 51 GLU H H 51 8.400 8.400 8.350 0.050 17919 47964 1 117 . 1 1 52 52 ASP N N 52 120.030 120.030 126.051 -6.021 17919 47965 1 117 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.387 -0.028 17919 47966 1 117 . 1 1 52 52 ASP C C 52 177.330 177.330 176.910 0.420 17919 47967 1 117 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.075 -0.115 17919 47968 1 117 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.986 -0.136 17919 47969 1 117 . 1 1 52 52 ASP H H 52 8.160 8.160 8.922 -0.762 17919 47970 1 117 . 1 1 53 53 GLY N N 53 106.660 106.660 105.359 1.301 17919 47971 1 117 . 1 1 53 53 GLY C C 53 174.870 174.870 174.050 0.820 17919 47972 1 117 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.430 0.740 17919 47973 1 117 . 1 1 53 53 GLY H H 53 9.390 9.390 8.314 1.076 17919 47974 1 117 . 1 1 54 54 ARG N N 54 119.050 119.050 120.905 -1.855 17919 47975 1 117 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.585 0.110 17919 47976 1 117 . 1 1 54 54 ARG C C 54 175.350 175.350 175.436 -0.086 17919 47977 1 117 . 1 1 54 54 ARG CA C 54 54.390 54.390 55.192 -0.802 17919 47978 1 117 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.002 0.648 17919 47979 1 117 . 1 1 54 54 ARG H H 54 7.460 7.460 7.990 -0.530 17919 47980 1 117 . 1 1 55 55 THR N N 55 108.400 108.400 110.898 -2.498 17919 47981 1 117 . 1 1 55 55 THR HA H 55 5.240 5.240 5.013 0.227 17919 47982 1 117 . 1 1 55 55 THR C C 55 176.560 176.560 176.110 0.450 17919 47983 1 117 . 1 1 55 55 THR CA C 55 59.690 59.690 59.803 -0.113 17919 47984 1 117 . 1 1 55 55 THR CB C 55 72.260 72.260 71.418 0.842 17919 47985 1 117 . 1 1 55 55 THR H H 55 8.730 8.730 8.844 -0.114 17919 47986 1 117 . 1 1 56 56 LEU N N 56 117.920 117.920 120.896 -2.976 17919 47987 1 117 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.922 0.138 17919 47988 1 117 . 1 1 56 56 LEU C C 56 180.810 180.810 178.501 2.309 17919 47989 1 117 . 1 1 56 56 LEU CA C 56 58.710 58.710 57.980 0.730 17919 47990 1 117 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.291 -0.921 17919 47991 1 117 . 1 1 56 56 LEU H H 56 8.140 8.140 8.403 -0.263 17919 47992 1 117 . 1 1 57 57 SER N N 57 113.330 113.330 115.983 -2.653 17919 47993 1 117 . 1 1 57 57 SER HA H 57 4.370 4.370 4.110 0.260 17919 47994 1 117 . 1 1 57 57 SER C C 57 178.310 178.310 176.728 1.582 17919 47995 1 117 . 1 1 57 57 SER CA C 57 61.080 61.080 61.789 -0.709 17919 47996 1 117 . 1 1 57 57 SER CB C 57 62.530 62.530 62.282 0.248 17919 47997 1 117 . 1 1 57 57 SER H H 57 8.470 8.470 8.167 0.303 17919 47998 1 117 . 1 1 58 58 ASP N N 58 124.190 124.190 121.693 2.497 17919 47999 1 117 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.397 -0.101 17919 48000 1 117 . 1 1 58 58 ASP C C 58 177.400 177.400 176.958 0.442 17919 48001 1 117 . 1 1 58 58 ASP CA C 58 57.180 57.180 57.003 0.177 17919 48002 1 117 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.763 -0.663 17919 48003 1 117 . 1 1 58 58 ASP H H 58 7.930 7.930 8.014 -0.084 17919 48004 1 117 . 1 1 59 59 TYR N N 59 115.510 115.510 115.010 0.500 17919 48005 1 117 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.586 0.084 17919 48006 1 117 . 1 1 59 59 TYR C C 59 174.700 174.700 175.769 -1.069 17919 48007 1 117 . 1 1 59 59 TYR CA C 59 58.250 58.250 58.090 0.160 17919 48008 1 117 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.517 1.552 17919 48009 1 117 . 1 1 59 59 TYR H H 59 7.250 7.250 7.463 -0.213 17919 48010 1 117 . 1 1 60 60 ASN N N 60 115.900 115.900 117.226 -1.326 17919 48011 1 117 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.348 0.007 17919 48012 1 117 . 1 1 60 60 ASN C C 60 174.340 174.340 174.443 -0.103 17919 48013 1 117 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.266 -0.146 17919 48014 1 117 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.300 0.110 17919 48015 1 117 . 1 1 60 60 ASN H H 60 8.150 8.150 7.925 0.225 17919 48016 1 117 . 1 1 61 61 ILE N N 61 118.600 118.600 119.938 -1.338 17919 48017 1 117 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.480 -0.087 17919 48018 1 117 . 1 1 61 61 ILE C C 61 174.610 174.610 175.103 -0.493 17919 48019 1 117 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.296 0.124 17919 48020 1 117 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.144 -0.404 17919 48021 1 117 . 1 1 61 61 ILE H H 61 7.250 7.250 7.947 -0.697 17919 48022 1 117 . 1 1 62 62 GLN N N 62 124.740 124.740 126.137 -1.397 17919 48023 1 117 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.632 -0.126 17919 48024 1 117 . 1 1 62 62 GLN C C 62 175.970 175.970 175.587 0.383 17919 48025 1 117 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.487 0.173 17919 48026 1 117 . 1 1 62 62 GLN CB C 62 31.650 31.650 32.274 -0.624 17919 48027 1 117 . 1 1 62 62 GLN H H 62 7.610 7.610 7.910 -0.300 17919 48028 1 117 . 1 1 63 63 LYS N N 63 120.300 120.300 121.408 -1.108 17919 48029 1 117 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.936 0.065 17919 48030 1 117 . 1 1 63 63 LYS C C 63 175.810 175.810 177.021 -1.211 17919 48031 1 117 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.532 0.258 17919 48032 1 117 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.659 0.991 17919 48033 1 117 . 1 1 63 63 LYS H H 63 8.490 8.490 8.707 -0.217 17919 48034 1 117 . 1 1 64 64 GLU N N 64 113.950 113.950 119.898 -5.948 17919 48035 1 117 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.608 -0.143 17919 48036 1 117 . 1 1 64 64 GLU C C 64 175.250 175.250 175.949 -0.699 17919 48037 1 117 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.610 0.280 17919 48038 1 117 . 1 1 64 64 GLU CB C 64 25.900 25.900 27.989 -2.089 17919 48039 1 117 . 1 1 64 64 GLU H H 64 9.280 9.280 8.951 0.329 17919 48040 1 117 . 1 1 65 65 SER N N 65 114.730 114.730 114.661 0.069 17919 48041 1 117 . 1 1 65 65 SER HA H 65 4.640 4.640 4.538 0.102 17919 48042 1 117 . 1 1 65 65 SER C C 65 172.160 172.160 174.213 -2.053 17919 48043 1 117 . 1 1 65 65 SER CA C 65 60.890 60.890 60.283 0.607 17919 48044 1 117 . 1 1 65 65 SER CB C 65 64.910 64.910 64.079 0.831 17919 48045 1 117 . 1 1 65 65 SER H H 65 7.670 7.670 7.563 0.107 17919 48046 1 117 . 1 1 66 66 THR N N 66 117.110 117.110 117.046 0.064 17919 48047 1 117 . 1 1 66 66 THR HA H 66 5.270 5.270 4.836 0.434 17919 48048 1 117 . 1 1 66 66 THR C C 66 173.950 173.950 173.924 0.026 17919 48049 1 117 . 1 1 66 66 THR CA C 66 62.340 62.340 62.305 0.035 17919 48050 1 117 . 1 1 66 66 THR CB C 66 70.080 70.080 70.258 -0.178 17919 48051 1 117 . 1 1 66 66 THR H H 66 8.730 8.730 8.574 0.156 17919 48052 1 117 . 1 1 67 67 LEU N N 67 127.110 127.110 128.569 -1.459 17919 48053 1 117 . 1 1 67 67 LEU HA H 67 5.060 5.060 5.002 0.058 17919 48054 1 117 . 1 1 67 67 LEU C C 67 175.770 175.770 175.792 -0.022 17919 48055 1 117 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.551 0.349 17919 48056 1 117 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.513 -0.253 17919 48057 1 117 . 1 1 67 67 LEU H H 67 9.410 9.410 8.859 0.551 17919 48058 1 117 . 1 1 68 68 HIS N N 68 118.380 118.380 124.163 -5.783 17919 48059 1 117 . 1 1 68 68 HIS HA H 68 5.240 5.240 4.668 0.572 17919 48060 1 117 . 1 1 68 68 HIS C C 68 173.150 173.150 174.316 -1.166 17919 48061 1 117 . 1 1 68 68 HIS CA C 68 55.000 55.000 55.073 -0.073 17919 48062 1 117 . 1 1 68 68 HIS CB C 68 30.530 30.530 29.785 0.745 17919 48063 1 117 . 1 1 68 68 HIS H H 68 9.230 9.230 8.385 0.845 17919 48064 1 117 . 1 1 69 69 LEU N N 69 124.460 124.460 131.145 -6.685 17919 48065 1 117 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.546 0.644 17919 48066 1 117 . 1 1 69 69 LEU C C 69 175.270 175.270 174.767 0.503 17919 48067 1 117 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.743 -0.853 17919 48068 1 117 . 1 1 69 69 LEU CB C 69 44.380 44.380 42.770 1.610 17919 48069 1 117 . 1 1 69 69 LEU H H 69 8.340 8.340 7.850 0.490 17919 48070 1 117 . 1 1 70 70 VAL N N 70 126.940 126.940 121.845 5.095 17919 48071 1 117 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.498 -0.148 17919 48072 1 117 . 1 1 70 70 VAL C C 70 174.000 174.000 174.379 -0.379 17919 48073 1 117 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.171 1.629 17919 48074 1 117 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.099 -0.189 17919 48075 1 117 . 1 1 70 70 VAL H H 70 9.200 9.200 7.993 1.207 17919 48076 1 117 . 1 1 71 71 LEU N N 71 123.130 123.130 119.976 3.154 17919 48077 1 117 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.600 0.460 17919 48078 1 117 . 1 1 71 71 LEU C C 71 177.830 177.830 177.225 0.605 17919 48079 1 117 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.763 0.177 17919 48080 1 117 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.243 0.607 17919 48081 1 117 . 1 1 71 71 LEU H H 71 8.120 8.120 8.204 -0.084 17919 48082 1 117 . 1 1 72 72 ARG N N 72 123.490 123.490 122.813 0.677 17919 48083 1 117 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.256 0.045 17919 48084 1 117 . 1 1 72 72 ARG C C 72 175.350 175.350 175.083 0.267 17919 48085 1 117 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.570 -0.960 17919 48086 1 117 . 1 1 72 72 ARG CB C 72 31.350 31.350 31.277 0.073 17919 48087 1 117 . 1 1 72 72 ARG H H 72 8.580 8.580 8.532 0.048 17919 48088 1 118 . 1 1 2 2 GLN N N 2 123.220 123.220 123.234 -0.014 17919 48089 1 118 . 1 1 2 2 GLN HA H 2 5.249 5.249 4.862 0.387 17919 48090 1 118 . 1 1 2 2 GLN C C 2 175.920 175.920 174.567 1.353 17919 48091 1 118 . 1 1 2 2 GLN CA C 2 55.080 55.080 55.879 -0.798 17919 48092 1 118 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.394 0.366 17919 48093 1 118 . 1 1 2 2 GLN H H 2 8.900 8.900 8.557 0.343 17919 48094 1 118 . 1 1 3 3 ILE N N 3 115.340 115.340 118.415 -3.075 17919 48095 1 118 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.128 0.085 17919 48096 1 118 . 1 1 3 3 ILE C C 3 172.450 172.450 173.375 -0.925 17919 48097 1 118 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.299 0.271 17919 48098 1 118 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.460 0.750 17919 48099 1 118 . 1 1 3 3 ILE H H 3 8.320 8.320 8.413 -0.093 17919 48100 1 118 . 1 1 4 4 PHE N N 4 118.110 118.110 121.499 -3.389 17919 48101 1 118 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.445 0.185 17919 48102 1 118 . 1 1 4 4 PHE C C 4 175.320 175.320 175.597 -0.277 17919 48103 1 118 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.074 0.136 17919 48104 1 118 . 1 1 4 4 PHE CB C 4 41.480 41.480 40.758 0.722 17919 48105 1 118 . 1 1 4 4 PHE H H 4 8.610 8.610 7.665 0.945 17919 48106 1 118 . 1 1 5 5 VAL N N 5 121.000 121.000 122.092 -1.092 17919 48107 1 118 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.705 0.020 17919 48108 1 118 . 1 1 5 5 VAL C C 5 174.870 174.870 174.469 0.401 17919 48109 1 118 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.291 -0.671 17919 48110 1 118 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.028 0.202 17919 48111 1 118 . 1 1 5 5 VAL H H 5 9.300 9.300 8.696 0.604 17919 48112 1 118 . 1 1 6 6 LYS N N 6 127.520 127.520 128.900 -1.380 17919 48113 1 118 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.426 -0.059 17919 48114 1 118 . 1 1 6 6 LYS C C 6 177.140 177.140 175.975 1.165 17919 48115 1 118 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.012 0.508 17919 48116 1 118 . 1 1 6 6 LYS CB C 6 35.050 35.050 36.483 -1.433 17919 48117 1 118 . 1 1 6 6 LYS H H 6 8.820 8.820 9.007 -0.187 17919 48118 1 118 . 1 1 7 7 THR N N 7 115.400 115.400 116.393 -0.993 17919 48119 1 118 . 1 1 7 7 THR HA H 7 4.970 4.970 4.493 0.477 17919 48120 1 118 . 1 1 7 7 THR C C 7 176.910 176.910 176.490 0.420 17919 48121 1 118 . 1 1 7 7 THR CA C 7 60.470 60.470 60.546 -0.076 17919 48122 1 118 . 1 1 7 7 THR CB C 7 70.630 70.630 70.982 -0.352 17919 48123 1 118 . 1 1 7 7 THR H H 7 8.730 8.730 8.909 -0.179 17919 48124 1 118 . 1 1 8 8 LEU N N 8 121.330 121.330 118.828 2.502 17919 48125 1 118 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.371 -0.061 17919 48126 1 118 . 1 1 8 8 LEU C C 8 178.800 178.800 177.663 1.137 17919 48127 1 118 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.907 -0.327 17919 48128 1 118 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.395 0.575 17919 48129 1 118 . 1 1 8 8 LEU H H 8 9.100 9.100 8.369 0.731 17919 48130 1 118 . 1 1 9 9 THR N N 9 105.590 105.590 108.910 -3.320 17919 48131 1 118 . 1 1 9 9 THR HA H 9 4.428 4.428 4.296 0.132 17919 48132 1 118 . 1 1 9 9 THR C C 9 175.520 175.520 175.446 0.074 17919 48133 1 118 . 1 1 9 9 THR CA C 9 61.400 61.400 62.118 -0.718 17919 48134 1 118 . 1 1 9 9 THR CB C 9 69.140 69.140 68.903 0.236 17919 48135 1 118 . 1 1 9 9 THR H H 9 7.630 7.630 8.045 -0.415 17919 48136 1 118 . 1 1 10 10 GLY N N 10 108.890 108.890 111.127 -2.237 17919 48137 1 118 . 1 1 10 10 GLY C C 10 174.070 174.070 173.889 0.181 17919 48138 1 118 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.100 0.360 17919 48139 1 118 . 1 1 10 10 GLY H H 10 7.810 7.810 8.017 -0.207 17919 48140 1 118 . 1 1 11 11 LYS N N 11 121.600 121.600 120.478 1.122 17919 48141 1 118 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.645 -0.284 17919 48142 1 118 . 1 1 11 11 LYS C C 11 175.940 175.940 175.754 0.186 17919 48143 1 118 . 1 1 11 11 LYS CA C 11 56.280 56.280 54.969 1.311 17919 48144 1 118 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.853 -0.653 17919 48145 1 118 . 1 1 11 11 LYS H H 11 7.280 7.280 7.687 -0.407 17919 48146 1 118 . 1 1 12 12 THR N N 12 120.440 120.440 118.453 1.987 17919 48147 1 118 . 1 1 12 12 THR HA H 12 5.046 5.046 4.725 0.321 17919 48148 1 118 . 1 1 12 12 THR C C 12 174.320 174.320 174.153 0.167 17919 48149 1 118 . 1 1 12 12 THR CA C 12 62.390 62.390 61.986 0.404 17919 48150 1 118 . 1 1 12 12 THR CB C 12 69.910 69.910 69.776 0.134 17919 48151 1 118 . 1 1 12 12 THR H H 12 8.650 8.650 8.401 0.249 17919 48152 1 118 . 1 1 13 13 ILE N N 13 127.110 127.110 126.599 0.511 17919 48153 1 118 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.544 -0.000 17919 48154 1 118 . 1 1 13 13 ILE C C 13 175.220 175.220 174.672 0.548 17919 48155 1 118 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.309 -0.329 17919 48156 1 118 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.530 0.420 17919 48157 1 118 . 1 1 13 13 ILE H H 13 9.450 9.450 8.920 0.530 17919 48158 1 118 . 1 1 14 14 THR N N 14 121.520 121.520 122.709 -1.189 17919 48159 1 118 . 1 1 14 14 THR HA H 14 4.964 4.964 5.037 -0.073 17919 48160 1 118 . 1 1 14 14 THR C C 14 173.790 173.790 173.987 -0.197 17919 48161 1 118 . 1 1 14 14 THR CA C 14 61.940 61.940 61.962 -0.022 17919 48162 1 118 . 1 1 14 14 THR CB C 14 69.650 69.650 69.679 -0.029 17919 48163 1 118 . 1 1 14 14 THR H H 14 8.710 8.710 8.395 0.315 17919 48164 1 118 . 1 1 15 15 LEU N N 15 124.800 124.800 129.310 -4.510 17919 48165 1 118 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.691 0.089 17919 48166 1 118 . 1 1 15 15 LEU C C 15 174.670 174.670 174.987 -0.317 17919 48167 1 118 . 1 1 15 15 LEU CA C 15 52.830 52.830 54.004 -1.174 17919 48168 1 118 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.462 1.608 17919 48169 1 118 . 1 1 15 15 LEU H H 15 8.710 8.710 8.604 0.106 17919 48170 1 118 . 1 1 16 16 GLU N N 16 122.160 122.160 124.644 -2.484 17919 48171 1 118 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.424 0.493 17919 48172 1 118 . 1 1 16 16 GLU C C 16 175.860 175.860 175.573 0.287 17919 48173 1 118 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.680 -0.860 17919 48174 1 118 . 1 1 16 16 GLU CB C 16 29.450 29.450 29.508 -0.058 17919 48175 1 118 . 1 1 16 16 GLU H H 16 8.140 8.140 8.565 -0.425 17919 48176 1 118 . 1 1 17 17 VAL N N 17 117.210 117.210 118.765 -1.555 17919 48177 1 118 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.587 0.127 17919 48178 1 118 . 1 1 17 17 VAL C C 17 174.160 174.160 174.700 -0.540 17919 48179 1 118 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.420 -0.990 17919 48180 1 118 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.115 1.285 17919 48181 1 118 . 1 1 17 17 VAL H H 17 8.900 8.900 8.141 0.759 17919 48182 1 118 . 1 1 18 18 GLU N N 18 118.990 118.990 120.045 -1.055 17919 48183 1 118 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.950 0.129 17919 48184 1 118 . 1 1 18 18 GLU C C 18 176.160 176.160 175.338 0.822 17919 48185 1 118 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.049 -0.329 17919 48186 1 118 . 1 1 18 18 GLU CB C 18 30.310 30.310 31.469 -1.159 17919 48187 1 118 . 1 1 18 18 GLU H H 18 8.640 8.640 8.090 0.550 17919 48188 1 118 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.226 -0.085 17919 48189 1 118 . 1 1 19 19 PRO C C 19 175.310 175.310 177.912 -2.602 17919 48190 1 118 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.886 -0.416 17919 48191 1 118 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.026 -0.076 17919 48192 1 118 . 1 1 20 20 SER N N 20 103.400 103.400 108.568 -5.168 17919 48193 1 118 . 1 1 20 20 SER HA H 20 4.370 4.370 4.322 0.048 17919 48194 1 118 . 1 1 20 20 SER C C 20 174.660 174.660 174.779 -0.119 17919 48195 1 118 . 1 1 20 20 SER CA C 20 57.400 57.400 58.558 -1.158 17919 48196 1 118 . 1 1 20 20 SER CB C 20 63.370 63.370 62.652 0.718 17919 48197 1 118 . 1 1 20 20 SER H H 20 7.040 7.040 7.928 -0.888 17919 48198 1 118 . 1 1 21 21 ASP N N 21 123.480 123.480 124.950 -1.470 17919 48199 1 118 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.640 0.055 17919 48200 1 118 . 1 1 21 21 ASP C C 21 176.360 176.360 175.620 0.740 17919 48201 1 118 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.900 -0.200 17919 48202 1 118 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.726 -0.926 17919 48203 1 118 . 1 1 21 21 ASP H H 21 8.030 8.030 7.548 0.482 17919 48204 1 118 . 1 1 22 22 THR N N 22 108.800 108.800 114.124 -5.324 17919 48205 1 118 . 1 1 22 22 THR HA H 22 4.920 4.920 4.826 0.094 17919 48206 1 118 . 1 1 22 22 THR C C 22 176.750 176.750 175.899 0.851 17919 48207 1 118 . 1 1 22 22 THR CA C 22 59.690 59.690 61.091 -1.401 17919 48208 1 118 . 1 1 22 22 THR CB C 22 71.200 71.200 70.192 1.008 17919 48209 1 118 . 1 1 22 22 THR H H 22 7.900 7.900 8.216 -0.316 17919 48210 1 118 . 1 1 23 23 ILE N N 23 121.190 121.190 122.475 -1.285 17919 48211 1 118 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.738 -0.081 17919 48212 1 118 . 1 1 23 23 ILE C C 23 179.040 179.040 177.589 1.451 17919 48213 1 118 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.221 -0.961 17919 48214 1 118 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.597 -2.247 17919 48215 1 118 . 1 1 23 23 ILE H H 23 8.560 8.560 9.131 -0.571 17919 48216 1 118 . 1 1 24 24 GLU N N 24 120.830 120.830 120.376 0.454 17919 48217 1 118 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.909 0.008 17919 48218 1 118 . 1 1 24 24 GLU C C 24 178.640 178.640 178.545 0.095 17919 48219 1 118 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.278 -0.058 17919 48220 1 118 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.380 -1.100 17919 48221 1 118 . 1 1 24 24 GLU H H 24 9.760 9.760 7.806 1.954 17919 48222 1 118 . 1 1 25 25 ASN N N 25 120.570 120.570 117.497 3.073 17919 48223 1 118 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.557 -0.032 17919 48224 1 118 . 1 1 25 25 ASN C C 25 178.380 178.380 177.772 0.608 17919 48225 1 118 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.051 0.009 17919 48226 1 118 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.079 0.371 17919 48227 1 118 . 1 1 25 25 ASN H H 25 7.920 7.920 8.234 -0.314 17919 48228 1 118 . 1 1 26 26 VAL N N 26 121.710 121.710 120.629 1.081 17919 48229 1 118 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.633 -0.236 17919 48230 1 118 . 1 1 26 26 VAL C C 26 177.950 177.950 178.171 -0.221 17919 48231 1 118 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.554 1.106 17919 48232 1 118 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.224 -0.384 17919 48233 1 118 . 1 1 26 26 VAL H H 26 8.070 8.070 7.995 0.075 17919 48234 1 118 . 1 1 27 27 LYS N N 27 118.860 118.860 119.442 -0.582 17919 48235 1 118 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.162 0.418 17919 48236 1 118 . 1 1 27 27 LYS C C 27 180.550 180.550 179.055 1.495 17919 48237 1 118 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.538 -0.288 17919 48238 1 118 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.119 1.611 17919 48239 1 118 . 1 1 27 27 LYS H H 27 8.560 8.560 8.132 0.428 17919 48240 1 118 . 1 1 28 28 ALA N N 28 123.440 123.440 121.158 2.282 17919 48241 1 118 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.047 0.113 17919 48242 1 118 . 1 1 28 28 ALA C C 28 180.300 180.300 178.845 1.455 17919 48243 1 118 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.235 0.135 17919 48244 1 118 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.277 -0.567 17919 48245 1 118 . 1 1 28 28 ALA H H 28 8.060 8.060 8.459 -0.399 17919 48246 1 118 . 1 1 29 29 LYS N N 29 119.940 119.940 119.276 0.664 17919 48247 1 118 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.015 0.192 17919 48248 1 118 . 1 1 29 29 LYS C C 29 180.320 180.320 179.118 1.202 17919 48249 1 118 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.403 0.247 17919 48250 1 118 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.188 1.102 17919 48251 1 118 . 1 1 29 29 LYS H H 29 7.850 7.850 7.428 0.422 17919 48252 1 118 . 1 1 30 30 ILE N N 30 121.080 121.080 120.235 0.845 17919 48253 1 118 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.577 -0.070 17919 48254 1 118 . 1 1 30 30 ILE C C 30 178.310 178.310 177.752 0.558 17919 48255 1 118 . 1 1 30 30 ILE CA C 30 66.150 66.150 64.960 1.190 17919 48256 1 118 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.206 -0.406 17919 48257 1 118 . 1 1 30 30 ILE H H 30 8.280 8.280 7.715 0.565 17919 48258 1 118 . 1 1 31 31 GLN N N 31 123.490 123.490 120.295 3.195 17919 48259 1 118 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.977 -0.148 17919 48260 1 118 . 1 1 31 31 GLN C C 31 178.890 178.890 178.459 0.431 17919 48261 1 118 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.207 0.793 17919 48262 1 118 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.497 -0.777 17919 48263 1 118 . 1 1 31 31 GLN H H 31 8.580 8.580 8.384 0.196 17919 48264 1 118 . 1 1 32 32 ASP N N 32 119.360 119.360 119.504 -0.144 17919 48265 1 118 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.456 -0.102 17919 48266 1 118 . 1 1 32 32 ASP C C 32 177.250 177.250 178.147 -0.897 17919 48267 1 118 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.559 0.631 17919 48268 1 118 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.426 0.154 17919 48269 1 118 . 1 1 32 32 ASP H H 32 8.010 8.010 8.019 -0.009 17919 48270 1 118 . 1 1 33 33 LYS N N 33 115.130 115.130 118.618 -3.488 17919 48271 1 118 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.184 0.153 17919 48272 1 118 . 1 1 33 33 LYS C C 33 177.870 177.870 177.591 0.279 17919 48273 1 118 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.651 0.399 17919 48274 1 118 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.055 1.115 17919 48275 1 118 . 1 1 33 33 LYS H H 33 7.430 7.430 7.817 -0.387 17919 48276 1 118 . 1 1 34 34 GLU N N 34 113.870 113.870 114.574 -0.704 17919 48277 1 118 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.453 0.172 17919 48278 1 118 . 1 1 34 34 GLU C C 34 177.840 177.840 176.924 0.916 17919 48279 1 118 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.466 -1.296 17919 48280 1 118 . 1 1 34 34 GLU CB C 34 32.660 32.660 32.671 -0.011 17919 48281 1 118 . 1 1 34 34 GLU H H 34 8.740 8.740 7.747 0.993 17919 48282 1 118 . 1 1 35 35 GLY N N 35 108.650 108.650 110.262 -1.612 17919 48283 1 118 . 1 1 35 35 GLY C C 35 173.960 173.960 174.666 -0.706 17919 48284 1 118 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.642 0.439 17919 48285 1 118 . 1 1 35 35 GLY H H 35 8.530 8.530 8.462 0.068 17919 48286 1 118 . 1 1 36 36 ILE N N 36 119.880 119.880 118.578 1.302 17919 48287 1 118 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.181 0.264 17919 48288 1 118 . 1 1 36 36 ILE C C 36 173.590 173.590 174.342 -0.752 17919 48289 1 118 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.798 -1.048 17919 48290 1 118 . 1 1 36 36 ILE CB C 36 40.580 40.580 36.824 3.756 17919 48291 1 118 . 1 1 36 36 ILE H H 36 6.150 6.150 7.648 -1.498 17919 48292 1 118 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.904 -0.270 17919 48293 1 118 . 1 1 37 37 PRO C C 37 176.940 176.940 176.587 0.353 17919 48294 1 118 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.310 0.350 17919 48295 1 118 . 1 1 37 37 PRO CB C 37 31.850 31.850 30.963 0.887 17919 48296 1 118 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.208 -0.091 17919 48297 1 118 . 1 1 38 38 PRO C C 38 178.320 178.320 177.645 0.675 17919 48298 1 118 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.633 0.627 17919 48299 1 118 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.785 1.105 17919 48300 1 118 . 1 1 39 39 ASP N N 39 113.380 113.380 114.302 -0.922 17919 48301 1 118 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.358 0.072 17919 48302 1 118 . 1 1 39 39 ASP C C 39 177.090 177.090 177.143 -0.053 17919 48303 1 118 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.040 -0.400 17919 48304 1 118 . 1 1 39 39 ASP CB C 39 39.540 39.540 39.855 -0.315 17919 48305 1 118 . 1 1 39 39 ASP H H 39 8.550 8.550 8.745 -0.195 17919 48306 1 118 . 1 1 40 40 GLN N N 40 116.780 116.780 117.678 -0.898 17919 48307 1 118 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.560 -0.096 17919 48308 1 118 . 1 1 40 40 GLN C C 40 175.380 175.380 176.445 -1.065 17919 48309 1 118 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.804 -1.164 17919 48310 1 118 . 1 1 40 40 GLN CB C 40 30.140 30.140 30.482 -0.342 17919 48311 1 118 . 1 1 40 40 GLN H H 40 7.820 7.820 7.467 0.353 17919 48312 1 118 . 1 1 41 41 GLN N N 41 117.720 117.720 119.436 -1.716 17919 48313 1 118 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.282 -0.038 17919 48314 1 118 . 1 1 41 41 GLN C C 41 176.300 176.300 175.472 0.828 17919 48315 1 118 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.662 -0.192 17919 48316 1 118 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.254 2.396 17919 48317 1 118 . 1 1 41 41 GLN H H 41 7.480 7.480 7.413 0.067 17919 48318 1 118 . 1 1 42 42 ARG N N 42 122.680 122.680 125.113 -2.433 17919 48319 1 118 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.646 -0.146 17919 48320 1 118 . 1 1 42 42 ARG C C 42 174.050 174.050 173.985 0.065 17919 48321 1 118 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.152 -0.102 17919 48322 1 118 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.944 -1.194 17919 48323 1 118 . 1 1 42 42 ARG H H 42 8.530 8.530 8.070 0.460 17919 48324 1 118 . 1 1 43 43 LEU N N 43 124.040 124.040 127.676 -3.636 17919 48325 1 118 . 1 1 43 43 LEU C C 43 175.290 175.290 174.927 0.363 17919 48326 1 118 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.956 -0.976 17919 48327 1 118 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.667 1.123 17919 48328 1 118 . 1 1 43 43 LEU H H 43 8.820 8.820 8.841 -0.021 17919 48329 1 118 . 1 1 44 44 ILE N N 44 121.920 121.920 122.542 -0.622 17919 48330 1 118 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.890 0.102 17919 48331 1 118 . 1 1 44 44 ILE C C 44 176.060 176.060 174.894 1.166 17919 48332 1 118 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.397 -1.417 17919 48333 1 118 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.335 0.085 17919 48334 1 118 . 1 1 44 44 ILE H H 44 9.030 9.030 8.473 0.557 17919 48335 1 118 . 1 1 45 45 PHE N N 45 125.390 125.390 128.822 -3.432 17919 48336 1 118 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.964 0.081 17919 48337 1 118 . 1 1 45 45 PHE C C 45 174.470 174.470 175.497 -1.027 17919 48338 1 118 . 1 1 45 45 PHE CA C 45 57.020 57.020 57.625 -0.605 17919 48339 1 118 . 1 1 45 45 PHE CB C 45 43.760 43.760 41.877 1.883 17919 48340 1 118 . 1 1 45 45 PHE H H 45 8.830 8.830 8.129 0.701 17919 48341 1 118 . 1 1 46 46 ALA N N 46 132.200 132.200 122.295 9.905 17919 48342 1 118 . 1 1 46 46 ALA HA H 46 3.690 3.690 4.250 -0.560 17919 48343 1 118 . 1 1 46 46 ALA C C 46 177.290 177.290 177.592 -0.302 17919 48344 1 118 . 1 1 46 46 ALA CA C 46 52.540 52.540 51.253 1.287 17919 48345 1 118 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.875 -0.305 17919 48346 1 118 . 1 1 46 46 ALA H H 46 8.810 8.810 8.299 0.511 17919 48347 1 118 . 1 1 47 47 GLY N N 47 102.340 102.340 107.384 -5.044 17919 48348 1 118 . 1 1 47 47 GLY C C 47 173.810 173.810 173.916 -0.106 17919 48349 1 118 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.186 0.164 17919 48350 1 118 . 1 1 47 47 GLY H H 47 8.130 8.130 8.294 -0.164 17919 48351 1 118 . 1 1 48 48 LYS N N 48 121.570 121.570 121.621 -0.051 17919 48352 1 118 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.597 0.025 17919 48353 1 118 . 1 1 48 48 LYS C C 48 174.700 174.700 175.405 -0.705 17919 48354 1 118 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.873 -0.323 17919 48355 1 118 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.047 0.483 17919 48356 1 118 . 1 1 48 48 LYS H H 48 7.980 7.980 7.688 0.292 17919 48357 1 118 . 1 1 49 49 GLN N N 49 122.410 122.410 123.482 -1.072 17919 48358 1 118 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.068 0.492 17919 48359 1 118 . 1 1 49 49 GLN C C 49 175.670 175.670 175.428 0.242 17919 48360 1 118 . 1 1 49 49 GLN CA C 49 55.740 55.740 57.031 -1.291 17919 48361 1 118 . 1 1 49 49 GLN CB C 49 29.000 29.000 28.718 0.282 17919 48362 1 118 . 1 1 49 49 GLN H H 49 8.600 8.600 8.547 0.053 17919 48363 1 118 . 1 1 50 50 LEU N N 50 125.520 125.520 126.427 -0.907 17919 48364 1 118 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.241 -0.151 17919 48365 1 118 . 1 1 50 50 LEU C C 50 176.660 176.660 176.554 0.106 17919 48366 1 118 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.694 -0.454 17919 48367 1 118 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.458 -0.888 17919 48368 1 118 . 1 1 50 50 LEU H H 50 8.530 8.530 8.756 -0.226 17919 48369 1 118 . 1 1 51 51 GLU N N 51 122.940 122.940 120.565 2.375 17919 48370 1 118 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.575 -0.087 17919 48371 1 118 . 1 1 51 51 GLU C C 51 175.870 175.870 176.689 -0.819 17919 48372 1 118 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.541 0.419 17919 48373 1 118 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.592 -0.022 17919 48374 1 118 . 1 1 51 51 GLU H H 51 8.400 8.400 8.220 0.180 17919 48375 1 118 . 1 1 52 52 ASP N N 52 120.030 120.030 124.667 -4.637 17919 48376 1 118 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.515 -0.156 17919 48377 1 118 . 1 1 52 52 ASP C C 52 177.330 177.330 177.474 -0.144 17919 48378 1 118 . 1 1 52 52 ASP CA C 52 56.960 56.960 56.952 0.008 17919 48379 1 118 . 1 1 52 52 ASP CB C 52 40.850 40.850 41.224 -0.374 17919 48380 1 118 . 1 1 52 52 ASP H H 52 8.160 8.160 8.810 -0.650 17919 48381 1 118 . 1 1 53 53 GLY N N 53 106.660 106.660 106.106 0.554 17919 48382 1 118 . 1 1 53 53 GLY C C 53 174.870 174.870 174.413 0.457 17919 48383 1 118 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.959 0.210 17919 48384 1 118 . 1 1 53 53 GLY H H 53 9.390 9.390 8.206 1.184 17919 48385 1 118 . 1 1 54 54 ARG N N 54 119.050 119.050 120.154 -1.104 17919 48386 1 118 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.676 0.019 17919 48387 1 118 . 1 1 54 54 ARG C C 54 175.350 175.350 174.944 0.406 17919 48388 1 118 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.097 0.293 17919 48389 1 118 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.300 -0.650 17919 48390 1 118 . 1 1 54 54 ARG H H 54 7.460 7.460 7.428 0.032 17919 48391 1 118 . 1 1 55 55 THR N N 55 108.400 108.400 114.150 -5.750 17919 48392 1 118 . 1 1 55 55 THR HA H 55 5.240 5.240 5.146 0.094 17919 48393 1 118 . 1 1 55 55 THR C C 55 176.560 176.560 175.726 0.834 17919 48394 1 118 . 1 1 55 55 THR CA C 55 59.690 59.690 59.906 -0.216 17919 48395 1 118 . 1 1 55 55 THR CB C 55 72.260 72.260 71.465 0.795 17919 48396 1 118 . 1 1 55 55 THR H H 55 8.730 8.730 8.619 0.111 17919 48397 1 118 . 1 1 56 56 LEU N N 56 117.920 117.920 121.011 -3.091 17919 48398 1 118 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.047 0.013 17919 48399 1 118 . 1 1 56 56 LEU C C 56 180.810 180.810 179.092 1.718 17919 48400 1 118 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.510 0.200 17919 48401 1 118 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.542 -1.172 17919 48402 1 118 . 1 1 56 56 LEU H H 56 8.140 8.140 8.224 -0.084 17919 48403 1 118 . 1 1 57 57 SER N N 57 113.330 113.330 114.740 -1.410 17919 48404 1 118 . 1 1 57 57 SER HA H 57 4.370 4.370 4.099 0.271 17919 48405 1 118 . 1 1 57 57 SER C C 57 178.310 178.310 176.924 1.386 17919 48406 1 118 . 1 1 57 57 SER CA C 57 61.080 61.080 62.126 -1.046 17919 48407 1 118 . 1 1 57 57 SER CB C 57 62.530 62.530 62.681 -0.151 17919 48408 1 118 . 1 1 57 57 SER H H 57 8.470 8.470 7.868 0.602 17919 48409 1 118 . 1 1 58 58 ASP N N 58 124.190 124.190 121.462 2.728 17919 48410 1 118 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.367 -0.071 17919 48411 1 118 . 1 1 58 58 ASP C C 58 177.400 177.400 177.180 0.220 17919 48412 1 118 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.770 0.410 17919 48413 1 118 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.584 -0.484 17919 48414 1 118 . 1 1 58 58 ASP H H 58 7.930 7.930 7.832 0.098 17919 48415 1 118 . 1 1 59 59 TYR N N 59 115.510 115.510 115.378 0.132 17919 48416 1 118 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.670 0.000 17919 48417 1 118 . 1 1 59 59 TYR C C 59 174.700 174.700 175.140 -0.440 17919 48418 1 118 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.303 0.947 17919 48419 1 118 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.340 1.730 17919 48420 1 118 . 1 1 59 59 TYR H H 59 7.250 7.250 7.115 0.135 17919 48421 1 118 . 1 1 60 60 ASN N N 60 115.900 115.900 116.940 -1.040 17919 48422 1 118 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.419 -0.064 17919 48423 1 118 . 1 1 60 60 ASN C C 60 174.340 174.340 174.493 -0.153 17919 48424 1 118 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.507 -0.387 17919 48425 1 118 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.313 0.097 17919 48426 1 118 . 1 1 60 60 ASN H H 60 8.150 8.150 8.060 0.090 17919 48427 1 118 . 1 1 61 61 ILE N N 61 118.600 118.600 119.716 -1.116 17919 48428 1 118 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.960 -0.567 17919 48429 1 118 . 1 1 61 61 ILE C C 61 174.610 174.610 175.713 -1.103 17919 48430 1 118 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.051 0.369 17919 48431 1 118 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.418 -0.678 17919 48432 1 118 . 1 1 61 61 ILE H H 61 7.250 7.250 8.105 -0.855 17919 48433 1 118 . 1 1 62 62 GLN N N 62 124.740 124.740 126.887 -2.147 17919 48434 1 118 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.516 -0.010 17919 48435 1 118 . 1 1 62 62 GLN C C 62 175.970 175.970 175.994 -0.024 17919 48436 1 118 . 1 1 62 62 GLN CA C 62 53.660 53.660 54.687 -1.027 17919 48437 1 118 . 1 1 62 62 GLN CB C 62 31.650 31.650 30.045 1.605 17919 48438 1 118 . 1 1 62 62 GLN H H 62 7.610 7.610 8.286 -0.676 17919 48439 1 118 . 1 1 63 63 LYS N N 63 120.300 120.300 120.166 0.134 17919 48440 1 118 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.054 -0.053 17919 48441 1 118 . 1 1 63 63 LYS C C 63 175.810 175.810 177.112 -1.302 17919 48442 1 118 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.380 0.410 17919 48443 1 118 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.167 0.483 17919 48444 1 118 . 1 1 63 63 LYS H H 63 8.490 8.490 8.530 -0.040 17919 48445 1 118 . 1 1 64 64 GLU N N 64 113.950 113.950 116.723 -2.773 17919 48446 1 118 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.430 0.035 17919 48447 1 118 . 1 1 64 64 GLU C C 64 175.250 175.250 175.794 -0.544 17919 48448 1 118 . 1 1 64 64 GLU CA C 64 57.890 57.890 58.416 -0.526 17919 48449 1 118 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.844 -2.944 17919 48450 1 118 . 1 1 64 64 GLU H H 64 9.280 9.280 8.871 0.409 17919 48451 1 118 . 1 1 65 65 SER N N 65 114.730 114.730 115.611 -0.881 17919 48452 1 118 . 1 1 65 65 SER HA H 65 4.640 4.640 4.426 0.214 17919 48453 1 118 . 1 1 65 65 SER C C 65 172.160 172.160 174.263 -2.103 17919 48454 1 118 . 1 1 65 65 SER CA C 65 60.890 60.890 60.178 0.712 17919 48455 1 118 . 1 1 65 65 SER CB C 65 64.910 64.910 63.736 1.173 17919 48456 1 118 . 1 1 65 65 SER H H 65 7.670 7.670 7.515 0.155 17919 48457 1 118 . 1 1 66 66 THR N N 66 117.110 117.110 121.021 -3.911 17919 48458 1 118 . 1 1 66 66 THR HA H 66 5.270 5.270 4.948 0.322 17919 48459 1 118 . 1 1 66 66 THR C C 66 173.950 173.950 174.388 -0.438 17919 48460 1 118 . 1 1 66 66 THR CA C 66 62.340 62.340 62.291 0.049 17919 48461 1 118 . 1 1 66 66 THR CB C 66 70.080 70.080 69.625 0.455 17919 48462 1 118 . 1 1 66 66 THR H H 66 8.730 8.730 8.313 0.417 17919 48463 1 118 . 1 1 67 67 LEU N N 67 127.110 127.110 128.269 -1.159 17919 48464 1 118 . 1 1 67 67 LEU HA H 67 5.060 5.060 5.035 0.025 17919 48465 1 118 . 1 1 67 67 LEU C C 67 175.770 175.770 175.112 0.658 17919 48466 1 118 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.015 -0.115 17919 48467 1 118 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.704 -0.444 17919 48468 1 118 . 1 1 67 67 LEU H H 67 9.410 9.410 8.635 0.775 17919 48469 1 118 . 1 1 68 68 HIS N N 68 118.380 118.380 120.554 -2.174 17919 48470 1 118 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.389 -0.149 17919 48471 1 118 . 1 1 68 68 HIS C C 68 173.150 173.150 174.270 -1.120 17919 48472 1 118 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.456 0.544 17919 48473 1 118 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.358 -1.828 17919 48474 1 118 . 1 1 68 68 HIS H H 68 9.230 9.230 8.899 0.331 17919 48475 1 118 . 1 1 69 69 LEU N N 69 124.460 124.460 130.013 -5.553 17919 48476 1 118 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.344 -0.154 17919 48477 1 118 . 1 1 69 69 LEU C C 69 175.270 175.270 174.401 0.869 17919 48478 1 118 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.786 0.103 17919 48479 1 118 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.323 0.057 17919 48480 1 118 . 1 1 69 69 LEU H H 69 8.340 8.340 8.591 -0.251 17919 48481 1 118 . 1 1 70 70 VAL N N 70 126.940 126.940 123.617 3.323 17919 48482 1 118 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.522 -0.172 17919 48483 1 118 . 1 1 70 70 VAL C C 70 174.000 174.000 173.674 0.326 17919 48484 1 118 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.493 1.307 17919 48485 1 118 . 1 1 70 70 VAL CB C 70 34.910 34.910 36.037 -1.127 17919 48486 1 118 . 1 1 70 70 VAL H H 70 9.200 9.200 8.595 0.605 17919 48487 1 118 . 1 1 71 71 LEU N N 71 123.130 123.130 121.024 2.106 17919 48488 1 118 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.946 0.114 17919 48489 1 118 . 1 1 71 71 LEU C C 71 177.830 177.830 176.673 1.157 17919 48490 1 118 . 1 1 71 71 LEU CA C 71 53.940 53.940 54.227 -0.287 17919 48491 1 118 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.859 -0.009 17919 48492 1 118 . 1 1 71 71 LEU H H 71 8.120 8.120 8.256 -0.136 17919 48493 1 118 . 1 1 72 72 ARG N N 72 123.490 123.490 122.665 0.825 17919 48494 1 118 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.654 -0.353 17919 48495 1 118 . 1 1 72 72 ARG C C 72 175.350 175.350 174.144 1.206 17919 48496 1 118 . 1 1 72 72 ARG CA C 72 55.610 55.610 54.916 0.694 17919 48497 1 118 . 1 1 72 72 ARG CB C 72 31.350 31.350 34.289 -2.939 17919 48498 1 118 . 1 1 72 72 ARG H H 72 8.580 8.580 8.690 -0.110 17919 48499 1 119 . 1 1 2 2 GLN N N 2 123.220 123.220 126.284 -3.064 17919 48500 1 119 . 1 1 2 2 GLN HA H 2 5.249 5.249 4.899 0.350 17919 48501 1 119 . 1 1 2 2 GLN C C 2 175.920 175.920 175.018 0.902 17919 48502 1 119 . 1 1 2 2 GLN CA C 2 55.080 55.080 55.778 -0.698 17919 48503 1 119 . 1 1 2 2 GLN CB C 2 30.760 30.760 29.580 1.180 17919 48504 1 119 . 1 1 2 2 GLN H H 2 8.900 8.900 8.389 0.511 17919 48505 1 119 . 1 1 3 3 ILE N N 3 115.340 115.340 119.184 -3.844 17919 48506 1 119 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.514 -0.301 17919 48507 1 119 . 1 1 3 3 ILE C C 3 172.450 172.450 173.559 -1.109 17919 48508 1 119 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.542 0.028 17919 48509 1 119 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.403 0.807 17919 48510 1 119 . 1 1 3 3 ILE H H 3 8.320 8.320 8.221 0.099 17919 48511 1 119 . 1 1 4 4 PHE N N 4 118.110 118.110 120.369 -2.259 17919 48512 1 119 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.399 0.231 17919 48513 1 119 . 1 1 4 4 PHE C C 4 175.320 175.320 175.163 0.157 17919 48514 1 119 . 1 1 4 4 PHE CA C 4 55.210 55.210 56.219 -1.009 17919 48515 1 119 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.649 -1.169 17919 48516 1 119 . 1 1 4 4 PHE H H 4 8.610 8.610 8.178 0.432 17919 48517 1 119 . 1 1 5 5 VAL N N 5 121.000 121.000 120.277 0.723 17919 48518 1 119 . 1 1 5 5 VAL HA H 5 4.725 4.725 5.073 -0.348 17919 48519 1 119 . 1 1 5 5 VAL C C 5 174.870 174.870 174.955 -0.085 17919 48520 1 119 . 1 1 5 5 VAL CA C 5 60.620 60.620 60.958 -0.338 17919 48521 1 119 . 1 1 5 5 VAL CB C 5 34.230 34.230 35.182 -0.952 17919 48522 1 119 . 1 1 5 5 VAL H H 5 9.300 9.300 8.929 0.371 17919 48523 1 119 . 1 1 6 6 LYS N N 6 127.520 127.520 127.123 0.397 17919 48524 1 119 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.388 -0.021 17919 48525 1 119 . 1 1 6 6 LYS C C 6 177.140 177.140 176.800 0.340 17919 48526 1 119 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.763 -0.243 17919 48527 1 119 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.113 -0.063 17919 48528 1 119 . 1 1 6 6 LYS H H 6 8.820 8.820 8.737 0.083 17919 48529 1 119 . 1 1 7 7 THR N N 7 115.400 115.400 114.710 0.690 17919 48530 1 119 . 1 1 7 7 THR HA H 7 4.970 4.970 4.410 0.560 17919 48531 1 119 . 1 1 7 7 THR C C 7 176.910 176.910 176.864 0.046 17919 48532 1 119 . 1 1 7 7 THR CA C 7 60.470 60.470 60.544 -0.074 17919 48533 1 119 . 1 1 7 7 THR CB C 7 70.630 70.630 70.297 0.333 17919 48534 1 119 . 1 1 7 7 THR H H 7 8.730 8.730 8.354 0.376 17919 48535 1 119 . 1 1 8 8 LEU N N 8 121.330 121.330 119.953 1.377 17919 48536 1 119 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.315 -0.005 17919 48537 1 119 . 1 1 8 8 LEU C C 8 178.800 178.800 178.611 0.189 17919 48538 1 119 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.462 0.118 17919 48539 1 119 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.758 0.212 17919 48540 1 119 . 1 1 8 8 LEU H H 8 9.100 9.100 8.617 0.483 17919 48541 1 119 . 1 1 9 9 THR N N 9 105.590 105.590 109.457 -3.867 17919 48542 1 119 . 1 1 9 9 THR HA H 9 4.428 4.428 4.330 0.098 17919 48543 1 119 . 1 1 9 9 THR C C 9 175.520 175.520 175.839 -0.319 17919 48544 1 119 . 1 1 9 9 THR CA C 9 61.400 61.400 62.019 -0.619 17919 48545 1 119 . 1 1 9 9 THR CB C 9 69.140 69.140 69.490 -0.350 17919 48546 1 119 . 1 1 9 9 THR H H 9 7.630 7.630 7.784 -0.154 17919 48547 1 119 . 1 1 10 10 GLY N N 10 108.890 108.890 111.530 -2.640 17919 48548 1 119 . 1 1 10 10 GLY C C 10 174.070 174.070 173.447 0.623 17919 48549 1 119 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.191 0.269 17919 48550 1 119 . 1 1 10 10 GLY H H 10 7.810 7.810 7.953 -0.143 17919 48551 1 119 . 1 1 11 11 LYS N N 11 121.600 121.600 121.549 0.051 17919 48552 1 119 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.747 -0.386 17919 48553 1 119 . 1 1 11 11 LYS C C 11 175.940 175.940 174.953 0.987 17919 48554 1 119 . 1 1 11 11 LYS CA C 11 56.280 56.280 54.817 1.463 17919 48555 1 119 . 1 1 11 11 LYS CB C 11 33.200 33.200 34.108 -0.908 17919 48556 1 119 . 1 1 11 11 LYS H H 11 7.280 7.280 7.636 -0.356 17919 48557 1 119 . 1 1 12 12 THR N N 12 120.440 120.440 120.689 -0.249 17919 48558 1 119 . 1 1 12 12 THR HA H 12 5.046 5.046 5.586 -0.540 17919 48559 1 119 . 1 1 12 12 THR C C 12 174.320 174.320 174.653 -0.333 17919 48560 1 119 . 1 1 12 12 THR CA C 12 62.390 62.390 60.755 1.635 17919 48561 1 119 . 1 1 12 12 THR CB C 12 69.910 69.910 70.287 -0.377 17919 48562 1 119 . 1 1 12 12 THR H H 12 8.650 8.650 8.241 0.409 17919 48563 1 119 . 1 1 13 13 ILE N N 13 127.110 127.110 123.808 3.302 17919 48564 1 119 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.748 -0.204 17919 48565 1 119 . 1 1 13 13 ILE C C 13 175.220 175.220 175.149 0.071 17919 48566 1 119 . 1 1 13 13 ILE CA C 13 59.980 59.980 58.686 1.294 17919 48567 1 119 . 1 1 13 13 ILE CB C 13 40.950 40.950 39.382 1.568 17919 48568 1 119 . 1 1 13 13 ILE H H 13 9.450 9.450 8.498 0.952 17919 48569 1 119 . 1 1 14 14 THR N N 14 121.520 121.520 119.494 2.026 17919 48570 1 119 . 1 1 14 14 THR HA H 14 4.964 4.964 4.729 0.235 17919 48571 1 119 . 1 1 14 14 THR C C 14 173.790 173.790 173.501 0.289 17919 48572 1 119 . 1 1 14 14 THR CA C 14 61.940 61.940 62.138 -0.198 17919 48573 1 119 . 1 1 14 14 THR CB C 14 69.650 69.650 69.701 -0.051 17919 48574 1 119 . 1 1 14 14 THR H H 14 8.710 8.710 8.254 0.456 17919 48575 1 119 . 1 1 15 15 LEU N N 15 124.800 124.800 126.710 -1.910 17919 48576 1 119 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.660 0.120 17919 48577 1 119 . 1 1 15 15 LEU C C 15 174.670 174.670 175.320 -0.650 17919 48578 1 119 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.848 -1.018 17919 48579 1 119 . 1 1 15 15 LEU CB C 15 47.070 47.070 43.769 3.301 17919 48580 1 119 . 1 1 15 15 LEU H H 15 8.710 8.710 8.431 0.279 17919 48581 1 119 . 1 1 16 16 GLU N N 16 122.160 122.160 123.734 -1.574 17919 48582 1 119 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.361 0.556 17919 48583 1 119 . 1 1 16 16 GLU C C 16 175.860 175.860 175.961 -0.101 17919 48584 1 119 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.560 -0.740 17919 48585 1 119 . 1 1 16 16 GLU CB C 16 29.450 29.450 29.819 -0.369 17919 48586 1 119 . 1 1 16 16 GLU H H 16 8.140 8.140 8.602 -0.462 17919 48587 1 119 . 1 1 17 17 VAL N N 17 117.210 117.210 120.819 -3.609 17919 48588 1 119 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.855 -0.141 17919 48589 1 119 . 1 1 17 17 VAL C C 17 174.160 174.160 174.928 -0.768 17919 48590 1 119 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.161 -0.731 17919 48591 1 119 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.161 1.239 17919 48592 1 119 . 1 1 17 17 VAL H H 17 8.900 8.900 8.004 0.896 17919 48593 1 119 . 1 1 18 18 GLU N N 18 118.990 118.990 118.528 0.462 17919 48594 1 119 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.923 0.156 17919 48595 1 119 . 1 1 18 18 GLU C C 18 176.160 176.160 175.171 0.989 17919 48596 1 119 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.033 -0.313 17919 48597 1 119 . 1 1 18 18 GLU CB C 18 30.310 30.310 31.310 -1.000 17919 48598 1 119 . 1 1 18 18 GLU H H 18 8.640 8.640 8.155 0.485 17919 48599 1 119 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.301 -0.160 17919 48600 1 119 . 1 1 19 19 PRO C C 19 175.310 175.310 177.672 -2.362 17919 48601 1 119 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.403 0.068 17919 48602 1 119 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.024 -0.074 17919 48603 1 119 . 1 1 20 20 SER N N 20 103.400 103.400 108.418 -5.018 17919 48604 1 119 . 1 1 20 20 SER HA H 20 4.370 4.370 4.335 0.035 17919 48605 1 119 . 1 1 20 20 SER C C 20 174.660 174.660 174.330 0.330 17919 48606 1 119 . 1 1 20 20 SER CA C 20 57.400 57.400 58.654 -1.254 17919 48607 1 119 . 1 1 20 20 SER CB C 20 63.370 63.370 63.159 0.211 17919 48608 1 119 . 1 1 20 20 SER H H 20 7.040 7.040 7.892 -0.852 17919 48609 1 119 . 1 1 21 21 ASP N N 21 123.480 123.480 125.110 -1.630 17919 48610 1 119 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.542 0.153 17919 48611 1 119 . 1 1 21 21 ASP C C 21 176.360 176.360 176.060 0.300 17919 48612 1 119 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.805 -0.105 17919 48613 1 119 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.454 -0.654 17919 48614 1 119 . 1 1 21 21 ASP H H 21 8.030 8.030 7.763 0.267 17919 48615 1 119 . 1 1 22 22 THR N N 22 108.800 108.800 114.475 -5.675 17919 48616 1 119 . 1 1 22 22 THR HA H 22 4.920 4.920 4.426 0.494 17919 48617 1 119 . 1 1 22 22 THR C C 22 176.750 176.750 175.949 0.801 17919 48618 1 119 . 1 1 22 22 THR CA C 22 59.690 59.690 62.353 -2.663 17919 48619 1 119 . 1 1 22 22 THR CB C 22 71.200 71.200 70.104 1.096 17919 48620 1 119 . 1 1 22 22 THR H H 22 7.900 7.900 8.436 -0.536 17919 48621 1 119 . 1 1 23 23 ILE N N 23 121.190 121.190 123.277 -2.087 17919 48622 1 119 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.787 -0.130 17919 48623 1 119 . 1 1 23 23 ILE C C 23 179.040 179.040 177.725 1.315 17919 48624 1 119 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.008 0.252 17919 48625 1 119 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.315 -1.965 17919 48626 1 119 . 1 1 23 23 ILE H H 23 8.560 8.560 9.054 -0.494 17919 48627 1 119 . 1 1 24 24 GLU N N 24 120.830 120.830 120.307 0.523 17919 48628 1 119 . 1 1 24 24 GLU HA H 24 3.917 3.917 4.062 -0.145 17919 48629 1 119 . 1 1 24 24 GLU C C 24 178.640 178.640 178.590 0.050 17919 48630 1 119 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.881 0.339 17919 48631 1 119 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.415 -1.135 17919 48632 1 119 . 1 1 24 24 GLU H H 24 9.760 9.760 7.934 1.826 17919 48633 1 119 . 1 1 25 25 ASN N N 25 120.570 120.570 116.688 3.882 17919 48634 1 119 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.622 -0.097 17919 48635 1 119 . 1 1 25 25 ASN C C 25 178.380 178.380 178.048 0.332 17919 48636 1 119 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.286 0.774 17919 48637 1 119 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.033 0.417 17919 48638 1 119 . 1 1 25 25 ASN H H 25 7.920 7.920 7.669 0.251 17919 48639 1 119 . 1 1 26 26 VAL N N 26 121.710 121.710 121.742 -0.032 17919 48640 1 119 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.615 -0.218 17919 48641 1 119 . 1 1 26 26 VAL C C 26 177.950 177.950 177.380 0.570 17919 48642 1 119 . 1 1 26 26 VAL CA C 26 67.660 67.660 67.077 0.583 17919 48643 1 119 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.711 -0.871 17919 48644 1 119 . 1 1 26 26 VAL H H 26 8.070 8.070 8.021 0.049 17919 48645 1 119 . 1 1 27 27 LYS N N 27 118.860 118.860 119.661 -0.801 17919 48646 1 119 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.241 0.339 17919 48647 1 119 . 1 1 27 27 LYS C C 27 180.550 180.550 178.922 1.628 17919 48648 1 119 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.388 -0.138 17919 48649 1 119 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.151 1.579 17919 48650 1 119 . 1 1 27 27 LYS H H 27 8.560 8.560 7.717 0.843 17919 48651 1 119 . 1 1 28 28 ALA N N 28 123.440 123.440 122.792 0.648 17919 48652 1 119 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.010 0.150 17919 48653 1 119 . 1 1 28 28 ALA C C 28 180.300 180.300 178.939 1.361 17919 48654 1 119 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.364 0.006 17919 48655 1 119 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.320 -0.610 17919 48656 1 119 . 1 1 28 28 ALA H H 28 8.060 8.060 8.009 0.051 17919 48657 1 119 . 1 1 29 29 LYS N N 29 119.940 119.940 118.951 0.989 17919 48658 1 119 . 1 1 29 29 LYS HA H 29 4.207 4.207 3.977 0.230 17919 48659 1 119 . 1 1 29 29 LYS C C 29 180.320 180.320 179.321 0.999 17919 48660 1 119 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.330 0.321 17919 48661 1 119 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.176 1.114 17919 48662 1 119 . 1 1 29 29 LYS H H 29 7.850 7.850 7.441 0.409 17919 48663 1 119 . 1 1 30 30 ILE N N 30 121.080 121.080 119.756 1.324 17919 48664 1 119 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.674 -0.167 17919 48665 1 119 . 1 1 30 30 ILE C C 30 178.310 178.310 177.336 0.974 17919 48666 1 119 . 1 1 30 30 ILE CA C 30 66.150 66.150 64.965 1.185 17919 48667 1 119 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.305 -0.505 17919 48668 1 119 . 1 1 30 30 ILE H H 30 8.280 8.280 7.908 0.372 17919 48669 1 119 . 1 1 31 31 GLN N N 31 123.490 123.490 121.565 1.925 17919 48670 1 119 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.094 -0.265 17919 48671 1 119 . 1 1 31 31 GLN C C 31 178.890 178.890 178.549 0.341 17919 48672 1 119 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.249 0.751 17919 48673 1 119 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.330 -0.610 17919 48674 1 119 . 1 1 31 31 GLN H H 31 8.580 8.580 8.360 0.220 17919 48675 1 119 . 1 1 32 32 ASP N N 32 119.360 119.360 119.719 -0.359 17919 48676 1 119 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.391 -0.037 17919 48677 1 119 . 1 1 32 32 ASP C C 32 177.250 177.250 177.896 -0.646 17919 48678 1 119 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.832 0.358 17919 48679 1 119 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.858 -0.278 17919 48680 1 119 . 1 1 32 32 ASP H H 32 8.010 8.010 8.344 -0.334 17919 48681 1 119 . 1 1 33 33 LYS N N 33 115.130 115.130 116.655 -1.525 17919 48682 1 119 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.387 -0.050 17919 48683 1 119 . 1 1 33 33 LYS C C 33 177.870 177.870 178.069 -0.199 17919 48684 1 119 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.863 0.187 17919 48685 1 119 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.998 0.172 17919 48686 1 119 . 1 1 33 33 LYS H H 33 7.430 7.430 7.511 -0.081 17919 48687 1 119 . 1 1 34 34 GLU N N 34 113.870 113.870 115.567 -1.697 17919 48688 1 119 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.480 0.145 17919 48689 1 119 . 1 1 34 34 GLU C C 34 177.840 177.840 177.650 0.190 17919 48690 1 119 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.633 -0.463 17919 48691 1 119 . 1 1 34 34 GLU CB C 34 32.660 32.660 30.861 1.799 17919 48692 1 119 . 1 1 34 34 GLU H H 34 8.740 8.740 8.376 0.364 17919 48693 1 119 . 1 1 35 35 GLY N N 35 108.650 108.650 109.042 -0.392 17919 48694 1 119 . 1 1 35 35 GLY C C 35 173.960 173.960 174.490 -0.530 17919 48695 1 119 . 1 1 35 35 GLY CA C 35 46.080 46.080 46.021 0.059 17919 48696 1 119 . 1 1 35 35 GLY H H 35 8.530 8.530 7.985 0.545 17919 48697 1 119 . 1 1 36 36 ILE N N 36 119.880 119.880 118.659 1.221 17919 48698 1 119 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.418 0.027 17919 48699 1 119 . 1 1 36 36 ILE C C 36 173.590 173.590 174.001 -0.411 17919 48700 1 119 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.947 -0.196 17919 48701 1 119 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.029 2.551 17919 48702 1 119 . 1 1 36 36 ILE H H 36 6.150 6.150 7.617 -1.467 17919 48703 1 119 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.758 -0.124 17919 48704 1 119 . 1 1 37 37 PRO C C 37 176.940 176.940 176.337 0.603 17919 48705 1 119 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.729 -0.069 17919 48706 1 119 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.265 0.585 17919 48707 1 119 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.150 -0.033 17919 48708 1 119 . 1 1 38 38 PRO C C 38 178.320 178.320 177.743 0.577 17919 48709 1 119 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.703 0.557 17919 48710 1 119 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.696 1.194 17919 48711 1 119 . 1 1 39 39 ASP N N 39 113.380 113.380 114.451 -1.071 17919 48712 1 119 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.336 0.094 17919 48713 1 119 . 1 1 39 39 ASP C C 39 177.090 177.090 178.105 -1.015 17919 48714 1 119 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.575 -0.935 17919 48715 1 119 . 1 1 39 39 ASP CB C 39 39.540 39.540 39.442 0.098 17919 48716 1 119 . 1 1 39 39 ASP H H 39 8.550 8.550 8.608 -0.058 17919 48717 1 119 . 1 1 40 40 GLN N N 40 116.780 116.780 118.503 -1.723 17919 48718 1 119 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.097 0.367 17919 48719 1 119 . 1 1 40 40 GLN C C 40 175.380 175.380 176.227 -0.847 17919 48720 1 119 . 1 1 40 40 GLN CA C 40 55.640 55.640 57.825 -2.185 17919 48721 1 119 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.183 0.957 17919 48722 1 119 . 1 1 40 40 GLN H H 40 7.820 7.820 7.972 -0.152 17919 48723 1 119 . 1 1 41 41 GLN N N 41 117.720 117.720 117.644 0.076 17919 48724 1 119 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.464 -0.220 17919 48725 1 119 . 1 1 41 41 GLN C C 41 176.300 176.300 175.923 0.377 17919 48726 1 119 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.634 0.836 17919 48727 1 119 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.582 2.068 17919 48728 1 119 . 1 1 41 41 GLN H H 41 7.480 7.480 7.276 0.204 17919 48729 1 119 . 1 1 42 42 ARG N N 42 122.680 122.680 125.420 -2.740 17919 48730 1 119 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.585 -0.085 17919 48731 1 119 . 1 1 42 42 ARG C C 42 174.050 174.050 174.590 -0.540 17919 48732 1 119 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.966 0.084 17919 48733 1 119 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.187 -0.437 17919 48734 1 119 . 1 1 42 42 ARG H H 42 8.530 8.530 8.175 0.355 17919 48735 1 119 . 1 1 43 43 LEU N N 43 124.040 124.040 126.591 -2.551 17919 48736 1 119 . 1 1 43 43 LEU C C 43 175.290 175.290 175.651 -0.361 17919 48737 1 119 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.081 -1.101 17919 48738 1 119 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.400 1.390 17919 48739 1 119 . 1 1 43 43 LEU H H 43 8.820 8.820 8.769 0.051 17919 48740 1 119 . 1 1 44 44 ILE N N 44 121.920 121.920 121.703 0.217 17919 48741 1 119 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.162 -0.170 17919 48742 1 119 . 1 1 44 44 ILE C C 44 176.060 176.060 174.541 1.519 17919 48743 1 119 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.067 -1.087 17919 48744 1 119 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.567 -0.147 17919 48745 1 119 . 1 1 44 44 ILE H H 44 9.030 9.030 8.426 0.604 17919 48746 1 119 . 1 1 45 45 PHE N N 45 125.390 125.390 127.964 -2.574 17919 48747 1 119 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.018 0.027 17919 48748 1 119 . 1 1 45 45 PHE C C 45 174.470 174.470 174.574 -0.104 17919 48749 1 119 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.129 0.891 17919 48750 1 119 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.969 0.791 17919 48751 1 119 . 1 1 45 45 PHE H H 45 8.830 8.830 8.428 0.402 17919 48752 1 119 . 1 1 46 46 ALA N N 46 132.200 132.200 129.147 3.053 17919 48753 1 119 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.650 0.040 17919 48754 1 119 . 1 1 46 46 ALA C C 46 177.290 177.290 177.640 -0.350 17919 48755 1 119 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.644 -0.104 17919 48756 1 119 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.582 -0.012 17919 48757 1 119 . 1 1 46 46 ALA H H 46 8.810 8.810 8.649 0.161 17919 48758 1 119 . 1 1 47 47 GLY N N 47 102.340 102.340 103.765 -1.425 17919 48759 1 119 . 1 1 47 47 GLY C C 47 173.810 173.810 174.570 -0.760 17919 48760 1 119 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.981 0.369 17919 48761 1 119 . 1 1 47 47 GLY H H 47 8.130 8.130 8.366 -0.236 17919 48762 1 119 . 1 1 48 48 LYS N N 48 121.570 121.570 123.501 -1.931 17919 48763 1 119 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.295 0.327 17919 48764 1 119 . 1 1 48 48 LYS C C 48 174.700 174.700 175.988 -1.288 17919 48765 1 119 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.367 -0.817 17919 48766 1 119 . 1 1 48 48 LYS CB C 48 34.530 34.530 32.644 1.886 17919 48767 1 119 . 1 1 48 48 LYS H H 48 7.980 7.980 7.805 0.175 17919 48768 1 119 . 1 1 49 49 GLN N N 49 122.410 122.410 123.568 -1.158 17919 48769 1 119 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.291 0.269 17919 48770 1 119 . 1 1 49 49 GLN C C 49 175.670 175.670 175.654 0.016 17919 48771 1 119 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.227 -0.487 17919 48772 1 119 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.132 -0.132 17919 48773 1 119 . 1 1 49 49 GLN H H 49 8.600 8.600 8.569 0.031 17919 48774 1 119 . 1 1 50 50 LEU N N 50 125.520 125.520 128.011 -2.491 17919 48775 1 119 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.063 0.027 17919 48776 1 119 . 1 1 50 50 LEU C C 50 176.660 176.660 175.920 0.740 17919 48777 1 119 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.038 0.202 17919 48778 1 119 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.498 -0.929 17919 48779 1 119 . 1 1 50 50 LEU H H 50 8.530 8.530 8.912 -0.382 17919 48780 1 119 . 1 1 51 51 GLU N N 51 122.940 122.940 122.558 0.382 17919 48781 1 119 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.645 -0.157 17919 48782 1 119 . 1 1 51 51 GLU C C 51 175.870 175.870 176.567 -0.697 17919 48783 1 119 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.148 0.812 17919 48784 1 119 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.640 -1.070 17919 48785 1 119 . 1 1 51 51 GLU H H 51 8.400 8.400 8.350 0.050 17919 48786 1 119 . 1 1 52 52 ASP N N 52 120.030 120.030 123.041 -3.011 17919 48787 1 119 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.600 -0.241 17919 48788 1 119 . 1 1 52 52 ASP C C 52 177.330 177.330 177.397 -0.067 17919 48789 1 119 . 1 1 52 52 ASP CA C 52 56.960 56.960 56.506 0.454 17919 48790 1 119 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.918 -0.068 17919 48791 1 119 . 1 1 52 52 ASP H H 52 8.160 8.160 8.839 -0.679 17919 48792 1 119 . 1 1 53 53 GLY N N 53 106.660 106.660 105.245 1.415 17919 48793 1 119 . 1 1 53 53 GLY C C 53 174.870 174.870 174.668 0.202 17919 48794 1 119 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.142 0.028 17919 48795 1 119 . 1 1 53 53 GLY H H 53 9.390 9.390 8.531 0.859 17919 48796 1 119 . 1 1 54 54 ARG N N 54 119.050 119.050 119.957 -0.907 17919 48797 1 119 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.457 0.238 17919 48798 1 119 . 1 1 54 54 ARG C C 54 175.350 175.350 175.387 -0.037 17919 48799 1 119 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.722 -0.332 17919 48800 1 119 . 1 1 54 54 ARG CB C 54 32.650 32.650 31.687 0.963 17919 48801 1 119 . 1 1 54 54 ARG H H 54 7.460 7.460 7.328 0.132 17919 48802 1 119 . 1 1 55 55 THR N N 55 108.400 108.400 111.592 -3.192 17919 48803 1 119 . 1 1 55 55 THR HA H 55 5.240 5.240 4.954 0.286 17919 48804 1 119 . 1 1 55 55 THR C C 55 176.560 176.560 176.341 0.219 17919 48805 1 119 . 1 1 55 55 THR CA C 55 59.690 59.690 59.819 -0.130 17919 48806 1 119 . 1 1 55 55 THR CB C 55 72.260 72.260 70.967 1.293 17919 48807 1 119 . 1 1 55 55 THR H H 55 8.730 8.730 8.493 0.237 17919 48808 1 119 . 1 1 56 56 LEU N N 56 117.920 117.920 120.437 -2.517 17919 48809 1 119 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.976 0.084 17919 48810 1 119 . 1 1 56 56 LEU C C 56 180.810 180.810 178.905 1.905 17919 48811 1 119 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.433 0.277 17919 48812 1 119 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.183 -0.813 17919 48813 1 119 . 1 1 56 56 LEU H H 56 8.140 8.140 8.326 -0.186 17919 48814 1 119 . 1 1 57 57 SER N N 57 113.330 113.330 114.184 -0.854 17919 48815 1 119 . 1 1 57 57 SER HA H 57 4.370 4.370 4.222 0.148 17919 48816 1 119 . 1 1 57 57 SER C C 57 178.310 178.310 176.979 1.331 17919 48817 1 119 . 1 1 57 57 SER CA C 57 61.080 61.080 61.282 -0.202 17919 48818 1 119 . 1 1 57 57 SER CB C 57 62.530 62.530 62.640 -0.110 17919 48819 1 119 . 1 1 57 57 SER H H 57 8.470 8.470 7.792 0.678 17919 48820 1 119 . 1 1 58 58 ASP N N 58 124.190 124.190 121.715 2.475 17919 48821 1 119 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.303 -0.007 17919 48822 1 119 . 1 1 58 58 ASP C C 58 177.400 177.400 177.689 -0.289 17919 48823 1 119 . 1 1 58 58 ASP CA C 58 57.180 57.180 57.334 -0.154 17919 48824 1 119 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.636 -0.536 17919 48825 1 119 . 1 1 58 58 ASP H H 58 7.930 7.930 7.795 0.135 17919 48826 1 119 . 1 1 59 59 TYR N N 59 115.510 115.510 115.713 -0.203 17919 48827 1 119 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.657 0.013 17919 48828 1 119 . 1 1 59 59 TYR C C 59 174.700 174.700 174.940 -0.240 17919 48829 1 119 . 1 1 59 59 TYR CA C 59 58.250 58.250 56.083 2.167 17919 48830 1 119 . 1 1 59 59 TYR CB C 59 40.070 40.070 37.923 2.147 17919 48831 1 119 . 1 1 59 59 TYR H H 59 7.250 7.250 7.187 0.063 17919 48832 1 119 . 1 1 60 60 ASN N N 60 115.900 115.900 115.659 0.241 17919 48833 1 119 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.329 0.026 17919 48834 1 119 . 1 1 60 60 ASN C C 60 174.340 174.340 174.092 0.248 17919 48835 1 119 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.047 0.073 17919 48836 1 119 . 1 1 60 60 ASN CB C 60 37.410 37.410 36.795 0.615 17919 48837 1 119 . 1 1 60 60 ASN H H 60 8.150 8.150 7.841 0.309 17919 48838 1 119 . 1 1 61 61 ILE N N 61 118.600 118.600 119.650 -1.050 17919 48839 1 119 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.581 -0.188 17919 48840 1 119 . 1 1 61 61 ILE C C 61 174.610 174.610 175.361 -0.751 17919 48841 1 119 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.795 0.625 17919 48842 1 119 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.982 -1.242 17919 48843 1 119 . 1 1 61 61 ILE H H 61 7.250 7.250 7.880 -0.630 17919 48844 1 119 . 1 1 62 62 GLN N N 62 124.740 124.740 124.900 -0.160 17919 48845 1 119 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.680 -0.174 17919 48846 1 119 . 1 1 62 62 GLN C C 62 175.970 175.970 175.903 0.067 17919 48847 1 119 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.046 0.614 17919 48848 1 119 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.210 0.440 17919 48849 1 119 . 1 1 62 62 GLN H H 62 7.610 7.610 7.898 -0.288 17919 48850 1 119 . 1 1 63 63 LYS N N 63 120.300 120.300 120.344 -0.044 17919 48851 1 119 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.020 -0.019 17919 48852 1 119 . 1 1 63 63 LYS C C 63 175.810 175.810 177.341 -1.531 17919 48853 1 119 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.107 -0.317 17919 48854 1 119 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.778 0.872 17919 48855 1 119 . 1 1 63 63 LYS H H 63 8.490 8.490 8.778 -0.288 17919 48856 1 119 . 1 1 64 64 GLU N N 64 113.950 113.950 118.826 -4.876 17919 48857 1 119 . 1 1 64 64 GLU HA H 64 3.465 3.465 4.030 -0.565 17919 48858 1 119 . 1 1 64 64 GLU C C 64 175.250 175.250 176.123 -0.873 17919 48859 1 119 . 1 1 64 64 GLU CA C 64 57.890 57.890 58.873 -0.983 17919 48860 1 119 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.433 -2.533 17919 48861 1 119 . 1 1 64 64 GLU H H 64 9.280 9.280 8.996 0.284 17919 48862 1 119 . 1 1 65 65 SER N N 65 114.730 114.730 116.949 -2.219 17919 48863 1 119 . 1 1 65 65 SER HA H 65 4.640 4.640 4.535 0.105 17919 48864 1 119 . 1 1 65 65 SER C C 65 172.160 172.160 174.661 -2.501 17919 48865 1 119 . 1 1 65 65 SER CA C 65 60.890 60.890 59.771 1.119 17919 48866 1 119 . 1 1 65 65 SER CB C 65 64.910 64.910 63.723 1.187 17919 48867 1 119 . 1 1 65 65 SER H H 65 7.670 7.670 7.914 -0.244 17919 48868 1 119 . 1 1 66 66 THR N N 66 117.110 117.110 122.439 -5.329 17919 48869 1 119 . 1 1 66 66 THR HA H 66 5.270 5.270 4.813 0.457 17919 48870 1 119 . 1 1 66 66 THR C C 66 173.950 173.950 174.322 -0.372 17919 48871 1 119 . 1 1 66 66 THR CA C 66 62.340 62.340 63.243 -0.903 17919 48872 1 119 . 1 1 66 66 THR CB C 66 70.080 70.080 69.654 0.426 17919 48873 1 119 . 1 1 66 66 THR H H 66 8.730 8.730 8.429 0.301 17919 48874 1 119 . 1 1 67 67 LEU N N 67 127.110 127.110 128.490 -1.380 17919 48875 1 119 . 1 1 67 67 LEU HA H 67 5.060 5.060 5.094 -0.034 17919 48876 1 119 . 1 1 67 67 LEU C C 67 175.770 175.770 175.295 0.475 17919 48877 1 119 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.846 0.054 17919 48878 1 119 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.628 -0.368 17919 48879 1 119 . 1 1 67 67 LEU H H 67 9.410 9.410 9.125 0.285 17919 48880 1 119 . 1 1 68 68 HIS N N 68 118.380 118.380 122.672 -4.292 17919 48881 1 119 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.558 -0.318 17919 48882 1 119 . 1 1 68 68 HIS C C 68 173.150 173.150 173.599 -0.449 17919 48883 1 119 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.173 0.827 17919 48884 1 119 . 1 1 68 68 HIS CB C 68 30.530 30.530 33.420 -2.890 17919 48885 1 119 . 1 1 68 68 HIS H H 68 9.230 9.230 8.293 0.937 17919 48886 1 119 . 1 1 69 69 LEU N N 69 124.460 124.460 125.347 -0.887 17919 48887 1 119 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.841 0.349 17919 48888 1 119 . 1 1 69 69 LEU C C 69 175.270 175.270 173.972 1.298 17919 48889 1 119 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.184 -0.295 17919 48890 1 119 . 1 1 69 69 LEU CB C 69 44.380 44.380 45.450 -1.071 17919 48891 1 119 . 1 1 69 69 LEU H H 69 8.340 8.340 7.204 1.136 17919 48892 1 119 . 1 1 70 70 VAL N N 70 126.940 126.940 123.958 2.982 17919 48893 1 119 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.547 -0.197 17919 48894 1 119 . 1 1 70 70 VAL C C 70 174.000 174.000 173.766 0.234 17919 48895 1 119 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.583 1.217 17919 48896 1 119 . 1 1 70 70 VAL CB C 70 34.910 34.910 34.729 0.181 17919 48897 1 119 . 1 1 70 70 VAL H H 70 9.200 9.200 7.895 1.305 17919 48898 1 119 . 1 1 71 71 LEU N N 71 123.130 123.130 125.998 -2.868 17919 48899 1 119 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.944 0.116 17919 48900 1 119 . 1 1 71 71 LEU C C 71 177.830 177.830 177.150 0.680 17919 48901 1 119 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.148 0.792 17919 48902 1 119 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.576 -0.726 17919 48903 1 119 . 1 1 71 71 LEU H H 71 8.120 8.120 8.354 -0.234 17919 48904 1 119 . 1 1 72 72 ARG N N 72 123.490 123.490 121.236 2.254 17919 48905 1 119 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.453 -0.152 17919 48906 1 119 . 1 1 72 72 ARG C C 72 175.350 175.350 175.063 0.287 17919 48907 1 119 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.296 -0.686 17919 48908 1 119 . 1 1 72 72 ARG CB C 72 31.350 31.350 31.127 0.223 17919 48909 1 119 . 1 1 72 72 ARG H H 72 8.580 8.580 8.552 0.028 17919 48910 1 120 . 1 1 2 2 GLN N N 2 123.220 123.220 119.963 3.257 17919 48911 1 120 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.280 -0.031 17919 48912 1 120 . 1 1 2 2 GLN C C 2 175.920 175.920 175.118 0.802 17919 48913 1 120 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.212 0.868 17919 48914 1 120 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.478 0.282 17919 48915 1 120 . 1 1 2 2 GLN H H 2 8.900 8.900 8.392 0.508 17919 48916 1 120 . 1 1 3 3 ILE N N 3 115.340 115.340 118.306 -2.966 17919 48917 1 120 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.609 -0.396 17919 48918 1 120 . 1 1 3 3 ILE C C 3 172.450 172.450 173.678 -1.228 17919 48919 1 120 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.801 -0.231 17919 48920 1 120 . 1 1 3 3 ILE CB C 3 42.210 42.210 40.706 1.504 17919 48921 1 120 . 1 1 3 3 ILE H H 3 8.320 8.320 7.969 0.351 17919 48922 1 120 . 1 1 4 4 PHE N N 4 118.110 118.110 123.394 -5.284 17919 48923 1 120 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.213 0.417 17919 48924 1 120 . 1 1 4 4 PHE C C 4 175.320 175.320 175.415 -0.095 17919 48925 1 120 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.961 -0.751 17919 48926 1 120 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.594 -0.114 17919 48927 1 120 . 1 1 4 4 PHE H H 4 8.610 8.610 9.047 -0.437 17919 48928 1 120 . 1 1 5 5 VAL N N 5 121.000 121.000 121.432 -0.432 17919 48929 1 120 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.843 -0.118 17919 48930 1 120 . 1 1 5 5 VAL C C 5 174.870 174.870 174.711 0.159 17919 48931 1 120 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.303 -0.683 17919 48932 1 120 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.095 0.135 17919 48933 1 120 . 1 1 5 5 VAL H H 5 9.300 9.300 8.811 0.489 17919 48934 1 120 . 1 1 6 6 LYS N N 6 127.520 127.520 127.641 -0.121 17919 48935 1 120 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.152 0.215 17919 48936 1 120 . 1 1 6 6 LYS C C 6 177.140 177.140 176.628 0.512 17919 48937 1 120 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.469 0.050 17919 48938 1 120 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.509 0.541 17919 48939 1 120 . 1 1 6 6 LYS H H 6 8.820 8.820 8.853 -0.033 17919 48940 1 120 . 1 1 7 7 THR N N 7 115.400 115.400 114.337 1.063 17919 48941 1 120 . 1 1 7 7 THR HA H 7 4.970 4.970 4.343 0.627 17919 48942 1 120 . 1 1 7 7 THR C C 7 176.910 176.910 176.106 0.804 17919 48943 1 120 . 1 1 7 7 THR CA C 7 60.470 60.470 60.682 -0.212 17919 48944 1 120 . 1 1 7 7 THR CB C 7 70.630 70.630 70.214 0.416 17919 48945 1 120 . 1 1 7 7 THR H H 7 8.730 8.730 8.733 -0.003 17919 48946 1 120 . 1 1 8 8 LEU N N 8 121.330 121.330 121.525 -0.195 17919 48947 1 120 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.435 -0.125 17919 48948 1 120 . 1 1 8 8 LEU C C 8 178.800 178.800 177.090 1.710 17919 48949 1 120 . 1 1 8 8 LEU CA C 8 57.580 57.580 56.567 1.013 17919 48950 1 120 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.973 -0.003 17919 48951 1 120 . 1 1 8 8 LEU H H 8 9.100 9.100 8.741 0.359 17919 48952 1 120 . 1 1 9 9 THR N N 9 105.590 105.590 108.295 -2.705 17919 48953 1 120 . 1 1 9 9 THR HA H 9 4.428 4.428 4.368 0.060 17919 48954 1 120 . 1 1 9 9 THR C C 9 175.520 175.520 175.283 0.237 17919 48955 1 120 . 1 1 9 9 THR CA C 9 61.400 61.400 61.659 -0.259 17919 48956 1 120 . 1 1 9 9 THR CB C 9 69.140 69.140 70.318 -1.178 17919 48957 1 120 . 1 1 9 9 THR H H 9 7.630 7.630 7.363 0.267 17919 48958 1 120 . 1 1 10 10 GLY N N 10 108.890 108.890 111.406 -2.516 17919 48959 1 120 . 1 1 10 10 GLY C C 10 174.070 174.070 174.064 0.006 17919 48960 1 120 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.987 0.473 17919 48961 1 120 . 1 1 10 10 GLY H H 10 7.810 7.810 7.523 0.287 17919 48962 1 120 . 1 1 11 11 LYS N N 11 121.600 121.600 121.312 0.288 17919 48963 1 120 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.327 0.034 17919 48964 1 120 . 1 1 11 11 LYS C C 11 175.940 175.940 175.538 0.402 17919 48965 1 120 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.546 -0.266 17919 48966 1 120 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.657 -0.457 17919 48967 1 120 . 1 1 11 11 LYS H H 11 7.280 7.280 7.868 -0.588 17919 48968 1 120 . 1 1 12 12 THR N N 12 120.440 120.440 116.962 3.478 17919 48969 1 120 . 1 1 12 12 THR HA H 12 5.046 5.046 4.890 0.156 17919 48970 1 120 . 1 1 12 12 THR C C 12 174.320 174.320 173.873 0.447 17919 48971 1 120 . 1 1 12 12 THR CA C 12 62.390 62.390 60.813 1.577 17919 48972 1 120 . 1 1 12 12 THR CB C 12 69.910 69.910 71.027 -1.117 17919 48973 1 120 . 1 1 12 12 THR H H 12 8.650 8.650 8.254 0.396 17919 48974 1 120 . 1 1 13 13 ILE N N 13 127.110 127.110 124.414 2.696 17919 48975 1 120 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.544 0.000 17919 48976 1 120 . 1 1 13 13 ILE C C 13 175.220 175.220 174.533 0.687 17919 48977 1 120 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.095 -0.115 17919 48978 1 120 . 1 1 13 13 ILE CB C 13 40.950 40.950 42.135 -1.185 17919 48979 1 120 . 1 1 13 13 ILE H H 13 9.450 9.450 8.829 0.621 17919 48980 1 120 . 1 1 14 14 THR N N 14 121.520 121.520 122.775 -1.255 17919 48981 1 120 . 1 1 14 14 THR HA H 14 4.964 4.964 4.942 0.022 17919 48982 1 120 . 1 1 14 14 THR C C 14 173.790 173.790 174.002 -0.212 17919 48983 1 120 . 1 1 14 14 THR CA C 14 61.940 61.940 61.474 0.466 17919 48984 1 120 . 1 1 14 14 THR CB C 14 69.650 69.650 69.886 -0.236 17919 48985 1 120 . 1 1 14 14 THR H H 14 8.710 8.710 8.365 0.345 17919 48986 1 120 . 1 1 15 15 LEU N N 15 124.800 124.800 126.233 -1.433 17919 48987 1 120 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.757 0.023 17919 48988 1 120 . 1 1 15 15 LEU C C 15 174.670 174.670 175.185 -0.515 17919 48989 1 120 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.712 -0.882 17919 48990 1 120 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.406 1.664 17919 48991 1 120 . 1 1 15 15 LEU H H 15 8.710 8.710 8.096 0.614 17919 48992 1 120 . 1 1 16 16 GLU N N 16 122.160 122.160 123.281 -1.121 17919 48993 1 120 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.322 -0.405 17919 48994 1 120 . 1 1 16 16 GLU C C 16 175.860 175.860 176.224 -0.364 17919 48995 1 120 . 1 1 16 16 GLU CA C 16 54.820 54.820 54.983 -0.163 17919 48996 1 120 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.790 -1.340 17919 48997 1 120 . 1 1 16 16 GLU H H 16 8.140 8.140 8.569 -0.429 17919 48998 1 120 . 1 1 17 17 VAL N N 17 117.210 117.210 120.275 -3.065 17919 48999 1 120 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.500 0.214 17919 49000 1 120 . 1 1 17 17 VAL C C 17 174.160 174.160 174.676 -0.516 17919 49001 1 120 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.294 -0.864 17919 49002 1 120 . 1 1 17 17 VAL CB C 17 36.400 36.400 34.822 1.578 17919 49003 1 120 . 1 1 17 17 VAL H H 17 8.900 8.900 8.833 0.067 17919 49004 1 120 . 1 1 18 18 GLU N N 18 118.990 118.990 118.617 0.373 17919 49005 1 120 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.849 0.230 17919 49006 1 120 . 1 1 18 18 GLU C C 18 176.160 176.160 175.356 0.804 17919 49007 1 120 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.362 -0.642 17919 49008 1 120 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.540 -0.230 17919 49009 1 120 . 1 1 18 18 GLU H H 18 8.640 8.640 8.490 0.150 17919 49010 1 120 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.360 -0.219 17919 49011 1 120 . 1 1 19 19 PRO C C 19 175.310 175.310 177.349 -2.039 17919 49012 1 120 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.174 0.296 17919 49013 1 120 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.914 0.036 17919 49014 1 120 . 1 1 20 20 SER N N 20 103.400 103.400 110.900 -7.500 17919 49015 1 120 . 1 1 20 20 SER HA H 20 4.370 4.370 4.280 0.090 17919 49016 1 120 . 1 1 20 20 SER C C 20 174.660 174.660 174.089 0.571 17919 49017 1 120 . 1 1 20 20 SER CA C 20 57.400 57.400 59.459 -2.059 17919 49018 1 120 . 1 1 20 20 SER CB C 20 63.370 63.370 62.773 0.597 17919 49019 1 120 . 1 1 20 20 SER H H 20 7.040 7.040 8.291 -1.251 17919 49020 1 120 . 1 1 21 21 ASP N N 21 123.480 123.480 122.387 1.093 17919 49021 1 120 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.742 -0.047 17919 49022 1 120 . 1 1 21 21 ASP C C 21 176.360 176.360 175.085 1.275 17919 49023 1 120 . 1 1 21 21 ASP CA C 21 55.700 55.700 53.947 1.754 17919 49024 1 120 . 1 1 21 21 ASP CB C 21 40.800 40.800 42.472 -1.672 17919 49025 1 120 . 1 1 21 21 ASP H H 21 8.030 8.030 7.394 0.636 17919 49026 1 120 . 1 1 22 22 THR N N 22 108.800 108.800 114.628 -5.828 17919 49027 1 120 . 1 1 22 22 THR HA H 22 4.920 4.920 4.560 0.360 17919 49028 1 120 . 1 1 22 22 THR C C 22 176.750 176.750 175.526 1.224 17919 49029 1 120 . 1 1 22 22 THR CA C 22 59.690 59.690 61.027 -1.337 17919 49030 1 120 . 1 1 22 22 THR CB C 22 71.200 71.200 70.582 0.618 17919 49031 1 120 . 1 1 22 22 THR H H 22 7.900 7.900 8.182 -0.282 17919 49032 1 120 . 1 1 23 23 ILE N N 23 121.190 121.190 121.698 -0.508 17919 49033 1 120 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.909 -0.252 17919 49034 1 120 . 1 1 23 23 ILE C C 23 179.040 179.040 177.853 1.187 17919 49035 1 120 . 1 1 23 23 ILE CA C 23 62.260 62.260 60.918 1.342 17919 49036 1 120 . 1 1 23 23 ILE CB C 23 34.350 34.350 35.982 -1.632 17919 49037 1 120 . 1 1 23 23 ILE H H 23 8.560 8.560 8.856 -0.296 17919 49038 1 120 . 1 1 24 24 GLU N N 24 120.830 120.830 120.626 0.204 17919 49039 1 120 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.931 -0.014 17919 49040 1 120 . 1 1 24 24 GLU C C 24 178.640 178.640 178.672 -0.032 17919 49041 1 120 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.806 0.414 17919 49042 1 120 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.061 -0.781 17919 49043 1 120 . 1 1 24 24 GLU H H 24 9.760 9.760 8.388 1.372 17919 49044 1 120 . 1 1 25 25 ASN N N 25 120.570 120.570 117.271 3.299 17919 49045 1 120 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.532 -0.007 17919 49046 1 120 . 1 1 25 25 ASN C C 25 178.380 178.380 177.851 0.529 17919 49047 1 120 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.979 0.081 17919 49048 1 120 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.069 0.381 17919 49049 1 120 . 1 1 25 25 ASN H H 25 7.920 7.920 7.639 0.281 17919 49050 1 120 . 1 1 26 26 VAL N N 26 121.710 121.710 120.422 1.288 17919 49051 1 120 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.652 -0.255 17919 49052 1 120 . 1 1 26 26 VAL C C 26 177.950 177.950 177.974 -0.024 17919 49053 1 120 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.095 1.565 17919 49054 1 120 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.529 -0.689 17919 49055 1 120 . 1 1 26 26 VAL H H 26 8.070 8.070 7.601 0.469 17919 49056 1 120 . 1 1 27 27 LYS N N 27 118.860 118.860 120.145 -1.285 17919 49057 1 120 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.053 0.527 17919 49058 1 120 . 1 1 27 27 LYS C C 27 180.550 180.550 178.775 1.775 17919 49059 1 120 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.724 -0.474 17919 49060 1 120 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.167 1.563 17919 49061 1 120 . 1 1 27 27 LYS H H 27 8.560 8.560 8.440 0.120 17919 49062 1 120 . 1 1 28 28 ALA N N 28 123.440 123.440 120.432 3.008 17919 49063 1 120 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.136 0.024 17919 49064 1 120 . 1 1 28 28 ALA C C 28 180.300 180.300 178.862 1.438 17919 49065 1 120 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.660 0.709 17919 49066 1 120 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.412 -0.702 17919 49067 1 120 . 1 1 28 28 ALA H H 28 8.060 8.060 8.380 -0.320 17919 49068 1 120 . 1 1 29 29 LYS N N 29 119.940 119.940 119.943 -0.003 17919 49069 1 120 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.053 0.154 17919 49070 1 120 . 1 1 29 29 LYS C C 29 180.320 180.320 178.886 1.434 17919 49071 1 120 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.211 0.439 17919 49072 1 120 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.425 0.865 17919 49073 1 120 . 1 1 29 29 LYS H H 29 7.850 7.850 7.433 0.417 17919 49074 1 120 . 1 1 30 30 ILE N N 30 121.080 121.080 119.818 1.262 17919 49075 1 120 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.591 -0.084 17919 49076 1 120 . 1 1 30 30 ILE C C 30 178.310 178.310 177.590 0.720 17919 49077 1 120 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.104 1.046 17919 49078 1 120 . 1 1 30 30 ILE CB C 30 36.800 36.800 36.699 0.101 17919 49079 1 120 . 1 1 30 30 ILE H H 30 8.280 8.280 8.045 0.235 17919 49080 1 120 . 1 1 31 31 GLN N N 31 123.490 123.490 121.242 2.248 17919 49081 1 120 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.087 -0.258 17919 49082 1 120 . 1 1 31 31 GLN C C 31 178.890 178.890 178.662 0.228 17919 49083 1 120 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.577 0.423 17919 49084 1 120 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.382 -0.662 17919 49085 1 120 . 1 1 31 31 GLN H H 31 8.580 8.580 8.541 0.039 17919 49086 1 120 . 1 1 32 32 ASP N N 32 119.360 119.360 117.928 1.432 17919 49087 1 120 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.395 -0.041 17919 49088 1 120 . 1 1 32 32 ASP C C 32 177.250 177.250 177.474 -0.224 17919 49089 1 120 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.543 0.647 17919 49090 1 120 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.689 -0.109 17919 49091 1 120 . 1 1 32 32 ASP H H 32 8.010 8.010 7.974 0.036 17919 49092 1 120 . 1 1 33 33 LYS N N 33 115.130 115.130 118.326 -3.196 17919 49093 1 120 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.376 -0.039 17919 49094 1 120 . 1 1 33 33 LYS C C 33 177.870 177.870 177.811 0.059 17919 49095 1 120 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.551 0.499 17919 49096 1 120 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.811 0.359 17919 49097 1 120 . 1 1 33 33 LYS H H 33 7.430 7.430 7.432 -0.002 17919 49098 1 120 . 1 1 34 34 GLU N N 34 113.870 113.870 115.830 -1.960 17919 49099 1 120 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.497 0.128 17919 49100 1 120 . 1 1 34 34 GLU C C 34 177.840 177.840 176.789 1.051 17919 49101 1 120 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.935 -0.765 17919 49102 1 120 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.357 1.303 17919 49103 1 120 . 1 1 34 34 GLU H H 34 8.740 8.740 8.362 0.378 17919 49104 1 120 . 1 1 35 35 GLY N N 35 108.650 108.650 108.596 0.054 17919 49105 1 120 . 1 1 35 35 GLY C C 35 173.960 173.960 174.625 -0.665 17919 49106 1 120 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.866 0.214 17919 49107 1 120 . 1 1 35 35 GLY H H 35 8.530 8.530 8.276 0.254 17919 49108 1 120 . 1 1 36 36 ILE N N 36 119.880 119.880 118.606 1.274 17919 49109 1 120 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.267 0.178 17919 49110 1 120 . 1 1 36 36 ILE C C 36 173.590 173.590 173.954 -0.364 17919 49111 1 120 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.846 -1.096 17919 49112 1 120 . 1 1 36 36 ILE CB C 36 40.580 40.580 37.641 2.939 17919 49113 1 120 . 1 1 36 36 ILE H H 36 6.150 6.150 7.702 -1.552 17919 49114 1 120 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.684 -0.050 17919 49115 1 120 . 1 1 37 37 PRO C C 37 176.940 176.940 176.136 0.804 17919 49116 1 120 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.545 0.114 17919 49117 1 120 . 1 1 37 37 PRO CB C 37 31.850 31.850 30.888 0.962 17919 49118 1 120 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.195 -0.078 17919 49119 1 120 . 1 1 38 38 PRO C C 38 178.320 178.320 177.602 0.718 17919 49120 1 120 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.913 0.347 17919 49121 1 120 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.725 1.165 17919 49122 1 120 . 1 1 39 39 ASP N N 39 113.380 113.380 115.612 -2.232 17919 49123 1 120 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.476 -0.046 17919 49124 1 120 . 1 1 39 39 ASP C C 39 177.090 177.090 176.923 0.167 17919 49125 1 120 . 1 1 39 39 ASP CA C 39 55.640 55.640 55.794 -0.153 17919 49126 1 120 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.200 -0.660 17919 49127 1 120 . 1 1 39 39 ASP H H 39 8.550 8.550 8.715 -0.165 17919 49128 1 120 . 1 1 40 40 GLN N N 40 116.780 116.780 116.531 0.249 17919 49129 1 120 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.242 0.222 17919 49130 1 120 . 1 1 40 40 GLN C C 40 175.380 175.380 175.262 0.118 17919 49131 1 120 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.475 -0.835 17919 49132 1 120 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.369 0.771 17919 49133 1 120 . 1 1 40 40 GLN H H 40 7.820 7.820 7.811 0.009 17919 49134 1 120 . 1 1 41 41 GLN N N 41 117.720 117.720 115.818 1.902 17919 49135 1 120 . 1 1 41 41 GLN HA H 41 4.244 4.244 5.427 -1.183 17919 49136 1 120 . 1 1 41 41 GLN C C 41 176.300 176.300 175.248 1.052 17919 49137 1 120 . 1 1 41 41 GLN CA C 41 56.470 56.470 54.245 2.225 17919 49138 1 120 . 1 1 41 41 GLN CB C 41 31.650 31.650 32.172 -0.522 17919 49139 1 120 . 1 1 41 41 GLN H H 41 7.480 7.480 7.326 0.154 17919 49140 1 120 . 1 1 42 42 ARG N N 42 122.680 122.680 121.247 1.433 17919 49141 1 120 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.738 -0.238 17919 49142 1 120 . 1 1 42 42 ARG C C 42 174.050 174.050 174.725 -0.675 17919 49143 1 120 . 1 1 42 42 ARG CA C 42 55.050 55.050 53.858 1.192 17919 49144 1 120 . 1 1 42 42 ARG CB C 42 31.750 31.750 34.262 -2.512 17919 49145 1 120 . 1 1 42 42 ARG H H 42 8.530 8.530 8.436 0.094 17919 49146 1 120 . 1 1 43 43 LEU N N 43 124.040 124.040 120.306 3.734 17919 49147 1 120 . 1 1 43 43 LEU C C 43 175.290 175.290 174.955 0.335 17919 49148 1 120 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.953 -0.973 17919 49149 1 120 . 1 1 43 43 LEU CB C 43 45.790 45.790 45.829 -0.039 17919 49150 1 120 . 1 1 43 43 LEU H H 43 8.820 8.820 8.690 0.130 17919 49151 1 120 . 1 1 44 44 ILE N N 44 121.920 121.920 123.166 -1.246 17919 49152 1 120 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.814 0.178 17919 49153 1 120 . 1 1 44 44 ILE C C 44 176.060 176.060 174.441 1.619 17919 49154 1 120 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.459 -1.479 17919 49155 1 120 . 1 1 44 44 ILE CB C 44 41.420 41.420 39.776 1.644 17919 49156 1 120 . 1 1 44 44 ILE H H 44 9.030 9.030 8.225 0.805 17919 49157 1 120 . 1 1 45 45 PHE N N 45 125.390 125.390 128.600 -3.210 17919 49158 1 120 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.003 0.042 17919 49159 1 120 . 1 1 45 45 PHE C C 45 174.470 174.470 174.774 -0.304 17919 49160 1 120 . 1 1 45 45 PHE CA C 45 57.020 57.020 55.292 1.728 17919 49161 1 120 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.043 0.717 17919 49162 1 120 . 1 1 45 45 PHE H H 45 8.830 8.830 8.943 -0.113 17919 49163 1 120 . 1 1 46 46 ALA N N 46 132.200 132.200 129.292 2.908 17919 49164 1 120 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.608 0.082 17919 49165 1 120 . 1 1 46 46 ALA C C 46 177.290 177.290 177.717 -0.427 17919 49166 1 120 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.545 -0.005 17919 49167 1 120 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.259 0.311 17919 49168 1 120 . 1 1 46 46 ALA H H 46 8.810 8.810 8.898 -0.088 17919 49169 1 120 . 1 1 47 47 GLY N N 47 102.340 102.340 104.406 -2.066 17919 49170 1 120 . 1 1 47 47 GLY C C 47 173.810 173.810 174.256 -0.446 17919 49171 1 120 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.150 0.200 17919 49172 1 120 . 1 1 47 47 GLY H H 47 8.130 8.130 8.477 -0.347 17919 49173 1 120 . 1 1 48 48 LYS N N 48 121.570 121.570 121.865 -0.295 17919 49174 1 120 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.486 0.136 17919 49175 1 120 . 1 1 48 48 LYS C C 48 174.700 174.700 175.293 -0.593 17919 49176 1 120 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.706 -0.156 17919 49177 1 120 . 1 1 48 48 LYS CB C 48 34.530 34.530 33.822 0.708 17919 49178 1 120 . 1 1 48 48 LYS H H 48 7.980 7.980 7.955 0.025 17919 49179 1 120 . 1 1 49 49 GLN N N 49 122.410 122.410 126.178 -3.768 17919 49180 1 120 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.466 0.094 17919 49181 1 120 . 1 1 49 49 GLN C C 49 175.670 175.670 175.537 0.133 17919 49182 1 120 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.373 -0.633 17919 49183 1 120 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.087 -0.087 17919 49184 1 120 . 1 1 49 49 GLN H H 49 8.600 8.600 8.650 -0.050 17919 49185 1 120 . 1 1 50 50 LEU N N 50 125.520 125.520 128.970 -3.450 17919 49186 1 120 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.346 -0.256 17919 49187 1 120 . 1 1 50 50 LEU C C 50 176.660 176.660 176.857 -0.197 17919 49188 1 120 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.129 0.111 17919 49189 1 120 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.898 -0.328 17919 49190 1 120 . 1 1 50 50 LEU H H 50 8.530 8.530 8.807 -0.277 17919 49191 1 120 . 1 1 51 51 GLU N N 51 122.940 122.940 123.125 -0.185 17919 49192 1 120 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.401 0.087 17919 49193 1 120 . 1 1 51 51 GLU C C 51 175.870 175.870 176.432 -0.562 17919 49194 1 120 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.351 0.609 17919 49195 1 120 . 1 1 51 51 GLU CB C 51 31.570 31.570 30.652 0.918 17919 49196 1 120 . 1 1 51 51 GLU H H 51 8.400 8.400 8.427 -0.027 17919 49197 1 120 . 1 1 52 52 ASP N N 52 120.030 120.030 123.395 -3.365 17919 49198 1 120 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.395 -0.036 17919 49199 1 120 . 1 1 52 52 ASP C C 52 177.330 177.330 177.934 -0.604 17919 49200 1 120 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.666 -0.706 17919 49201 1 120 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.672 0.178 17919 49202 1 120 . 1 1 52 52 ASP H H 52 8.160 8.160 8.795 -0.635 17919 49203 1 120 . 1 1 53 53 GLY N N 53 106.660 106.660 105.228 1.432 17919 49204 1 120 . 1 1 53 53 GLY C C 53 174.870 174.870 174.143 0.727 17919 49205 1 120 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.838 0.332 17919 49206 1 120 . 1 1 53 53 GLY H H 53 9.390 9.390 8.209 1.181 17919 49207 1 120 . 1 1 54 54 ARG N N 54 119.050 119.050 120.584 -1.534 17919 49208 1 120 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.877 -0.182 17919 49209 1 120 . 1 1 54 54 ARG C C 54 175.350 175.350 175.099 0.251 17919 49210 1 120 . 1 1 54 54 ARG CA C 54 54.390 54.390 53.587 0.803 17919 49211 1 120 . 1 1 54 54 ARG CB C 54 32.650 32.650 34.197 -1.547 17919 49212 1 120 . 1 1 54 54 ARG H H 54 7.460 7.460 7.671 -0.211 17919 49213 1 120 . 1 1 55 55 THR N N 55 108.400 108.400 112.045 -3.645 17919 49214 1 120 . 1 1 55 55 THR HA H 55 5.240 5.240 5.274 -0.034 17919 49215 1 120 . 1 1 55 55 THR C C 55 176.560 176.560 176.039 0.521 17919 49216 1 120 . 1 1 55 55 THR CA C 55 59.690 59.690 59.709 -0.019 17919 49217 1 120 . 1 1 55 55 THR CB C 55 72.260 72.260 70.953 1.307 17919 49218 1 120 . 1 1 55 55 THR H H 55 8.730 8.730 9.154 -0.424 17919 49219 1 120 . 1 1 56 56 LEU N N 56 117.920 117.920 120.917 -2.997 17919 49220 1 120 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.907 0.153 17919 49221 1 120 . 1 1 56 56 LEU C C 56 180.810 180.810 178.595 2.215 17919 49222 1 120 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.506 0.204 17919 49223 1 120 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.387 -1.017 17919 49224 1 120 . 1 1 56 56 LEU H H 56 8.140 8.140 8.198 -0.058 17919 49225 1 120 . 1 1 57 57 SER N N 57 113.330 113.330 114.265 -0.935 17919 49226 1 120 . 1 1 57 57 SER HA H 57 4.370 4.370 4.128 0.242 17919 49227 1 120 . 1 1 57 57 SER C C 57 178.310 178.310 176.797 1.513 17919 49228 1 120 . 1 1 57 57 SER CA C 57 61.080 61.080 61.156 -0.076 17919 49229 1 120 . 1 1 57 57 SER CB C 57 62.530 62.530 62.240 0.290 17919 49230 1 120 . 1 1 57 57 SER H H 57 8.470 8.470 7.796 0.674 17919 49231 1 120 . 1 1 58 58 ASP N N 58 124.190 124.190 122.727 1.463 17919 49232 1 120 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.220 0.076 17919 49233 1 120 . 1 1 58 58 ASP C C 58 177.400 177.400 176.707 0.693 17919 49234 1 120 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.702 0.478 17919 49235 1 120 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.353 -0.253 17919 49236 1 120 . 1 1 58 58 ASP H H 58 7.930 7.930 7.895 0.035 17919 49237 1 120 . 1 1 59 59 TYR N N 59 115.510 115.510 114.478 1.032 17919 49238 1 120 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.753 -0.083 17919 49239 1 120 . 1 1 59 59 TYR C C 59 174.700 174.700 175.084 -0.384 17919 49240 1 120 . 1 1 59 59 TYR CA C 59 58.250 58.250 56.297 1.953 17919 49241 1 120 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.842 1.228 17919 49242 1 120 . 1 1 59 59 TYR H H 59 7.250 7.250 7.088 0.162 17919 49243 1 120 . 1 1 60 60 ASN N N 60 115.900 115.900 118.412 -2.512 17919 49244 1 120 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.373 -0.018 17919 49245 1 120 . 1 1 60 60 ASN C C 60 174.340 174.340 175.301 -0.961 17919 49246 1 120 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.109 0.011 17919 49247 1 120 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.508 -0.098 17919 49248 1 120 . 1 1 60 60 ASN H H 60 8.150 8.150 8.092 0.058 17919 49249 1 120 . 1 1 61 61 ILE N N 61 118.600 118.600 118.684 -0.084 17919 49250 1 120 . 1 1 61 61 ILE HA H 61 3.393 3.393 4.181 -0.787 17919 49251 1 120 . 1 1 61 61 ILE C C 61 174.610 174.610 174.676 -0.066 17919 49252 1 120 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.547 0.873 17919 49253 1 120 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.780 -1.040 17919 49254 1 120 . 1 1 61 61 ILE H H 61 7.250 7.250 7.322 -0.072 17919 49255 1 120 . 1 1 62 62 GLN N N 62 124.740 124.740 127.841 -3.101 17919 49256 1 120 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.573 -0.067 17919 49257 1 120 . 1 1 62 62 GLN C C 62 175.970 175.970 175.966 0.004 17919 49258 1 120 . 1 1 62 62 GLN CA C 62 53.660 53.660 54.046 -0.386 17919 49259 1 120 . 1 1 62 62 GLN CB C 62 31.650 31.650 29.680 1.970 17919 49260 1 120 . 1 1 62 62 GLN H H 62 7.610 7.610 8.079 -0.469 17919 49261 1 120 . 1 1 63 63 LYS N N 63 120.300 120.300 119.055 1.245 17919 49262 1 120 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.801 0.200 17919 49263 1 120 . 1 1 63 63 LYS C C 63 175.810 175.810 176.468 -0.658 17919 49264 1 120 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.212 -0.422 17919 49265 1 120 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.061 0.589 17919 49266 1 120 . 1 1 63 63 LYS H H 63 8.490 8.490 8.399 0.091 17919 49267 1 120 . 1 1 64 64 GLU N N 64 113.950 113.950 118.123 -4.173 17919 49268 1 120 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.804 -0.339 17919 49269 1 120 . 1 1 64 64 GLU C C 64 175.250 175.250 175.849 -0.599 17919 49270 1 120 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.903 -0.013 17919 49271 1 120 . 1 1 64 64 GLU CB C 64 25.900 25.900 29.091 -3.191 17919 49272 1 120 . 1 1 64 64 GLU H H 64 9.280 9.280 8.747 0.533 17919 49273 1 120 . 1 1 65 65 SER N N 65 114.730 114.730 114.560 0.170 17919 49274 1 120 . 1 1 65 65 SER HA H 65 4.640 4.640 4.556 0.084 17919 49275 1 120 . 1 1 65 65 SER C C 65 172.160 172.160 173.777 -1.617 17919 49276 1 120 . 1 1 65 65 SER CA C 65 60.890 60.890 59.984 0.906 17919 49277 1 120 . 1 1 65 65 SER CB C 65 64.910 64.910 64.424 0.486 17919 49278 1 120 . 1 1 65 65 SER H H 65 7.670 7.670 7.436 0.234 17919 49279 1 120 . 1 1 66 66 THR N N 66 117.110 117.110 117.731 -0.621 17919 49280 1 120 . 1 1 66 66 THR HA H 66 5.270 5.270 5.298 -0.028 17919 49281 1 120 . 1 1 66 66 THR C C 66 173.950 173.950 173.767 0.183 17919 49282 1 120 . 1 1 66 66 THR CA C 66 62.340 62.340 61.665 0.675 17919 49283 1 120 . 1 1 66 66 THR CB C 66 70.080 70.080 70.996 -0.916 17919 49284 1 120 . 1 1 66 66 THR H H 66 8.730 8.730 8.413 0.317 17919 49285 1 120 . 1 1 67 67 LEU N N 67 127.110 127.110 126.088 1.022 17919 49286 1 120 . 1 1 67 67 LEU HA H 67 5.060 5.060 5.082 -0.022 17919 49287 1 120 . 1 1 67 67 LEU C C 67 175.770 175.770 174.924 0.846 17919 49288 1 120 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.578 0.322 17919 49289 1 120 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.360 -0.100 17919 49290 1 120 . 1 1 67 67 LEU H H 67 9.410 9.410 8.859 0.551 17919 49291 1 120 . 1 1 68 68 HIS N N 68 118.380 118.380 120.744 -2.364 17919 49292 1 120 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.264 -0.024 17919 49293 1 120 . 1 1 68 68 HIS C C 68 173.150 173.150 175.555 -2.405 17919 49294 1 120 . 1 1 68 68 HIS CA C 68 55.000 55.000 53.402 1.598 17919 49295 1 120 . 1 1 68 68 HIS CB C 68 30.530 30.530 31.146 -0.616 17919 49296 1 120 . 1 1 68 68 HIS H H 68 9.230 9.230 8.724 0.506 17919 49297 1 120 . 1 1 69 69 LEU N N 69 124.460 124.460 126.744 -2.284 17919 49298 1 120 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.848 0.342 17919 49299 1 120 . 1 1 69 69 LEU C C 69 175.270 175.270 175.316 -0.046 17919 49300 1 120 . 1 1 69 69 LEU CA C 69 53.890 53.890 55.124 -1.234 17919 49301 1 120 . 1 1 69 69 LEU CB C 69 44.380 44.380 43.082 1.298 17919 49302 1 120 . 1 1 69 69 LEU H H 69 8.340 8.340 7.836 0.504 17919 49303 1 120 . 1 1 70 70 VAL N N 70 126.940 126.940 119.707 7.233 17919 49304 1 120 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.531 -0.181 17919 49305 1 120 . 1 1 70 70 VAL C C 70 174.000 174.000 174.741 -0.741 17919 49306 1 120 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.721 1.079 17919 49307 1 120 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.673 -0.763 17919 49308 1 120 . 1 1 70 70 VAL H H 70 9.200 9.200 8.419 0.781 17919 49309 1 120 . 1 1 71 71 LEU N N 71 123.130 123.130 127.580 -4.450 17919 49310 1 120 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.442 0.618 17919 49311 1 120 . 1 1 71 71 LEU C C 71 177.830 177.830 177.305 0.525 17919 49312 1 120 . 1 1 71 71 LEU CA C 71 53.940 53.940 54.523 -0.583 17919 49313 1 120 . 1 1 71 71 LEU CB C 71 42.850 42.850 40.406 2.444 17919 49314 1 120 . 1 1 71 71 LEU H H 71 8.120 8.120 8.720 -0.600 17919 49315 1 120 . 1 1 72 72 ARG N N 72 123.490 123.490 127.919 -4.429 17919 49316 1 120 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.225 0.076 17919 49317 1 120 . 1 1 72 72 ARG C C 72 175.350 175.350 175.491 -0.141 17919 49318 1 120 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.569 0.041 17919 49319 1 120 . 1 1 72 72 ARG CB C 72 31.350 31.350 29.034 2.317 17919 49320 1 120 . 1 1 72 72 ARG H H 72 8.580 8.580 8.660 -0.080 17919 49321 1 121 . 1 1 2 2 GLN N N 2 123.220 123.220 121.313 1.907 17919 49322 1 121 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.149 0.100 17919 49323 1 121 . 1 1 2 2 GLN C C 2 175.920 175.920 175.269 0.651 17919 49324 1 121 . 1 1 2 2 GLN CA C 2 55.080 55.080 55.919 -0.839 17919 49325 1 121 . 1 1 2 2 GLN CB C 2 30.760 30.760 29.140 1.620 17919 49326 1 121 . 1 1 2 2 GLN H H 2 8.900 8.900 8.407 0.493 17919 49327 1 121 . 1 1 3 3 ILE N N 3 115.340 115.340 115.499 -0.159 17919 49328 1 121 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.491 -0.278 17919 49329 1 121 . 1 1 3 3 ILE C C 3 172.450 172.450 174.218 -1.768 17919 49330 1 121 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.081 0.489 17919 49331 1 121 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.712 0.498 17919 49332 1 121 . 1 1 3 3 ILE H H 3 8.320 8.320 8.233 0.087 17919 49333 1 121 . 1 1 4 4 PHE N N 4 118.110 118.110 121.248 -3.138 17919 49334 1 121 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.100 0.530 17919 49335 1 121 . 1 1 4 4 PHE C C 4 175.320 175.320 175.100 0.220 17919 49336 1 121 . 1 1 4 4 PHE CA C 4 55.210 55.210 54.306 0.904 17919 49337 1 121 . 1 1 4 4 PHE CB C 4 41.480 41.480 40.054 1.426 17919 49338 1 121 . 1 1 4 4 PHE H H 4 8.610 8.610 8.242 0.368 17919 49339 1 121 . 1 1 5 5 VAL N N 5 121.000 121.000 125.085 -4.085 17919 49340 1 121 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.497 0.228 17919 49341 1 121 . 1 1 5 5 VAL C C 5 174.870 174.870 175.641 -0.771 17919 49342 1 121 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.637 -1.017 17919 49343 1 121 . 1 1 5 5 VAL CB C 5 34.230 34.230 32.384 1.846 17919 49344 1 121 . 1 1 5 5 VAL H H 5 9.300 9.300 9.357 -0.057 17919 49345 1 121 . 1 1 6 6 LYS N N 6 127.520 127.520 129.430 -1.910 17919 49346 1 121 . 1 1 6 6 LYS HA H 6 5.367 5.367 4.522 0.845 17919 49347 1 121 . 1 1 6 6 LYS C C 6 177.140 177.140 176.876 0.264 17919 49348 1 121 . 1 1 6 6 LYS CA C 6 54.520 54.520 55.810 -1.290 17919 49349 1 121 . 1 1 6 6 LYS CB C 6 35.050 35.050 33.621 1.429 17919 49350 1 121 . 1 1 6 6 LYS H H 6 8.820 8.820 8.851 -0.031 17919 49351 1 121 . 1 1 7 7 THR N N 7 115.400 115.400 116.697 -1.297 17919 49352 1 121 . 1 1 7 7 THR HA H 7 4.970 4.970 4.223 0.747 17919 49353 1 121 . 1 1 7 7 THR C C 7 176.910 176.910 175.228 1.682 17919 49354 1 121 . 1 1 7 7 THR CA C 7 60.470 60.470 61.171 -0.701 17919 49355 1 121 . 1 1 7 7 THR CB C 7 70.630 70.630 69.480 1.150 17919 49356 1 121 . 1 1 7 7 THR H H 7 8.730 8.730 8.039 0.691 17919 49357 1 121 . 1 1 8 8 LEU N N 8 121.330 121.330 119.851 1.479 17919 49358 1 121 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.636 -0.326 17919 49359 1 121 . 1 1 8 8 LEU C C 8 178.800 178.800 176.994 1.806 17919 49360 1 121 . 1 1 8 8 LEU CA C 8 57.580 57.580 56.508 1.073 17919 49361 1 121 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.550 -0.580 17919 49362 1 121 . 1 1 8 8 LEU H H 8 9.100 9.100 8.600 0.500 17919 49363 1 121 . 1 1 9 9 THR N N 9 105.590 105.590 108.274 -2.684 17919 49364 1 121 . 1 1 9 9 THR HA H 9 4.428 4.428 4.461 -0.033 17919 49365 1 121 . 1 1 9 9 THR C C 9 175.520 175.520 175.372 0.148 17919 49366 1 121 . 1 1 9 9 THR CA C 9 61.400 61.400 61.541 -0.141 17919 49367 1 121 . 1 1 9 9 THR CB C 9 69.140 69.140 68.965 0.175 17919 49368 1 121 . 1 1 9 9 THR H H 9 7.630 7.630 7.595 0.035 17919 49369 1 121 . 1 1 10 10 GLY N N 10 108.890 108.890 111.196 -2.306 17919 49370 1 121 . 1 1 10 10 GLY C C 10 174.070 174.070 173.520 0.550 17919 49371 1 121 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.037 0.423 17919 49372 1 121 . 1 1 10 10 GLY H H 10 7.810 7.810 8.676 -0.866 17919 49373 1 121 . 1 1 11 11 LYS N N 11 121.600 121.600 118.564 3.036 17919 49374 1 121 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.649 -0.288 17919 49375 1 121 . 1 1 11 11 LYS C C 11 175.940 175.940 175.354 0.586 17919 49376 1 121 . 1 1 11 11 LYS CA C 11 56.280 56.280 55.297 0.983 17919 49377 1 121 . 1 1 11 11 LYS CB C 11 33.200 33.200 34.576 -1.376 17919 49378 1 121 . 1 1 11 11 LYS H H 11 7.280 7.280 7.682 -0.402 17919 49379 1 121 . 1 1 12 12 THR N N 12 120.440 120.440 118.796 1.644 17919 49380 1 121 . 1 1 12 12 THR HA H 12 5.046 5.046 4.435 0.611 17919 49381 1 121 . 1 1 12 12 THR C C 12 174.320 174.320 174.818 -0.498 17919 49382 1 121 . 1 1 12 12 THR CA C 12 62.390 62.390 63.335 -0.945 17919 49383 1 121 . 1 1 12 12 THR CB C 12 69.910 69.910 69.409 0.501 17919 49384 1 121 . 1 1 12 12 THR H H 12 8.650 8.650 8.463 0.187 17919 49385 1 121 . 1 1 13 13 ILE N N 13 127.110 127.110 126.920 0.190 17919 49386 1 121 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.316 0.228 17919 49387 1 121 . 1 1 13 13 ILE C C 13 175.220 175.220 174.849 0.371 17919 49388 1 121 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.638 -0.658 17919 49389 1 121 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.271 0.679 17919 49390 1 121 . 1 1 13 13 ILE H H 13 9.450 9.450 8.578 0.872 17919 49391 1 121 . 1 1 14 14 THR N N 14 121.520 121.520 124.614 -3.094 17919 49392 1 121 . 1 1 14 14 THR HA H 14 4.964 4.964 5.213 -0.249 17919 49393 1 121 . 1 1 14 14 THR C C 14 173.790 173.790 173.835 -0.045 17919 49394 1 121 . 1 1 14 14 THR CA C 14 61.940 61.940 62.892 -0.952 17919 49395 1 121 . 1 1 14 14 THR CB C 14 69.650 69.650 69.458 0.192 17919 49396 1 121 . 1 1 14 14 THR H H 14 8.710 8.710 8.652 0.058 17919 49397 1 121 . 1 1 15 15 LEU N N 15 124.800 124.800 125.764 -0.964 17919 49398 1 121 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.796 -0.016 17919 49399 1 121 . 1 1 15 15 LEU C C 15 174.670 174.670 174.728 -0.058 17919 49400 1 121 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.753 -0.923 17919 49401 1 121 . 1 1 15 15 LEU CB C 15 47.070 47.070 46.029 1.042 17919 49402 1 121 . 1 1 15 15 LEU H H 15 8.710 8.710 8.184 0.526 17919 49403 1 121 . 1 1 16 16 GLU N N 16 122.160 122.160 122.829 -0.669 17919 49404 1 121 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.507 0.410 17919 49405 1 121 . 1 1 16 16 GLU C C 16 175.860 175.860 176.062 -0.202 17919 49406 1 121 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.605 -0.784 17919 49407 1 121 . 1 1 16 16 GLU CB C 16 29.450 29.450 29.630 -0.180 17919 49408 1 121 . 1 1 16 16 GLU H H 16 8.140 8.140 8.607 -0.467 17919 49409 1 121 . 1 1 17 17 VAL N N 17 117.210 117.210 121.315 -4.105 17919 49410 1 121 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.746 -0.032 17919 49411 1 121 . 1 1 17 17 VAL C C 17 174.160 174.160 175.054 -0.894 17919 49412 1 121 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.626 -0.196 17919 49413 1 121 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.018 1.382 17919 49414 1 121 . 1 1 17 17 VAL H H 17 8.900 8.900 8.926 -0.026 17919 49415 1 121 . 1 1 18 18 GLU N N 18 118.990 118.990 119.478 -0.488 17919 49416 1 121 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.931 0.148 17919 49417 1 121 . 1 1 18 18 GLU C C 18 176.160 176.160 175.401 0.759 17919 49418 1 121 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.070 -0.350 17919 49419 1 121 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.316 -0.006 17919 49420 1 121 . 1 1 18 18 GLU H H 18 8.640 8.640 7.935 0.705 17919 49421 1 121 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.383 -0.242 17919 49422 1 121 . 1 1 19 19 PRO C C 19 175.310 175.310 178.165 -2.855 17919 49423 1 121 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.341 0.129 17919 49424 1 121 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.057 -0.107 17919 49425 1 121 . 1 1 20 20 SER N N 20 103.400 103.400 111.803 -8.403 17919 49426 1 121 . 1 1 20 20 SER HA H 20 4.370 4.370 4.318 0.052 17919 49427 1 121 . 1 1 20 20 SER C C 20 174.660 174.660 174.534 0.126 17919 49428 1 121 . 1 1 20 20 SER CA C 20 57.400 57.400 59.014 -1.614 17919 49429 1 121 . 1 1 20 20 SER CB C 20 63.370 63.370 62.949 0.421 17919 49430 1 121 . 1 1 20 20 SER H H 20 7.040 7.040 8.267 -1.227 17919 49431 1 121 . 1 1 21 21 ASP N N 21 123.480 123.480 123.855 -0.375 17919 49432 1 121 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.682 0.013 17919 49433 1 121 . 1 1 21 21 ASP C C 21 176.360 176.360 175.444 0.916 17919 49434 1 121 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.240 0.460 17919 49435 1 121 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.265 -0.465 17919 49436 1 121 . 1 1 21 21 ASP H H 21 8.030 8.030 7.654 0.376 17919 49437 1 121 . 1 1 22 22 THR N N 22 108.800 108.800 111.415 -2.615 17919 49438 1 121 . 1 1 22 22 THR HA H 22 4.920 4.920 4.558 0.362 17919 49439 1 121 . 1 1 22 22 THR C C 22 176.750 176.750 175.742 1.008 17919 49440 1 121 . 1 1 22 22 THR CA C 22 59.690 59.690 61.284 -1.594 17919 49441 1 121 . 1 1 22 22 THR CB C 22 71.200 71.200 70.608 0.592 17919 49442 1 121 . 1 1 22 22 THR H H 22 7.900 7.900 8.132 -0.232 17919 49443 1 121 . 1 1 23 23 ILE N N 23 121.190 121.190 122.426 -1.236 17919 49444 1 121 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.893 -0.236 17919 49445 1 121 . 1 1 23 23 ILE C C 23 179.040 179.040 177.373 1.667 17919 49446 1 121 . 1 1 23 23 ILE CA C 23 62.260 62.260 61.367 0.893 17919 49447 1 121 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.722 -2.372 17919 49448 1 121 . 1 1 23 23 ILE H H 23 8.560 8.560 8.780 -0.220 17919 49449 1 121 . 1 1 24 24 GLU N N 24 120.830 120.830 121.931 -1.101 17919 49450 1 121 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.863 0.054 17919 49451 1 121 . 1 1 24 24 GLU C C 24 178.640 178.640 178.726 -0.086 17919 49452 1 121 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.104 0.116 17919 49453 1 121 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.384 -1.103 17919 49454 1 121 . 1 1 24 24 GLU H H 24 9.760 9.760 8.523 1.237 17919 49455 1 121 . 1 1 25 25 ASN N N 25 120.570 120.570 117.927 2.643 17919 49456 1 121 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.494 0.031 17919 49457 1 121 . 1 1 25 25 ASN C C 25 178.380 178.380 177.933 0.447 17919 49458 1 121 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.113 -0.053 17919 49459 1 121 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.814 -0.364 17919 49460 1 121 . 1 1 25 25 ASN H H 25 7.920 7.920 7.470 0.450 17919 49461 1 121 . 1 1 26 26 VAL N N 26 121.710 121.710 120.421 1.289 17919 49462 1 121 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.797 -0.400 17919 49463 1 121 . 1 1 26 26 VAL C C 26 177.950 177.950 177.277 0.673 17919 49464 1 121 . 1 1 26 26 VAL CA C 26 67.660 67.660 64.016 3.644 17919 49465 1 121 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.638 -0.798 17919 49466 1 121 . 1 1 26 26 VAL H H 26 8.070 8.070 7.964 0.106 17919 49467 1 121 . 1 1 27 27 LYS N N 27 118.860 118.860 119.881 -1.021 17919 49468 1 121 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.245 0.335 17919 49469 1 121 . 1 1 27 27 LYS C C 27 180.550 180.550 178.727 1.823 17919 49470 1 121 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.426 -0.176 17919 49471 1 121 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.303 1.427 17919 49472 1 121 . 1 1 27 27 LYS H H 27 8.560 8.560 8.338 0.222 17919 49473 1 121 . 1 1 28 28 ALA N N 28 123.440 123.440 122.044 1.396 17919 49474 1 121 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.126 0.034 17919 49475 1 121 . 1 1 28 28 ALA C C 28 180.300 180.300 179.133 1.167 17919 49476 1 121 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.862 0.508 17919 49477 1 121 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.378 -0.668 17919 49478 1 121 . 1 1 28 28 ALA H H 28 8.060 8.060 8.314 -0.254 17919 49479 1 121 . 1 1 29 29 LYS N N 29 119.940 119.940 119.863 0.077 17919 49480 1 121 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.027 0.180 17919 49481 1 121 . 1 1 29 29 LYS C C 29 180.320 180.320 178.939 1.381 17919 49482 1 121 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.416 0.234 17919 49483 1 121 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.266 1.024 17919 49484 1 121 . 1 1 29 29 LYS H H 29 7.850 7.850 7.552 0.298 17919 49485 1 121 . 1 1 30 30 ILE N N 30 121.080 121.080 120.492 0.588 17919 49486 1 121 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.548 -0.041 17919 49487 1 121 . 1 1 30 30 ILE C C 30 178.310 178.310 177.265 1.045 17919 49488 1 121 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.956 0.194 17919 49489 1 121 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.667 -0.867 17919 49490 1 121 . 1 1 30 30 ILE H H 30 8.280 8.280 7.516 0.764 17919 49491 1 121 . 1 1 31 31 GLN N N 31 123.490 123.490 119.489 4.001 17919 49492 1 121 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.951 -0.122 17919 49493 1 121 . 1 1 31 31 GLN C C 31 178.890 178.890 178.140 0.750 17919 49494 1 121 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.477 0.523 17919 49495 1 121 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.437 -0.717 17919 49496 1 121 . 1 1 31 31 GLN H H 31 8.580 8.580 7.763 0.817 17919 49497 1 121 . 1 1 32 32 ASP N N 32 119.360 119.360 118.828 0.532 17919 49498 1 121 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.384 -0.030 17919 49499 1 121 . 1 1 32 32 ASP C C 32 177.250 177.250 178.151 -0.901 17919 49500 1 121 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.747 0.443 17919 49501 1 121 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.944 -0.364 17919 49502 1 121 . 1 1 32 32 ASP H H 32 8.010 8.010 7.902 0.108 17919 49503 1 121 . 1 1 33 33 LYS N N 33 115.130 115.130 116.042 -0.912 17919 49504 1 121 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.372 -0.035 17919 49505 1 121 . 1 1 33 33 LYS C C 33 177.870 177.870 177.025 0.845 17919 49506 1 121 . 1 1 33 33 LYS CA C 33 58.050 58.050 56.764 1.286 17919 49507 1 121 . 1 1 33 33 LYS CB C 33 34.170 34.170 34.265 -0.095 17919 49508 1 121 . 1 1 33 33 LYS H H 33 7.430 7.430 7.707 -0.277 17919 49509 1 121 . 1 1 34 34 GLU N N 34 113.870 113.870 118.529 -4.659 17919 49510 1 121 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.440 0.185 17919 49511 1 121 . 1 1 34 34 GLU C C 34 177.840 177.840 176.408 1.432 17919 49512 1 121 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.693 -0.523 17919 49513 1 121 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.287 1.373 17919 49514 1 121 . 1 1 34 34 GLU H H 34 8.740 8.740 8.366 0.374 17919 49515 1 121 . 1 1 35 35 GLY N N 35 108.650 108.650 107.777 0.873 17919 49516 1 121 . 1 1 35 35 GLY C C 35 173.960 173.960 174.764 -0.804 17919 49517 1 121 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.089 0.991 17919 49518 1 121 . 1 1 35 35 GLY H H 35 8.530 8.530 7.702 0.828 17919 49519 1 121 . 1 1 36 36 ILE N N 36 119.880 119.880 121.682 -1.802 17919 49520 1 121 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.398 0.047 17919 49521 1 121 . 1 1 36 36 ILE C C 36 173.590 173.590 174.379 -0.789 17919 49522 1 121 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.021 -0.271 17919 49523 1 121 . 1 1 36 36 ILE CB C 36 40.580 40.580 37.991 2.589 17919 49524 1 121 . 1 1 36 36 ILE H H 36 6.150 6.150 7.674 -1.524 17919 49525 1 121 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.846 -0.212 17919 49526 1 121 . 1 1 37 37 PRO C C 37 176.940 176.940 175.983 0.957 17919 49527 1 121 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.536 0.124 17919 49528 1 121 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.057 0.793 17919 49529 1 121 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.348 -0.232 17919 49530 1 121 . 1 1 38 38 PRO C C 38 178.320 178.320 178.008 0.312 17919 49531 1 121 . 1 1 38 38 PRO CA C 38 66.260 66.260 64.934 1.326 17919 49532 1 121 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.711 1.179 17919 49533 1 121 . 1 1 39 39 ASP N N 39 113.380 113.380 117.026 -3.646 17919 49534 1 121 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.348 0.082 17919 49535 1 121 . 1 1 39 39 ASP C C 39 177.090 177.090 176.657 0.433 17919 49536 1 121 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.155 -0.515 17919 49537 1 121 . 1 1 39 39 ASP CB C 39 39.540 39.540 39.110 0.430 17919 49538 1 121 . 1 1 39 39 ASP H H 39 8.550 8.550 8.846 -0.296 17919 49539 1 121 . 1 1 40 40 GLN N N 40 116.780 116.780 117.417 -0.637 17919 49540 1 121 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.510 -0.046 17919 49541 1 121 . 1 1 40 40 GLN C C 40 175.380 175.380 174.873 0.507 17919 49542 1 121 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.408 0.232 17919 49543 1 121 . 1 1 40 40 GLN CB C 40 30.140 30.140 30.113 0.027 17919 49544 1 121 . 1 1 40 40 GLN H H 40 7.820 7.820 7.506 0.314 17919 49545 1 121 . 1 1 41 41 GLN N N 41 117.720 117.720 119.185 -1.465 17919 49546 1 121 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.487 -0.243 17919 49547 1 121 . 1 1 41 41 GLN C C 41 176.300 176.300 176.157 0.143 17919 49548 1 121 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.472 0.998 17919 49549 1 121 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.302 2.348 17919 49550 1 121 . 1 1 41 41 GLN H H 41 7.480 7.480 7.372 0.108 17919 49551 1 121 . 1 1 42 42 ARG N N 42 122.680 122.680 127.794 -5.114 17919 49552 1 121 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.636 -0.136 17919 49553 1 121 . 1 1 42 42 ARG C C 42 174.050 174.050 174.621 -0.571 17919 49554 1 121 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.309 0.741 17919 49555 1 121 . 1 1 42 42 ARG CB C 42 31.750 31.750 30.765 0.985 17919 49556 1 121 . 1 1 42 42 ARG H H 42 8.530 8.530 8.292 0.238 17919 49557 1 121 . 1 1 43 43 LEU N N 43 124.040 124.040 125.673 -1.633 17919 49558 1 121 . 1 1 43 43 LEU C C 43 175.290 175.290 175.098 0.192 17919 49559 1 121 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.825 -1.845 17919 49560 1 121 . 1 1 43 43 LEU CB C 43 45.790 45.790 42.231 3.559 17919 49561 1 121 . 1 1 43 43 LEU H H 43 8.820 8.820 8.148 0.672 17919 49562 1 121 . 1 1 44 44 ILE N N 44 121.920 121.920 119.954 1.966 17919 49563 1 121 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.484 0.508 17919 49564 1 121 . 1 1 44 44 ILE C C 44 176.060 176.060 173.445 2.615 17919 49565 1 121 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.149 -0.169 17919 49566 1 121 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.835 -0.415 17919 49567 1 121 . 1 1 44 44 ILE H H 44 9.030 9.030 7.496 1.534 17919 49568 1 121 . 1 1 45 45 PHE N N 45 125.390 125.390 124.355 1.035 17919 49569 1 121 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.016 0.029 17919 49570 1 121 . 1 1 45 45 PHE C C 45 174.470 174.470 174.841 -0.371 17919 49571 1 121 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.261 0.759 17919 49572 1 121 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.953 0.807 17919 49573 1 121 . 1 1 45 45 PHE H H 45 8.830 8.830 7.931 0.899 17919 49574 1 121 . 1 1 46 46 ALA N N 46 132.200 132.200 128.284 3.916 17919 49575 1 121 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.623 0.067 17919 49576 1 121 . 1 1 46 46 ALA C C 46 177.290 177.290 177.468 -0.178 17919 49577 1 121 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.487 0.053 17919 49578 1 121 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.714 -0.144 17919 49579 1 121 . 1 1 46 46 ALA H H 46 8.810 8.810 8.584 0.226 17919 49580 1 121 . 1 1 47 47 GLY N N 47 102.340 102.340 104.038 -1.698 17919 49581 1 121 . 1 1 47 47 GLY C C 47 173.810 173.810 174.213 -0.403 17919 49582 1 121 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.004 0.346 17919 49583 1 121 . 1 1 47 47 GLY H H 47 8.130 8.130 8.404 -0.274 17919 49584 1 121 . 1 1 48 48 LYS N N 48 121.570 121.570 121.696 -0.126 17919 49585 1 121 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.555 0.067 17919 49586 1 121 . 1 1 48 48 LYS C C 48 174.700 174.700 175.678 -0.978 17919 49587 1 121 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.847 -0.297 17919 49588 1 121 . 1 1 48 48 LYS CB C 48 34.530 34.530 33.854 0.676 17919 49589 1 121 . 1 1 48 48 LYS H H 48 7.980 7.980 7.687 0.293 17919 49590 1 121 . 1 1 49 49 GLN N N 49 122.410 122.410 125.815 -3.405 17919 49591 1 121 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.192 0.368 17919 49592 1 121 . 1 1 49 49 GLN C C 49 175.670 175.670 175.930 -0.260 17919 49593 1 121 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.000 -0.260 17919 49594 1 121 . 1 1 49 49 GLN CB C 49 29.000 29.000 28.961 0.039 17919 49595 1 121 . 1 1 49 49 GLN H H 49 8.600 8.600 8.859 -0.259 17919 49596 1 121 . 1 1 50 50 LEU N N 50 125.520 125.520 126.518 -0.998 17919 49597 1 121 . 1 1 50 50 LEU HA H 50 4.090 4.090 3.766 0.324 17919 49598 1 121 . 1 1 50 50 LEU C C 50 176.660 176.660 176.636 0.024 17919 49599 1 121 . 1 1 50 50 LEU CA C 50 54.240 54.240 55.407 -1.167 17919 49600 1 121 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.134 -0.564 17919 49601 1 121 . 1 1 50 50 LEU H H 50 8.530 8.530 7.923 0.607 17919 49602 1 121 . 1 1 51 51 GLU N N 51 122.940 122.940 121.626 1.314 17919 49603 1 121 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.548 -0.060 17919 49604 1 121 . 1 1 51 51 GLU C C 51 175.870 175.870 175.974 -0.104 17919 49605 1 121 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.015 0.945 17919 49606 1 121 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.489 -0.919 17919 49607 1 121 . 1 1 51 51 GLU H H 51 8.400 8.400 8.296 0.104 17919 49608 1 121 . 1 1 52 52 ASP N N 52 120.030 120.030 125.178 -5.148 17919 49609 1 121 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.392 -0.033 17919 49610 1 121 . 1 1 52 52 ASP C C 52 177.330 177.330 177.671 -0.341 17919 49611 1 121 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.866 -0.906 17919 49612 1 121 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.947 -0.097 17919 49613 1 121 . 1 1 52 52 ASP H H 52 8.160 8.160 8.870 -0.710 17919 49614 1 121 . 1 1 53 53 GLY N N 53 106.660 106.660 103.837 2.823 17919 49615 1 121 . 1 1 53 53 GLY C C 53 174.870 174.870 174.369 0.501 17919 49616 1 121 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.967 0.203 17919 49617 1 121 . 1 1 53 53 GLY H H 53 9.390 9.390 8.173 1.217 17919 49618 1 121 . 1 1 54 54 ARG N N 54 119.050 119.050 121.056 -2.006 17919 49619 1 121 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.448 0.247 17919 49620 1 121 . 1 1 54 54 ARG C C 54 175.350 175.350 175.366 -0.016 17919 49621 1 121 . 1 1 54 54 ARG CA C 54 54.390 54.390 55.823 -1.433 17919 49622 1 121 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.044 0.606 17919 49623 1 121 . 1 1 54 54 ARG H H 54 7.460 7.460 7.833 -0.373 17919 49624 1 121 . 1 1 55 55 THR N N 55 108.400 108.400 115.753 -7.353 17919 49625 1 121 . 1 1 55 55 THR HA H 55 5.240 5.240 4.796 0.444 17919 49626 1 121 . 1 1 55 55 THR C C 55 176.560 176.560 176.309 0.251 17919 49627 1 121 . 1 1 55 55 THR CA C 55 59.690 59.690 61.841 -2.151 17919 49628 1 121 . 1 1 55 55 THR CB C 55 72.260 72.260 69.733 2.527 17919 49629 1 121 . 1 1 55 55 THR H H 55 8.730 8.730 8.285 0.445 17919 49630 1 121 . 1 1 56 56 LEU N N 56 117.920 117.920 122.786 -4.866 17919 49631 1 121 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.878 0.182 17919 49632 1 121 . 1 1 56 56 LEU C C 56 180.810 180.810 178.978 1.832 17919 49633 1 121 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.589 0.121 17919 49634 1 121 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.061 -0.691 17919 49635 1 121 . 1 1 56 56 LEU H H 56 8.140 8.140 8.393 -0.253 17919 49636 1 121 . 1 1 57 57 SER N N 57 113.330 113.330 112.315 1.015 17919 49637 1 121 . 1 1 57 57 SER HA H 57 4.370 4.370 4.109 0.261 17919 49638 1 121 . 1 1 57 57 SER C C 57 178.310 178.310 176.720 1.590 17919 49639 1 121 . 1 1 57 57 SER CA C 57 61.080 61.080 61.181 -0.101 17919 49640 1 121 . 1 1 57 57 SER CB C 57 62.530 62.530 62.256 0.274 17919 49641 1 121 . 1 1 57 57 SER H H 57 8.470 8.470 7.954 0.516 17919 49642 1 121 . 1 1 58 58 ASP N N 58 124.190 124.190 123.673 0.517 17919 49643 1 121 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.303 -0.007 17919 49644 1 121 . 1 1 58 58 ASP C C 58 177.400 177.400 177.166 0.234 17919 49645 1 121 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.499 0.681 17919 49646 1 121 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.550 -0.450 17919 49647 1 121 . 1 1 58 58 ASP H H 58 7.930 7.930 7.904 0.026 17919 49648 1 121 . 1 1 59 59 TYR N N 59 115.510 115.510 117.140 -1.630 17919 49649 1 121 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.434 0.236 17919 49650 1 121 . 1 1 59 59 TYR C C 59 174.700 174.700 175.471 -0.771 17919 49651 1 121 . 1 1 59 59 TYR CA C 59 58.250 58.250 58.948 -0.698 17919 49652 1 121 . 1 1 59 59 TYR CB C 59 40.070 40.070 37.919 2.151 17919 49653 1 121 . 1 1 59 59 TYR H H 59 7.250 7.250 7.347 -0.097 17919 49654 1 121 . 1 1 60 60 ASN N N 60 115.900 115.900 113.987 1.913 17919 49655 1 121 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.322 0.033 17919 49656 1 121 . 1 1 60 60 ASN C C 60 174.340 174.340 174.507 -0.167 17919 49657 1 121 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.760 -0.640 17919 49658 1 121 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.355 0.055 17919 49659 1 121 . 1 1 60 60 ASN H H 60 8.150 8.150 7.659 0.491 17919 49660 1 121 . 1 1 61 61 ILE N N 61 118.600 118.600 119.903 -1.303 17919 49661 1 121 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.678 -0.285 17919 49662 1 121 . 1 1 61 61 ILE C C 61 174.610 174.610 174.790 -0.180 17919 49663 1 121 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.227 0.193 17919 49664 1 121 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.570 -0.830 17919 49665 1 121 . 1 1 61 61 ILE H H 61 7.250 7.250 7.826 -0.576 17919 49666 1 121 . 1 1 62 62 GLN N N 62 124.740 124.740 125.915 -1.175 17919 49667 1 121 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.632 -0.126 17919 49668 1 121 . 1 1 62 62 GLN C C 62 175.970 175.970 175.050 0.920 17919 49669 1 121 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.722 -0.062 17919 49670 1 121 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.011 0.639 17919 49671 1 121 . 1 1 62 62 GLN H H 62 7.610 7.610 7.972 -0.362 17919 49672 1 121 . 1 1 63 63 LYS N N 63 120.300 120.300 118.436 1.864 17919 49673 1 121 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.045 -0.044 17919 49674 1 121 . 1 1 63 63 LYS C C 63 175.810 175.810 176.669 -0.859 17919 49675 1 121 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.468 0.323 17919 49676 1 121 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.332 0.318 17919 49677 1 121 . 1 1 63 63 LYS H H 63 8.490 8.490 8.364 0.126 17919 49678 1 121 . 1 1 64 64 GLU N N 64 113.950 113.950 118.499 -4.549 17919 49679 1 121 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.318 0.147 17919 49680 1 121 . 1 1 64 64 GLU C C 64 175.250 175.250 175.366 -0.116 17919 49681 1 121 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.466 0.424 17919 49682 1 121 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.454 -2.554 17919 49683 1 121 . 1 1 64 64 GLU H H 64 9.280 9.280 8.404 0.876 17919 49684 1 121 . 1 1 65 65 SER N N 65 114.730 114.730 113.484 1.246 17919 49685 1 121 . 1 1 65 65 SER HA H 65 4.640 4.640 4.402 0.238 17919 49686 1 121 . 1 1 65 65 SER C C 65 172.160 172.160 174.021 -1.861 17919 49687 1 121 . 1 1 65 65 SER CA C 65 60.890 60.890 59.912 0.978 17919 49688 1 121 . 1 1 65 65 SER CB C 65 64.910 64.910 64.002 0.908 17919 49689 1 121 . 1 1 65 65 SER H H 65 7.670 7.670 7.267 0.403 17919 49690 1 121 . 1 1 66 66 THR N N 66 117.110 117.110 119.435 -2.325 17919 49691 1 121 . 1 1 66 66 THR HA H 66 5.270 5.270 5.040 0.230 17919 49692 1 121 . 1 1 66 66 THR C C 66 173.950 173.950 173.784 0.166 17919 49693 1 121 . 1 1 66 66 THR CA C 66 62.340 62.340 61.832 0.508 17919 49694 1 121 . 1 1 66 66 THR CB C 66 70.080 70.080 70.467 -0.387 17919 49695 1 121 . 1 1 66 66 THR H H 66 8.730 8.730 8.394 0.336 17919 49696 1 121 . 1 1 67 67 LEU N N 67 127.110 127.110 127.029 0.081 17919 49697 1 121 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.862 0.198 17919 49698 1 121 . 1 1 67 67 LEU C C 67 175.770 175.770 175.163 0.607 17919 49699 1 121 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.095 -0.195 17919 49700 1 121 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.180 0.080 17919 49701 1 121 . 1 1 67 67 LEU H H 67 9.410 9.410 9.269 0.141 17919 49702 1 121 . 1 1 68 68 HIS N N 68 118.380 118.380 124.192 -5.812 17919 49703 1 121 . 1 1 68 68 HIS HA H 68 5.240 5.240 4.912 0.328 17919 49704 1 121 . 1 1 68 68 HIS C C 68 173.150 173.150 174.893 -1.743 17919 49705 1 121 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.958 0.042 17919 49706 1 121 . 1 1 68 68 HIS CB C 68 30.530 30.530 29.716 0.814 17919 49707 1 121 . 1 1 68 68 HIS H H 68 9.230 9.230 8.304 0.926 17919 49708 1 121 . 1 1 69 69 LEU N N 69 124.460 124.460 127.838 -3.378 17919 49709 1 121 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.094 1.096 17919 49710 1 121 . 1 1 69 69 LEU C C 69 175.270 175.270 175.205 0.065 17919 49711 1 121 . 1 1 69 69 LEU CA C 69 53.890 53.890 55.840 -1.950 17919 49712 1 121 . 1 1 69 69 LEU CB C 69 44.380 44.380 42.264 2.116 17919 49713 1 121 . 1 1 69 69 LEU H H 69 8.340 8.340 7.724 0.616 17919 49714 1 121 . 1 1 70 70 VAL N N 70 126.940 126.940 126.564 0.376 17919 49715 1 121 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.300 0.050 17919 49716 1 121 . 1 1 70 70 VAL C C 70 174.000 174.000 175.263 -1.263 17919 49717 1 121 . 1 1 70 70 VAL CA C 70 60.800 60.800 62.047 -1.247 17919 49718 1 121 . 1 1 70 70 VAL CB C 70 34.910 34.910 33.083 1.827 17919 49719 1 121 . 1 1 70 70 VAL H H 70 9.200 9.200 8.401 0.799 17919 49720 1 121 . 1 1 71 71 LEU N N 71 123.130 123.130 123.449 -0.319 17919 49721 1 121 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.826 0.234 17919 49722 1 121 . 1 1 71 71 LEU C C 71 177.830 177.830 176.956 0.874 17919 49723 1 121 . 1 1 71 71 LEU CA C 71 53.940 53.940 52.388 1.552 17919 49724 1 121 . 1 1 71 71 LEU CB C 71 42.850 42.850 44.210 -1.360 17919 49725 1 121 . 1 1 71 71 LEU H H 71 8.120 8.120 8.213 -0.093 17919 49726 1 121 . 1 1 72 72 ARG N N 72 123.490 123.490 120.590 2.900 17919 49727 1 121 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.241 0.060 17919 49728 1 121 . 1 1 72 72 ARG C C 72 175.350 175.350 175.027 0.323 17919 49729 1 121 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.739 -1.129 17919 49730 1 121 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.665 0.685 17919 49731 1 121 . 1 1 72 72 ARG H H 72 8.580 8.580 8.470 0.110 17919 49732 1 122 . 1 1 2 2 GLN N N 2 123.220 123.220 121.945 1.275 17919 49733 1 122 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.256 -0.007 17919 49734 1 122 . 1 1 2 2 GLN C C 2 175.920 175.920 174.931 0.989 17919 49735 1 122 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.080 1.000 17919 49736 1 122 . 1 1 2 2 GLN CB C 2 30.760 30.760 31.635 -0.875 17919 49737 1 122 . 1 1 2 2 GLN H H 2 8.900 8.900 8.248 0.652 17919 49738 1 122 . 1 1 3 3 ILE N N 3 115.340 115.340 115.483 -0.143 17919 49739 1 122 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.211 0.002 17919 49740 1 122 . 1 1 3 3 ILE C C 3 172.450 172.450 173.388 -0.938 17919 49741 1 122 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.638 -0.068 17919 49742 1 122 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.508 0.702 17919 49743 1 122 . 1 1 3 3 ILE H H 3 8.320 8.320 7.796 0.524 17919 49744 1 122 . 1 1 4 4 PHE N N 4 118.110 118.110 120.033 -1.923 17919 49745 1 122 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.279 0.351 17919 49746 1 122 . 1 1 4 4 PHE C C 4 175.320 175.320 175.344 -0.024 17919 49747 1 122 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.255 -0.045 17919 49748 1 122 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.728 -0.249 17919 49749 1 122 . 1 1 4 4 PHE H H 4 8.610 8.610 7.808 0.802 17919 49750 1 122 . 1 1 5 5 VAL N N 5 121.000 121.000 122.735 -1.735 17919 49751 1 122 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.784 -0.059 17919 49752 1 122 . 1 1 5 5 VAL C C 5 174.870 174.870 175.147 -0.277 17919 49753 1 122 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.246 -0.626 17919 49754 1 122 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.391 0.840 17919 49755 1 122 . 1 1 5 5 VAL H H 5 9.300 9.300 8.453 0.847 17919 49756 1 122 . 1 1 6 6 LYS N N 6 127.520 127.520 130.139 -2.619 17919 49757 1 122 . 1 1 6 6 LYS HA H 6 5.367 5.367 4.799 0.568 17919 49758 1 122 . 1 1 6 6 LYS C C 6 177.140 177.140 176.915 0.225 17919 49759 1 122 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.611 -0.091 17919 49760 1 122 . 1 1 6 6 LYS CB C 6 35.050 35.050 32.337 2.713 17919 49761 1 122 . 1 1 6 6 LYS H H 6 8.820 8.820 8.861 -0.041 17919 49762 1 122 . 1 1 7 7 THR N N 7 115.400 115.400 119.665 -4.265 17919 49763 1 122 . 1 1 7 7 THR HA H 7 4.970 4.970 4.209 0.761 17919 49764 1 122 . 1 1 7 7 THR C C 7 176.910 176.910 174.876 2.034 17919 49765 1 122 . 1 1 7 7 THR CA C 7 60.470 60.470 61.670 -1.200 17919 49766 1 122 . 1 1 7 7 THR CB C 7 70.630 70.630 69.573 1.057 17919 49767 1 122 . 1 1 7 7 THR H H 7 8.730 8.730 8.056 0.674 17919 49768 1 122 . 1 1 8 8 LEU N N 8 121.330 121.330 120.575 0.755 17919 49769 1 122 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.329 -0.019 17919 49770 1 122 . 1 1 8 8 LEU C C 8 178.800 178.800 177.857 0.943 17919 49771 1 122 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.123 0.457 17919 49772 1 122 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.120 -0.150 17919 49773 1 122 . 1 1 8 8 LEU H H 8 9.100 9.100 8.538 0.562 17919 49774 1 122 . 1 1 9 9 THR N N 9 105.590 105.590 106.117 -0.527 17919 49775 1 122 . 1 1 9 9 THR HA H 9 4.428 4.428 4.280 0.148 17919 49776 1 122 . 1 1 9 9 THR C C 9 175.520 175.520 175.719 -0.199 17919 49777 1 122 . 1 1 9 9 THR CA C 9 61.400 61.400 61.937 -0.537 17919 49778 1 122 . 1 1 9 9 THR CB C 9 69.140 69.140 69.198 -0.058 17919 49779 1 122 . 1 1 9 9 THR H H 9 7.630 7.630 7.650 -0.020 17919 49780 1 122 . 1 1 10 10 GLY N N 10 108.890 108.890 111.017 -2.127 17919 49781 1 122 . 1 1 10 10 GLY C C 10 174.070 174.070 174.137 -0.067 17919 49782 1 122 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.813 0.647 17919 49783 1 122 . 1 1 10 10 GLY H H 10 7.810 7.810 7.679 0.131 17919 49784 1 122 . 1 1 11 11 LYS N N 11 121.600 121.600 121.260 0.340 17919 49785 1 122 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.292 0.069 17919 49786 1 122 . 1 1 11 11 LYS C C 11 175.940 175.940 175.265 0.675 17919 49787 1 122 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.656 -0.376 17919 49788 1 122 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.683 -0.483 17919 49789 1 122 . 1 1 11 11 LYS H H 11 7.280 7.280 7.483 -0.203 17919 49790 1 122 . 1 1 12 12 THR N N 12 120.440 120.440 115.912 4.528 17919 49791 1 122 . 1 1 12 12 THR HA H 12 5.046 5.046 4.921 0.125 17919 49792 1 122 . 1 1 12 12 THR C C 12 174.320 174.320 174.925 -0.605 17919 49793 1 122 . 1 1 12 12 THR CA C 12 62.390 62.390 61.074 1.316 17919 49794 1 122 . 1 1 12 12 THR CB C 12 69.910 69.910 69.417 0.493 17919 49795 1 122 . 1 1 12 12 THR H H 12 8.650 8.650 8.238 0.412 17919 49796 1 122 . 1 1 13 13 ILE N N 13 127.110 127.110 127.809 -0.699 17919 49797 1 122 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.422 0.122 17919 49798 1 122 . 1 1 13 13 ILE C C 13 175.220 175.220 176.020 -0.800 17919 49799 1 122 . 1 1 13 13 ILE CA C 13 59.980 59.980 61.033 -1.053 17919 49800 1 122 . 1 1 13 13 ILE CB C 13 40.950 40.950 39.291 1.659 17919 49801 1 122 . 1 1 13 13 ILE H H 13 9.450 9.450 8.368 1.082 17919 49802 1 122 . 1 1 14 14 THR N N 14 121.520 121.520 121.998 -0.478 17919 49803 1 122 . 1 1 14 14 THR HA H 14 4.964 4.964 5.067 -0.103 17919 49804 1 122 . 1 1 14 14 THR C C 14 173.790 173.790 173.781 0.009 17919 49805 1 122 . 1 1 14 14 THR CA C 14 61.940 61.940 61.523 0.417 17919 49806 1 122 . 1 1 14 14 THR CB C 14 69.650 69.650 70.067 -0.417 17919 49807 1 122 . 1 1 14 14 THR H H 14 8.710 8.710 8.318 0.392 17919 49808 1 122 . 1 1 15 15 LEU N N 15 124.800 124.800 126.596 -1.796 17919 49809 1 122 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.800 -0.020 17919 49810 1 122 . 1 1 15 15 LEU C C 15 174.670 174.670 175.350 -0.680 17919 49811 1 122 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.463 -0.633 17919 49812 1 122 . 1 1 15 15 LEU CB C 15 47.070 47.070 44.495 2.575 17919 49813 1 122 . 1 1 15 15 LEU H H 15 8.710 8.710 8.502 0.208 17919 49814 1 122 . 1 1 16 16 GLU N N 16 122.160 122.160 123.075 -0.915 17919 49815 1 122 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.484 0.433 17919 49816 1 122 . 1 1 16 16 GLU C C 16 175.860 175.860 175.649 0.211 17919 49817 1 122 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.631 -0.811 17919 49818 1 122 . 1 1 16 16 GLU CB C 16 29.450 29.450 29.668 -0.218 17919 49819 1 122 . 1 1 16 16 GLU H H 16 8.140 8.140 8.614 -0.474 17919 49820 1 122 . 1 1 17 17 VAL N N 17 117.210 117.210 121.377 -4.167 17919 49821 1 122 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.554 0.160 17919 49822 1 122 . 1 1 17 17 VAL C C 17 174.160 174.160 174.606 -0.446 17919 49823 1 122 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.033 -0.603 17919 49824 1 122 . 1 1 17 17 VAL CB C 17 36.400 36.400 34.998 1.402 17919 49825 1 122 . 1 1 17 17 VAL H H 17 8.900 8.900 8.912 -0.012 17919 49826 1 122 . 1 1 18 18 GLU N N 18 118.990 118.990 118.680 0.310 17919 49827 1 122 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.815 0.264 17919 49828 1 122 . 1 1 18 18 GLU C C 18 176.160 176.160 175.037 1.123 17919 49829 1 122 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.346 -0.626 17919 49830 1 122 . 1 1 18 18 GLU CB C 18 30.310 30.310 31.569 -1.259 17919 49831 1 122 . 1 1 18 18 GLU H H 18 8.640 8.640 8.428 0.212 17919 49832 1 122 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.322 -0.181 17919 49833 1 122 . 1 1 19 19 PRO C C 19 175.310 175.310 177.539 -2.229 17919 49834 1 122 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.510 -0.040 17919 49835 1 122 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.127 -0.177 17919 49836 1 122 . 1 1 20 20 SER N N 20 103.400 103.400 109.663 -6.263 17919 49837 1 122 . 1 1 20 20 SER HA H 20 4.370 4.370 4.400 -0.030 17919 49838 1 122 . 1 1 20 20 SER C C 20 174.660 174.660 174.131 0.529 17919 49839 1 122 . 1 1 20 20 SER CA C 20 57.400 57.400 59.000 -1.600 17919 49840 1 122 . 1 1 20 20 SER CB C 20 63.370 63.370 63.158 0.212 17919 49841 1 122 . 1 1 20 20 SER H H 20 7.040 7.040 7.961 -0.921 17919 49842 1 122 . 1 1 21 21 ASP N N 21 123.480 123.480 123.641 -0.161 17919 49843 1 122 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.584 0.111 17919 49844 1 122 . 1 1 21 21 ASP C C 21 176.360 176.360 175.801 0.559 17919 49845 1 122 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.497 0.203 17919 49846 1 122 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.304 -0.504 17919 49847 1 122 . 1 1 21 21 ASP H H 21 8.030 8.030 7.909 0.121 17919 49848 1 122 . 1 1 22 22 THR N N 22 108.800 108.800 112.634 -3.834 17919 49849 1 122 . 1 1 22 22 THR HA H 22 4.920 4.920 4.441 0.479 17919 49850 1 122 . 1 1 22 22 THR C C 22 176.750 176.750 175.423 1.327 17919 49851 1 122 . 1 1 22 22 THR CA C 22 59.690 59.690 61.493 -1.803 17919 49852 1 122 . 1 1 22 22 THR CB C 22 71.200 71.200 70.473 0.727 17919 49853 1 122 . 1 1 22 22 THR H H 22 7.900 7.900 8.315 -0.415 17919 49854 1 122 . 1 1 23 23 ILE N N 23 121.190 121.190 122.694 -1.504 17919 49855 1 122 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.813 -0.156 17919 49856 1 122 . 1 1 23 23 ILE C C 23 179.040 179.040 177.674 1.366 17919 49857 1 122 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.636 -0.376 17919 49858 1 122 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.662 -2.312 17919 49859 1 122 . 1 1 23 23 ILE H H 23 8.560 8.560 8.898 -0.338 17919 49860 1 122 . 1 1 24 24 GLU N N 24 120.830 120.830 120.511 0.319 17919 49861 1 122 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.874 0.043 17919 49862 1 122 . 1 1 24 24 GLU C C 24 178.640 178.640 178.213 0.427 17919 49863 1 122 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.051 0.169 17919 49864 1 122 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.473 -1.193 17919 49865 1 122 . 1 1 24 24 GLU H H 24 9.760 9.760 8.525 1.235 17919 49866 1 122 . 1 1 25 25 ASN N N 25 120.570 120.570 117.887 2.683 17919 49867 1 122 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.530 -0.005 17919 49868 1 122 . 1 1 25 25 ASN C C 25 178.380 178.380 177.920 0.460 17919 49869 1 122 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.779 0.281 17919 49870 1 122 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.726 -0.276 17919 49871 1 122 . 1 1 25 25 ASN H H 25 7.920 7.920 7.520 0.400 17919 49872 1 122 . 1 1 26 26 VAL N N 26 121.710 121.710 121.363 0.347 17919 49873 1 122 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.718 -0.321 17919 49874 1 122 . 1 1 26 26 VAL C C 26 177.950 177.950 177.301 0.649 17919 49875 1 122 . 1 1 26 26 VAL CA C 26 67.660 67.660 64.720 2.940 17919 49876 1 122 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.789 -0.949 17919 49877 1 122 . 1 1 26 26 VAL H H 26 8.070 8.070 7.743 0.327 17919 49878 1 122 . 1 1 27 27 LYS N N 27 118.860 118.860 120.151 -1.291 17919 49879 1 122 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.016 0.564 17919 49880 1 122 . 1 1 27 27 LYS C C 27 180.550 180.550 178.858 1.692 17919 49881 1 122 . 1 1 27 27 LYS CA C 27 59.250 59.250 60.037 -0.787 17919 49882 1 122 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.308 1.422 17919 49883 1 122 . 1 1 27 27 LYS H H 27 8.560 8.560 7.695 0.865 17919 49884 1 122 . 1 1 28 28 ALA N N 28 123.440 123.440 120.901 2.539 17919 49885 1 122 . 1 1 28 28 ALA HA H 28 4.160 4.160 3.970 0.190 17919 49886 1 122 . 1 1 28 28 ALA C C 28 180.300 180.300 179.139 1.161 17919 49887 1 122 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.577 -0.207 17919 49888 1 122 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.349 -0.639 17919 49889 1 122 . 1 1 28 28 ALA H H 28 8.060 8.060 7.914 0.146 17919 49890 1 122 . 1 1 29 29 LYS N N 29 119.940 119.940 119.004 0.936 17919 49891 1 122 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.038 0.169 17919 49892 1 122 . 1 1 29 29 LYS C C 29 180.320 180.320 179.014 1.306 17919 49893 1 122 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.214 0.436 17919 49894 1 122 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.271 1.019 17919 49895 1 122 . 1 1 29 29 LYS H H 29 7.850 7.850 7.382 0.468 17919 49896 1 122 . 1 1 30 30 ILE N N 30 121.080 121.080 120.517 0.563 17919 49897 1 122 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.605 -0.098 17919 49898 1 122 . 1 1 30 30 ILE C C 30 178.310 178.310 177.461 0.849 17919 49899 1 122 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.461 0.689 17919 49900 1 122 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.653 -0.853 17919 49901 1 122 . 1 1 30 30 ILE H H 30 8.280 8.280 8.199 0.081 17919 49902 1 122 . 1 1 31 31 GLN N N 31 123.490 123.490 121.121 2.369 17919 49903 1 122 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.976 -0.147 17919 49904 1 122 . 1 1 31 31 GLN C C 31 178.890 178.890 178.141 0.749 17919 49905 1 122 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.391 0.609 17919 49906 1 122 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.498 -0.778 17919 49907 1 122 . 1 1 31 31 GLN H H 31 8.580 8.580 8.417 0.163 17919 49908 1 122 . 1 1 32 32 ASP N N 32 119.360 119.360 119.043 0.317 17919 49909 1 122 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.319 0.035 17919 49910 1 122 . 1 1 32 32 ASP C C 32 177.250 177.250 177.898 -0.648 17919 49911 1 122 . 1 1 32 32 ASP CA C 32 57.190 57.190 57.049 0.141 17919 49912 1 122 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.702 -0.121 17919 49913 1 122 . 1 1 32 32 ASP H H 32 8.010 8.010 8.086 -0.076 17919 49914 1 122 . 1 1 33 33 LYS N N 33 115.130 115.130 116.470 -1.340 17919 49915 1 122 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.386 -0.049 17919 49916 1 122 . 1 1 33 33 LYS C C 33 177.870 177.870 178.021 -0.151 17919 49917 1 122 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.546 0.504 17919 49918 1 122 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.297 0.873 17919 49919 1 122 . 1 1 33 33 LYS H H 33 7.430 7.430 7.519 -0.089 17919 49920 1 122 . 1 1 34 34 GLU N N 34 113.870 113.870 115.396 -1.526 17919 49921 1 122 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.520 0.105 17919 49922 1 122 . 1 1 34 34 GLU C C 34 177.840 177.840 177.668 0.172 17919 49923 1 122 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.581 -0.411 17919 49924 1 122 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.624 1.036 17919 49925 1 122 . 1 1 34 34 GLU H H 34 8.740 8.740 7.844 0.896 17919 49926 1 122 . 1 1 35 35 GLY N N 35 108.650 108.650 109.453 -0.803 17919 49927 1 122 . 1 1 35 35 GLY C C 35 173.960 173.960 175.020 -1.060 17919 49928 1 122 . 1 1 35 35 GLY CA C 35 46.080 46.080 46.021 0.059 17919 49929 1 122 . 1 1 35 35 GLY H H 35 8.530 8.530 8.367 0.163 17919 49930 1 122 . 1 1 36 36 ILE N N 36 119.880 119.880 118.403 1.477 17919 49931 1 122 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.230 0.215 17919 49932 1 122 . 1 1 36 36 ILE C C 36 173.590 173.590 174.316 -0.726 17919 49933 1 122 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.726 -0.976 17919 49934 1 122 . 1 1 36 36 ILE CB C 36 40.580 40.580 37.287 3.293 17919 49935 1 122 . 1 1 36 36 ILE H H 36 6.150 6.150 7.598 -1.448 17919 49936 1 122 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.932 -0.298 17919 49937 1 122 . 1 1 37 37 PRO C C 37 176.940 176.940 176.146 0.794 17919 49938 1 122 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.180 0.480 17919 49939 1 122 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.357 0.493 17919 49940 1 122 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.315 -0.198 17919 49941 1 122 . 1 1 38 38 PRO C C 38 178.320 178.320 177.667 0.653 17919 49942 1 122 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.188 1.072 17919 49943 1 122 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.718 1.172 17919 49944 1 122 . 1 1 39 39 ASP N N 39 113.380 113.380 117.683 -4.303 17919 49945 1 122 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.365 0.065 17919 49946 1 122 . 1 1 39 39 ASP C C 39 177.090 177.090 177.893 -0.803 17919 49947 1 122 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.915 -1.275 17919 49948 1 122 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.234 -0.694 17919 49949 1 122 . 1 1 39 39 ASP H H 39 8.550 8.550 8.843 -0.293 17919 49950 1 122 . 1 1 40 40 GLN N N 40 116.780 116.780 118.723 -1.943 17919 49951 1 122 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.389 0.075 17919 49952 1 122 . 1 1 40 40 GLN C C 40 175.380 175.380 176.942 -1.562 17919 49953 1 122 . 1 1 40 40 GLN CA C 40 55.640 55.640 57.381 -1.741 17919 49954 1 122 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.475 0.665 17919 49955 1 122 . 1 1 40 40 GLN H H 40 7.820 7.820 7.537 0.283 17919 49956 1 122 . 1 1 41 41 GLN N N 41 117.720 117.720 119.326 -1.606 17919 49957 1 122 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.102 0.142 17919 49958 1 122 . 1 1 41 41 GLN C C 41 176.300 176.300 175.065 1.235 17919 49959 1 122 . 1 1 41 41 GLN CA C 41 56.470 56.470 57.273 -0.803 17919 49960 1 122 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.095 2.555 17919 49961 1 122 . 1 1 41 41 GLN H H 41 7.480 7.480 7.522 -0.042 17919 49962 1 122 . 1 1 42 42 ARG N N 42 122.680 122.680 125.144 -2.464 17919 49963 1 122 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.621 -0.121 17919 49964 1 122 . 1 1 42 42 ARG C C 42 174.050 174.050 174.920 -0.870 17919 49965 1 122 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.872 0.178 17919 49966 1 122 . 1 1 42 42 ARG CB C 42 31.750 31.750 31.626 0.124 17919 49967 1 122 . 1 1 42 42 ARG H H 42 8.530 8.530 7.997 0.533 17919 49968 1 122 . 1 1 43 43 LEU N N 43 124.040 124.040 127.965 -3.925 17919 49969 1 122 . 1 1 43 43 LEU C C 43 175.290 175.290 176.148 -0.858 17919 49970 1 122 . 1 1 43 43 LEU CA C 43 52.980 52.980 56.148 -3.168 17919 49971 1 122 . 1 1 43 43 LEU CB C 43 45.790 45.790 42.228 3.562 17919 49972 1 122 . 1 1 43 43 LEU H H 43 8.820 8.820 8.720 0.100 17919 49973 1 122 . 1 1 44 44 ILE N N 44 121.920 121.920 122.030 -0.110 17919 49974 1 122 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.892 0.100 17919 49975 1 122 . 1 1 44 44 ILE C C 44 176.060 176.060 174.824 1.236 17919 49976 1 122 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.041 -0.061 17919 49977 1 122 . 1 1 44 44 ILE CB C 44 41.420 41.420 40.471 0.949 17919 49978 1 122 . 1 1 44 44 ILE H H 44 9.030 9.030 8.685 0.345 17919 49979 1 122 . 1 1 45 45 PHE N N 45 125.390 125.390 126.206 -0.816 17919 49980 1 122 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.839 0.206 17919 49981 1 122 . 1 1 45 45 PHE C C 45 174.470 174.470 174.059 0.411 17919 49982 1 122 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.999 0.021 17919 49983 1 122 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.334 1.426 17919 49984 1 122 . 1 1 45 45 PHE H H 45 8.830 8.830 8.886 -0.056 17919 49985 1 122 . 1 1 46 46 ALA N N 46 132.200 132.200 130.978 1.222 17919 49986 1 122 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.718 -0.028 17919 49987 1 122 . 1 1 46 46 ALA C C 46 177.290 177.290 177.405 -0.115 17919 49988 1 122 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.791 -0.251 17919 49989 1 122 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.487 0.083 17919 49990 1 122 . 1 1 46 46 ALA H H 46 8.810 8.810 8.688 0.122 17919 49991 1 122 . 1 1 47 47 GLY N N 47 102.340 102.340 103.154 -0.814 17919 49992 1 122 . 1 1 47 47 GLY C C 47 173.810 173.810 174.269 -0.459 17919 49993 1 122 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.090 0.259 17919 49994 1 122 . 1 1 47 47 GLY H H 47 8.130 8.130 8.428 -0.298 17919 49995 1 122 . 1 1 48 48 LYS N N 48 121.570 121.570 121.696 -0.126 17919 49996 1 122 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.662 -0.040 17919 49997 1 122 . 1 1 48 48 LYS C C 48 174.700 174.700 175.401 -0.701 17919 49998 1 122 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.159 0.391 17919 49999 1 122 . 1 1 48 48 LYS CB C 48 34.530 34.530 33.566 0.964 17919 50000 1 122 . 1 1 48 48 LYS H H 48 7.980 7.980 7.982 -0.002 17919 50001 1 122 . 1 1 49 49 GLN N N 49 122.410 122.410 123.192 -0.782 17919 50002 1 122 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.680 -0.120 17919 50003 1 122 . 1 1 49 49 GLN C C 49 175.670 175.670 175.749 -0.079 17919 50004 1 122 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.565 0.175 17919 50005 1 122 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.569 -0.569 17919 50006 1 122 . 1 1 49 49 GLN H H 49 8.600 8.600 8.543 0.057 17919 50007 1 122 . 1 1 50 50 LEU N N 50 125.520 125.520 125.488 0.032 17919 50008 1 122 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.235 -0.145 17919 50009 1 122 . 1 1 50 50 LEU C C 50 176.660 176.660 176.111 0.549 17919 50010 1 122 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.056 0.184 17919 50011 1 122 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.304 -0.734 17919 50012 1 122 . 1 1 50 50 LEU H H 50 8.530 8.530 8.583 -0.053 17919 50013 1 122 . 1 1 51 51 GLU N N 51 122.940 122.940 124.906 -1.966 17919 50014 1 122 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.423 0.065 17919 50015 1 122 . 1 1 51 51 GLU C C 51 175.870 175.870 176.596 -0.726 17919 50016 1 122 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.624 0.336 17919 50017 1 122 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.257 0.313 17919 50018 1 122 . 1 1 51 51 GLU H H 51 8.400 8.400 8.516 -0.116 17919 50019 1 122 . 1 1 52 52 ASP N N 52 120.030 120.030 126.937 -6.907 17919 50020 1 122 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.550 -0.191 17919 50021 1 122 . 1 1 52 52 ASP C C 52 177.330 177.330 177.584 -0.254 17919 50022 1 122 . 1 1 52 52 ASP CA C 52 56.960 56.960 56.898 0.062 17919 50023 1 122 . 1 1 52 52 ASP CB C 52 40.850 40.850 41.076 -0.226 17919 50024 1 122 . 1 1 52 52 ASP H H 52 8.160 8.160 8.947 -0.787 17919 50025 1 122 . 1 1 53 53 GLY N N 53 106.660 106.660 105.744 0.916 17919 50026 1 122 . 1 1 53 53 GLY C C 53 174.870 174.870 174.875 -0.005 17919 50027 1 122 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.206 -0.036 17919 50028 1 122 . 1 1 53 53 GLY H H 53 9.390 9.390 8.252 1.138 17919 50029 1 122 . 1 1 54 54 ARG N N 54 119.050 119.050 120.555 -1.505 17919 50030 1 122 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.561 0.134 17919 50031 1 122 . 1 1 54 54 ARG C C 54 175.350 175.350 176.135 -0.785 17919 50032 1 122 . 1 1 54 54 ARG CA C 54 54.390 54.390 55.076 -0.686 17919 50033 1 122 . 1 1 54 54 ARG CB C 54 32.650 32.650 31.738 0.913 17919 50034 1 122 . 1 1 54 54 ARG H H 54 7.460 7.460 7.750 -0.290 17919 50035 1 122 . 1 1 55 55 THR N N 55 108.400 108.400 112.221 -3.821 17919 50036 1 122 . 1 1 55 55 THR HA H 55 5.240 5.240 4.803 0.437 17919 50037 1 122 . 1 1 55 55 THR C C 55 176.560 176.560 176.181 0.379 17919 50038 1 122 . 1 1 55 55 THR CA C 55 59.690 59.690 60.338 -0.648 17919 50039 1 122 . 1 1 55 55 THR CB C 55 72.260 72.260 71.100 1.160 17919 50040 1 122 . 1 1 55 55 THR H H 55 8.730 8.730 8.880 -0.150 17919 50041 1 122 . 1 1 56 56 LEU N N 56 117.920 117.920 120.179 -2.259 17919 50042 1 122 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.064 -0.004 17919 50043 1 122 . 1 1 56 56 LEU C C 56 180.810 180.810 179.106 1.704 17919 50044 1 122 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.668 0.042 17919 50045 1 122 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.529 -1.159 17919 50046 1 122 . 1 1 56 56 LEU H H 56 8.140 8.140 8.086 0.054 17919 50047 1 122 . 1 1 57 57 SER N N 57 113.330 113.330 111.888 1.442 17919 50048 1 122 . 1 1 57 57 SER HA H 57 4.370 4.370 4.350 0.020 17919 50049 1 122 . 1 1 57 57 SER C C 57 178.310 178.310 175.574 2.736 17919 50050 1 122 . 1 1 57 57 SER CA C 57 61.080 61.080 59.843 1.237 17919 50051 1 122 . 1 1 57 57 SER CB C 57 62.530 62.530 62.401 0.129 17919 50052 1 122 . 1 1 57 57 SER H H 57 8.470 8.470 7.889 0.581 17919 50053 1 122 . 1 1 58 58 ASP N N 58 124.190 124.190 121.779 2.411 17919 50054 1 122 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.294 0.002 17919 50055 1 122 . 1 1 58 58 ASP C C 58 177.400 177.400 177.366 0.034 17919 50056 1 122 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.516 0.664 17919 50057 1 122 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.255 -0.155 17919 50058 1 122 . 1 1 58 58 ASP H H 58 7.930 7.930 7.651 0.279 17919 50059 1 122 . 1 1 59 59 TYR N N 59 115.510 115.510 115.589 -0.079 17919 50060 1 122 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.598 0.072 17919 50061 1 122 . 1 1 59 59 TYR C C 59 174.700 174.700 175.631 -0.931 17919 50062 1 122 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.942 0.308 17919 50063 1 122 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.705 1.365 17919 50064 1 122 . 1 1 59 59 TYR H H 59 7.250 7.250 7.279 -0.029 17919 50065 1 122 . 1 1 60 60 ASN N N 60 115.900 115.900 116.395 -0.495 17919 50066 1 122 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.405 -0.050 17919 50067 1 122 . 1 1 60 60 ASN C C 60 174.340 174.340 174.879 -0.539 17919 50068 1 122 . 1 1 60 60 ASN CA C 60 54.120 54.120 53.871 0.249 17919 50069 1 122 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.661 -0.251 17919 50070 1 122 . 1 1 60 60 ASN H H 60 8.150 8.150 7.753 0.397 17919 50071 1 122 . 1 1 61 61 ILE N N 61 118.600 118.600 121.013 -2.413 17919 50072 1 122 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.595 -0.202 17919 50073 1 122 . 1 1 61 61 ILE C C 61 174.610 174.610 174.636 -0.026 17919 50074 1 122 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.938 0.482 17919 50075 1 122 . 1 1 61 61 ILE CB C 61 36.740 36.740 35.545 1.195 17919 50076 1 122 . 1 1 61 61 ILE H H 61 7.250 7.250 7.992 -0.742 17919 50077 1 122 . 1 1 62 62 GLN N N 62 124.740 124.740 124.836 -0.096 17919 50078 1 122 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.507 -0.001 17919 50079 1 122 . 1 1 62 62 GLN C C 62 175.970 175.970 175.560 0.410 17919 50080 1 122 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.709 -0.049 17919 50081 1 122 . 1 1 62 62 GLN CB C 62 31.650 31.650 30.969 0.681 17919 50082 1 122 . 1 1 62 62 GLN H H 62 7.610 7.610 7.636 -0.026 17919 50083 1 122 . 1 1 63 63 LYS N N 63 120.300 120.300 123.075 -2.775 17919 50084 1 122 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.798 0.203 17919 50085 1 122 . 1 1 63 63 LYS C C 63 175.810 175.810 177.462 -1.652 17919 50086 1 122 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.313 -0.523 17919 50087 1 122 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.380 0.270 17919 50088 1 122 . 1 1 63 63 LYS H H 63 8.490 8.490 8.806 -0.316 17919 50089 1 122 . 1 1 64 64 GLU N N 64 113.950 113.950 121.372 -7.422 17919 50090 1 122 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.532 -0.067 17919 50091 1 122 . 1 1 64 64 GLU C C 64 175.250 175.250 175.257 -0.007 17919 50092 1 122 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.608 0.282 17919 50093 1 122 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.887 -2.987 17919 50094 1 122 . 1 1 64 64 GLU H H 64 9.280 9.280 8.604 0.676 17919 50095 1 122 . 1 1 65 65 SER N N 65 114.730 114.730 115.737 -1.007 17919 50096 1 122 . 1 1 65 65 SER HA H 65 4.640 4.640 4.450 0.190 17919 50097 1 122 . 1 1 65 65 SER C C 65 172.160 172.160 174.527 -2.367 17919 50098 1 122 . 1 1 65 65 SER CA C 65 60.890 60.890 59.736 1.154 17919 50099 1 122 . 1 1 65 65 SER CB C 65 64.910 64.910 63.434 1.476 17919 50100 1 122 . 1 1 65 65 SER H H 65 7.670 7.670 7.549 0.121 17919 50101 1 122 . 1 1 66 66 THR N N 66 117.110 117.110 122.050 -4.940 17919 50102 1 122 . 1 1 66 66 THR HA H 66 5.270 5.270 4.646 0.624 17919 50103 1 122 . 1 1 66 66 THR C C 66 173.950 173.950 174.869 -0.919 17919 50104 1 122 . 1 1 66 66 THR CA C 66 62.340 62.340 63.703 -1.363 17919 50105 1 122 . 1 1 66 66 THR CB C 66 70.080 70.080 69.431 0.648 17919 50106 1 122 . 1 1 66 66 THR H H 66 8.730 8.730 8.423 0.307 17919 50107 1 122 . 1 1 67 67 LEU N N 67 127.110 127.110 128.930 -1.820 17919 50108 1 122 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.605 0.455 17919 50109 1 122 . 1 1 67 67 LEU C C 67 175.770 175.770 175.818 -0.048 17919 50110 1 122 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.337 -0.437 17919 50111 1 122 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.681 0.579 17919 50112 1 122 . 1 1 67 67 LEU H H 67 9.410 9.410 9.134 0.276 17919 50113 1 122 . 1 1 68 68 HIS N N 68 118.380 118.380 120.261 -1.881 17919 50114 1 122 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.694 -0.454 17919 50115 1 122 . 1 1 68 68 HIS C C 68 173.150 173.150 174.168 -1.018 17919 50116 1 122 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.287 0.713 17919 50117 1 122 . 1 1 68 68 HIS CB C 68 30.530 30.530 34.306 -3.776 17919 50118 1 122 . 1 1 68 68 HIS H H 68 9.230 9.230 8.464 0.766 17919 50119 1 122 . 1 1 69 69 LEU N N 69 124.460 124.460 120.592 3.868 17919 50120 1 122 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.212 -0.022 17919 50121 1 122 . 1 1 69 69 LEU C C 69 175.270 175.270 174.249 1.021 17919 50122 1 122 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.874 -0.984 17919 50123 1 122 . 1 1 69 69 LEU CB C 69 44.380 44.380 46.196 -1.816 17919 50124 1 122 . 1 1 69 69 LEU H H 69 8.340 8.340 8.547 -0.207 17919 50125 1 122 . 1 1 70 70 VAL N N 70 126.940 126.940 122.181 4.759 17919 50126 1 122 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.491 -0.141 17919 50127 1 122 . 1 1 70 70 VAL C C 70 174.000 174.000 174.379 -0.379 17919 50128 1 122 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.087 0.713 17919 50129 1 122 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.517 -0.607 17919 50130 1 122 . 1 1 70 70 VAL H H 70 9.200 9.200 8.052 1.148 17919 50131 1 122 . 1 1 71 71 LEU N N 71 123.130 123.130 123.214 -0.084 17919 50132 1 122 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.090 -0.030 17919 50133 1 122 . 1 1 71 71 LEU C C 71 177.830 177.830 177.049 0.781 17919 50134 1 122 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.510 0.430 17919 50135 1 122 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.839 0.011 17919 50136 1 122 . 1 1 71 71 LEU H H 71 8.120 8.120 8.311 -0.191 17919 50137 1 122 . 1 1 72 72 ARG N N 72 123.490 123.490 125.559 -2.069 17919 50138 1 122 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.541 -0.240 17919 50139 1 122 . 1 1 72 72 ARG C C 72 175.350 175.350 175.936 -0.586 17919 50140 1 122 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.345 0.265 17919 50141 1 122 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.023 1.327 17919 50142 1 122 . 1 1 72 72 ARG H H 72 8.580 8.580 8.616 -0.036 17919 50143 1 123 . 1 1 2 2 GLN N N 2 123.220 123.220 119.708 3.512 17919 50144 1 123 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.448 -0.199 17919 50145 1 123 . 1 1 2 2 GLN C C 2 175.920 175.920 175.600 0.320 17919 50146 1 123 . 1 1 2 2 GLN CA C 2 55.080 55.080 53.478 1.602 17919 50147 1 123 . 1 1 2 2 GLN CB C 2 30.760 30.760 31.262 -0.502 17919 50148 1 123 . 1 1 2 2 GLN H H 2 8.900 8.900 8.199 0.701 17919 50149 1 123 . 1 1 3 3 ILE N N 3 115.340 115.340 116.133 -0.793 17919 50150 1 123 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.323 -0.110 17919 50151 1 123 . 1 1 3 3 ILE C C 3 172.450 172.450 173.810 -1.360 17919 50152 1 123 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.539 0.031 17919 50153 1 123 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.046 1.164 17919 50154 1 123 . 1 1 3 3 ILE H H 3 8.320 8.320 8.402 -0.082 17919 50155 1 123 . 1 1 4 4 PHE N N 4 118.110 118.110 119.983 -1.873 17919 50156 1 123 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.507 0.123 17919 50157 1 123 . 1 1 4 4 PHE C C 4 175.320 175.320 175.345 -0.025 17919 50158 1 123 . 1 1 4 4 PHE CA C 4 55.210 55.210 54.917 0.293 17919 50159 1 123 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.721 -0.241 17919 50160 1 123 . 1 1 4 4 PHE H H 4 8.610 8.610 8.922 -0.312 17919 50161 1 123 . 1 1 5 5 VAL N N 5 121.000 121.000 120.957 0.043 17919 50162 1 123 . 1 1 5 5 VAL HA H 5 4.725 4.725 5.062 -0.337 17919 50163 1 123 . 1 1 5 5 VAL C C 5 174.870 174.870 174.809 0.061 17919 50164 1 123 . 1 1 5 5 VAL CA C 5 60.620 60.620 60.943 -0.323 17919 50165 1 123 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.200 0.030 17919 50166 1 123 . 1 1 5 5 VAL H H 5 9.300 9.300 9.079 0.221 17919 50167 1 123 . 1 1 6 6 LYS N N 6 127.520 127.520 129.374 -1.854 17919 50168 1 123 . 1 1 6 6 LYS HA H 6 5.367 5.367 4.948 0.419 17919 50169 1 123 . 1 1 6 6 LYS C C 6 177.140 177.140 176.818 0.322 17919 50170 1 123 . 1 1 6 6 LYS CA C 6 54.520 54.520 55.419 -0.899 17919 50171 1 123 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.359 0.691 17919 50172 1 123 . 1 1 6 6 LYS H H 6 8.820 8.820 8.244 0.576 17919 50173 1 123 . 1 1 7 7 THR N N 7 115.400 115.400 117.539 -2.139 17919 50174 1 123 . 1 1 7 7 THR HA H 7 4.970 4.970 4.400 0.570 17919 50175 1 123 . 1 1 7 7 THR C C 7 176.910 176.910 175.421 1.489 17919 50176 1 123 . 1 1 7 7 THR CA C 7 60.470 60.470 61.748 -1.278 17919 50177 1 123 . 1 1 7 7 THR CB C 7 70.630 70.630 70.131 0.499 17919 50178 1 123 . 1 1 7 7 THR H H 7 8.730 8.730 8.389 0.341 17919 50179 1 123 . 1 1 8 8 LEU N N 8 121.330 121.330 121.293 0.037 17919 50180 1 123 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.245 0.065 17919 50181 1 123 . 1 1 8 8 LEU C C 8 178.800 178.800 178.677 0.123 17919 50182 1 123 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.841 -0.261 17919 50183 1 123 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.601 0.369 17919 50184 1 123 . 1 1 8 8 LEU H H 8 9.100 9.100 8.967 0.133 17919 50185 1 123 . 1 1 9 9 THR N N 9 105.590 105.590 109.321 -3.731 17919 50186 1 123 . 1 1 9 9 THR HA H 9 4.428 4.428 4.298 0.130 17919 50187 1 123 . 1 1 9 9 THR C C 9 175.520 175.520 175.842 -0.322 17919 50188 1 123 . 1 1 9 9 THR CA C 9 61.400 61.400 63.078 -1.678 17919 50189 1 123 . 1 1 9 9 THR CB C 9 69.140 69.140 69.550 -0.410 17919 50190 1 123 . 1 1 9 9 THR H H 9 7.630 7.630 8.146 -0.516 17919 50191 1 123 . 1 1 10 10 GLY N N 10 108.890 108.890 110.288 -1.398 17919 50192 1 123 . 1 1 10 10 GLY C C 10 174.070 174.070 173.950 0.120 17919 50193 1 123 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.583 0.877 17919 50194 1 123 . 1 1 10 10 GLY H H 10 7.810 7.810 7.826 -0.016 17919 50195 1 123 . 1 1 11 11 LYS N N 11 121.600 121.600 121.531 0.069 17919 50196 1 123 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.341 0.020 17919 50197 1 123 . 1 1 11 11 LYS C C 11 175.940 175.940 175.821 0.119 17919 50198 1 123 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.368 -0.088 17919 50199 1 123 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.487 -0.287 17919 50200 1 123 . 1 1 11 11 LYS H H 11 7.280 7.280 7.931 -0.651 17919 50201 1 123 . 1 1 12 12 THR N N 12 120.440 120.440 120.455 -0.015 17919 50202 1 123 . 1 1 12 12 THR HA H 12 5.046 5.046 5.221 -0.175 17919 50203 1 123 . 1 1 12 12 THR C C 12 174.320 174.320 174.470 -0.150 17919 50204 1 123 . 1 1 12 12 THR CA C 12 62.390 62.390 61.690 0.700 17919 50205 1 123 . 1 1 12 12 THR CB C 12 69.910 69.910 70.107 -0.197 17919 50206 1 123 . 1 1 12 12 THR H H 12 8.650 8.650 8.253 0.397 17919 50207 1 123 . 1 1 13 13 ILE N N 13 127.110 127.110 127.664 -0.554 17919 50208 1 123 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.495 0.049 17919 50209 1 123 . 1 1 13 13 ILE C C 13 175.220 175.220 175.348 -0.128 17919 50210 1 123 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.313 -0.334 17919 50211 1 123 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.610 0.340 17919 50212 1 123 . 1 1 13 13 ILE H H 13 9.450 9.450 9.056 0.394 17919 50213 1 123 . 1 1 14 14 THR N N 14 121.520 121.520 122.539 -1.019 17919 50214 1 123 . 1 1 14 14 THR HA H 14 4.964 4.964 5.001 -0.037 17919 50215 1 123 . 1 1 14 14 THR C C 14 173.790 173.790 173.676 0.114 17919 50216 1 123 . 1 1 14 14 THR CA C 14 61.940 61.940 61.984 -0.044 17919 50217 1 123 . 1 1 14 14 THR CB C 14 69.650 69.650 69.668 -0.018 17919 50218 1 123 . 1 1 14 14 THR H H 14 8.710 8.710 8.426 0.284 17919 50219 1 123 . 1 1 15 15 LEU N N 15 124.800 124.800 126.498 -1.698 17919 50220 1 123 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.794 -0.014 17919 50221 1 123 . 1 1 15 15 LEU C C 15 174.670 174.670 175.278 -0.608 17919 50222 1 123 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.713 -0.883 17919 50223 1 123 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.332 1.738 17919 50224 1 123 . 1 1 15 15 LEU H H 15 8.710 8.710 8.334 0.376 17919 50225 1 123 . 1 1 16 16 GLU N N 16 122.160 122.160 124.099 -1.939 17919 50226 1 123 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.751 0.166 17919 50227 1 123 . 1 1 16 16 GLU C C 16 175.860 175.860 176.067 -0.207 17919 50228 1 123 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.722 -0.902 17919 50229 1 123 . 1 1 16 16 GLU CB C 16 29.450 29.450 28.625 0.825 17919 50230 1 123 . 1 1 16 16 GLU H H 16 8.140 8.140 8.681 -0.541 17919 50231 1 123 . 1 1 17 17 VAL N N 17 117.210 117.210 119.771 -2.561 17919 50232 1 123 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.880 -0.166 17919 50233 1 123 . 1 1 17 17 VAL C C 17 174.160 174.160 175.189 -1.029 17919 50234 1 123 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.083 -0.653 17919 50235 1 123 . 1 1 17 17 VAL CB C 17 36.400 36.400 34.765 1.635 17919 50236 1 123 . 1 1 17 17 VAL H H 17 8.900 8.900 7.925 0.975 17919 50237 1 123 . 1 1 18 18 GLU N N 18 118.990 118.990 116.957 2.033 17919 50238 1 123 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.826 0.253 17919 50239 1 123 . 1 1 18 18 GLU C C 18 176.160 176.160 174.395 1.765 17919 50240 1 123 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.569 -0.849 17919 50241 1 123 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.550 -0.240 17919 50242 1 123 . 1 1 18 18 GLU H H 18 8.640 8.640 8.185 0.455 17919 50243 1 123 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.256 -0.115 17919 50244 1 123 . 1 1 19 19 PRO C C 19 175.310 175.310 178.618 -3.308 17919 50245 1 123 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.409 0.062 17919 50246 1 123 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.845 0.105 17919 50247 1 123 . 1 1 20 20 SER N N 20 103.400 103.400 112.652 -9.252 17919 50248 1 123 . 1 1 20 20 SER HA H 20 4.370 4.370 4.086 0.284 17919 50249 1 123 . 1 1 20 20 SER C C 20 174.660 174.660 174.712 -0.052 17919 50250 1 123 . 1 1 20 20 SER CA C 20 57.400 57.400 60.332 -2.932 17919 50251 1 123 . 1 1 20 20 SER CB C 20 63.370 63.370 62.864 0.506 17919 50252 1 123 . 1 1 20 20 SER H H 20 7.040 7.040 8.041 -1.001 17919 50253 1 123 . 1 1 21 21 ASP N N 21 123.480 123.480 122.160 1.320 17919 50254 1 123 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.679 0.016 17919 50255 1 123 . 1 1 21 21 ASP C C 21 176.360 176.360 176.169 0.191 17919 50256 1 123 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.041 0.659 17919 50257 1 123 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.209 -0.409 17919 50258 1 123 . 1 1 21 21 ASP H H 21 8.030 8.030 7.834 0.196 17919 50259 1 123 . 1 1 22 22 THR N N 22 108.800 108.800 113.521 -4.721 17919 50260 1 123 . 1 1 22 22 THR HA H 22 4.920 4.920 4.391 0.529 17919 50261 1 123 . 1 1 22 22 THR C C 22 176.750 176.750 176.145 0.605 17919 50262 1 123 . 1 1 22 22 THR CA C 22 59.690 59.690 61.938 -2.248 17919 50263 1 123 . 1 1 22 22 THR CB C 22 71.200 71.200 69.688 1.512 17919 50264 1 123 . 1 1 22 22 THR H H 22 7.900 7.900 8.328 -0.428 17919 50265 1 123 . 1 1 23 23 ILE N N 23 121.190 121.190 122.177 -0.987 17919 50266 1 123 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.720 -0.063 17919 50267 1 123 . 1 1 23 23 ILE C C 23 179.040 179.040 177.887 1.153 17919 50268 1 123 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.270 -0.010 17919 50269 1 123 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.171 -1.821 17919 50270 1 123 . 1 1 23 23 ILE H H 23 8.560 8.560 8.414 0.146 17919 50271 1 123 . 1 1 24 24 GLU N N 24 120.830 120.830 119.690 1.140 17919 50272 1 123 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.789 0.128 17919 50273 1 123 . 1 1 24 24 GLU C C 24 178.640 178.640 178.534 0.106 17919 50274 1 123 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.543 -0.323 17919 50275 1 123 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.497 -1.217 17919 50276 1 123 . 1 1 24 24 GLU H H 24 9.760 9.760 8.340 1.420 17919 50277 1 123 . 1 1 25 25 ASN N N 25 120.570 120.570 117.021 3.549 17919 50278 1 123 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.555 -0.030 17919 50279 1 123 . 1 1 25 25 ASN C C 25 178.380 178.380 177.988 0.392 17919 50280 1 123 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.565 0.495 17919 50281 1 123 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.183 0.267 17919 50282 1 123 . 1 1 25 25 ASN H H 25 7.920 7.920 7.756 0.164 17919 50283 1 123 . 1 1 26 26 VAL N N 26 121.710 121.710 120.508 1.202 17919 50284 1 123 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.450 -0.053 17919 50285 1 123 . 1 1 26 26 VAL C C 26 177.950 177.950 177.798 0.152 17919 50286 1 123 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.933 0.727 17919 50287 1 123 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.291 -0.451 17919 50288 1 123 . 1 1 26 26 VAL H H 26 8.070 8.070 8.145 -0.075 17919 50289 1 123 . 1 1 27 27 LYS N N 27 118.860 118.860 119.820 -0.960 17919 50290 1 123 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.089 0.491 17919 50291 1 123 . 1 1 27 27 LYS C C 27 180.550 180.550 179.078 1.472 17919 50292 1 123 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.560 -0.310 17919 50293 1 123 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.380 1.349 17919 50294 1 123 . 1 1 27 27 LYS H H 27 8.560 8.560 7.827 0.733 17919 50295 1 123 . 1 1 28 28 ALA N N 28 123.440 123.440 120.088 3.352 17919 50296 1 123 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.071 0.089 17919 50297 1 123 . 1 1 28 28 ALA C C 28 180.300 180.300 179.191 1.109 17919 50298 1 123 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.082 0.288 17919 50299 1 123 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.490 -0.780 17919 50300 1 123 . 1 1 28 28 ALA H H 28 8.060 8.060 8.271 -0.211 17919 50301 1 123 . 1 1 29 29 LYS N N 29 119.940 119.940 119.500 0.440 17919 50302 1 123 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.047 0.160 17919 50303 1 123 . 1 1 29 29 LYS C C 29 180.320 180.320 178.970 1.350 17919 50304 1 123 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.210 0.440 17919 50305 1 123 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.245 1.045 17919 50306 1 123 . 1 1 29 29 LYS H H 29 7.850 7.850 7.558 0.292 17919 50307 1 123 . 1 1 30 30 ILE N N 30 121.080 121.080 119.930 1.150 17919 50308 1 123 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.605 -0.098 17919 50309 1 123 . 1 1 30 30 ILE C C 30 178.310 178.310 177.701 0.609 17919 50310 1 123 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.207 0.943 17919 50311 1 123 . 1 1 30 30 ILE CB C 30 36.800 36.800 36.904 -0.104 17919 50312 1 123 . 1 1 30 30 ILE H H 30 8.280 8.280 8.066 0.214 17919 50313 1 123 . 1 1 31 31 GLN N N 31 123.490 123.490 119.242 4.248 17919 50314 1 123 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.064 -0.235 17919 50315 1 123 . 1 1 31 31 GLN C C 31 178.890 178.890 178.607 0.283 17919 50316 1 123 . 1 1 31 31 GLN CA C 31 60.000 60.000 58.931 1.069 17919 50317 1 123 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.392 -0.673 17919 50318 1 123 . 1 1 31 31 GLN H H 31 8.580 8.580 7.807 0.773 17919 50319 1 123 . 1 1 32 32 ASP N N 32 119.360 119.360 120.357 -0.997 17919 50320 1 123 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.375 -0.021 17919 50321 1 123 . 1 1 32 32 ASP C C 32 177.250 177.250 177.947 -0.697 17919 50322 1 123 . 1 1 32 32 ASP CA C 32 57.190 57.190 57.012 0.178 17919 50323 1 123 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.718 -0.138 17919 50324 1 123 . 1 1 32 32 ASP H H 32 8.010 8.010 7.750 0.260 17919 50325 1 123 . 1 1 33 33 LYS N N 33 115.130 115.130 117.586 -2.456 17919 50326 1 123 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.301 0.036 17919 50327 1 123 . 1 1 33 33 LYS C C 33 177.870 177.870 177.955 -0.085 17919 50328 1 123 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.756 0.294 17919 50329 1 123 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.199 0.971 17919 50330 1 123 . 1 1 33 33 LYS H H 33 7.430 7.430 7.643 -0.213 17919 50331 1 123 . 1 1 34 34 GLU N N 34 113.870 113.870 114.271 -0.401 17919 50332 1 123 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.502 0.123 17919 50333 1 123 . 1 1 34 34 GLU C C 34 177.840 177.840 177.043 0.797 17919 50334 1 123 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.069 -0.900 17919 50335 1 123 . 1 1 34 34 GLU CB C 34 32.660 32.660 32.174 0.486 17919 50336 1 123 . 1 1 34 34 GLU H H 34 8.740 8.740 7.677 1.063 17919 50337 1 123 . 1 1 35 35 GLY N N 35 108.650 108.650 109.814 -1.164 17919 50338 1 123 . 1 1 35 35 GLY C C 35 173.960 173.960 174.619 -0.659 17919 50339 1 123 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.778 0.302 17919 50340 1 123 . 1 1 35 35 GLY H H 35 8.530 8.530 7.924 0.606 17919 50341 1 123 . 1 1 36 36 ILE N N 36 119.880 119.880 121.946 -2.066 17919 50342 1 123 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.203 0.242 17919 50343 1 123 . 1 1 36 36 ILE C C 36 173.590 173.590 174.913 -1.323 17919 50344 1 123 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.081 -0.331 17919 50345 1 123 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.267 2.313 17919 50346 1 123 . 1 1 36 36 ILE H H 36 6.150 6.150 7.628 -1.478 17919 50347 1 123 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.802 -0.168 17919 50348 1 123 . 1 1 37 37 PRO C C 37 176.940 176.940 176.354 0.586 17919 50349 1 123 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.104 0.556 17919 50350 1 123 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.254 0.596 17919 50351 1 123 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.164 -0.047 17919 50352 1 123 . 1 1 38 38 PRO C C 38 178.320 178.320 178.428 -0.108 17919 50353 1 123 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.838 0.422 17919 50354 1 123 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.792 1.098 17919 50355 1 123 . 1 1 39 39 ASP N N 39 113.380 113.380 115.209 -1.829 17919 50356 1 123 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.355 0.075 17919 50357 1 123 . 1 1 39 39 ASP C C 39 177.090 177.090 177.685 -0.595 17919 50358 1 123 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.788 -1.148 17919 50359 1 123 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.270 -0.730 17919 50360 1 123 . 1 1 39 39 ASP H H 39 8.550 8.550 8.577 -0.027 17919 50361 1 123 . 1 1 40 40 GLN N N 40 116.780 116.780 116.759 0.021 17919 50362 1 123 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.176 0.288 17919 50363 1 123 . 1 1 40 40 GLN C C 40 175.380 175.380 176.250 -0.870 17919 50364 1 123 . 1 1 40 40 GLN CA C 40 55.640 55.640 57.055 -1.415 17919 50365 1 123 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.238 0.902 17919 50366 1 123 . 1 1 40 40 GLN H H 40 7.820 7.820 8.086 -0.266 17919 50367 1 123 . 1 1 41 41 GLN N N 41 117.720 117.720 118.530 -0.810 17919 50368 1 123 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.470 -0.226 17919 50369 1 123 . 1 1 41 41 GLN C C 41 176.300 176.300 175.106 1.194 17919 50370 1 123 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.499 0.971 17919 50371 1 123 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.969 1.681 17919 50372 1 123 . 1 1 41 41 GLN H H 41 7.480 7.480 7.428 0.052 17919 50373 1 123 . 1 1 42 42 ARG N N 42 122.680 122.680 125.038 -2.358 17919 50374 1 123 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.499 0.001 17919 50375 1 123 . 1 1 42 42 ARG C C 42 174.050 174.050 174.027 0.023 17919 50376 1 123 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.279 -0.229 17919 50377 1 123 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.163 -0.413 17919 50378 1 123 . 1 1 42 42 ARG H H 42 8.530 8.530 8.023 0.507 17919 50379 1 123 . 1 1 43 43 LEU N N 43 124.040 124.040 128.107 -4.067 17919 50380 1 123 . 1 1 43 43 LEU C C 43 175.290 175.290 175.476 -0.186 17919 50381 1 123 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.439 -0.459 17919 50382 1 123 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.416 1.374 17919 50383 1 123 . 1 1 43 43 LEU H H 43 8.820 8.820 8.524 0.296 17919 50384 1 123 . 1 1 44 44 ILE N N 44 121.920 121.920 124.376 -2.456 17919 50385 1 123 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.351 -0.359 17919 50386 1 123 . 1 1 44 44 ILE C C 44 176.060 176.060 174.570 1.490 17919 50387 1 123 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.822 -0.842 17919 50388 1 123 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.202 0.218 17919 50389 1 123 . 1 1 44 44 ILE H H 44 9.030 9.030 8.617 0.413 17919 50390 1 123 . 1 1 45 45 PHE N N 45 125.390 125.390 126.088 -0.698 17919 50391 1 123 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.972 0.073 17919 50392 1 123 . 1 1 45 45 PHE C C 45 174.470 174.470 174.087 0.383 17919 50393 1 123 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.483 0.537 17919 50394 1 123 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.058 0.702 17919 50395 1 123 . 1 1 45 45 PHE H H 45 8.830 8.830 9.069 -0.239 17919 50396 1 123 . 1 1 46 46 ALA N N 46 132.200 132.200 128.784 3.416 17919 50397 1 123 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.601 0.089 17919 50398 1 123 . 1 1 46 46 ALA C C 46 177.290 177.290 177.979 -0.689 17919 50399 1 123 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.559 -0.019 17919 50400 1 123 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.579 -0.009 17919 50401 1 123 . 1 1 46 46 ALA H H 46 8.810 8.810 8.961 -0.151 17919 50402 1 123 . 1 1 47 47 GLY N N 47 102.340 102.340 102.656 -0.316 17919 50403 1 123 . 1 1 47 47 GLY C C 47 173.810 173.810 174.404 -0.594 17919 50404 1 123 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.353 -0.003 17919 50405 1 123 . 1 1 47 47 GLY H H 47 8.130 8.130 8.556 -0.426 17919 50406 1 123 . 1 1 48 48 LYS N N 48 121.570 121.570 121.235 0.335 17919 50407 1 123 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.549 0.073 17919 50408 1 123 . 1 1 48 48 LYS C C 48 174.700 174.700 175.328 -0.628 17919 50409 1 123 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.738 -0.188 17919 50410 1 123 . 1 1 48 48 LYS CB C 48 34.530 34.530 33.912 0.618 17919 50411 1 123 . 1 1 48 48 LYS H H 48 7.980 7.980 8.034 -0.053 17919 50412 1 123 . 1 1 49 49 GLN N N 49 122.410 122.410 124.811 -2.401 17919 50413 1 123 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.487 0.073 17919 50414 1 123 . 1 1 49 49 GLN C C 49 175.670 175.670 175.823 -0.153 17919 50415 1 123 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.901 -0.161 17919 50416 1 123 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.407 -0.407 17919 50417 1 123 . 1 1 49 49 GLN H H 49 8.600 8.600 8.643 -0.043 17919 50418 1 123 . 1 1 50 50 LEU N N 50 125.520 125.520 127.712 -2.192 17919 50419 1 123 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.022 0.068 17919 50420 1 123 . 1 1 50 50 LEU C C 50 176.660 176.660 176.235 0.425 17919 50421 1 123 . 1 1 50 50 LEU CA C 50 54.240 54.240 55.507 -1.267 17919 50422 1 123 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.516 -0.946 17919 50423 1 123 . 1 1 50 50 LEU H H 50 8.530 8.530 8.508 0.022 17919 50424 1 123 . 1 1 51 51 GLU N N 51 122.940 122.940 120.378 2.562 17919 50425 1 123 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.529 -0.041 17919 50426 1 123 . 1 1 51 51 GLU C C 51 175.870 175.870 176.550 -0.680 17919 50427 1 123 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.053 0.907 17919 50428 1 123 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.103 -0.533 17919 50429 1 123 . 1 1 51 51 GLU H H 51 8.400 8.400 7.967 0.433 17919 50430 1 123 . 1 1 52 52 ASP N N 52 120.030 120.030 126.918 -6.888 17919 50431 1 123 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.442 -0.083 17919 50432 1 123 . 1 1 52 52 ASP C C 52 177.330 177.330 177.232 0.098 17919 50433 1 123 . 1 1 52 52 ASP CA C 52 56.960 56.960 56.504 0.456 17919 50434 1 123 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.929 -0.079 17919 50435 1 123 . 1 1 52 52 ASP H H 52 8.160 8.160 8.884 -0.724 17919 50436 1 123 . 1 1 53 53 GLY N N 53 106.660 106.660 105.319 1.341 17919 50437 1 123 . 1 1 53 53 GLY C C 53 174.870 174.870 174.317 0.553 17919 50438 1 123 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.005 0.165 17919 50439 1 123 . 1 1 53 53 GLY H H 53 9.390 9.390 8.569 0.821 17919 50440 1 123 . 1 1 54 54 ARG N N 54 119.050 119.050 120.338 -1.288 17919 50441 1 123 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.733 -0.038 17919 50442 1 123 . 1 1 54 54 ARG C C 54 175.350 175.350 175.138 0.212 17919 50443 1 123 . 1 1 54 54 ARG CA C 54 54.390 54.390 53.996 0.394 17919 50444 1 123 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.290 0.360 17919 50445 1 123 . 1 1 54 54 ARG H H 54 7.460 7.460 7.694 -0.234 17919 50446 1 123 . 1 1 55 55 THR N N 55 108.400 108.400 111.405 -3.005 17919 50447 1 123 . 1 1 55 55 THR HA H 55 5.240 5.240 4.940 0.300 17919 50448 1 123 . 1 1 55 55 THR C C 55 176.560 176.560 176.337 0.223 17919 50449 1 123 . 1 1 55 55 THR CA C 55 59.690 59.690 59.979 -0.289 17919 50450 1 123 . 1 1 55 55 THR CB C 55 72.260 72.260 71.721 0.539 17919 50451 1 123 . 1 1 55 55 THR H H 55 8.730 8.730 9.028 -0.298 17919 50452 1 123 . 1 1 56 56 LEU N N 56 117.920 117.920 121.479 -3.559 17919 50453 1 123 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.060 -0.000 17919 50454 1 123 . 1 1 56 56 LEU C C 56 180.810 180.810 179.230 1.580 17919 50455 1 123 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.132 0.578 17919 50456 1 123 . 1 1 56 56 LEU CB C 56 40.370 40.370 40.405 -0.035 17919 50457 1 123 . 1 1 56 56 LEU H H 56 8.140 8.140 8.470 -0.330 17919 50458 1 123 . 1 1 57 57 SER N N 57 113.330 113.330 113.882 -0.552 17919 50459 1 123 . 1 1 57 57 SER HA H 57 4.370 4.370 4.216 0.154 17919 50460 1 123 . 1 1 57 57 SER C C 57 178.310 178.310 176.098 2.212 17919 50461 1 123 . 1 1 57 57 SER CA C 57 61.080 61.080 60.947 0.133 17919 50462 1 123 . 1 1 57 57 SER CB C 57 62.530 62.530 62.691 -0.161 17919 50463 1 123 . 1 1 57 57 SER H H 57 8.470 8.470 7.890 0.580 17919 50464 1 123 . 1 1 58 58 ASP N N 58 124.190 124.190 121.567 2.623 17919 50465 1 123 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.325 -0.029 17919 50466 1 123 . 1 1 58 58 ASP C C 58 177.400 177.400 177.040 0.360 17919 50467 1 123 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.353 0.827 17919 50468 1 123 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.834 -0.734 17919 50469 1 123 . 1 1 58 58 ASP H H 58 7.930 7.930 7.629 0.301 17919 50470 1 123 . 1 1 59 59 TYR N N 59 115.510 115.510 115.685 -0.175 17919 50471 1 123 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.705 -0.035 17919 50472 1 123 . 1 1 59 59 TYR C C 59 174.700 174.700 174.637 0.063 17919 50473 1 123 . 1 1 59 59 TYR CA C 59 58.250 58.250 56.922 1.329 17919 50474 1 123 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.555 1.515 17919 50475 1 123 . 1 1 59 59 TYR H H 59 7.250 7.250 7.303 -0.053 17919 50476 1 123 . 1 1 60 60 ASN N N 60 115.900 115.900 117.920 -2.020 17919 50477 1 123 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.392 -0.037 17919 50478 1 123 . 1 1 60 60 ASN C C 60 174.340 174.340 174.598 -0.258 17919 50479 1 123 . 1 1 60 60 ASN CA C 60 54.120 54.120 53.984 0.136 17919 50480 1 123 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.460 -0.050 17919 50481 1 123 . 1 1 60 60 ASN H H 60 8.150 8.150 7.696 0.454 17919 50482 1 123 . 1 1 61 61 ILE N N 61 118.600 118.600 119.486 -0.886 17919 50483 1 123 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.889 -0.496 17919 50484 1 123 . 1 1 61 61 ILE C C 61 174.610 174.610 175.653 -1.043 17919 50485 1 123 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.520 0.900 17919 50486 1 123 . 1 1 61 61 ILE CB C 61 36.740 36.740 36.994 -0.254 17919 50487 1 123 . 1 1 61 61 ILE H H 61 7.250 7.250 8.179 -0.929 17919 50488 1 123 . 1 1 62 62 GLN N N 62 124.740 124.740 125.761 -1.021 17919 50489 1 123 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.633 -0.127 17919 50490 1 123 . 1 1 62 62 GLN C C 62 175.970 175.970 175.760 0.210 17919 50491 1 123 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.505 0.155 17919 50492 1 123 . 1 1 62 62 GLN CB C 62 31.650 31.650 32.633 -0.983 17919 50493 1 123 . 1 1 62 62 GLN H H 62 7.610 7.610 8.010 -0.400 17919 50494 1 123 . 1 1 63 63 LYS N N 63 120.300 120.300 124.231 -3.931 17919 50495 1 123 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.876 0.125 17919 50496 1 123 . 1 1 63 63 LYS C C 63 175.810 175.810 176.674 -0.864 17919 50497 1 123 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.906 -0.116 17919 50498 1 123 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.994 0.656 17919 50499 1 123 . 1 1 63 63 LYS H H 63 8.490 8.490 8.835 -0.345 17919 50500 1 123 . 1 1 64 64 GLU N N 64 113.950 113.950 120.117 -6.167 17919 50501 1 123 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.403 0.062 17919 50502 1 123 . 1 1 64 64 GLU C C 64 175.250 175.250 175.400 -0.150 17919 50503 1 123 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.444 0.445 17919 50504 1 123 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.010 -2.110 17919 50505 1 123 . 1 1 64 64 GLU H H 64 9.280 9.280 8.844 0.436 17919 50506 1 123 . 1 1 65 65 SER N N 65 114.730 114.730 114.946 -0.216 17919 50507 1 123 . 1 1 65 65 SER HA H 65 4.640 4.640 4.443 0.197 17919 50508 1 123 . 1 1 65 65 SER C C 65 172.160 172.160 173.865 -1.705 17919 50509 1 123 . 1 1 65 65 SER CA C 65 60.890 60.890 60.365 0.525 17919 50510 1 123 . 1 1 65 65 SER CB C 65 64.910 64.910 64.095 0.815 17919 50511 1 123 . 1 1 65 65 SER H H 65 7.670 7.670 7.733 -0.063 17919 50512 1 123 . 1 1 66 66 THR N N 66 117.110 117.110 120.339 -3.229 17919 50513 1 123 . 1 1 66 66 THR HA H 66 5.270 5.270 5.250 0.020 17919 50514 1 123 . 1 1 66 66 THR C C 66 173.950 173.950 174.421 -0.471 17919 50515 1 123 . 1 1 66 66 THR CA C 66 62.340 62.340 62.505 -0.165 17919 50516 1 123 . 1 1 66 66 THR CB C 66 70.080 70.080 69.729 0.351 17919 50517 1 123 . 1 1 66 66 THR H H 66 8.730 8.730 8.583 0.147 17919 50518 1 123 . 1 1 67 67 LEU N N 67 127.110 127.110 127.330 -0.220 17919 50519 1 123 . 1 1 67 67 LEU HA H 67 5.060 5.060 5.107 -0.047 17919 50520 1 123 . 1 1 67 67 LEU C C 67 175.770 175.770 175.610 0.160 17919 50521 1 123 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.879 0.021 17919 50522 1 123 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.275 -0.015 17919 50523 1 123 . 1 1 67 67 LEU H H 67 9.410 9.410 8.993 0.417 17919 50524 1 123 . 1 1 68 68 HIS N N 68 118.380 118.380 119.330 -0.950 17919 50525 1 123 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.067 0.173 17919 50526 1 123 . 1 1 68 68 HIS C C 68 173.150 173.150 173.560 -0.410 17919 50527 1 123 . 1 1 68 68 HIS CA C 68 55.000 55.000 53.843 1.157 17919 50528 1 123 . 1 1 68 68 HIS CB C 68 30.530 30.530 34.052 -3.522 17919 50529 1 123 . 1 1 68 68 HIS H H 68 9.230 9.230 9.035 0.195 17919 50530 1 123 . 1 1 69 69 LEU N N 69 124.460 124.460 124.292 0.168 17919 50531 1 123 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.001 0.189 17919 50532 1 123 . 1 1 69 69 LEU C C 69 175.270 175.270 174.030 1.240 17919 50533 1 123 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.240 -0.350 17919 50534 1 123 . 1 1 69 69 LEU CB C 69 44.380 44.380 45.137 -0.757 17919 50535 1 123 . 1 1 69 69 LEU H H 69 8.340 8.340 7.648 0.692 17919 50536 1 123 . 1 1 70 70 VAL N N 70 126.940 126.940 119.944 6.996 17919 50537 1 123 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.531 -0.181 17919 50538 1 123 . 1 1 70 70 VAL C C 70 174.000 174.000 173.873 0.127 17919 50539 1 123 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.185 1.615 17919 50540 1 123 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.663 -0.752 17919 50541 1 123 . 1 1 70 70 VAL H H 70 9.200 9.200 8.080 1.120 17919 50542 1 123 . 1 1 71 71 LEU N N 71 123.130 123.130 123.826 -0.696 17919 50543 1 123 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.817 0.243 17919 50544 1 123 . 1 1 71 71 LEU C C 71 177.830 177.830 177.787 0.043 17919 50545 1 123 . 1 1 71 71 LEU CA C 71 53.940 53.940 54.199 -0.259 17919 50546 1 123 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.670 0.180 17919 50547 1 123 . 1 1 71 71 LEU H H 71 8.120 8.120 8.486 -0.366 17919 50548 1 123 . 1 1 72 72 ARG N N 72 123.490 123.490 124.058 -0.568 17919 50549 1 123 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.356 -0.055 17919 50550 1 123 . 1 1 72 72 ARG C C 72 175.350 175.350 175.698 -0.348 17919 50551 1 123 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.459 0.152 17919 50552 1 123 . 1 1 72 72 ARG CB C 72 31.350 31.350 28.322 3.028 17919 50553 1 123 . 1 1 72 72 ARG H H 72 8.580 8.580 8.554 0.026 17919 50554 1 124 . 1 1 2 2 GLN N N 2 123.220 123.220 123.125 0.095 17919 50555 1 124 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.438 -0.189 17919 50556 1 124 . 1 1 2 2 GLN C C 2 175.920 175.920 175.585 0.335 17919 50557 1 124 . 1 1 2 2 GLN CA C 2 55.080 55.080 55.057 0.023 17919 50558 1 124 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.703 0.057 17919 50559 1 124 . 1 1 2 2 GLN H H 2 8.900 8.900 8.556 0.344 17919 50560 1 124 . 1 1 3 3 ILE N N 3 115.340 115.340 115.585 -0.245 17919 50561 1 124 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.330 -0.117 17919 50562 1 124 . 1 1 3 3 ILE C C 3 172.450 172.450 173.426 -0.976 17919 50563 1 124 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.326 0.244 17919 50564 1 124 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.323 0.887 17919 50565 1 124 . 1 1 3 3 ILE H H 3 8.320 8.320 8.882 -0.562 17919 50566 1 124 . 1 1 4 4 PHE N N 4 118.110 118.110 121.339 -3.229 17919 50567 1 124 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.287 0.343 17919 50568 1 124 . 1 1 4 4 PHE C C 4 175.320 175.320 175.285 0.035 17919 50569 1 124 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.029 0.181 17919 50570 1 124 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.863 -0.383 17919 50571 1 124 . 1 1 4 4 PHE H H 4 8.610 8.610 8.451 0.159 17919 50572 1 124 . 1 1 5 5 VAL N N 5 121.000 121.000 121.757 -0.757 17919 50573 1 124 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.685 0.040 17919 50574 1 124 . 1 1 5 5 VAL C C 5 174.870 174.870 174.925 -0.055 17919 50575 1 124 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.404 -0.784 17919 50576 1 124 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.178 0.052 17919 50577 1 124 . 1 1 5 5 VAL H H 5 9.300 9.300 8.826 0.474 17919 50578 1 124 . 1 1 6 6 LYS N N 6 127.520 127.520 129.451 -1.931 17919 50579 1 124 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.134 0.233 17919 50580 1 124 . 1 1 6 6 LYS C C 6 177.140 177.140 176.524 0.616 17919 50581 1 124 . 1 1 6 6 LYS CA C 6 54.520 54.520 53.414 1.106 17919 50582 1 124 . 1 1 6 6 LYS CB C 6 35.050 35.050 33.173 1.877 17919 50583 1 124 . 1 1 6 6 LYS H H 6 8.820 8.820 8.964 -0.144 17919 50584 1 124 . 1 1 7 7 THR N N 7 115.400 115.400 118.003 -2.603 17919 50585 1 124 . 1 1 7 7 THR HA H 7 4.970 4.970 4.193 0.777 17919 50586 1 124 . 1 1 7 7 THR C C 7 176.910 176.910 176.962 -0.052 17919 50587 1 124 . 1 1 7 7 THR CA C 7 60.470 60.470 62.228 -1.758 17919 50588 1 124 . 1 1 7 7 THR CB C 7 70.630 70.630 69.823 0.807 17919 50589 1 124 . 1 1 7 7 THR H H 7 8.730 8.730 8.415 0.315 17919 50590 1 124 . 1 1 8 8 LEU N N 8 121.330 121.330 119.284 2.046 17919 50591 1 124 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.269 0.041 17919 50592 1 124 . 1 1 8 8 LEU C C 8 178.800 178.800 177.493 1.307 17919 50593 1 124 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.610 -0.030 17919 50594 1 124 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.756 0.214 17919 50595 1 124 . 1 1 8 8 LEU H H 8 9.100 9.100 8.157 0.943 17919 50596 1 124 . 1 1 9 9 THR N N 9 105.590 105.590 107.008 -1.418 17919 50597 1 124 . 1 1 9 9 THR HA H 9 4.428 4.428 4.241 0.187 17919 50598 1 124 . 1 1 9 9 THR C C 9 175.520 175.520 175.722 -0.202 17919 50599 1 124 . 1 1 9 9 THR CA C 9 61.400 61.400 62.338 -0.938 17919 50600 1 124 . 1 1 9 9 THR CB C 9 69.140 69.140 68.777 0.363 17919 50601 1 124 . 1 1 9 9 THR H H 9 7.630 7.630 7.619 0.011 17919 50602 1 124 . 1 1 10 10 GLY N N 10 108.890 108.890 110.734 -1.844 17919 50603 1 124 . 1 1 10 10 GLY C C 10 174.070 174.070 173.692 0.378 17919 50604 1 124 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.895 0.565 17919 50605 1 124 . 1 1 10 10 GLY H H 10 7.810 7.810 7.632 0.178 17919 50606 1 124 . 1 1 11 11 LYS N N 11 121.600 121.600 121.301 0.299 17919 50607 1 124 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.331 0.030 17919 50608 1 124 . 1 1 11 11 LYS C C 11 175.940 175.940 175.471 0.469 17919 50609 1 124 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.595 -0.315 17919 50610 1 124 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.685 -0.485 17919 50611 1 124 . 1 1 11 11 LYS H H 11 7.280 7.280 7.727 -0.447 17919 50612 1 124 . 1 1 12 12 THR N N 12 120.440 120.440 121.279 -0.839 17919 50613 1 124 . 1 1 12 12 THR HA H 12 5.046 5.046 5.410 -0.364 17919 50614 1 124 . 1 1 12 12 THR C C 12 174.320 174.320 174.532 -0.212 17919 50615 1 124 . 1 1 12 12 THR CA C 12 62.390 62.390 61.542 0.848 17919 50616 1 124 . 1 1 12 12 THR CB C 12 69.910 69.910 69.898 0.012 17919 50617 1 124 . 1 1 12 12 THR H H 12 8.650 8.650 8.383 0.267 17919 50618 1 124 . 1 1 13 13 ILE N N 13 127.110 127.110 126.821 0.289 17919 50619 1 124 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.598 -0.054 17919 50620 1 124 . 1 1 13 13 ILE C C 13 175.220 175.220 174.800 0.420 17919 50621 1 124 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.344 -0.364 17919 50622 1 124 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.593 0.357 17919 50623 1 124 . 1 1 13 13 ILE H H 13 9.450 9.450 8.677 0.773 17919 50624 1 124 . 1 1 14 14 THR N N 14 121.520 121.520 119.031 2.489 17919 50625 1 124 . 1 1 14 14 THR HA H 14 4.964 4.964 5.171 -0.207 17919 50626 1 124 . 1 1 14 14 THR C C 14 173.790 173.790 173.829 -0.039 17919 50627 1 124 . 1 1 14 14 THR CA C 14 61.940 61.940 60.842 1.098 17919 50628 1 124 . 1 1 14 14 THR CB C 14 69.650 69.650 70.581 -0.930 17919 50629 1 124 . 1 1 14 14 THR H H 14 8.710 8.710 8.439 0.271 17919 50630 1 124 . 1 1 15 15 LEU N N 15 124.800 124.800 125.680 -0.880 17919 50631 1 124 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.751 0.029 17919 50632 1 124 . 1 1 15 15 LEU C C 15 174.670 174.670 174.751 -0.081 17919 50633 1 124 . 1 1 15 15 LEU CA C 15 52.830 52.830 54.331 -1.501 17919 50634 1 124 . 1 1 15 15 LEU CB C 15 47.070 47.070 46.546 0.524 17919 50635 1 124 . 1 1 15 15 LEU H H 15 8.710 8.710 8.815 -0.105 17919 50636 1 124 . 1 1 16 16 GLU N N 16 122.160 122.160 124.926 -2.766 17919 50637 1 124 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.654 0.263 17919 50638 1 124 . 1 1 16 16 GLU C C 16 175.860 175.860 175.315 0.545 17919 50639 1 124 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.358 -0.538 17919 50640 1 124 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.171 -0.720 17919 50641 1 124 . 1 1 16 16 GLU H H 16 8.140 8.140 8.628 -0.488 17919 50642 1 124 . 1 1 17 17 VAL N N 17 117.210 117.210 120.213 -3.003 17919 50643 1 124 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.836 -0.122 17919 50644 1 124 . 1 1 17 17 VAL C C 17 174.160 174.160 175.180 -1.020 17919 50645 1 124 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.679 -0.249 17919 50646 1 124 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.215 1.185 17919 50647 1 124 . 1 1 17 17 VAL H H 17 8.900 8.900 8.886 0.014 17919 50648 1 124 . 1 1 18 18 GLU N N 18 118.990 118.990 120.800 -1.810 17919 50649 1 124 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.828 0.251 17919 50650 1 124 . 1 1 18 18 GLU C C 18 176.160 176.160 175.290 0.870 17919 50651 1 124 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.456 0.264 17919 50652 1 124 . 1 1 18 18 GLU CB C 18 30.310 30.310 29.808 0.502 17919 50653 1 124 . 1 1 18 18 GLU H H 18 8.640 8.640 8.357 0.283 17919 50654 1 124 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.152 -0.011 17919 50655 1 124 . 1 1 19 19 PRO C C 19 175.310 175.310 177.842 -2.532 17919 50656 1 124 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.923 -0.453 17919 50657 1 124 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.043 -0.093 17919 50658 1 124 . 1 1 20 20 SER N N 20 103.400 103.400 109.989 -6.589 17919 50659 1 124 . 1 1 20 20 SER HA H 20 4.370 4.370 4.455 -0.085 17919 50660 1 124 . 1 1 20 20 SER C C 20 174.660 174.660 174.473 0.187 17919 50661 1 124 . 1 1 20 20 SER CA C 20 57.400 57.400 59.306 -1.906 17919 50662 1 124 . 1 1 20 20 SER CB C 20 63.370 63.370 63.002 0.368 17919 50663 1 124 . 1 1 20 20 SER H H 20 7.040 7.040 8.114 -1.074 17919 50664 1 124 . 1 1 21 21 ASP N N 21 123.480 123.480 123.835 -0.355 17919 50665 1 124 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.683 0.012 17919 50666 1 124 . 1 1 21 21 ASP C C 21 176.360 176.360 175.414 0.946 17919 50667 1 124 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.468 0.232 17919 50668 1 124 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.409 -0.609 17919 50669 1 124 . 1 1 21 21 ASP H H 21 8.030 8.030 7.720 0.310 17919 50670 1 124 . 1 1 22 22 THR N N 22 108.800 108.800 112.963 -4.163 17919 50671 1 124 . 1 1 22 22 THR HA H 22 4.920 4.920 4.670 0.250 17919 50672 1 124 . 1 1 22 22 THR C C 22 176.750 176.750 175.751 0.999 17919 50673 1 124 . 1 1 22 22 THR CA C 22 59.690 59.690 61.461 -1.771 17919 50674 1 124 . 1 1 22 22 THR CB C 22 71.200 71.200 69.983 1.217 17919 50675 1 124 . 1 1 22 22 THR H H 22 7.900 7.900 8.237 -0.337 17919 50676 1 124 . 1 1 23 23 ILE N N 23 121.190 121.190 121.707 -0.517 17919 50677 1 124 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.916 -0.259 17919 50678 1 124 . 1 1 23 23 ILE C C 23 179.040 179.040 177.756 1.284 17919 50679 1 124 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.068 0.192 17919 50680 1 124 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.495 -2.145 17919 50681 1 124 . 1 1 23 23 ILE H H 23 8.560 8.560 8.763 -0.203 17919 50682 1 124 . 1 1 24 24 GLU N N 24 120.830 120.830 120.872 -0.042 17919 50683 1 124 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.857 0.060 17919 50684 1 124 . 1 1 24 24 GLU C C 24 178.640 178.640 178.402 0.238 17919 50685 1 124 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.410 -0.190 17919 50686 1 124 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.277 -0.997 17919 50687 1 124 . 1 1 24 24 GLU H H 24 9.760 9.760 8.178 1.582 17919 50688 1 124 . 1 1 25 25 ASN N N 25 120.570 120.570 117.029 3.541 17919 50689 1 124 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.584 -0.059 17919 50690 1 124 . 1 1 25 25 ASN C C 25 178.380 178.380 177.942 0.438 17919 50691 1 124 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.656 0.404 17919 50692 1 124 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.040 0.410 17919 50693 1 124 . 1 1 25 25 ASN H H 25 7.920 7.920 7.584 0.336 17919 50694 1 124 . 1 1 26 26 VAL N N 26 121.710 121.710 118.384 3.326 17919 50695 1 124 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.621 -0.224 17919 50696 1 124 . 1 1 26 26 VAL C C 26 177.950 177.950 177.858 0.092 17919 50697 1 124 . 1 1 26 26 VAL CA C 26 67.660 67.660 65.898 1.762 17919 50698 1 124 . 1 1 26 26 VAL CB C 26 30.840 30.840 30.205 0.635 17919 50699 1 124 . 1 1 26 26 VAL H H 26 8.070 8.070 7.795 0.275 17919 50700 1 124 . 1 1 27 27 LYS N N 27 118.860 118.860 120.942 -2.082 17919 50701 1 124 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.139 0.441 17919 50702 1 124 . 1 1 27 27 LYS C C 27 180.550 180.550 179.176 1.374 17919 50703 1 124 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.675 -0.425 17919 50704 1 124 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.298 1.432 17919 50705 1 124 . 1 1 27 27 LYS H H 27 8.560 8.560 8.011 0.549 17919 50706 1 124 . 1 1 28 28 ALA N N 28 123.440 123.440 120.713 2.727 17919 50707 1 124 . 1 1 28 28 ALA HA H 28 4.160 4.160 3.965 0.195 17919 50708 1 124 . 1 1 28 28 ALA C C 28 180.300 180.300 179.272 1.028 17919 50709 1 124 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.469 -0.099 17919 50710 1 124 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.308 -0.599 17919 50711 1 124 . 1 1 28 28 ALA H H 28 8.060 8.060 8.659 -0.599 17919 50712 1 124 . 1 1 29 29 LYS N N 29 119.940 119.940 119.494 0.446 17919 50713 1 124 . 1 1 29 29 LYS HA H 29 4.207 4.207 3.967 0.239 17919 50714 1 124 . 1 1 29 29 LYS C C 29 180.320 180.320 178.994 1.326 17919 50715 1 124 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.487 0.163 17919 50716 1 124 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.190 1.100 17919 50717 1 124 . 1 1 29 29 LYS H H 29 7.850 7.850 7.467 0.383 17919 50718 1 124 . 1 1 30 30 ILE N N 30 121.080 121.080 119.409 1.671 17919 50719 1 124 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.602 -0.095 17919 50720 1 124 . 1 1 30 30 ILE C C 30 178.310 178.310 177.651 0.659 17919 50721 1 124 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.201 0.949 17919 50722 1 124 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.043 -0.243 17919 50723 1 124 . 1 1 30 30 ILE H H 30 8.280 8.280 7.690 0.590 17919 50724 1 124 . 1 1 31 31 GLN N N 31 123.490 123.490 120.884 2.606 17919 50725 1 124 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.008 -0.179 17919 50726 1 124 . 1 1 31 31 GLN C C 31 178.890 178.890 177.960 0.930 17919 50727 1 124 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.113 0.887 17919 50728 1 124 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.571 -0.851 17919 50729 1 124 . 1 1 31 31 GLN H H 31 8.580 8.580 8.543 0.037 17919 50730 1 124 . 1 1 32 32 ASP N N 32 119.360 119.360 118.320 1.040 17919 50731 1 124 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.423 -0.069 17919 50732 1 124 . 1 1 32 32 ASP C C 32 177.250 177.250 178.130 -0.880 17919 50733 1 124 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.522 0.668 17919 50734 1 124 . 1 1 32 32 ASP CB C 32 40.580 40.580 41.008 -0.428 17919 50735 1 124 . 1 1 32 32 ASP H H 32 8.010 8.010 7.945 0.065 17919 50736 1 124 . 1 1 33 33 LYS N N 33 115.130 115.130 119.567 -4.437 17919 50737 1 124 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.238 0.099 17919 50738 1 124 . 1 1 33 33 LYS C C 33 177.870 177.870 178.633 -0.763 17919 50739 1 124 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.919 0.131 17919 50740 1 124 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.130 1.040 17919 50741 1 124 . 1 1 33 33 LYS H H 33 7.430 7.430 7.860 -0.430 17919 50742 1 124 . 1 1 34 34 GLU N N 34 113.870 113.870 115.653 -1.783 17919 50743 1 124 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.448 0.177 17919 50744 1 124 . 1 1 34 34 GLU C C 34 177.840 177.840 177.251 0.589 17919 50745 1 124 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.461 -1.291 17919 50746 1 124 . 1 1 34 34 GLU CB C 34 32.660 32.660 30.824 1.836 17919 50747 1 124 . 1 1 34 34 GLU H H 34 8.740 8.740 8.261 0.479 17919 50748 1 124 . 1 1 35 35 GLY N N 35 108.650 108.650 108.890 -0.240 17919 50749 1 124 . 1 1 35 35 GLY C C 35 173.960 173.960 174.414 -0.454 17919 50750 1 124 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.679 0.401 17919 50751 1 124 . 1 1 35 35 GLY H H 35 8.530 8.530 7.941 0.589 17919 50752 1 124 . 1 1 36 36 ILE N N 36 119.880 119.880 121.441 -1.561 17919 50753 1 124 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.321 0.124 17919 50754 1 124 . 1 1 36 36 ILE C C 36 173.590 173.590 174.240 -0.650 17919 50755 1 124 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.076 -0.326 17919 50756 1 124 . 1 1 36 36 ILE CB C 36 40.580 40.580 37.888 2.692 17919 50757 1 124 . 1 1 36 36 ILE H H 36 6.150 6.150 7.630 -1.480 17919 50758 1 124 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.828 -0.194 17919 50759 1 124 . 1 1 37 37 PRO C C 37 176.940 176.940 176.192 0.748 17919 50760 1 124 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.496 0.164 17919 50761 1 124 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.212 0.638 17919 50762 1 124 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.247 -0.130 17919 50763 1 124 . 1 1 38 38 PRO C C 38 178.320 178.320 177.954 0.366 17919 50764 1 124 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.133 1.127 17919 50765 1 124 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.769 1.121 17919 50766 1 124 . 1 1 39 39 ASP N N 39 113.380 113.380 115.168 -1.788 17919 50767 1 124 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.454 -0.024 17919 50768 1 124 . 1 1 39 39 ASP C C 39 177.090 177.090 177.095 -0.005 17919 50769 1 124 . 1 1 39 39 ASP CA C 39 55.640 55.640 55.801 -0.161 17919 50770 1 124 . 1 1 39 39 ASP CB C 39 39.540 39.540 39.577 -0.037 17919 50771 1 124 . 1 1 39 39 ASP H H 39 8.550 8.550 8.980 -0.430 17919 50772 1 124 . 1 1 40 40 GLN N N 40 116.780 116.780 118.496 -1.716 17919 50773 1 124 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.423 0.041 17919 50774 1 124 . 1 1 40 40 GLN C C 40 175.380 175.380 176.391 -1.011 17919 50775 1 124 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.557 -0.917 17919 50776 1 124 . 1 1 40 40 GLN CB C 40 30.140 30.140 30.340 -0.200 17919 50777 1 124 . 1 1 40 40 GLN H H 40 7.820 7.820 7.514 0.306 17919 50778 1 124 . 1 1 41 41 GLN N N 41 117.720 117.720 119.596 -1.876 17919 50779 1 124 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.111 0.133 17919 50780 1 124 . 1 1 41 41 GLN C C 41 176.300 176.300 175.703 0.597 17919 50781 1 124 . 1 1 41 41 GLN CA C 41 56.470 56.470 57.005 -0.535 17919 50782 1 124 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.483 2.167 17919 50783 1 124 . 1 1 41 41 GLN H H 41 7.480 7.480 7.393 0.087 17919 50784 1 124 . 1 1 42 42 ARG N N 42 122.680 122.680 123.232 -0.552 17919 50785 1 124 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.571 -0.071 17919 50786 1 124 . 1 1 42 42 ARG C C 42 174.050 174.050 173.754 0.296 17919 50787 1 124 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.886 0.164 17919 50788 1 124 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.639 -1.889 17919 50789 1 124 . 1 1 42 42 ARG H H 42 8.530 8.530 8.013 0.517 17919 50790 1 124 . 1 1 43 43 LEU N N 43 124.040 124.040 127.314 -3.274 17919 50791 1 124 . 1 1 43 43 LEU C C 43 175.290 175.290 175.309 -0.019 17919 50792 1 124 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.560 -0.581 17919 50793 1 124 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.268 1.522 17919 50794 1 124 . 1 1 43 43 LEU H H 43 8.820 8.820 8.600 0.220 17919 50795 1 124 . 1 1 44 44 ILE N N 44 121.920 121.920 122.350 -0.430 17919 50796 1 124 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.900 0.092 17919 50797 1 124 . 1 1 44 44 ILE C C 44 176.060 176.060 174.810 1.250 17919 50798 1 124 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.879 -1.899 17919 50799 1 124 . 1 1 44 44 ILE CB C 44 41.420 41.420 40.318 1.102 17919 50800 1 124 . 1 1 44 44 ILE H H 44 9.030 9.030 8.987 0.043 17919 50801 1 124 . 1 1 45 45 PHE N N 45 125.390 125.390 128.954 -3.564 17919 50802 1 124 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.948 0.097 17919 50803 1 124 . 1 1 45 45 PHE C C 45 174.470 174.470 175.664 -1.194 17919 50804 1 124 . 1 1 45 45 PHE CA C 45 57.020 57.020 57.950 -0.930 17919 50805 1 124 . 1 1 45 45 PHE CB C 45 43.760 43.760 41.457 2.303 17919 50806 1 124 . 1 1 45 45 PHE H H 45 8.830 8.830 8.315 0.515 17919 50807 1 124 . 1 1 46 46 ALA N N 46 132.200 132.200 122.856 9.344 17919 50808 1 124 . 1 1 46 46 ALA HA H 46 3.690 3.690 4.323 -0.633 17919 50809 1 124 . 1 1 46 46 ALA C C 46 177.290 177.290 177.412 -0.122 17919 50810 1 124 . 1 1 46 46 ALA CA C 46 52.540 52.540 51.046 1.494 17919 50811 1 124 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.982 -0.412 17919 50812 1 124 . 1 1 46 46 ALA H H 46 8.810 8.810 8.603 0.207 17919 50813 1 124 . 1 1 47 47 GLY N N 47 102.340 102.340 105.599 -3.259 17919 50814 1 124 . 1 1 47 47 GLY C C 47 173.810 173.810 173.940 -0.130 17919 50815 1 124 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.308 0.042 17919 50816 1 124 . 1 1 47 47 GLY H H 47 8.130 8.130 7.776 0.354 17919 50817 1 124 . 1 1 48 48 LYS N N 48 121.570 121.570 121.233 0.337 17919 50818 1 124 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.585 0.037 17919 50819 1 124 . 1 1 48 48 LYS C C 48 174.700 174.700 175.874 -1.174 17919 50820 1 124 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.709 -0.159 17919 50821 1 124 . 1 1 48 48 LYS CB C 48 34.530 34.530 33.660 0.870 17919 50822 1 124 . 1 1 48 48 LYS H H 48 7.980 7.980 7.665 0.315 17919 50823 1 124 . 1 1 49 49 GLN N N 49 122.410 122.410 121.744 0.666 17919 50824 1 124 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.312 0.248 17919 50825 1 124 . 1 1 49 49 GLN C C 49 175.670 175.670 175.596 0.074 17919 50826 1 124 . 1 1 49 49 GLN CA C 49 55.740 55.740 57.047 -1.307 17919 50827 1 124 . 1 1 49 49 GLN CB C 49 29.000 29.000 28.855 0.145 17919 50828 1 124 . 1 1 49 49 GLN H H 49 8.600 8.600 8.575 0.025 17919 50829 1 124 . 1 1 50 50 LEU N N 50 125.520 125.520 124.238 1.282 17919 50830 1 124 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.111 -0.021 17919 50831 1 124 . 1 1 50 50 LEU C C 50 176.660 176.660 176.710 -0.050 17919 50832 1 124 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.806 0.434 17919 50833 1 124 . 1 1 50 50 LEU CB C 50 41.570 41.570 40.849 0.721 17919 50834 1 124 . 1 1 50 50 LEU H H 50 8.530 8.530 8.085 0.445 17919 50835 1 124 . 1 1 51 51 GLU N N 51 122.940 122.940 124.661 -1.721 17919 50836 1 124 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.048 0.440 17919 50837 1 124 . 1 1 51 51 GLU C C 51 175.870 175.870 177.029 -1.159 17919 50838 1 124 . 1 1 51 51 GLU CA C 51 55.960 55.960 57.319 -1.359 17919 50839 1 124 . 1 1 51 51 GLU CB C 51 31.570 31.570 29.776 1.794 17919 50840 1 124 . 1 1 51 51 GLU H H 51 8.400 8.400 8.226 0.174 17919 50841 1 124 . 1 1 52 52 ASP N N 52 120.030 120.030 123.752 -3.722 17919 50842 1 124 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.529 -0.170 17919 50843 1 124 . 1 1 52 52 ASP C C 52 177.330 177.330 177.522 -0.192 17919 50844 1 124 . 1 1 52 52 ASP CA C 52 56.960 56.960 56.710 0.250 17919 50845 1 124 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.728 0.122 17919 50846 1 124 . 1 1 52 52 ASP H H 52 8.160 8.160 8.623 -0.463 17919 50847 1 124 . 1 1 53 53 GLY N N 53 106.660 106.660 105.672 0.988 17919 50848 1 124 . 1 1 53 53 GLY C C 53 174.870 174.870 174.749 0.121 17919 50849 1 124 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.920 0.250 17919 50850 1 124 . 1 1 53 53 GLY H H 53 9.390 9.390 8.458 0.932 17919 50851 1 124 . 1 1 54 54 ARG N N 54 119.050 119.050 120.918 -1.868 17919 50852 1 124 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.448 0.247 17919 50853 1 124 . 1 1 54 54 ARG C C 54 175.350 175.350 175.318 0.032 17919 50854 1 124 . 1 1 54 54 ARG CA C 54 54.390 54.390 55.341 -0.951 17919 50855 1 124 . 1 1 54 54 ARG CB C 54 32.650 32.650 31.203 1.446 17919 50856 1 124 . 1 1 54 54 ARG H H 54 7.460 7.460 7.795 -0.335 17919 50857 1 124 . 1 1 55 55 THR N N 55 108.400 108.400 110.103 -1.703 17919 50858 1 124 . 1 1 55 55 THR HA H 55 5.240 5.240 5.100 0.140 17919 50859 1 124 . 1 1 55 55 THR C C 55 176.560 176.560 175.767 0.793 17919 50860 1 124 . 1 1 55 55 THR CA C 55 59.690 59.690 59.787 -0.097 17919 50861 1 124 . 1 1 55 55 THR CB C 55 72.260 72.260 71.562 0.698 17919 50862 1 124 . 1 1 55 55 THR H H 55 8.730 8.730 8.039 0.691 17919 50863 1 124 . 1 1 56 56 LEU N N 56 117.920 117.920 120.450 -2.530 17919 50864 1 124 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.149 -0.089 17919 50865 1 124 . 1 1 56 56 LEU C C 56 180.810 180.810 178.854 1.956 17919 50866 1 124 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.117 0.593 17919 50867 1 124 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.750 -1.380 17919 50868 1 124 . 1 1 56 56 LEU H H 56 8.140 8.140 8.094 0.046 17919 50869 1 124 . 1 1 57 57 SER N N 57 113.330 113.330 115.629 -2.299 17919 50870 1 124 . 1 1 57 57 SER HA H 57 4.370 4.370 3.997 0.373 17919 50871 1 124 . 1 1 57 57 SER C C 57 178.310 178.310 176.746 1.564 17919 50872 1 124 . 1 1 57 57 SER CA C 57 61.080 61.080 62.142 -1.062 17919 50873 1 124 . 1 1 57 57 SER CB C 57 62.530 62.530 62.612 -0.082 17919 50874 1 124 . 1 1 57 57 SER H H 57 8.470 8.470 8.155 0.315 17919 50875 1 124 . 1 1 58 58 ASP N N 58 124.190 124.190 121.434 2.756 17919 50876 1 124 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.256 0.040 17919 50877 1 124 . 1 1 58 58 ASP C C 58 177.400 177.400 177.565 -0.165 17919 50878 1 124 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.800 0.380 17919 50879 1 124 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.349 -0.249 17919 50880 1 124 . 1 1 58 58 ASP H H 58 7.930 7.930 7.982 -0.052 17919 50881 1 124 . 1 1 59 59 TYR N N 59 115.510 115.510 115.194 0.316 17919 50882 1 124 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.712 -0.042 17919 50883 1 124 . 1 1 59 59 TYR C C 59 174.700 174.700 175.088 -0.388 17919 50884 1 124 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.566 0.684 17919 50885 1 124 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.432 1.638 17919 50886 1 124 . 1 1 59 59 TYR H H 59 7.250 7.250 7.288 -0.038 17919 50887 1 124 . 1 1 60 60 ASN N N 60 115.900 115.900 114.592 1.308 17919 50888 1 124 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.395 -0.040 17919 50889 1 124 . 1 1 60 60 ASN C C 60 174.340 174.340 174.407 -0.067 17919 50890 1 124 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.020 0.100 17919 50891 1 124 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.215 0.195 17919 50892 1 124 . 1 1 60 60 ASN H H 60 8.150 8.150 7.931 0.219 17919 50893 1 124 . 1 1 61 61 ILE N N 61 118.600 118.600 121.426 -2.826 17919 50894 1 124 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.983 -0.590 17919 50895 1 124 . 1 1 61 61 ILE C C 61 174.610 174.610 174.846 -0.236 17919 50896 1 124 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.515 0.905 17919 50897 1 124 . 1 1 61 61 ILE CB C 61 36.740 36.740 35.470 1.270 17919 50898 1 124 . 1 1 61 61 ILE H H 61 7.250 7.250 8.044 -0.794 17919 50899 1 124 . 1 1 62 62 GLN N N 62 124.740 124.740 124.731 0.009 17919 50900 1 124 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.544 -0.038 17919 50901 1 124 . 1 1 62 62 GLN C C 62 175.970 175.970 176.103 -0.133 17919 50902 1 124 . 1 1 62 62 GLN CA C 62 53.660 53.660 54.695 -1.035 17919 50903 1 124 . 1 1 62 62 GLN CB C 62 31.650 31.650 30.065 1.585 17919 50904 1 124 . 1 1 62 62 GLN H H 62 7.610 7.610 7.727 -0.117 17919 50905 1 124 . 1 1 63 63 LYS N N 63 120.300 120.300 119.780 0.520 17919 50906 1 124 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.110 -0.109 17919 50907 1 124 . 1 1 63 63 LYS C C 63 175.810 175.810 177.460 -1.650 17919 50908 1 124 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.542 0.248 17919 50909 1 124 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.208 0.442 17919 50910 1 124 . 1 1 63 63 LYS H H 63 8.490 8.490 8.479 0.011 17919 50911 1 124 . 1 1 64 64 GLU N N 64 113.950 113.950 118.361 -4.411 17919 50912 1 124 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.637 -0.172 17919 50913 1 124 . 1 1 64 64 GLU C C 64 175.250 175.250 175.376 -0.126 17919 50914 1 124 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.726 0.164 17919 50915 1 124 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.523 -2.623 17919 50916 1 124 . 1 1 64 64 GLU H H 64 9.280 9.280 8.619 0.661 17919 50917 1 124 . 1 1 65 65 SER N N 65 114.730 114.730 113.967 0.763 17919 50918 1 124 . 1 1 65 65 SER HA H 65 4.640 4.640 4.633 0.007 17919 50919 1 124 . 1 1 65 65 SER C C 65 172.160 172.160 173.829 -1.669 17919 50920 1 124 . 1 1 65 65 SER CA C 65 60.890 60.890 59.234 1.656 17919 50921 1 124 . 1 1 65 65 SER CB C 65 64.910 64.910 64.056 0.854 17919 50922 1 124 . 1 1 65 65 SER H H 65 7.670 7.670 7.561 0.109 17919 50923 1 124 . 1 1 66 66 THR N N 66 117.110 117.110 119.320 -2.210 17919 50924 1 124 . 1 1 66 66 THR HA H 66 5.270 5.270 4.829 0.441 17919 50925 1 124 . 1 1 66 66 THR C C 66 173.950 173.950 174.179 -0.229 17919 50926 1 124 . 1 1 66 66 THR CA C 66 62.340 62.340 62.378 -0.038 17919 50927 1 124 . 1 1 66 66 THR CB C 66 70.080 70.080 69.832 0.248 17919 50928 1 124 . 1 1 66 66 THR H H 66 8.730 8.730 8.402 0.328 17919 50929 1 124 . 1 1 67 67 LEU N N 67 127.110 127.110 126.366 0.744 17919 50930 1 124 . 1 1 67 67 LEU HA H 67 5.060 5.060 5.152 -0.092 17919 50931 1 124 . 1 1 67 67 LEU C C 67 175.770 175.770 175.139 0.631 17919 50932 1 124 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.761 0.139 17919 50933 1 124 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.739 -0.479 17919 50934 1 124 . 1 1 67 67 LEU H H 67 9.410 9.410 8.834 0.576 17919 50935 1 124 . 1 1 68 68 HIS N N 68 118.380 118.380 119.586 -1.206 17919 50936 1 124 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.732 -0.492 17919 50937 1 124 . 1 1 68 68 HIS C C 68 173.150 173.150 173.595 -0.445 17919 50938 1 124 . 1 1 68 68 HIS CA C 68 55.000 55.000 53.658 1.342 17919 50939 1 124 . 1 1 68 68 HIS CB C 68 30.530 30.530 34.172 -3.642 17919 50940 1 124 . 1 1 68 68 HIS H H 68 9.230 9.230 9.165 0.065 17919 50941 1 124 . 1 1 69 69 LEU N N 69 124.460 124.460 123.743 0.717 17919 50942 1 124 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.131 0.059 17919 50943 1 124 . 1 1 69 69 LEU C C 69 175.270 175.270 174.301 0.969 17919 50944 1 124 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.347 -0.457 17919 50945 1 124 . 1 1 69 69 LEU CB C 69 44.380 44.380 45.174 -0.794 17919 50946 1 124 . 1 1 69 69 LEU H H 69 8.340 8.340 7.342 0.998 17919 50947 1 124 . 1 1 70 70 VAL N N 70 126.940 126.940 121.428 5.512 17919 50948 1 124 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.472 -0.122 17919 50949 1 124 . 1 1 70 70 VAL C C 70 174.000 174.000 174.169 -0.169 17919 50950 1 124 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.002 0.798 17919 50951 1 124 . 1 1 70 70 VAL CB C 70 34.910 34.910 33.954 0.956 17919 50952 1 124 . 1 1 70 70 VAL H H 70 9.200 9.200 7.952 1.248 17919 50953 1 124 . 1 1 71 71 LEU N N 71 123.130 123.130 121.256 1.874 17919 50954 1 124 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.853 0.207 17919 50955 1 124 . 1 1 71 71 LEU C C 71 177.830 177.830 177.222 0.608 17919 50956 1 124 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.337 0.603 17919 50957 1 124 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.027 -0.177 17919 50958 1 124 . 1 1 71 71 LEU H H 71 8.120 8.120 8.425 -0.305 17919 50959 1 124 . 1 1 72 72 ARG N N 72 123.490 123.490 126.703 -3.213 17919 50960 1 124 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.441 -0.140 17919 50961 1 124 . 1 1 72 72 ARG C C 72 175.350 175.350 175.137 0.213 17919 50962 1 124 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.735 -0.125 17919 50963 1 124 . 1 1 72 72 ARG CB C 72 31.350 31.350 29.122 2.228 17919 50964 1 124 . 1 1 72 72 ARG H H 72 8.580 8.580 8.290 0.290 17919 50965 1 125 . 1 1 2 2 GLN N N 2 123.220 123.220 120.310 2.910 17919 50966 1 125 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.346 -0.097 17919 50967 1 125 . 1 1 2 2 GLN C C 2 175.920 175.920 174.757 1.163 17919 50968 1 125 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.494 0.586 17919 50969 1 125 . 1 1 2 2 GLN CB C 2 30.760 30.760 31.190 -0.430 17919 50970 1 125 . 1 1 2 2 GLN H H 2 8.900 8.900 8.238 0.662 17919 50971 1 125 . 1 1 3 3 ILE N N 3 115.340 115.340 117.153 -1.813 17919 50972 1 125 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.273 -0.060 17919 50973 1 125 . 1 1 3 3 ILE C C 3 172.450 172.450 173.388 -0.938 17919 50974 1 125 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.347 0.223 17919 50975 1 125 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.502 0.708 17919 50976 1 125 . 1 1 3 3 ILE H H 3 8.320 8.320 8.269 0.051 17919 50977 1 125 . 1 1 4 4 PHE N N 4 118.110 118.110 121.550 -3.440 17919 50978 1 125 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.363 0.267 17919 50979 1 125 . 1 1 4 4 PHE C C 4 175.320 175.320 175.510 -0.190 17919 50980 1 125 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.179 0.031 17919 50981 1 125 . 1 1 4 4 PHE CB C 4 41.480 41.480 40.595 0.885 17919 50982 1 125 . 1 1 4 4 PHE H H 4 8.610 8.610 8.604 0.006 17919 50983 1 125 . 1 1 5 5 VAL N N 5 121.000 121.000 122.735 -1.735 17919 50984 1 125 . 1 1 5 5 VAL HA H 5 4.725 4.725 5.058 -0.333 17919 50985 1 125 . 1 1 5 5 VAL C C 5 174.870 174.870 175.059 -0.189 17919 50986 1 125 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.031 -0.411 17919 50987 1 125 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.166 0.063 17919 50988 1 125 . 1 1 5 5 VAL H H 5 9.300 9.300 8.733 0.567 17919 50989 1 125 . 1 1 6 6 LYS N N 6 127.520 127.520 127.554 -0.034 17919 50990 1 125 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.088 0.279 17919 50991 1 125 . 1 1 6 6 LYS C C 6 177.140 177.140 176.584 0.556 17919 50992 1 125 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.632 -0.112 17919 50993 1 125 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.130 0.920 17919 50994 1 125 . 1 1 6 6 LYS H H 6 8.820 8.820 8.858 -0.038 17919 50995 1 125 . 1 1 7 7 THR N N 7 115.400 115.400 115.152 0.248 17919 50996 1 125 . 1 1 7 7 THR HA H 7 4.970 4.970 4.434 0.536 17919 50997 1 125 . 1 1 7 7 THR C C 7 176.910 176.910 175.396 1.514 17919 50998 1 125 . 1 1 7 7 THR CA C 7 60.470 60.470 61.580 -1.110 17919 50999 1 125 . 1 1 7 7 THR CB C 7 70.630 70.630 69.963 0.667 17919 51000 1 125 . 1 1 7 7 THR H H 7 8.730 8.730 8.927 -0.197 17919 51001 1 125 . 1 1 8 8 LEU N N 8 121.330 121.330 122.120 -0.790 17919 51002 1 125 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.836 -0.526 17919 51003 1 125 . 1 1 8 8 LEU C C 8 178.800 178.800 176.339 2.461 17919 51004 1 125 . 1 1 8 8 LEU CA C 8 57.580 57.580 54.077 3.503 17919 51005 1 125 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.477 0.493 17919 51006 1 125 . 1 1 8 8 LEU H H 8 9.100 9.100 8.776 0.324 17919 51007 1 125 . 1 1 9 9 THR N N 9 105.590 105.590 112.483 -6.893 17919 51008 1 125 . 1 1 9 9 THR HA H 9 4.428 4.428 4.414 0.014 17919 51009 1 125 . 1 1 9 9 THR C C 9 175.520 175.520 175.301 0.219 17919 51010 1 125 . 1 1 9 9 THR CA C 9 61.400 61.400 61.964 -0.564 17919 51011 1 125 . 1 1 9 9 THR CB C 9 69.140 69.140 70.040 -0.900 17919 51012 1 125 . 1 1 9 9 THR H H 9 7.630 7.630 7.635 -0.005 17919 51013 1 125 . 1 1 10 10 GLY N N 10 108.890 108.890 110.608 -1.718 17919 51014 1 125 . 1 1 10 10 GLY C C 10 174.070 174.070 173.766 0.304 17919 51015 1 125 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.058 0.402 17919 51016 1 125 . 1 1 10 10 GLY H H 10 7.810 7.810 8.500 -0.690 17919 51017 1 125 . 1 1 11 11 LYS N N 11 121.600 121.600 120.909 0.691 17919 51018 1 125 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.750 -0.389 17919 51019 1 125 . 1 1 11 11 LYS C C 11 175.940 175.940 174.862 1.078 17919 51020 1 125 . 1 1 11 11 LYS CA C 11 56.280 56.280 54.824 1.456 17919 51021 1 125 . 1 1 11 11 LYS CB C 11 33.200 33.200 35.187 -1.987 17919 51022 1 125 . 1 1 11 11 LYS H H 11 7.280 7.280 7.808 -0.528 17919 51023 1 125 . 1 1 12 12 THR N N 12 120.440 120.440 117.142 3.298 17919 51024 1 125 . 1 1 12 12 THR HA H 12 5.046 5.046 5.085 -0.039 17919 51025 1 125 . 1 1 12 12 THR C C 12 174.320 174.320 173.661 0.659 17919 51026 1 125 . 1 1 12 12 THR CA C 12 62.390 62.390 61.175 1.215 17919 51027 1 125 . 1 1 12 12 THR CB C 12 69.910 69.910 71.001 -1.091 17919 51028 1 125 . 1 1 12 12 THR H H 12 8.650 8.650 8.325 0.325 17919 51029 1 125 . 1 1 13 13 ILE N N 13 127.110 127.110 125.088 2.022 17919 51030 1 125 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.537 0.007 17919 51031 1 125 . 1 1 13 13 ILE C C 13 175.220 175.220 174.389 0.831 17919 51032 1 125 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.486 -0.506 17919 51033 1 125 . 1 1 13 13 ILE CB C 13 40.950 40.950 42.716 -1.766 17919 51034 1 125 . 1 1 13 13 ILE H H 13 9.450 9.450 8.907 0.543 17919 51035 1 125 . 1 1 14 14 THR N N 14 121.520 121.520 121.437 0.083 17919 51036 1 125 . 1 1 14 14 THR HA H 14 4.964 4.964 5.217 -0.253 17919 51037 1 125 . 1 1 14 14 THR C C 14 173.790 173.790 173.782 0.008 17919 51038 1 125 . 1 1 14 14 THR CA C 14 61.940 61.940 61.846 0.094 17919 51039 1 125 . 1 1 14 14 THR CB C 14 69.650 69.650 70.110 -0.460 17919 51040 1 125 . 1 1 14 14 THR H H 14 8.710 8.710 8.464 0.246 17919 51041 1 125 . 1 1 15 15 LEU N N 15 124.800 124.800 126.785 -1.985 17919 51042 1 125 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.846 -0.066 17919 51043 1 125 . 1 1 15 15 LEU C C 15 174.670 174.670 174.921 -0.251 17919 51044 1 125 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.672 -0.842 17919 51045 1 125 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.503 1.567 17919 51046 1 125 . 1 1 15 15 LEU H H 15 8.710 8.710 8.489 0.221 17919 51047 1 125 . 1 1 16 16 GLU N N 16 122.160 122.160 123.893 -1.733 17919 51048 1 125 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.776 0.141 17919 51049 1 125 . 1 1 16 16 GLU C C 16 175.860 175.860 175.821 0.039 17919 51050 1 125 . 1 1 16 16 GLU CA C 16 54.820 54.820 54.475 0.345 17919 51051 1 125 . 1 1 16 16 GLU CB C 16 29.450 29.450 29.803 -0.353 17919 51052 1 125 . 1 1 16 16 GLU H H 16 8.140 8.140 8.486 -0.346 17919 51053 1 125 . 1 1 17 17 VAL N N 17 117.210 117.210 118.543 -1.333 17919 51054 1 125 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.581 0.133 17919 51055 1 125 . 1 1 17 17 VAL C C 17 174.160 174.160 175.384 -1.224 17919 51056 1 125 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.795 -1.365 17919 51057 1 125 . 1 1 17 17 VAL CB C 17 36.400 36.400 34.734 1.666 17919 51058 1 125 . 1 1 17 17 VAL H H 17 8.900 8.900 8.213 0.687 17919 51059 1 125 . 1 1 18 18 GLU N N 18 118.990 118.990 125.714 -6.724 17919 51060 1 125 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.820 0.259 17919 51061 1 125 . 1 1 18 18 GLU C C 18 176.160 176.160 175.987 0.173 17919 51062 1 125 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.678 0.042 17919 51063 1 125 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.988 -0.677 17919 51064 1 125 . 1 1 18 18 GLU H H 18 8.640 8.640 8.540 0.100 17919 51065 1 125 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.395 -0.254 17919 51066 1 125 . 1 1 19 19 PRO C C 19 175.310 175.310 177.156 -1.846 17919 51067 1 125 . 1 1 19 19 PRO CA C 19 65.470 65.470 64.958 0.512 17919 51068 1 125 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.279 -0.329 17919 51069 1 125 . 1 1 20 20 SER N N 20 103.400 103.400 112.280 -8.880 17919 51070 1 125 . 1 1 20 20 SER HA H 20 4.370 4.370 4.381 -0.011 17919 51071 1 125 . 1 1 20 20 SER C C 20 174.660 174.660 173.777 0.883 17919 51072 1 125 . 1 1 20 20 SER CA C 20 57.400 57.400 58.862 -1.462 17919 51073 1 125 . 1 1 20 20 SER CB C 20 63.370 63.370 62.509 0.861 17919 51074 1 125 . 1 1 20 20 SER H H 20 7.040 7.040 8.038 -0.998 17919 51075 1 125 . 1 1 21 21 ASP N N 21 123.480 123.480 123.313 0.167 17919 51076 1 125 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.639 0.056 17919 51077 1 125 . 1 1 21 21 ASP C C 21 176.360 176.360 175.885 0.475 17919 51078 1 125 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.640 1.060 17919 51079 1 125 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.417 -0.617 17919 51080 1 125 . 1 1 21 21 ASP H H 21 8.030 8.030 7.587 0.443 17919 51081 1 125 . 1 1 22 22 THR N N 22 108.800 108.800 112.916 -4.116 17919 51082 1 125 . 1 1 22 22 THR HA H 22 4.920 4.920 4.352 0.568 17919 51083 1 125 . 1 1 22 22 THR C C 22 176.750 176.750 176.088 0.662 17919 51084 1 125 . 1 1 22 22 THR CA C 22 59.690 59.690 62.077 -2.387 17919 51085 1 125 . 1 1 22 22 THR CB C 22 71.200 71.200 69.909 1.290 17919 51086 1 125 . 1 1 22 22 THR H H 22 7.900 7.900 8.467 -0.567 17919 51087 1 125 . 1 1 23 23 ILE N N 23 121.190 121.190 122.543 -1.353 17919 51088 1 125 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.747 -0.090 17919 51089 1 125 . 1 1 23 23 ILE C C 23 179.040 179.040 177.960 1.080 17919 51090 1 125 . 1 1 23 23 ILE CA C 23 62.260 62.260 61.931 0.329 17919 51091 1 125 . 1 1 23 23 ILE CB C 23 34.350 34.350 35.741 -1.391 17919 51092 1 125 . 1 1 23 23 ILE H H 23 8.560 8.560 9.102 -0.542 17919 51093 1 125 . 1 1 24 24 GLU N N 24 120.830 120.830 120.115 0.715 17919 51094 1 125 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.937 -0.020 17919 51095 1 125 . 1 1 24 24 GLU C C 24 178.640 178.640 178.649 -0.009 17919 51096 1 125 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.847 0.373 17919 51097 1 125 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.124 -0.844 17919 51098 1 125 . 1 1 24 24 GLU H H 24 9.760 9.760 7.934 1.826 17919 51099 1 125 . 1 1 25 25 ASN N N 25 120.570 120.570 116.735 3.835 17919 51100 1 125 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.635 -0.110 17919 51101 1 125 . 1 1 25 25 ASN C C 25 178.380 178.380 177.784 0.596 17919 51102 1 125 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.367 0.693 17919 51103 1 125 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.116 0.334 17919 51104 1 125 . 1 1 25 25 ASN H H 25 7.920 7.920 7.693 0.227 17919 51105 1 125 . 1 1 26 26 VAL N N 26 121.710 121.710 119.705 2.005 17919 51106 1 125 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.543 -0.146 17919 51107 1 125 . 1 1 26 26 VAL C C 26 177.950 177.950 177.903 0.047 17919 51108 1 125 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.023 1.637 17919 51109 1 125 . 1 1 26 26 VAL CB C 26 30.840 30.840 30.109 0.731 17919 51110 1 125 . 1 1 26 26 VAL H H 26 8.070 8.070 7.876 0.194 17919 51111 1 125 . 1 1 27 27 LYS N N 27 118.860 118.860 119.575 -0.715 17919 51112 1 125 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.309 0.271 17919 51113 1 125 . 1 1 27 27 LYS C C 27 180.550 180.550 179.082 1.468 17919 51114 1 125 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.217 0.033 17919 51115 1 125 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.031 1.699 17919 51116 1 125 . 1 1 27 27 LYS H H 27 8.560 8.560 8.143 0.417 17919 51117 1 125 . 1 1 28 28 ALA N N 28 123.440 123.440 123.297 0.143 17919 51118 1 125 . 1 1 28 28 ALA HA H 28 4.160 4.160 3.974 0.186 17919 51119 1 125 . 1 1 28 28 ALA C C 28 180.300 180.300 179.052 1.248 17919 51120 1 125 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.420 -0.050 17919 51121 1 125 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.291 -0.581 17919 51122 1 125 . 1 1 28 28 ALA H H 28 8.060 8.060 7.957 0.103 17919 51123 1 125 . 1 1 29 29 LYS N N 29 119.940 119.940 119.382 0.558 17919 51124 1 125 . 1 1 29 29 LYS HA H 29 4.207 4.207 3.928 0.279 17919 51125 1 125 . 1 1 29 29 LYS C C 29 180.320 180.320 179.421 0.899 17919 51126 1 125 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.474 0.176 17919 51127 1 125 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.237 1.053 17919 51128 1 125 . 1 1 29 29 LYS H H 29 7.850 7.850 7.504 0.346 17919 51129 1 125 . 1 1 30 30 ILE N N 30 121.080 121.080 119.756 1.324 17919 51130 1 125 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.652 -0.145 17919 51131 1 125 . 1 1 30 30 ILE C C 30 178.310 178.310 177.319 0.991 17919 51132 1 125 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.155 0.995 17919 51133 1 125 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.737 -0.937 17919 51134 1 125 . 1 1 30 30 ILE H H 30 8.280 8.280 8.236 0.044 17919 51135 1 125 . 1 1 31 31 GLN N N 31 123.490 123.490 121.216 2.274 17919 51136 1 125 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.038 -0.209 17919 51137 1 125 . 1 1 31 31 GLN C C 31 178.890 178.890 178.120 0.770 17919 51138 1 125 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.020 0.980 17919 51139 1 125 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.381 -0.661 17919 51140 1 125 . 1 1 31 31 GLN H H 31 8.580 8.580 8.171 0.409 17919 51141 1 125 . 1 1 32 32 ASP N N 32 119.360 119.360 117.893 1.467 17919 51142 1 125 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.433 -0.079 17919 51143 1 125 . 1 1 32 32 ASP C C 32 177.250 177.250 177.690 -0.440 17919 51144 1 125 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.605 0.585 17919 51145 1 125 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.963 -0.383 17919 51146 1 125 . 1 1 32 32 ASP H H 32 8.010 8.010 8.326 -0.316 17919 51147 1 125 . 1 1 33 33 LYS N N 33 115.130 115.130 117.874 -2.744 17919 51148 1 125 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.391 -0.054 17919 51149 1 125 . 1 1 33 33 LYS C C 33 177.870 177.870 177.868 0.002 17919 51150 1 125 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.146 0.904 17919 51151 1 125 . 1 1 33 33 LYS CB C 33 34.170 34.170 34.458 -0.288 17919 51152 1 125 . 1 1 33 33 LYS H H 33 7.430 7.430 7.446 -0.016 17919 51153 1 125 . 1 1 34 34 GLU N N 34 113.870 113.870 115.480 -1.610 17919 51154 1 125 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.467 0.158 17919 51155 1 125 . 1 1 34 34 GLU C C 34 177.840 177.840 177.105 0.735 17919 51156 1 125 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.749 -0.579 17919 51157 1 125 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.111 1.549 17919 51158 1 125 . 1 1 34 34 GLU H H 34 8.740 8.740 8.467 0.273 17919 51159 1 125 . 1 1 35 35 GLY N N 35 108.650 108.650 109.680 -1.030 17919 51160 1 125 . 1 1 35 35 GLY C C 35 173.960 173.960 174.653 -0.693 17919 51161 1 125 . 1 1 35 35 GLY CA C 35 46.080 46.080 46.102 -0.022 17919 51162 1 125 . 1 1 35 35 GLY H H 35 8.530 8.530 7.759 0.771 17919 51163 1 125 . 1 1 36 36 ILE N N 36 119.880 119.880 120.989 -1.109 17919 51164 1 125 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.255 0.190 17919 51165 1 125 . 1 1 36 36 ILE C C 36 173.590 173.590 174.173 -0.583 17919 51166 1 125 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.057 -0.307 17919 51167 1 125 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.232 2.348 17919 51168 1 125 . 1 1 36 36 ILE H H 36 6.150 6.150 7.668 -1.518 17919 51169 1 125 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.546 0.088 17919 51170 1 125 . 1 1 37 37 PRO C C 37 176.940 176.940 176.451 0.489 17919 51171 1 125 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.650 0.010 17919 51172 1 125 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.056 0.794 17919 51173 1 125 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.115 0.002 17919 51174 1 125 . 1 1 38 38 PRO C C 38 178.320 178.320 178.704 -0.384 17919 51175 1 125 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.858 0.402 17919 51176 1 125 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.889 1.001 17919 51177 1 125 . 1 1 39 39 ASP N N 39 113.380 113.380 117.503 -4.123 17919 51178 1 125 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.313 0.117 17919 51179 1 125 . 1 1 39 39 ASP C C 39 177.090 177.090 178.010 -0.920 17919 51180 1 125 . 1 1 39 39 ASP CA C 39 55.640 55.640 57.196 -1.556 17919 51181 1 125 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.469 -0.929 17919 51182 1 125 . 1 1 39 39 ASP H H 39 8.550 8.550 8.634 -0.084 17919 51183 1 125 . 1 1 40 40 GLN N N 40 116.780 116.780 116.408 0.372 17919 51184 1 125 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.365 0.099 17919 51185 1 125 . 1 1 40 40 GLN C C 40 175.380 175.380 176.254 -0.874 17919 51186 1 125 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.842 -0.202 17919 51187 1 125 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.543 0.597 17919 51188 1 125 . 1 1 40 40 GLN H H 40 7.820 7.820 7.792 0.028 17919 51189 1 125 . 1 1 41 41 GLN N N 41 117.720 117.720 119.134 -1.414 17919 51190 1 125 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.583 -0.339 17919 51191 1 125 . 1 1 41 41 GLN C C 41 176.300 176.300 175.427 0.873 17919 51192 1 125 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.249 0.221 17919 51193 1 125 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.737 1.913 17919 51194 1 125 . 1 1 41 41 GLN H H 41 7.480 7.480 7.464 0.016 17919 51195 1 125 . 1 1 42 42 ARG N N 42 122.680 122.680 122.537 0.143 17919 51196 1 125 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.656 -0.156 17919 51197 1 125 . 1 1 42 42 ARG C C 42 174.050 174.050 174.344 -0.294 17919 51198 1 125 . 1 1 42 42 ARG CA C 42 55.050 55.050 53.204 1.846 17919 51199 1 125 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.255 -0.505 17919 51200 1 125 . 1 1 42 42 ARG H H 42 8.530 8.530 8.008 0.522 17919 51201 1 125 . 1 1 43 43 LEU N N 43 124.040 124.040 125.772 -1.732 17919 51202 1 125 . 1 1 43 43 LEU C C 43 175.290 175.290 175.769 -0.479 17919 51203 1 125 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.843 -0.863 17919 51204 1 125 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.256 1.534 17919 51205 1 125 . 1 1 43 43 LEU H H 43 8.820 8.820 8.716 0.104 17919 51206 1 125 . 1 1 44 44 ILE N N 44 121.920 121.920 121.715 0.205 17919 51207 1 125 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.780 0.212 17919 51208 1 125 . 1 1 44 44 ILE C C 44 176.060 176.060 174.618 1.442 17919 51209 1 125 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.336 -0.356 17919 51210 1 125 . 1 1 44 44 ILE CB C 44 41.420 41.420 40.097 1.323 17919 51211 1 125 . 1 1 44 44 ILE H H 44 9.030 9.030 8.778 0.252 17919 51212 1 125 . 1 1 45 45 PHE N N 45 125.390 125.390 127.153 -1.763 17919 51213 1 125 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.903 0.142 17919 51214 1 125 . 1 1 45 45 PHE C C 45 174.470 174.470 174.424 0.046 17919 51215 1 125 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.242 0.778 17919 51216 1 125 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.989 0.771 17919 51217 1 125 . 1 1 45 45 PHE H H 45 8.830 8.830 8.559 0.271 17919 51218 1 125 . 1 1 46 46 ALA N N 46 132.200 132.200 129.824 2.376 17919 51219 1 125 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.623 0.067 17919 51220 1 125 . 1 1 46 46 ALA C C 46 177.290 177.290 177.236 0.054 17919 51221 1 125 . 1 1 46 46 ALA CA C 46 52.540 52.540 53.073 -0.533 17919 51222 1 125 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.758 -0.188 17919 51223 1 125 . 1 1 46 46 ALA H H 46 8.810 8.810 8.897 -0.087 17919 51224 1 125 . 1 1 47 47 GLY N N 47 102.340 102.340 103.389 -1.049 17919 51225 1 125 . 1 1 47 47 GLY C C 47 173.810 173.810 174.311 -0.501 17919 51226 1 125 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.223 0.127 17919 51227 1 125 . 1 1 47 47 GLY H H 47 8.130 8.130 8.315 -0.185 17919 51228 1 125 . 1 1 48 48 LYS N N 48 121.570 121.570 121.129 0.441 17919 51229 1 125 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.570 0.052 17919 51230 1 125 . 1 1 48 48 LYS C C 48 174.700 174.700 175.319 -0.619 17919 51231 1 125 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.895 -0.346 17919 51232 1 125 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.916 -0.386 17919 51233 1 125 . 1 1 48 48 LYS H H 48 7.980 7.980 8.028 -0.048 17919 51234 1 125 . 1 1 49 49 GLN N N 49 122.410 122.410 124.822 -2.412 17919 51235 1 125 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.301 0.259 17919 51236 1 125 . 1 1 49 49 GLN C C 49 175.670 175.670 175.617 0.053 17919 51237 1 125 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.204 -0.464 17919 51238 1 125 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.299 -0.299 17919 51239 1 125 . 1 1 49 49 GLN H H 49 8.600 8.600 8.615 -0.015 17919 51240 1 125 . 1 1 50 50 LEU N N 50 125.520 125.520 128.127 -2.607 17919 51241 1 125 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.058 0.032 17919 51242 1 125 . 1 1 50 50 LEU C C 50 176.660 176.660 176.915 -0.255 17919 51243 1 125 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.553 -0.313 17919 51244 1 125 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.379 0.191 17919 51245 1 125 . 1 1 50 50 LEU H H 50 8.530 8.530 8.269 0.261 17919 51246 1 125 . 1 1 51 51 GLU N N 51 122.940 122.940 125.353 -2.413 17919 51247 1 125 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.293 0.195 17919 51248 1 125 . 1 1 51 51 GLU C C 51 175.870 175.870 176.872 -1.002 17919 51249 1 125 . 1 1 51 51 GLU CA C 51 55.960 55.960 56.416 -0.456 17919 51250 1 125 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.083 0.487 17919 51251 1 125 . 1 1 51 51 GLU H H 51 8.400 8.400 8.194 0.206 17919 51252 1 125 . 1 1 52 52 ASP N N 52 120.030 120.030 125.453 -5.423 17919 51253 1 125 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.604 -0.245 17919 51254 1 125 . 1 1 52 52 ASP C C 52 177.330 177.330 176.924 0.406 17919 51255 1 125 . 1 1 52 52 ASP CA C 52 56.960 56.960 55.921 1.039 17919 51256 1 125 . 1 1 52 52 ASP CB C 52 40.850 40.850 41.340 -0.490 17919 51257 1 125 . 1 1 52 52 ASP H H 52 8.160 8.160 8.660 -0.500 17919 51258 1 125 . 1 1 53 53 GLY N N 53 106.660 106.660 106.172 0.488 17919 51259 1 125 . 1 1 53 53 GLY C C 53 174.870 174.870 174.049 0.821 17919 51260 1 125 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.825 0.345 17919 51261 1 125 . 1 1 53 53 GLY H H 53 9.390 9.390 8.516 0.874 17919 51262 1 125 . 1 1 54 54 ARG N N 54 119.050 119.050 119.933 -0.883 17919 51263 1 125 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.734 -0.039 17919 51264 1 125 . 1 1 54 54 ARG C C 54 175.350 175.350 175.018 0.332 17919 51265 1 125 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.113 0.277 17919 51266 1 125 . 1 1 54 54 ARG CB C 54 32.650 32.650 34.053 -1.403 17919 51267 1 125 . 1 1 54 54 ARG H H 54 7.460 7.460 7.455 0.005 17919 51268 1 125 . 1 1 55 55 THR N N 55 108.400 108.400 113.029 -4.629 17919 51269 1 125 . 1 1 55 55 THR HA H 55 5.240 5.240 5.033 0.207 17919 51270 1 125 . 1 1 55 55 THR C C 55 176.560 176.560 176.415 0.145 17919 51271 1 125 . 1 1 55 55 THR CA C 55 59.690 59.690 60.274 -0.584 17919 51272 1 125 . 1 1 55 55 THR CB C 55 72.260 72.260 70.769 1.491 17919 51273 1 125 . 1 1 55 55 THR H H 55 8.730 8.730 8.855 -0.125 17919 51274 1 125 . 1 1 56 56 LEU N N 56 117.920 117.920 120.639 -2.719 17919 51275 1 125 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.969 0.091 17919 51276 1 125 . 1 1 56 56 LEU C C 56 180.810 180.810 178.845 1.965 17919 51277 1 125 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.461 0.249 17919 51278 1 125 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.002 -0.632 17919 51279 1 125 . 1 1 56 56 LEU H H 56 8.140 8.140 8.615 -0.475 17919 51280 1 125 . 1 1 57 57 SER N N 57 113.330 113.330 114.527 -1.197 17919 51281 1 125 . 1 1 57 57 SER HA H 57 4.370 4.370 4.197 0.173 17919 51282 1 125 . 1 1 57 57 SER C C 57 178.310 178.310 176.857 1.453 17919 51283 1 125 . 1 1 57 57 SER CA C 57 61.080 61.080 61.310 -0.230 17919 51284 1 125 . 1 1 57 57 SER CB C 57 62.530 62.530 62.082 0.448 17919 51285 1 125 . 1 1 57 57 SER H H 57 8.470 8.470 7.974 0.496 17919 51286 1 125 . 1 1 58 58 ASP N N 58 124.190 124.190 123.355 0.835 17919 51287 1 125 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.218 0.078 17919 51288 1 125 . 1 1 58 58 ASP C C 58 177.400 177.400 176.499 0.901 17919 51289 1 125 . 1 1 58 58 ASP CA C 58 57.180 57.180 57.080 0.101 17919 51290 1 125 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.256 -0.156 17919 51291 1 125 . 1 1 58 58 ASP H H 58 7.930 7.930 7.742 0.188 17919 51292 1 125 . 1 1 59 59 TYR N N 59 115.510 115.510 113.508 2.002 17919 51293 1 125 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.774 -0.104 17919 51294 1 125 . 1 1 59 59 TYR C C 59 174.700 174.700 175.082 -0.382 17919 51295 1 125 . 1 1 59 59 TYR CA C 59 58.250 58.250 56.624 1.626 17919 51296 1 125 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.479 1.591 17919 51297 1 125 . 1 1 59 59 TYR H H 59 7.250 7.250 7.188 0.062 17919 51298 1 125 . 1 1 60 60 ASN N N 60 115.900 115.900 118.824 -2.924 17919 51299 1 125 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.360 -0.005 17919 51300 1 125 . 1 1 60 60 ASN C C 60 174.340 174.340 174.658 -0.318 17919 51301 1 125 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.202 -0.082 17919 51302 1 125 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.295 0.115 17919 51303 1 125 . 1 1 60 60 ASN H H 60 8.150 8.150 7.794 0.356 17919 51304 1 125 . 1 1 61 61 ILE N N 61 118.600 118.600 119.676 -1.076 17919 51305 1 125 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.756 -0.363 17919 51306 1 125 . 1 1 61 61 ILE C C 61 174.610 174.610 175.195 -0.585 17919 51307 1 125 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.715 0.705 17919 51308 1 125 . 1 1 61 61 ILE CB C 61 36.740 36.740 38.387 -1.647 17919 51309 1 125 . 1 1 61 61 ILE H H 61 7.250 7.250 8.367 -1.117 17919 51310 1 125 . 1 1 62 62 GLN N N 62 124.740 124.740 124.706 0.034 17919 51311 1 125 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.653 -0.147 17919 51312 1 125 . 1 1 62 62 GLN C C 62 175.970 175.970 174.870 1.100 17919 51313 1 125 . 1 1 62 62 GLN CA C 62 53.660 53.660 54.080 -0.420 17919 51314 1 125 . 1 1 62 62 GLN CB C 62 31.650 31.650 33.047 -1.397 17919 51315 1 125 . 1 1 62 62 GLN H H 62 7.610 7.610 8.126 -0.516 17919 51316 1 125 . 1 1 63 63 LYS N N 63 120.300 120.300 122.178 -1.878 17919 51317 1 125 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.811 0.190 17919 51318 1 125 . 1 1 63 63 LYS C C 63 175.810 175.810 176.726 -0.916 17919 51319 1 125 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.401 -0.611 17919 51320 1 125 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.147 0.503 17919 51321 1 125 . 1 1 63 63 LYS H H 63 8.490 8.490 8.600 -0.110 17919 51322 1 125 . 1 1 64 64 GLU N N 64 113.950 113.950 121.593 -7.643 17919 51323 1 125 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.491 -0.026 17919 51324 1 125 . 1 1 64 64 GLU C C 64 175.250 175.250 175.821 -0.571 17919 51325 1 125 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.403 0.487 17919 51326 1 125 . 1 1 64 64 GLU CB C 64 25.900 25.900 27.867 -1.967 17919 51327 1 125 . 1 1 64 64 GLU H H 64 9.280 9.280 8.701 0.579 17919 51328 1 125 . 1 1 65 65 SER N N 65 114.730 114.730 114.051 0.679 17919 51329 1 125 . 1 1 65 65 SER HA H 65 4.640 4.640 4.366 0.274 17919 51330 1 125 . 1 1 65 65 SER C C 65 172.160 172.160 174.163 -2.003 17919 51331 1 125 . 1 1 65 65 SER CA C 65 60.890 60.890 60.787 0.103 17919 51332 1 125 . 1 1 65 65 SER CB C 65 64.910 64.910 64.159 0.751 17919 51333 1 125 . 1 1 65 65 SER H H 65 7.670 7.670 7.895 -0.225 17919 51334 1 125 . 1 1 66 66 THR N N 66 117.110 117.110 116.861 0.249 17919 51335 1 125 . 1 1 66 66 THR HA H 66 5.270 5.270 5.241 0.029 17919 51336 1 125 . 1 1 66 66 THR C C 66 173.950 173.950 173.699 0.251 17919 51337 1 125 . 1 1 66 66 THR CA C 66 62.340 62.340 61.592 0.748 17919 51338 1 125 . 1 1 66 66 THR CB C 66 70.080 70.080 71.261 -1.181 17919 51339 1 125 . 1 1 66 66 THR H H 66 8.730 8.730 8.321 0.409 17919 51340 1 125 . 1 1 67 67 LEU N N 67 127.110 127.110 127.294 -0.184 17919 51341 1 125 . 1 1 67 67 LEU HA H 67 5.060 5.060 5.189 -0.129 17919 51342 1 125 . 1 1 67 67 LEU C C 67 175.770 175.770 175.702 0.068 17919 51343 1 125 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.661 0.239 17919 51344 1 125 . 1 1 67 67 LEU CB C 67 44.260 44.260 42.913 1.347 17919 51345 1 125 . 1 1 67 67 LEU H H 67 9.410 9.410 8.731 0.679 17919 51346 1 125 . 1 1 68 68 HIS N N 68 118.380 118.380 123.004 -4.624 17919 51347 1 125 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.258 -0.018 17919 51348 1 125 . 1 1 68 68 HIS C C 68 173.150 173.150 173.791 -0.641 17919 51349 1 125 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.672 0.328 17919 51350 1 125 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.770 -2.240 17919 51351 1 125 . 1 1 68 68 HIS H H 68 9.230 9.230 8.816 0.414 17919 51352 1 125 . 1 1 69 69 LEU N N 69 124.460 124.460 127.184 -2.724 17919 51353 1 125 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.796 0.394 17919 51354 1 125 . 1 1 69 69 LEU C C 69 175.270 175.270 174.216 1.054 17919 51355 1 125 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.590 0.300 17919 51356 1 125 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.307 0.073 17919 51357 1 125 . 1 1 69 69 LEU H H 69 8.340 8.340 8.086 0.254 17919 51358 1 125 . 1 1 70 70 VAL N N 70 126.940 126.940 125.723 1.217 17919 51359 1 125 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.031 0.319 17919 51360 1 125 . 1 1 70 70 VAL C C 70 174.000 174.000 174.911 -0.911 17919 51361 1 125 . 1 1 70 70 VAL CA C 70 60.800 60.800 61.783 -0.983 17919 51362 1 125 . 1 1 70 70 VAL CB C 70 34.910 34.910 32.495 2.414 17919 51363 1 125 . 1 1 70 70 VAL H H 70 9.200 9.200 8.466 0.734 17919 51364 1 125 . 1 1 71 71 LEU N N 71 123.130 123.130 123.738 -0.608 17919 51365 1 125 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.941 0.119 17919 51366 1 125 . 1 1 71 71 LEU C C 71 177.830 177.830 177.465 0.365 17919 51367 1 125 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.780 0.160 17919 51368 1 125 . 1 1 71 71 LEU CB C 71 42.850 42.850 45.398 -2.548 17919 51369 1 125 . 1 1 71 71 LEU H H 71 8.120 8.120 8.370 -0.250 17919 51370 1 125 . 1 1 72 72 ARG N N 72 123.490 123.490 124.485 -0.995 17919 51371 1 125 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.484 -0.183 17919 51372 1 125 . 1 1 72 72 ARG C C 72 175.350 175.350 176.006 -0.656 17919 51373 1 125 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.375 0.235 17919 51374 1 125 . 1 1 72 72 ARG CB C 72 31.350 31.350 28.709 2.641 17919 51375 1 125 . 1 1 72 72 ARG H H 72 8.580 8.580 8.483 0.097 17919 51376 1 126 . 1 1 2 2 GLN N N 2 123.220 123.220 120.455 2.765 17919 51377 1 126 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.225 0.024 17919 51378 1 126 . 1 1 2 2 GLN C C 2 175.920 175.920 175.601 0.319 17919 51379 1 126 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.882 0.198 17919 51380 1 126 . 1 1 2 2 GLN CB C 2 30.760 30.760 29.732 1.028 17919 51381 1 126 . 1 1 2 2 GLN H H 2 8.900 8.900 8.668 0.232 17919 51382 1 126 . 1 1 3 3 ILE N N 3 115.340 115.340 116.968 -1.628 17919 51383 1 126 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.492 -0.279 17919 51384 1 126 . 1 1 3 3 ILE C C 3 172.450 172.450 173.555 -1.105 17919 51385 1 126 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.024 0.546 17919 51386 1 126 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.157 1.053 17919 51387 1 126 . 1 1 3 3 ILE H H 3 8.320 8.320 7.815 0.505 17919 51388 1 126 . 1 1 4 4 PHE N N 4 118.110 118.110 121.002 -2.892 17919 51389 1 126 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.435 0.195 17919 51390 1 126 . 1 1 4 4 PHE C C 4 175.320 175.320 175.305 0.015 17919 51391 1 126 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.352 -0.142 17919 51392 1 126 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.046 -0.566 17919 51393 1 126 . 1 1 4 4 PHE H H 4 8.610 8.610 8.993 -0.383 17919 51394 1 126 . 1 1 5 5 VAL N N 5 121.000 121.000 121.281 -0.281 17919 51395 1 126 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.820 -0.095 17919 51396 1 126 . 1 1 5 5 VAL C C 5 174.870 174.870 174.606 0.264 17919 51397 1 126 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.214 -0.594 17919 51398 1 126 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.837 0.393 17919 51399 1 126 . 1 1 5 5 VAL H H 5 9.300 9.300 9.253 0.047 17919 51400 1 126 . 1 1 6 6 LYS N N 6 127.520 127.520 129.270 -1.750 17919 51401 1 126 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.123 0.244 17919 51402 1 126 . 1 1 6 6 LYS C C 6 177.140 177.140 176.310 0.830 17919 51403 1 126 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.826 -0.306 17919 51404 1 126 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.433 -0.383 17919 51405 1 126 . 1 1 6 6 LYS H H 6 8.820 8.820 9.031 -0.211 17919 51406 1 126 . 1 1 7 7 THR N N 7 115.400 115.400 116.860 -1.460 17919 51407 1 126 . 1 1 7 7 THR HA H 7 4.970 4.970 4.494 0.476 17919 51408 1 126 . 1 1 7 7 THR C C 7 176.910 176.910 175.660 1.250 17919 51409 1 126 . 1 1 7 7 THR CA C 7 60.470 60.470 59.830 0.640 17919 51410 1 126 . 1 1 7 7 THR CB C 7 70.630 70.630 70.884 -0.254 17919 51411 1 126 . 1 1 7 7 THR H H 7 8.730 8.730 8.703 0.027 17919 51412 1 126 . 1 1 8 8 LEU N N 8 121.330 121.330 119.422 1.908 17919 51413 1 126 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.296 0.013 17919 51414 1 126 . 1 1 8 8 LEU C C 8 178.800 178.800 178.130 0.670 17919 51415 1 126 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.656 -0.076 17919 51416 1 126 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.110 -0.140 17919 51417 1 126 . 1 1 8 8 LEU H H 8 9.100 9.100 8.657 0.443 17919 51418 1 126 . 1 1 9 9 THR N N 9 105.590 105.590 108.031 -2.441 17919 51419 1 126 . 1 1 9 9 THR HA H 9 4.428 4.428 4.264 0.164 17919 51420 1 126 . 1 1 9 9 THR C C 9 175.520 175.520 175.289 0.231 17919 51421 1 126 . 1 1 9 9 THR CA C 9 61.400 61.400 62.615 -1.215 17919 51422 1 126 . 1 1 9 9 THR CB C 9 69.140 69.140 68.913 0.227 17919 51423 1 126 . 1 1 9 9 THR H H 9 7.630 7.630 7.847 -0.217 17919 51424 1 126 . 1 1 10 10 GLY N N 10 108.890 108.890 110.831 -1.941 17919 51425 1 126 . 1 1 10 10 GLY C C 10 174.070 174.070 173.408 0.662 17919 51426 1 126 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.773 0.687 17919 51427 1 126 . 1 1 10 10 GLY H H 10 7.810 7.810 7.659 0.151 17919 51428 1 126 . 1 1 11 11 LYS N N 11 121.600 121.600 121.569 0.031 17919 51429 1 126 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.346 0.015 17919 51430 1 126 . 1 1 11 11 LYS C C 11 175.940 175.940 175.460 0.480 17919 51431 1 126 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.472 -0.193 17919 51432 1 126 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.212 -0.012 17919 51433 1 126 . 1 1 11 11 LYS H H 11 7.280 7.280 7.594 -0.314 17919 51434 1 126 . 1 1 12 12 THR N N 12 120.440 120.440 120.338 0.102 17919 51435 1 126 . 1 1 12 12 THR HA H 12 5.046 5.046 5.171 -0.125 17919 51436 1 126 . 1 1 12 12 THR C C 12 174.320 174.320 174.549 -0.229 17919 51437 1 126 . 1 1 12 12 THR CA C 12 62.390 62.390 62.097 0.293 17919 51438 1 126 . 1 1 12 12 THR CB C 12 69.910 69.910 70.037 -0.127 17919 51439 1 126 . 1 1 12 12 THR H H 12 8.650 8.650 8.193 0.457 17919 51440 1 126 . 1 1 13 13 ILE N N 13 127.110 127.110 125.142 1.968 17919 51441 1 126 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.492 0.052 17919 51442 1 126 . 1 1 13 13 ILE C C 13 175.220 175.220 174.793 0.427 17919 51443 1 126 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.571 -0.591 17919 51444 1 126 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.703 -0.753 17919 51445 1 126 . 1 1 13 13 ILE H H 13 9.450 9.450 8.926 0.524 17919 51446 1 126 . 1 1 14 14 THR N N 14 121.520 121.520 123.494 -1.974 17919 51447 1 126 . 1 1 14 14 THR HA H 14 4.964 4.964 4.590 0.374 17919 51448 1 126 . 1 1 14 14 THR C C 14 173.790 173.790 173.998 -0.208 17919 51449 1 126 . 1 1 14 14 THR CA C 14 61.940 61.940 62.700 -0.760 17919 51450 1 126 . 1 1 14 14 THR CB C 14 69.650 69.650 69.461 0.189 17919 51451 1 126 . 1 1 14 14 THR H H 14 8.710 8.710 8.547 0.163 17919 51452 1 126 . 1 1 15 15 LEU N N 15 124.800 124.800 128.666 -3.866 17919 51453 1 126 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.669 0.111 17919 51454 1 126 . 1 1 15 15 LEU C C 15 174.670 174.670 176.341 -1.671 17919 51455 1 126 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.404 -0.573 17919 51456 1 126 . 1 1 15 15 LEU CB C 15 47.070 47.070 44.309 2.761 17919 51457 1 126 . 1 1 15 15 LEU H H 15 8.710 8.710 8.427 0.283 17919 51458 1 126 . 1 1 16 16 GLU N N 16 122.160 122.160 122.510 -0.350 17919 51459 1 126 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.583 0.334 17919 51460 1 126 . 1 1 16 16 GLU C C 16 175.860 175.860 176.455 -0.595 17919 51461 1 126 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.765 -0.945 17919 51462 1 126 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.090 -0.640 17919 51463 1 126 . 1 1 16 16 GLU H H 16 8.140 8.140 8.492 -0.352 17919 51464 1 126 . 1 1 17 17 VAL N N 17 117.210 117.210 119.110 -1.900 17919 51465 1 126 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.834 -0.120 17919 51466 1 126 . 1 1 17 17 VAL C C 17 174.160 174.160 175.154 -0.994 17919 51467 1 126 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.986 -0.556 17919 51468 1 126 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.362 1.038 17919 51469 1 126 . 1 1 17 17 VAL H H 17 8.900 8.900 8.822 0.078 17919 51470 1 126 . 1 1 18 18 GLU N N 18 118.990 118.990 120.843 -1.853 17919 51471 1 126 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.926 0.153 17919 51472 1 126 . 1 1 18 18 GLU C C 18 176.160 176.160 176.118 0.042 17919 51473 1 126 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.847 -0.127 17919 51474 1 126 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.242 0.068 17919 51475 1 126 . 1 1 18 18 GLU H H 18 8.640 8.640 9.123 -0.483 17919 51476 1 126 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.184 -0.043 17919 51477 1 126 . 1 1 19 19 PRO C C 19 175.310 175.310 178.303 -2.993 17919 51478 1 126 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.808 -0.338 17919 51479 1 126 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.903 0.047 17919 51480 1 126 . 1 1 20 20 SER N N 20 103.400 103.400 110.290 -6.890 17919 51481 1 126 . 1 1 20 20 SER HA H 20 4.370 4.370 4.255 0.115 17919 51482 1 126 . 1 1 20 20 SER C C 20 174.660 174.660 174.037 0.623 17919 51483 1 126 . 1 1 20 20 SER CA C 20 57.400 57.400 58.717 -1.317 17919 51484 1 126 . 1 1 20 20 SER CB C 20 63.370 63.370 63.020 0.350 17919 51485 1 126 . 1 1 20 20 SER H H 20 7.040 7.040 8.024 -0.984 17919 51486 1 126 . 1 1 21 21 ASP N N 21 123.480 123.480 122.673 0.807 17919 51487 1 126 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.647 0.048 17919 51488 1 126 . 1 1 21 21 ASP C C 21 176.360 176.360 176.103 0.257 17919 51489 1 126 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.549 0.151 17919 51490 1 126 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.513 -0.713 17919 51491 1 126 . 1 1 21 21 ASP H H 21 8.030 8.030 7.521 0.509 17919 51492 1 126 . 1 1 22 22 THR N N 22 108.800 108.800 112.676 -3.876 17919 51493 1 126 . 1 1 22 22 THR HA H 22 4.920 4.920 4.624 0.296 17919 51494 1 126 . 1 1 22 22 THR C C 22 176.750 176.750 176.058 0.692 17919 51495 1 126 . 1 1 22 22 THR CA C 22 59.690 59.690 62.324 -2.634 17919 51496 1 126 . 1 1 22 22 THR CB C 22 71.200 71.200 70.603 0.597 17919 51497 1 126 . 1 1 22 22 THR H H 22 7.900 7.900 8.119 -0.219 17919 51498 1 126 . 1 1 23 23 ILE N N 23 121.190 121.190 123.124 -1.934 17919 51499 1 126 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.726 -0.069 17919 51500 1 126 . 1 1 23 23 ILE C C 23 179.040 179.040 177.380 1.660 17919 51501 1 126 . 1 1 23 23 ILE CA C 23 62.260 62.260 64.416 -2.156 17919 51502 1 126 . 1 1 23 23 ILE CB C 23 34.350 34.350 37.515 -3.165 17919 51503 1 126 . 1 1 23 23 ILE H H 23 8.560 8.560 9.041 -0.481 17919 51504 1 126 . 1 1 24 24 GLU N N 24 120.830 120.830 120.447 0.383 17919 51505 1 126 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.837 0.080 17919 51506 1 126 . 1 1 24 24 GLU C C 24 178.640 178.640 178.413 0.227 17919 51507 1 126 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.947 0.274 17919 51508 1 126 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.421 -1.141 17919 51509 1 126 . 1 1 24 24 GLU H H 24 9.760 9.760 8.332 1.428 17919 51510 1 126 . 1 1 25 25 ASN N N 25 120.570 120.570 117.772 2.798 17919 51511 1 126 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.512 0.013 17919 51512 1 126 . 1 1 25 25 ASN C C 25 178.380 178.380 178.049 0.331 17919 51513 1 126 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.753 0.307 17919 51514 1 126 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.292 0.158 17919 51515 1 126 . 1 1 25 25 ASN H H 25 7.920 7.920 7.589 0.331 17919 51516 1 126 . 1 1 26 26 VAL N N 26 121.710 121.710 120.483 1.227 17919 51517 1 126 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.503 -0.106 17919 51518 1 126 . 1 1 26 26 VAL C C 26 177.950 177.950 177.744 0.206 17919 51519 1 126 . 1 1 26 26 VAL CA C 26 67.660 67.660 67.185 0.475 17919 51520 1 126 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.522 -0.682 17919 51521 1 126 . 1 1 26 26 VAL H H 26 8.070 8.070 7.743 0.327 17919 51522 1 126 . 1 1 27 27 LYS N N 27 118.860 118.860 119.823 -0.963 17919 51523 1 126 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.107 0.473 17919 51524 1 126 . 1 1 27 27 LYS C C 27 180.550 180.550 178.858 1.692 17919 51525 1 126 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.779 -0.529 17919 51526 1 126 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.402 1.328 17919 51527 1 126 . 1 1 27 27 LYS H H 27 8.560 8.560 8.121 0.439 17919 51528 1 126 . 1 1 28 28 ALA N N 28 123.440 123.440 119.549 3.891 17919 51529 1 126 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.118 0.042 17919 51530 1 126 . 1 1 28 28 ALA C C 28 180.300 180.300 179.096 1.204 17919 51531 1 126 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.519 0.851 17919 51532 1 126 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.402 -0.692 17919 51533 1 126 . 1 1 28 28 ALA H H 28 8.060 8.060 8.316 -0.256 17919 51534 1 126 . 1 1 29 29 LYS N N 29 119.940 119.940 120.278 -0.338 17919 51535 1 126 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.035 0.172 17919 51536 1 126 . 1 1 29 29 LYS C C 29 180.320 180.320 178.809 1.511 17919 51537 1 126 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.246 0.404 17919 51538 1 126 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.421 0.869 17919 51539 1 126 . 1 1 29 29 LYS H H 29 7.850 7.850 7.445 0.405 17919 51540 1 126 . 1 1 30 30 ILE N N 30 121.080 121.080 120.985 0.095 17919 51541 1 126 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.489 0.018 17919 51542 1 126 . 1 1 30 30 ILE C C 30 178.310 178.310 177.609 0.701 17919 51543 1 126 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.557 0.593 17919 51544 1 126 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.389 -0.589 17919 51545 1 126 . 1 1 30 30 ILE H H 30 8.280 8.280 8.249 0.031 17919 51546 1 126 . 1 1 31 31 GLN N N 31 123.490 123.490 119.327 4.163 17919 51547 1 126 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.874 -0.045 17919 51548 1 126 . 1 1 31 31 GLN C C 31 178.890 178.890 178.425 0.465 17919 51549 1 126 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.023 0.977 17919 51550 1 126 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.519 -0.799 17919 51551 1 126 . 1 1 31 31 GLN H H 31 8.580 8.580 8.502 0.078 17919 51552 1 126 . 1 1 32 32 ASP N N 32 119.360 119.360 119.258 0.102 17919 51553 1 126 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.427 -0.073 17919 51554 1 126 . 1 1 32 32 ASP C C 32 177.250 177.250 177.900 -0.650 17919 51555 1 126 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.713 0.477 17919 51556 1 126 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.435 0.145 17919 51557 1 126 . 1 1 32 32 ASP H H 32 8.010 8.010 7.815 0.195 17919 51558 1 126 . 1 1 33 33 LYS N N 33 115.130 115.130 118.539 -3.409 17919 51559 1 126 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.273 0.064 17919 51560 1 126 . 1 1 33 33 LYS C C 33 177.870 177.870 178.190 -0.320 17919 51561 1 126 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.966 0.084 17919 51562 1 126 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.141 1.029 17919 51563 1 126 . 1 1 33 33 LYS H H 33 7.430 7.430 7.674 -0.244 17919 51564 1 126 . 1 1 34 34 GLU N N 34 113.870 113.870 114.701 -0.831 17919 51565 1 126 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.489 0.136 17919 51566 1 126 . 1 1 34 34 GLU C C 34 177.840 177.840 177.241 0.599 17919 51567 1 126 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.031 -0.861 17919 51568 1 126 . 1 1 34 34 GLU CB C 34 32.660 32.660 32.193 0.467 17919 51569 1 126 . 1 1 34 34 GLU H H 34 8.740 8.740 8.021 0.719 17919 51570 1 126 . 1 1 35 35 GLY N N 35 108.650 108.650 109.235 -0.585 17919 51571 1 126 . 1 1 35 35 GLY C C 35 173.960 173.960 174.380 -0.420 17919 51572 1 126 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.900 0.180 17919 51573 1 126 . 1 1 35 35 GLY H H 35 8.530 8.530 8.109 0.421 17919 51574 1 126 . 1 1 36 36 ILE N N 36 119.880 119.880 122.882 -3.002 17919 51575 1 126 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.256 0.189 17919 51576 1 126 . 1 1 36 36 ILE C C 36 173.590 173.590 174.353 -0.763 17919 51577 1 126 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.002 -0.252 17919 51578 1 126 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.431 2.149 17919 51579 1 126 . 1 1 36 36 ILE H H 36 6.150 6.150 7.638 -1.488 17919 51580 1 126 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.526 0.108 17919 51581 1 126 . 1 1 37 37 PRO C C 37 176.940 176.940 176.085 0.855 17919 51582 1 126 . 1 1 37 37 PRO CA C 37 61.660 61.660 62.053 -0.393 17919 51583 1 126 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.090 0.760 17919 51584 1 126 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.138 -0.021 17919 51585 1 126 . 1 1 38 38 PRO C C 38 178.320 178.320 178.129 0.191 17919 51586 1 126 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.721 0.540 17919 51587 1 126 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.841 1.049 17919 51588 1 126 . 1 1 39 39 ASP N N 39 113.380 113.380 114.420 -1.040 17919 51589 1 126 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.354 0.076 17919 51590 1 126 . 1 1 39 39 ASP C C 39 177.090 177.090 177.323 -0.233 17919 51591 1 126 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.481 -0.841 17919 51592 1 126 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.265 -0.725 17919 51593 1 126 . 1 1 39 39 ASP H H 39 8.550 8.550 8.723 -0.173 17919 51594 1 126 . 1 1 40 40 GLN N N 40 116.780 116.780 116.281 0.499 17919 51595 1 126 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.418 0.046 17919 51596 1 126 . 1 1 40 40 GLN C C 40 175.380 175.380 175.803 -0.423 17919 51597 1 126 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.143 0.497 17919 51598 1 126 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.235 0.905 17919 51599 1 126 . 1 1 40 40 GLN H H 40 7.820 7.820 7.854 -0.034 17919 51600 1 126 . 1 1 41 41 GLN N N 41 117.720 117.720 118.945 -1.225 17919 51601 1 126 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.590 -0.346 17919 51602 1 126 . 1 1 41 41 GLN C C 41 176.300 176.300 175.671 0.629 17919 51603 1 126 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.300 1.171 17919 51604 1 126 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.950 1.700 17919 51605 1 126 . 1 1 41 41 GLN H H 41 7.480 7.480 7.388 0.092 17919 51606 1 126 . 1 1 42 42 ARG N N 42 122.680 122.680 125.578 -2.898 17919 51607 1 126 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.559 -0.059 17919 51608 1 126 . 1 1 42 42 ARG C C 42 174.050 174.050 174.223 -0.173 17919 51609 1 126 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.471 0.579 17919 51610 1 126 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.337 -0.587 17919 51611 1 126 . 1 1 42 42 ARG H H 42 8.530 8.530 8.881 -0.351 17919 51612 1 126 . 1 1 43 43 LEU N N 43 124.040 124.040 127.740 -3.700 17919 51613 1 126 . 1 1 43 43 LEU C C 43 175.290 175.290 175.309 -0.019 17919 51614 1 126 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.123 -1.143 17919 51615 1 126 . 1 1 43 43 LEU CB C 43 45.790 45.790 41.015 4.775 17919 51616 1 126 . 1 1 43 43 LEU H H 43 8.820 8.820 8.925 -0.105 17919 51617 1 126 . 1 1 44 44 ILE N N 44 121.920 121.920 119.988 1.932 17919 51618 1 126 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.454 -0.462 17919 51619 1 126 . 1 1 44 44 ILE C C 44 176.060 176.060 173.695 2.365 17919 51620 1 126 . 1 1 44 44 ILE CA C 44 58.980 58.980 58.881 0.099 17919 51621 1 126 . 1 1 44 44 ILE CB C 44 41.420 41.420 42.194 -0.774 17919 51622 1 126 . 1 1 44 44 ILE H H 44 9.030 9.030 8.006 1.024 17919 51623 1 126 . 1 1 45 45 PHE N N 45 125.390 125.390 126.057 -0.667 17919 51624 1 126 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.008 0.037 17919 51625 1 126 . 1 1 45 45 PHE C C 45 174.470 174.470 174.242 0.228 17919 51626 1 126 . 1 1 45 45 PHE CA C 45 57.020 57.020 57.331 -0.311 17919 51627 1 126 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.989 0.771 17919 51628 1 126 . 1 1 45 45 PHE H H 45 8.830 8.830 8.932 -0.102 17919 51629 1 126 . 1 1 46 46 ALA N N 46 132.200 132.200 128.834 3.366 17919 51630 1 126 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.633 0.057 17919 51631 1 126 . 1 1 46 46 ALA C C 46 177.290 177.290 177.594 -0.304 17919 51632 1 126 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.485 0.055 17919 51633 1 126 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.089 0.481 17919 51634 1 126 . 1 1 46 46 ALA H H 46 8.810 8.810 8.930 -0.120 17919 51635 1 126 . 1 1 47 47 GLY N N 47 102.340 102.340 103.808 -1.468 17919 51636 1 126 . 1 1 47 47 GLY C C 47 173.810 173.810 174.397 -0.587 17919 51637 1 126 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.190 0.160 17919 51638 1 126 . 1 1 47 47 GLY H H 47 8.130 8.130 8.564 -0.434 17919 51639 1 126 . 1 1 48 48 LYS N N 48 121.570 121.570 121.992 -0.422 17919 51640 1 126 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.416 0.206 17919 51641 1 126 . 1 1 48 48 LYS C C 48 174.700 174.700 175.354 -0.654 17919 51642 1 126 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.342 -0.791 17919 51643 1 126 . 1 1 48 48 LYS CB C 48 34.530 34.530 33.370 1.160 17919 51644 1 126 . 1 1 48 48 LYS H H 48 7.980 7.980 7.777 0.203 17919 51645 1 126 . 1 1 49 49 GLN N N 49 122.410 122.410 124.891 -2.481 17919 51646 1 126 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.346 0.214 17919 51647 1 126 . 1 1 49 49 GLN C C 49 175.670 175.670 175.660 0.010 17919 51648 1 126 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.532 0.208 17919 51649 1 126 . 1 1 49 49 GLN CB C 49 29.000 29.000 28.651 0.349 17919 51650 1 126 . 1 1 49 49 GLN H H 49 8.600 8.600 8.657 -0.057 17919 51651 1 126 . 1 1 50 50 LEU N N 50 125.520 125.520 129.519 -3.999 17919 51652 1 126 . 1 1 50 50 LEU HA H 50 4.090 4.090 3.755 0.335 17919 51653 1 126 . 1 1 50 50 LEU C C 50 176.660 176.660 175.762 0.898 17919 51654 1 126 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.145 0.095 17919 51655 1 126 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.856 -0.286 17919 51656 1 126 . 1 1 50 50 LEU H H 50 8.530 8.530 8.386 0.144 17919 51657 1 126 . 1 1 51 51 GLU N N 51 122.940 122.940 121.706 1.234 17919 51658 1 126 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.472 0.016 17919 51659 1 126 . 1 1 51 51 GLU C C 51 175.870 175.870 176.453 -0.583 17919 51660 1 126 . 1 1 51 51 GLU CA C 51 55.960 55.960 54.927 1.033 17919 51661 1 126 . 1 1 51 51 GLU CB C 51 31.570 31.570 33.202 -1.631 17919 51662 1 126 . 1 1 51 51 GLU H H 51 8.400 8.400 8.039 0.361 17919 51663 1 126 . 1 1 52 52 ASP N N 52 120.030 120.030 124.885 -4.855 17919 51664 1 126 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.529 -0.170 17919 51665 1 126 . 1 1 52 52 ASP C C 52 177.330 177.330 176.854 0.476 17919 51666 1 126 . 1 1 52 52 ASP CA C 52 56.960 56.960 56.096 0.864 17919 51667 1 126 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.896 -0.046 17919 51668 1 126 . 1 1 52 52 ASP H H 52 8.160 8.160 8.756 -0.596 17919 51669 1 126 . 1 1 53 53 GLY N N 53 106.660 106.660 105.318 1.342 17919 51670 1 126 . 1 1 53 53 GLY C C 53 174.870 174.870 173.757 1.113 17919 51671 1 126 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.742 0.427 17919 51672 1 126 . 1 1 53 53 GLY H H 53 9.390 9.390 8.444 0.946 17919 51673 1 126 . 1 1 54 54 ARG N N 54 119.050 119.050 120.396 -1.346 17919 51674 1 126 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.665 0.030 17919 51675 1 126 . 1 1 54 54 ARG C C 54 175.350 175.350 175.275 0.075 17919 51676 1 126 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.216 0.174 17919 51677 1 126 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.389 -0.739 17919 51678 1 126 . 1 1 54 54 ARG H H 54 7.460 7.460 7.323 0.137 17919 51679 1 126 . 1 1 55 55 THR N N 55 108.400 108.400 113.050 -4.650 17919 51680 1 126 . 1 1 55 55 THR HA H 55 5.240 5.240 5.109 0.131 17919 51681 1 126 . 1 1 55 55 THR C C 55 176.560 176.560 176.004 0.556 17919 51682 1 126 . 1 1 55 55 THR CA C 55 59.690 59.690 60.306 -0.616 17919 51683 1 126 . 1 1 55 55 THR CB C 55 72.260 72.260 71.674 0.586 17919 51684 1 126 . 1 1 55 55 THR H H 55 8.730 8.730 8.251 0.479 17919 51685 1 126 . 1 1 56 56 LEU N N 56 117.920 117.920 122.882 -4.962 17919 51686 1 126 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.916 0.144 17919 51687 1 126 . 1 1 56 56 LEU C C 56 180.810 180.810 178.726 2.084 17919 51688 1 126 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.598 0.112 17919 51689 1 126 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.516 -1.146 17919 51690 1 126 . 1 1 56 56 LEU H H 56 8.140 8.140 8.649 -0.509 17919 51691 1 126 . 1 1 57 57 SER N N 57 113.330 113.330 114.380 -1.050 17919 51692 1 126 . 1 1 57 57 SER HA H 57 4.370 4.370 4.116 0.254 17919 51693 1 126 . 1 1 57 57 SER C C 57 178.310 178.310 176.637 1.673 17919 51694 1 126 . 1 1 57 57 SER CA C 57 61.080 61.080 62.231 -1.151 17919 51695 1 126 . 1 1 57 57 SER CB C 57 62.530 62.530 62.971 -0.441 17919 51696 1 126 . 1 1 57 57 SER H H 57 8.470 8.470 7.996 0.474 17919 51697 1 126 . 1 1 58 58 ASP N N 58 124.190 124.190 122.239 1.951 17919 51698 1 126 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.387 -0.091 17919 51699 1 126 . 1 1 58 58 ASP C C 58 177.400 177.400 177.888 -0.488 17919 51700 1 126 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.233 0.946 17919 51701 1 126 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.032 0.068 17919 51702 1 126 . 1 1 58 58 ASP H H 58 7.930 7.930 8.277 -0.347 17919 51703 1 126 . 1 1 59 59 TYR N N 59 115.510 115.510 118.529 -3.019 17919 51704 1 126 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.520 0.150 17919 51705 1 126 . 1 1 59 59 TYR C C 59 174.700 174.700 175.121 -0.421 17919 51706 1 126 . 1 1 59 59 TYR CA C 59 58.250 58.250 58.019 0.231 17919 51707 1 126 . 1 1 59 59 TYR CB C 59 40.070 40.070 37.905 2.165 17919 51708 1 126 . 1 1 59 59 TYR H H 59 7.250 7.250 7.401 -0.151 17919 51709 1 126 . 1 1 60 60 ASN N N 60 115.900 115.900 118.102 -2.202 17919 51710 1 126 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.441 -0.086 17919 51711 1 126 . 1 1 60 60 ASN C C 60 174.340 174.340 174.097 0.243 17919 51712 1 126 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.192 -0.072 17919 51713 1 126 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.409 0.001 17919 51714 1 126 . 1 1 60 60 ASN H H 60 8.150 8.150 7.882 0.268 17919 51715 1 126 . 1 1 61 61 ILE N N 61 118.600 118.600 120.081 -1.481 17919 51716 1 126 . 1 1 61 61 ILE HA H 61 3.393 3.393 4.000 -0.607 17919 51717 1 126 . 1 1 61 61 ILE C C 61 174.610 174.610 174.870 -0.260 17919 51718 1 126 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.145 1.275 17919 51719 1 126 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.752 -1.012 17919 51720 1 126 . 1 1 61 61 ILE H H 61 7.250 7.250 8.108 -0.858 17919 51721 1 126 . 1 1 62 62 GLN N N 62 124.740 124.740 126.020 -1.280 17919 51722 1 126 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.663 -0.157 17919 51723 1 126 . 1 1 62 62 GLN C C 62 175.970 175.970 175.794 0.176 17919 51724 1 126 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.725 -0.065 17919 51725 1 126 . 1 1 62 62 GLN CB C 62 31.650 31.650 30.816 0.834 17919 51726 1 126 . 1 1 62 62 GLN H H 62 7.610 7.610 7.893 -0.283 17919 51727 1 126 . 1 1 63 63 LYS N N 63 120.300 120.300 119.410 0.890 17919 51728 1 126 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.127 -0.126 17919 51729 1 126 . 1 1 63 63 LYS C C 63 175.810 175.810 177.383 -1.573 17919 51730 1 126 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.414 0.376 17919 51731 1 126 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.112 0.538 17919 51732 1 126 . 1 1 63 63 LYS H H 63 8.490 8.490 8.631 -0.141 17919 51733 1 126 . 1 1 64 64 GLU N N 64 113.950 113.950 118.010 -4.060 17919 51734 1 126 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.768 -0.303 17919 51735 1 126 . 1 1 64 64 GLU C C 64 175.250 175.250 175.727 -0.477 17919 51736 1 126 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.809 0.081 17919 51737 1 126 . 1 1 64 64 GLU CB C 64 25.900 25.900 27.864 -1.964 17919 51738 1 126 . 1 1 64 64 GLU H H 64 9.280 9.280 8.825 0.455 17919 51739 1 126 . 1 1 65 65 SER N N 65 114.730 114.730 114.494 0.236 17919 51740 1 126 . 1 1 65 65 SER HA H 65 4.640 4.640 4.426 0.214 17919 51741 1 126 . 1 1 65 65 SER C C 65 172.160 172.160 174.630 -2.470 17919 51742 1 126 . 1 1 65 65 SER CA C 65 60.890 60.890 59.977 0.913 17919 51743 1 126 . 1 1 65 65 SER CB C 65 64.910 64.910 63.830 1.080 17919 51744 1 126 . 1 1 65 65 SER H H 65 7.670 7.670 7.477 0.193 17919 51745 1 126 . 1 1 66 66 THR N N 66 117.110 117.110 121.077 -3.967 17919 51746 1 126 . 1 1 66 66 THR HA H 66 5.270 5.270 4.803 0.467 17919 51747 1 126 . 1 1 66 66 THR C C 66 173.950 173.950 174.218 -0.268 17919 51748 1 126 . 1 1 66 66 THR CA C 66 62.340 62.340 62.832 -0.492 17919 51749 1 126 . 1 1 66 66 THR CB C 66 70.080 70.080 69.397 0.684 17919 51750 1 126 . 1 1 66 66 THR H H 66 8.730 8.730 8.584 0.146 17919 51751 1 126 . 1 1 67 67 LEU N N 67 127.110 127.110 127.823 -0.713 17919 51752 1 126 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.682 0.378 17919 51753 1 126 . 1 1 67 67 LEU C C 67 175.770 175.770 175.151 0.619 17919 51754 1 126 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.405 -0.505 17919 51755 1 126 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.708 0.552 17919 51756 1 126 . 1 1 67 67 LEU H H 67 9.410 9.410 9.161 0.249 17919 51757 1 126 . 1 1 68 68 HIS N N 68 118.380 118.380 123.026 -4.646 17919 51758 1 126 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.396 -0.156 17919 51759 1 126 . 1 1 68 68 HIS C C 68 173.150 173.150 174.414 -1.264 17919 51760 1 126 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.214 0.786 17919 51761 1 126 . 1 1 68 68 HIS CB C 68 30.530 30.530 31.818 -1.288 17919 51762 1 126 . 1 1 68 68 HIS H H 68 9.230 9.230 8.900 0.330 17919 51763 1 126 . 1 1 69 69 LEU N N 69 124.460 124.460 129.919 -5.459 17919 51764 1 126 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.733 0.457 17919 51765 1 126 . 1 1 69 69 LEU C C 69 175.270 175.270 174.752 0.518 17919 51766 1 126 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.782 -0.892 17919 51767 1 126 . 1 1 69 69 LEU CB C 69 44.380 44.380 42.868 1.512 17919 51768 1 126 . 1 1 69 69 LEU H H 69 8.340 8.340 7.662 0.678 17919 51769 1 126 . 1 1 70 70 VAL N N 70 126.940 126.940 126.537 0.403 17919 51770 1 126 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.399 -0.049 17919 51771 1 126 . 1 1 70 70 VAL C C 70 174.000 174.000 174.841 -0.841 17919 51772 1 126 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.886 -0.087 17919 51773 1 126 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.336 -0.426 17919 51774 1 126 . 1 1 70 70 VAL H H 70 9.200 9.200 9.162 0.038 17919 51775 1 126 . 1 1 71 71 LEU N N 71 123.130 123.130 121.303 1.827 17919 51776 1 126 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.176 -0.116 17919 51777 1 126 . 1 1 71 71 LEU C C 71 177.830 177.830 177.868 -0.038 17919 51778 1 126 . 1 1 71 71 LEU CA C 71 53.940 53.940 52.912 1.028 17919 51779 1 126 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.582 -0.732 17919 51780 1 126 . 1 1 71 71 LEU H H 71 8.120 8.120 8.222 -0.102 17919 51781 1 126 . 1 1 72 72 ARG N N 72 123.490 123.490 122.209 1.281 17919 51782 1 126 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.132 0.169 17919 51783 1 126 . 1 1 72 72 ARG C C 72 175.350 175.350 174.929 0.421 17919 51784 1 126 . 1 1 72 72 ARG CA C 72 55.610 55.610 57.761 -2.151 17919 51785 1 126 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.760 0.590 17919 51786 1 126 . 1 1 72 72 ARG H H 72 8.580 8.580 8.043 0.537 17919 51787 1 127 . 1 1 2 2 GLN N N 2 123.220 123.220 121.099 2.121 17919 51788 1 127 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.359 -0.110 17919 51789 1 127 . 1 1 2 2 GLN C C 2 175.920 175.920 175.357 0.563 17919 51790 1 127 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.298 0.782 17919 51791 1 127 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.317 0.444 17919 51792 1 127 . 1 1 2 2 GLN H H 2 8.900 8.900 8.506 0.394 17919 51793 1 127 . 1 1 3 3 ILE N N 3 115.340 115.340 117.202 -1.862 17919 51794 1 127 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.349 -0.136 17919 51795 1 127 . 1 1 3 3 ILE C C 3 172.450 172.450 173.486 -1.036 17919 51796 1 127 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.384 0.186 17919 51797 1 127 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.069 1.141 17919 51798 1 127 . 1 1 3 3 ILE H H 3 8.320 8.320 7.681 0.639 17919 51799 1 127 . 1 1 4 4 PHE N N 4 118.110 118.110 123.402 -5.292 17919 51800 1 127 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.374 0.256 17919 51801 1 127 . 1 1 4 4 PHE C C 4 175.320 175.320 175.285 0.035 17919 51802 1 127 . 1 1 4 4 PHE CA C 4 55.210 55.210 54.982 0.228 17919 51803 1 127 . 1 1 4 4 PHE CB C 4 41.480 41.480 40.735 0.745 17919 51804 1 127 . 1 1 4 4 PHE H H 4 8.610 8.610 8.957 -0.347 17919 51805 1 127 . 1 1 5 5 VAL N N 5 121.000 121.000 124.721 -3.721 17919 51806 1 127 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.715 0.010 17919 51807 1 127 . 1 1 5 5 VAL C C 5 174.870 174.870 175.063 -0.193 17919 51808 1 127 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.778 -1.158 17919 51809 1 127 . 1 1 5 5 VAL CB C 5 34.230 34.230 32.465 1.765 17919 51810 1 127 . 1 1 5 5 VAL H H 5 9.300 9.300 8.746 0.554 17919 51811 1 127 . 1 1 6 6 LYS N N 6 127.520 127.520 126.999 0.521 17919 51812 1 127 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.518 -0.151 17919 51813 1 127 . 1 1 6 6 LYS C C 6 177.140 177.140 175.935 1.205 17919 51814 1 127 . 1 1 6 6 LYS CA C 6 54.520 54.520 53.920 0.600 17919 51815 1 127 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.862 -0.812 17919 51816 1 127 . 1 1 6 6 LYS H H 6 8.820 8.820 9.466 -0.646 17919 51817 1 127 . 1 1 7 7 THR N N 7 115.400 115.400 111.874 3.526 17919 51818 1 127 . 1 1 7 7 THR HA H 7 4.970 4.970 4.978 -0.008 17919 51819 1 127 . 1 1 7 7 THR C C 7 176.910 176.910 176.366 0.544 17919 51820 1 127 . 1 1 7 7 THR CA C 7 60.470 60.470 59.756 0.714 17919 51821 1 127 . 1 1 7 7 THR CB C 7 70.630 70.630 71.699 -1.069 17919 51822 1 127 . 1 1 7 7 THR H H 7 8.730 8.730 8.637 0.093 17919 51823 1 127 . 1 1 8 8 LEU N N 8 121.330 121.330 118.594 2.736 17919 51824 1 127 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.416 -0.106 17919 51825 1 127 . 1 1 8 8 LEU C C 8 178.800 178.800 177.545 1.255 17919 51826 1 127 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.324 0.256 17919 51827 1 127 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.082 -0.112 17919 51828 1 127 . 1 1 8 8 LEU H H 8 9.100 9.100 8.474 0.626 17919 51829 1 127 . 1 1 9 9 THR N N 9 105.590 105.590 108.729 -3.139 17919 51830 1 127 . 1 1 9 9 THR HA H 9 4.428 4.428 4.318 0.110 17919 51831 1 127 . 1 1 9 9 THR C C 9 175.520 175.520 175.794 -0.274 17919 51832 1 127 . 1 1 9 9 THR CA C 9 61.400 61.400 62.861 -1.461 17919 51833 1 127 . 1 1 9 9 THR CB C 9 69.140 69.140 69.605 -0.465 17919 51834 1 127 . 1 1 9 9 THR H H 9 7.630 7.630 7.486 0.144 17919 51835 1 127 . 1 1 10 10 GLY N N 10 108.890 108.890 111.165 -2.275 17919 51836 1 127 . 1 1 10 10 GLY C C 10 174.070 174.070 173.142 0.928 17919 51837 1 127 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.034 0.426 17919 51838 1 127 . 1 1 10 10 GLY H H 10 7.810 7.810 8.012 -0.202 17919 51839 1 127 . 1 1 11 11 LYS N N 11 121.600 121.600 120.961 0.639 17919 51840 1 127 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.837 -0.476 17919 51841 1 127 . 1 1 11 11 LYS C C 11 175.940 175.940 175.011 0.929 17919 51842 1 127 . 1 1 11 11 LYS CA C 11 56.280 56.280 54.650 1.631 17919 51843 1 127 . 1 1 11 11 LYS CB C 11 33.200 33.200 34.760 -1.560 17919 51844 1 127 . 1 1 11 11 LYS H H 11 7.280 7.280 7.642 -0.362 17919 51845 1 127 . 1 1 12 12 THR N N 12 120.440 120.440 117.750 2.690 17919 51846 1 127 . 1 1 12 12 THR HA H 12 5.046 5.046 5.070 -0.024 17919 51847 1 127 . 1 1 12 12 THR C C 12 174.320 174.320 174.270 0.050 17919 51848 1 127 . 1 1 12 12 THR CA C 12 62.390 62.390 61.890 0.500 17919 51849 1 127 . 1 1 12 12 THR CB C 12 69.910 69.910 69.868 0.043 17919 51850 1 127 . 1 1 12 12 THR H H 12 8.650 8.650 8.427 0.223 17919 51851 1 127 . 1 1 13 13 ILE N N 13 127.110 127.110 126.011 1.099 17919 51852 1 127 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.544 0.000 17919 51853 1 127 . 1 1 13 13 ILE C C 13 175.220 175.220 174.521 0.699 17919 51854 1 127 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.289 -0.309 17919 51855 1 127 . 1 1 13 13 ILE CB C 13 40.950 40.950 42.371 -1.421 17919 51856 1 127 . 1 1 13 13 ILE H H 13 9.450 9.450 9.207 0.243 17919 51857 1 127 . 1 1 14 14 THR N N 14 121.520 121.520 122.533 -1.013 17919 51858 1 127 . 1 1 14 14 THR HA H 14 4.964 4.964 4.797 0.167 17919 51859 1 127 . 1 1 14 14 THR C C 14 173.790 173.790 174.029 -0.239 17919 51860 1 127 . 1 1 14 14 THR CA C 14 61.940 61.940 62.189 -0.249 17919 51861 1 127 . 1 1 14 14 THR CB C 14 69.650 69.650 69.325 0.326 17919 51862 1 127 . 1 1 14 14 THR H H 14 8.710 8.710 8.486 0.224 17919 51863 1 127 . 1 1 15 15 LEU N N 15 124.800 124.800 127.235 -2.435 17919 51864 1 127 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.514 0.266 17919 51865 1 127 . 1 1 15 15 LEU C C 15 174.670 174.670 175.733 -1.063 17919 51866 1 127 . 1 1 15 15 LEU CA C 15 52.830 52.830 54.546 -1.716 17919 51867 1 127 . 1 1 15 15 LEU CB C 15 47.070 47.070 42.770 4.300 17919 51868 1 127 . 1 1 15 15 LEU H H 15 8.710 8.710 8.127 0.583 17919 51869 1 127 . 1 1 16 16 GLU N N 16 122.160 122.160 122.848 -0.688 17919 51870 1 127 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.623 0.294 17919 51871 1 127 . 1 1 16 16 GLU C C 16 175.860 175.860 176.399 -0.539 17919 51872 1 127 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.713 -0.893 17919 51873 1 127 . 1 1 16 16 GLU CB C 16 29.450 29.450 29.989 -0.539 17919 51874 1 127 . 1 1 16 16 GLU H H 16 8.140 8.140 8.623 -0.483 17919 51875 1 127 . 1 1 17 17 VAL N N 17 117.210 117.210 119.884 -2.674 17919 51876 1 127 . 1 1 17 17 VAL HA H 17 4.714 4.714 5.057 -0.343 17919 51877 1 127 . 1 1 17 17 VAL C C 17 174.160 174.160 174.769 -0.609 17919 51878 1 127 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.771 -0.341 17919 51879 1 127 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.758 0.642 17919 51880 1 127 . 1 1 17 17 VAL H H 17 8.900 8.900 8.852 0.048 17919 51881 1 127 . 1 1 18 18 GLU N N 18 118.990 118.990 118.191 0.799 17919 51882 1 127 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.758 0.321 17919 51883 1 127 . 1 1 18 18 GLU C C 18 176.160 176.160 174.134 2.026 17919 51884 1 127 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.991 -1.271 17919 51885 1 127 . 1 1 18 18 GLU CB C 18 30.310 30.310 32.662 -2.352 17919 51886 1 127 . 1 1 18 18 GLU H H 18 8.640 8.640 8.162 0.478 17919 51887 1 127 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.462 -0.321 17919 51888 1 127 . 1 1 19 19 PRO C C 19 175.310 175.310 177.146 -1.836 17919 51889 1 127 . 1 1 19 19 PRO CA C 19 65.470 65.470 64.659 0.811 17919 51890 1 127 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.088 -0.138 17919 51891 1 127 . 1 1 20 20 SER N N 20 103.400 103.400 110.203 -6.803 17919 51892 1 127 . 1 1 20 20 SER HA H 20 4.370 4.370 4.435 -0.065 17919 51893 1 127 . 1 1 20 20 SER C C 20 174.660 174.660 174.035 0.625 17919 51894 1 127 . 1 1 20 20 SER CA C 20 57.400 57.400 57.722 -0.322 17919 51895 1 127 . 1 1 20 20 SER CB C 20 63.370 63.370 62.606 0.764 17919 51896 1 127 . 1 1 20 20 SER H H 20 7.040 7.040 7.997 -0.957 17919 51897 1 127 . 1 1 21 21 ASP N N 21 123.480 123.480 124.821 -1.341 17919 51898 1 127 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.528 0.167 17919 51899 1 127 . 1 1 21 21 ASP C C 21 176.360 176.360 176.131 0.229 17919 51900 1 127 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.859 -0.159 17919 51901 1 127 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.517 -0.716 17919 51902 1 127 . 1 1 21 21 ASP H H 21 8.030 8.030 7.788 0.241 17919 51903 1 127 . 1 1 22 22 THR N N 22 108.800 108.800 116.141 -7.341 17919 51904 1 127 . 1 1 22 22 THR HA H 22 4.920 4.920 4.429 0.491 17919 51905 1 127 . 1 1 22 22 THR C C 22 176.750 176.750 176.588 0.162 17919 51906 1 127 . 1 1 22 22 THR CA C 22 59.690 59.690 61.945 -2.255 17919 51907 1 127 . 1 1 22 22 THR CB C 22 71.200 71.200 69.863 1.337 17919 51908 1 127 . 1 1 22 22 THR H H 22 7.900 7.900 8.075 -0.175 17919 51909 1 127 . 1 1 23 23 ILE N N 23 121.190 121.190 124.893 -3.703 17919 51910 1 127 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.587 0.070 17919 51911 1 127 . 1 1 23 23 ILE C C 23 179.040 179.040 177.500 1.540 17919 51912 1 127 . 1 1 23 23 ILE CA C 23 62.260 62.260 64.106 -1.847 17919 51913 1 127 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.218 -1.868 17919 51914 1 127 . 1 1 23 23 ILE H H 23 8.560 8.560 9.211 -0.651 17919 51915 1 127 . 1 1 24 24 GLU N N 24 120.830 120.830 120.067 0.763 17919 51916 1 127 . 1 1 24 24 GLU HA H 24 3.917 3.917 4.031 -0.114 17919 51917 1 127 . 1 1 24 24 GLU C C 24 178.640 178.640 178.624 0.016 17919 51918 1 127 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.692 0.528 17919 51919 1 127 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.564 -1.284 17919 51920 1 127 . 1 1 24 24 GLU H H 24 9.760 9.760 7.990 1.770 17919 51921 1 127 . 1 1 25 25 ASN N N 25 120.570 120.570 118.468 2.102 17919 51922 1 127 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.460 0.065 17919 51923 1 127 . 1 1 25 25 ASN C C 25 178.380 178.380 177.883 0.497 17919 51924 1 127 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.815 0.245 17919 51925 1 127 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.425 0.025 17919 51926 1 127 . 1 1 25 25 ASN H H 25 7.920 7.920 7.891 0.029 17919 51927 1 127 . 1 1 26 26 VAL N N 26 121.710 121.710 120.562 1.148 17919 51928 1 127 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.722 -0.325 17919 51929 1 127 . 1 1 26 26 VAL C C 26 177.950 177.950 176.836 1.114 17919 51930 1 127 . 1 1 26 26 VAL CA C 26 67.660 67.660 65.881 1.779 17919 51931 1 127 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.902 -1.062 17919 51932 1 127 . 1 1 26 26 VAL H H 26 8.070 8.070 8.228 -0.158 17919 51933 1 127 . 1 1 27 27 LYS N N 27 118.860 118.860 120.623 -1.763 17919 51934 1 127 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.161 0.419 17919 51935 1 127 . 1 1 27 27 LYS C C 27 180.550 180.550 178.866 1.684 17919 51936 1 127 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.598 -0.348 17919 51937 1 127 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.362 1.368 17919 51938 1 127 . 1 1 27 27 LYS H H 27 8.560 8.560 8.472 0.088 17919 51939 1 127 . 1 1 28 28 ALA N N 28 123.440 123.440 120.884 2.556 17919 51940 1 127 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.041 0.119 17919 51941 1 127 . 1 1 28 28 ALA C C 28 180.300 180.300 178.919 1.381 17919 51942 1 127 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.192 0.178 17919 51943 1 127 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.393 -0.683 17919 51944 1 127 . 1 1 28 28 ALA H H 28 8.060 8.060 8.258 -0.198 17919 51945 1 127 . 1 1 29 29 LYS N N 29 119.940 119.940 118.841 1.099 17919 51946 1 127 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.126 0.081 17919 51947 1 127 . 1 1 29 29 LYS C C 29 180.320 180.320 178.952 1.368 17919 51948 1 127 . 1 1 29 29 LYS CA C 29 59.650 59.650 58.960 0.690 17919 51949 1 127 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.359 0.931 17919 51950 1 127 . 1 1 29 29 LYS H H 29 7.850 7.850 7.387 0.463 17919 51951 1 127 . 1 1 30 30 ILE N N 30 121.080 121.080 121.151 -0.071 17919 51952 1 127 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.602 -0.095 17919 51953 1 127 . 1 1 30 30 ILE C C 30 178.310 178.310 177.358 0.952 17919 51954 1 127 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.480 0.670 17919 51955 1 127 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.524 -0.724 17919 51956 1 127 . 1 1 30 30 ILE H H 30 8.280 8.280 7.540 0.740 17919 51957 1 127 . 1 1 31 31 GLN N N 31 123.490 123.490 119.667 3.823 17919 51958 1 127 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.000 -0.171 17919 51959 1 127 . 1 1 31 31 GLN C C 31 178.890 178.890 178.517 0.373 17919 51960 1 127 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.176 0.824 17919 51961 1 127 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.403 -0.683 17919 51962 1 127 . 1 1 31 31 GLN H H 31 8.580 8.580 8.005 0.575 17919 51963 1 127 . 1 1 32 32 ASP N N 32 119.360 119.360 119.516 -0.156 17919 51964 1 127 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.412 -0.058 17919 51965 1 127 . 1 1 32 32 ASP C C 32 177.250 177.250 177.864 -0.614 17919 51966 1 127 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.876 0.314 17919 51967 1 127 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.850 -0.270 17919 51968 1 127 . 1 1 32 32 ASP H H 32 8.010 8.010 8.276 -0.266 17919 51969 1 127 . 1 1 33 33 LYS N N 33 115.130 115.130 118.581 -3.451 17919 51970 1 127 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.248 0.089 17919 51971 1 127 . 1 1 33 33 LYS C C 33 177.870 177.870 178.116 -0.246 17919 51972 1 127 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.063 -0.013 17919 51973 1 127 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.556 0.614 17919 51974 1 127 . 1 1 33 33 LYS H H 33 7.430 7.430 7.597 -0.167 17919 51975 1 127 . 1 1 34 34 GLU N N 34 113.870 113.870 114.312 -0.442 17919 51976 1 127 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.514 0.111 17919 51977 1 127 . 1 1 34 34 GLU C C 34 177.840 177.840 175.998 1.842 17919 51978 1 127 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.660 -0.490 17919 51979 1 127 . 1 1 34 34 GLU CB C 34 32.660 32.660 30.791 1.869 17919 51980 1 127 . 1 1 34 34 GLU H H 34 8.740 8.740 7.678 1.062 17919 51981 1 127 . 1 1 35 35 GLY N N 35 108.650 108.650 109.207 -0.557 17919 51982 1 127 . 1 1 35 35 GLY C C 35 173.960 173.960 174.689 -0.729 17919 51983 1 127 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.934 0.146 17919 51984 1 127 . 1 1 35 35 GLY H H 35 8.530 8.530 7.926 0.604 17919 51985 1 127 . 1 1 36 36 ILE N N 36 119.880 119.880 122.099 -2.219 17919 51986 1 127 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.243 0.202 17919 51987 1 127 . 1 1 36 36 ILE C C 36 173.590 173.590 174.101 -0.511 17919 51988 1 127 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.353 -0.603 17919 51989 1 127 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.288 2.292 17919 51990 1 127 . 1 1 36 36 ILE H H 36 6.150 6.150 7.692 -1.542 17919 51991 1 127 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.587 0.047 17919 51992 1 127 . 1 1 37 37 PRO C C 37 176.940 176.940 176.047 0.893 17919 51993 1 127 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.663 -0.003 17919 51994 1 127 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.317 0.533 17919 51995 1 127 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.171 -0.054 17919 51996 1 127 . 1 1 38 38 PRO C C 38 178.320 178.320 178.652 -0.332 17919 51997 1 127 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.818 0.442 17919 51998 1 127 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.866 1.024 17919 51999 1 127 . 1 1 39 39 ASP N N 39 113.380 113.380 115.334 -1.954 17919 52000 1 127 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.302 0.128 17919 52001 1 127 . 1 1 39 39 ASP C C 39 177.090 177.090 177.023 0.067 17919 52002 1 127 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.540 -0.900 17919 52003 1 127 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.270 -0.730 17919 52004 1 127 . 1 1 39 39 ASP H H 39 8.550 8.550 8.587 -0.037 17919 52005 1 127 . 1 1 40 40 GLN N N 40 116.780 116.780 115.843 0.937 17919 52006 1 127 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.190 0.274 17919 52007 1 127 . 1 1 40 40 GLN C C 40 175.380 175.380 176.169 -0.789 17919 52008 1 127 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.827 -1.187 17919 52009 1 127 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.212 0.928 17919 52010 1 127 . 1 1 40 40 GLN H H 40 7.820 7.820 7.556 0.264 17919 52011 1 127 . 1 1 41 41 GLN N N 41 117.720 117.720 118.044 -0.324 17919 52012 1 127 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.561 -0.317 17919 52013 1 127 . 1 1 41 41 GLN C C 41 176.300 176.300 174.969 1.331 17919 52014 1 127 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.394 1.076 17919 52015 1 127 . 1 1 41 41 GLN CB C 41 31.650 31.650 31.052 0.598 17919 52016 1 127 . 1 1 41 41 GLN H H 41 7.480 7.480 7.795 -0.315 17919 52017 1 127 . 1 1 42 42 ARG N N 42 122.680 122.680 124.769 -2.089 17919 52018 1 127 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.665 -0.165 17919 52019 1 127 . 1 1 42 42 ARG C C 42 174.050 174.050 173.739 0.311 17919 52020 1 127 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.352 -0.302 17919 52021 1 127 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.639 -0.889 17919 52022 1 127 . 1 1 42 42 ARG H H 42 8.530 8.530 8.069 0.461 17919 52023 1 127 . 1 1 43 43 LEU N N 43 124.040 124.040 127.008 -2.968 17919 52024 1 127 . 1 1 43 43 LEU C C 43 175.290 175.290 175.068 0.222 17919 52025 1 127 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.921 -0.941 17919 52026 1 127 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.569 1.220 17919 52027 1 127 . 1 1 43 43 LEU H H 43 8.820 8.820 8.805 0.015 17919 52028 1 127 . 1 1 44 44 ILE N N 44 121.920 121.920 121.111 0.809 17919 52029 1 127 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.213 -0.221 17919 52030 1 127 . 1 1 44 44 ILE C C 44 176.060 176.060 174.436 1.624 17919 52031 1 127 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.968 -0.988 17919 52032 1 127 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.833 -0.413 17919 52033 1 127 . 1 1 44 44 ILE H H 44 9.030 9.030 8.409 0.621 17919 52034 1 127 . 1 1 45 45 PHE N N 45 125.390 125.390 127.399 -2.009 17919 52035 1 127 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.001 0.044 17919 52036 1 127 . 1 1 45 45 PHE C C 45 174.470 174.470 174.210 0.260 17919 52037 1 127 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.812 0.208 17919 52038 1 127 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.930 0.830 17919 52039 1 127 . 1 1 45 45 PHE H H 45 8.830 8.830 8.829 0.001 17919 52040 1 127 . 1 1 46 46 ALA N N 46 132.200 132.200 130.078 2.122 17919 52041 1 127 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.608 0.082 17919 52042 1 127 . 1 1 46 46 ALA C C 46 177.290 177.290 177.489 -0.199 17919 52043 1 127 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.838 -0.298 17919 52044 1 127 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.953 -0.383 17919 52045 1 127 . 1 1 46 46 ALA H H 46 8.810 8.810 8.472 0.338 17919 52046 1 127 . 1 1 47 47 GLY N N 47 102.340 102.340 103.524 -1.184 17919 52047 1 127 . 1 1 47 47 GLY C C 47 173.810 173.810 174.791 -0.981 17919 52048 1 127 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.758 -0.409 17919 52049 1 127 . 1 1 47 47 GLY H H 47 8.130 8.130 8.550 -0.420 17919 52050 1 127 . 1 1 48 48 LYS N N 48 121.570 121.570 121.617 -0.047 17919 52051 1 127 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.615 0.007 17919 52052 1 127 . 1 1 48 48 LYS C C 48 174.700 174.700 175.889 -1.189 17919 52053 1 127 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.136 0.414 17919 52054 1 127 . 1 1 48 48 LYS CB C 48 34.530 34.530 33.292 1.238 17919 52055 1 127 . 1 1 48 48 LYS H H 48 7.980 7.980 7.934 0.046 17919 52056 1 127 . 1 1 49 49 GLN N N 49 122.410 122.410 121.639 0.771 17919 52057 1 127 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.710 -0.150 17919 52058 1 127 . 1 1 49 49 GLN C C 49 175.670 175.670 175.597 0.073 17919 52059 1 127 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.464 0.277 17919 52060 1 127 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.385 -0.385 17919 52061 1 127 . 1 1 49 49 GLN H H 49 8.600 8.600 8.603 -0.003 17919 52062 1 127 . 1 1 50 50 LEU N N 50 125.520 125.520 126.426 -0.906 17919 52063 1 127 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.036 0.054 17919 52064 1 127 . 1 1 50 50 LEU C C 50 176.660 176.660 176.471 0.189 17919 52065 1 127 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.182 0.058 17919 52066 1 127 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.304 0.266 17919 52067 1 127 . 1 1 50 50 LEU H H 50 8.530 8.530 8.268 0.262 17919 52068 1 127 . 1 1 51 51 GLU N N 51 122.940 122.940 125.887 -2.947 17919 52069 1 127 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.388 0.100 17919 52070 1 127 . 1 1 51 51 GLU C C 51 175.870 175.870 176.954 -1.084 17919 52071 1 127 . 1 1 51 51 GLU CA C 51 55.960 55.960 56.230 -0.270 17919 52072 1 127 . 1 1 51 51 GLU CB C 51 31.570 31.570 30.535 1.035 17919 52073 1 127 . 1 1 51 51 GLU H H 51 8.400 8.400 8.553 -0.153 17919 52074 1 127 . 1 1 52 52 ASP N N 52 120.030 120.030 125.045 -5.015 17919 52075 1 127 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.400 -0.041 17919 52076 1 127 . 1 1 52 52 ASP C C 52 177.330 177.330 177.775 -0.445 17919 52077 1 127 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.273 -0.312 17919 52078 1 127 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.851 -0.001 17919 52079 1 127 . 1 1 52 52 ASP H H 52 8.160 8.160 8.802 -0.642 17919 52080 1 127 . 1 1 53 53 GLY N N 53 106.660 106.660 107.554 -0.894 17919 52081 1 127 . 1 1 53 53 GLY C C 53 174.870 174.870 173.827 1.043 17919 52082 1 127 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.839 0.331 17919 52083 1 127 . 1 1 53 53 GLY H H 53 9.390 9.390 8.391 0.999 17919 52084 1 127 . 1 1 54 54 ARG N N 54 119.050 119.050 120.159 -1.109 17919 52085 1 127 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.729 -0.034 17919 52086 1 127 . 1 1 54 54 ARG C C 54 175.350 175.350 175.018 0.332 17919 52087 1 127 . 1 1 54 54 ARG CA C 54 54.390 54.390 53.812 0.578 17919 52088 1 127 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.406 -0.756 17919 52089 1 127 . 1 1 54 54 ARG H H 54 7.460 7.460 7.688 -0.228 17919 52090 1 127 . 1 1 55 55 THR N N 55 108.400 108.400 112.064 -3.664 17919 52091 1 127 . 1 1 55 55 THR HA H 55 5.240 5.240 5.153 0.087 17919 52092 1 127 . 1 1 55 55 THR C C 55 176.560 176.560 176.102 0.458 17919 52093 1 127 . 1 1 55 55 THR CA C 55 59.690 59.690 60.216 -0.526 17919 52094 1 127 . 1 1 55 55 THR CB C 55 72.260 72.260 71.491 0.769 17919 52095 1 127 . 1 1 55 55 THR H H 55 8.730 8.730 8.604 0.126 17919 52096 1 127 . 1 1 56 56 LEU N N 56 117.920 117.920 121.899 -3.979 17919 52097 1 127 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.912 0.148 17919 52098 1 127 . 1 1 56 56 LEU C C 56 180.810 180.810 178.824 1.986 17919 52099 1 127 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.568 0.142 17919 52100 1 127 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.523 -1.153 17919 52101 1 127 . 1 1 56 56 LEU H H 56 8.140 8.140 8.508 -0.368 17919 52102 1 127 . 1 1 57 57 SER N N 57 113.330 113.330 114.916 -1.586 17919 52103 1 127 . 1 1 57 57 SER HA H 57 4.370 4.370 4.108 0.262 17919 52104 1 127 . 1 1 57 57 SER C C 57 178.310 178.310 176.756 1.554 17919 52105 1 127 . 1 1 57 57 SER CA C 57 61.080 61.080 62.177 -1.097 17919 52106 1 127 . 1 1 57 57 SER CB C 57 62.530 62.530 62.724 -0.194 17919 52107 1 127 . 1 1 57 57 SER H H 57 8.470 8.470 7.944 0.526 17919 52108 1 127 . 1 1 58 58 ASP N N 58 124.190 124.190 122.236 1.954 17919 52109 1 127 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.282 0.014 17919 52110 1 127 . 1 1 58 58 ASP C C 58 177.400 177.400 177.678 -0.278 17919 52111 1 127 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.852 0.328 17919 52112 1 127 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.337 -0.237 17919 52113 1 127 . 1 1 58 58 ASP H H 58 7.930 7.930 7.807 0.123 17919 52114 1 127 . 1 1 59 59 TYR N N 59 115.510 115.510 115.007 0.503 17919 52115 1 127 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.792 -0.122 17919 52116 1 127 . 1 1 59 59 TYR C C 59 174.700 174.700 175.217 -0.517 17919 52117 1 127 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.313 0.937 17919 52118 1 127 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.292 1.778 17919 52119 1 127 . 1 1 59 59 TYR H H 59 7.250 7.250 7.487 -0.237 17919 52120 1 127 . 1 1 60 60 ASN N N 60 115.900 115.900 117.027 -1.127 17919 52121 1 127 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.503 -0.148 17919 52122 1 127 . 1 1 60 60 ASN C C 60 174.340 174.340 174.566 -0.226 17919 52123 1 127 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.362 -0.242 17919 52124 1 127 . 1 1 60 60 ASN CB C 60 37.410 37.410 38.017 -0.606 17919 52125 1 127 . 1 1 60 60 ASN H H 60 8.150 8.150 7.816 0.334 17919 52126 1 127 . 1 1 61 61 ILE N N 61 118.600 118.600 120.727 -2.127 17919 52127 1 127 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.810 -0.417 17919 52128 1 127 . 1 1 61 61 ILE C C 61 174.610 174.610 175.067 -0.457 17919 52129 1 127 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.296 1.124 17919 52130 1 127 . 1 1 61 61 ILE CB C 61 36.740 36.740 35.349 1.391 17919 52131 1 127 . 1 1 61 61 ILE H H 61 7.250 7.250 7.471 -0.221 17919 52132 1 127 . 1 1 62 62 GLN N N 62 124.740 124.740 125.825 -1.085 17919 52133 1 127 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.510 -0.004 17919 52134 1 127 . 1 1 62 62 GLN C C 62 175.970 175.970 176.088 -0.118 17919 52135 1 127 . 1 1 62 62 GLN CA C 62 53.660 53.660 54.458 -0.798 17919 52136 1 127 . 1 1 62 62 GLN CB C 62 31.650 31.650 29.809 1.841 17919 52137 1 127 . 1 1 62 62 GLN H H 62 7.610 7.610 7.840 -0.230 17919 52138 1 127 . 1 1 63 63 LYS N N 63 120.300 120.300 119.867 0.433 17919 52139 1 127 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.078 -0.077 17919 52140 1 127 . 1 1 63 63 LYS C C 63 175.810 175.810 176.896 -1.086 17919 52141 1 127 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.474 0.316 17919 52142 1 127 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.241 0.409 17919 52143 1 127 . 1 1 63 63 LYS H H 63 8.490 8.490 8.454 0.036 17919 52144 1 127 . 1 1 64 64 GLU N N 64 113.950 113.950 117.654 -3.704 17919 52145 1 127 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.535 -0.070 17919 52146 1 127 . 1 1 64 64 GLU C C 64 175.250 175.250 176.205 -0.955 17919 52147 1 127 . 1 1 64 64 GLU CA C 64 57.890 57.890 58.057 -0.167 17919 52148 1 127 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.335 -2.435 17919 52149 1 127 . 1 1 64 64 GLU H H 64 9.280 9.280 8.764 0.516 17919 52150 1 127 . 1 1 65 65 SER N N 65 114.730 114.730 114.091 0.639 17919 52151 1 127 . 1 1 65 65 SER HA H 65 4.640 4.640 4.332 0.308 17919 52152 1 127 . 1 1 65 65 SER C C 65 172.160 172.160 173.927 -1.767 17919 52153 1 127 . 1 1 65 65 SER CA C 65 60.890 60.890 60.604 0.286 17919 52154 1 127 . 1 1 65 65 SER CB C 65 64.910 64.910 63.944 0.966 17919 52155 1 127 . 1 1 65 65 SER H H 65 7.670 7.670 7.353 0.317 17919 52156 1 127 . 1 1 66 66 THR N N 66 117.110 117.110 118.275 -1.165 17919 52157 1 127 . 1 1 66 66 THR HA H 66 5.270 5.270 5.080 0.190 17919 52158 1 127 . 1 1 66 66 THR C C 66 173.950 173.950 173.968 -0.018 17919 52159 1 127 . 1 1 66 66 THR CA C 66 62.340 62.340 61.977 0.363 17919 52160 1 127 . 1 1 66 66 THR CB C 66 70.080 70.080 70.361 -0.281 17919 52161 1 127 . 1 1 66 66 THR H H 66 8.730 8.730 8.411 0.319 17919 52162 1 127 . 1 1 67 67 LEU N N 67 127.110 127.110 127.658 -0.548 17919 52163 1 127 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.883 0.177 17919 52164 1 127 . 1 1 67 67 LEU C C 67 175.770 175.770 175.439 0.331 17919 52165 1 127 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.119 -0.219 17919 52166 1 127 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.790 0.470 17919 52167 1 127 . 1 1 67 67 LEU H H 67 9.410 9.410 9.281 0.129 17919 52168 1 127 . 1 1 68 68 HIS N N 68 118.380 118.380 125.151 -6.771 17919 52169 1 127 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.079 0.161 17919 52170 1 127 . 1 1 68 68 HIS C C 68 173.150 173.150 174.823 -1.673 17919 52171 1 127 . 1 1 68 68 HIS CA C 68 55.000 55.000 53.942 1.058 17919 52172 1 127 . 1 1 68 68 HIS CB C 68 30.530 30.530 29.326 1.204 17919 52173 1 127 . 1 1 68 68 HIS H H 68 9.230 9.230 8.808 0.422 17919 52174 1 127 . 1 1 69 69 LEU N N 69 124.460 124.460 127.116 -2.656 17919 52175 1 127 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.189 1.001 17919 52176 1 127 . 1 1 69 69 LEU C C 69 175.270 175.270 175.175 0.095 17919 52177 1 127 . 1 1 69 69 LEU CA C 69 53.890 53.890 56.050 -2.159 17919 52178 1 127 . 1 1 69 69 LEU CB C 69 44.380 44.380 42.192 2.188 17919 52179 1 127 . 1 1 69 69 LEU H H 69 8.340 8.340 8.093 0.247 17919 52180 1 127 . 1 1 70 70 VAL N N 70 126.940 126.940 126.890 0.050 17919 52181 1 127 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.218 0.132 17919 52182 1 127 . 1 1 70 70 VAL C C 70 174.000 174.000 174.421 -0.421 17919 52183 1 127 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.823 -0.023 17919 52184 1 127 . 1 1 70 70 VAL CB C 70 34.910 34.910 34.155 0.755 17919 52185 1 127 . 1 1 70 70 VAL H H 70 9.200 9.200 8.257 0.943 17919 52186 1 127 . 1 1 71 71 LEU N N 71 123.130 123.130 125.544 -2.414 17919 52187 1 127 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.805 0.255 17919 52188 1 127 . 1 1 71 71 LEU C C 71 177.830 177.830 177.138 0.692 17919 52189 1 127 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.363 0.577 17919 52190 1 127 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.264 -0.414 17919 52191 1 127 . 1 1 71 71 LEU H H 71 8.120 8.120 8.479 -0.359 17919 52192 1 127 . 1 1 72 72 ARG N N 72 123.490 123.490 123.689 -0.199 17919 52193 1 127 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.466 -0.165 17919 52194 1 127 . 1 1 72 72 ARG C C 72 175.350 175.350 175.997 -0.647 17919 52195 1 127 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.762 -0.152 17919 52196 1 127 . 1 1 72 72 ARG CB C 72 31.350 31.350 31.056 0.294 17919 52197 1 127 . 1 1 72 72 ARG H H 72 8.580 8.580 7.983 0.597 17919 52198 1 128 . 1 1 2 2 GLN N N 2 123.220 123.220 119.784 3.436 17919 52199 1 128 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.157 0.092 17919 52200 1 128 . 1 1 2 2 GLN C C 2 175.920 175.920 175.465 0.455 17919 52201 1 128 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.114 0.966 17919 52202 1 128 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.271 0.489 17919 52203 1 128 . 1 1 2 2 GLN H H 2 8.900 8.900 8.309 0.591 17919 52204 1 128 . 1 1 3 3 ILE N N 3 115.340 115.340 114.570 0.770 17919 52205 1 128 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.175 0.038 17919 52206 1 128 . 1 1 3 3 ILE C C 3 172.450 172.450 173.491 -1.041 17919 52207 1 128 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.271 0.299 17919 52208 1 128 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.381 0.829 17919 52209 1 128 . 1 1 3 3 ILE H H 3 8.320 8.320 8.496 -0.176 17919 52210 1 128 . 1 1 4 4 PHE N N 4 118.110 118.110 118.054 0.056 17919 52211 1 128 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.631 -0.001 17919 52212 1 128 . 1 1 4 4 PHE C C 4 175.320 175.320 175.638 -0.318 17919 52213 1 128 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.247 -0.037 17919 52214 1 128 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.629 -0.149 17919 52215 1 128 . 1 1 4 4 PHE H H 4 8.610 8.610 8.502 0.108 17919 52216 1 128 . 1 1 5 5 VAL N N 5 121.000 121.000 118.431 2.569 17919 52217 1 128 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.827 -0.102 17919 52218 1 128 . 1 1 5 5 VAL C C 5 174.870 174.870 174.369 0.501 17919 52219 1 128 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.319 -0.699 17919 52220 1 128 . 1 1 5 5 VAL CB C 5 34.230 34.230 35.557 -1.327 17919 52221 1 128 . 1 1 5 5 VAL H H 5 9.300 9.300 9.105 0.195 17919 52222 1 128 . 1 1 6 6 LYS N N 6 127.520 127.520 128.343 -0.823 17919 52223 1 128 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.313 0.054 17919 52224 1 128 . 1 1 6 6 LYS C C 6 177.140 177.140 176.198 0.942 17919 52225 1 128 . 1 1 6 6 LYS CA C 6 54.520 54.520 53.664 0.856 17919 52226 1 128 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.428 0.622 17919 52227 1 128 . 1 1 6 6 LYS H H 6 8.820 8.820 9.257 -0.437 17919 52228 1 128 . 1 1 7 7 THR N N 7 115.400 115.400 119.615 -4.215 17919 52229 1 128 . 1 1 7 7 THR HA H 7 4.970 4.970 5.013 -0.043 17919 52230 1 128 . 1 1 7 7 THR C C 7 176.910 176.910 176.398 0.512 17919 52231 1 128 . 1 1 7 7 THR CA C 7 60.470 60.470 60.370 0.100 17919 52232 1 128 . 1 1 7 7 THR CB C 7 70.630 70.630 69.875 0.755 17919 52233 1 128 . 1 1 7 7 THR H H 7 8.730 8.730 8.099 0.631 17919 52234 1 128 . 1 1 8 8 LEU N N 8 121.330 121.330 120.919 0.411 17919 52235 1 128 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.266 0.044 17919 52236 1 128 . 1 1 8 8 LEU C C 8 178.800 178.800 178.585 0.215 17919 52237 1 128 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.387 0.193 17919 52238 1 128 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.559 0.411 17919 52239 1 128 . 1 1 8 8 LEU H H 8 9.100 9.100 8.781 0.319 17919 52240 1 128 . 1 1 9 9 THR N N 9 105.590 105.590 106.763 -1.173 17919 52241 1 128 . 1 1 9 9 THR HA H 9 4.428 4.428 4.314 0.114 17919 52242 1 128 . 1 1 9 9 THR C C 9 175.520 175.520 175.734 -0.214 17919 52243 1 128 . 1 1 9 9 THR CA C 9 61.400 61.400 61.973 -0.573 17919 52244 1 128 . 1 1 9 9 THR CB C 9 69.140 69.140 68.839 0.301 17919 52245 1 128 . 1 1 9 9 THR H H 9 7.630 7.630 7.694 -0.064 17919 52246 1 128 . 1 1 10 10 GLY N N 10 108.890 108.890 111.634 -2.744 17919 52247 1 128 . 1 1 10 10 GLY C C 10 174.070 174.070 174.108 -0.038 17919 52248 1 128 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.958 0.502 17919 52249 1 128 . 1 1 10 10 GLY H H 10 7.810 7.810 7.848 -0.038 17919 52250 1 128 . 1 1 11 11 LYS N N 11 121.600 121.600 120.494 1.106 17919 52251 1 128 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.262 0.099 17919 52252 1 128 . 1 1 11 11 LYS C C 11 175.940 175.940 175.635 0.305 17919 52253 1 128 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.568 -0.288 17919 52254 1 128 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.406 -0.206 17919 52255 1 128 . 1 1 11 11 LYS H H 11 7.280 7.280 7.769 -0.489 17919 52256 1 128 . 1 1 12 12 THR N N 12 120.440 120.440 118.456 1.984 17919 52257 1 128 . 1 1 12 12 THR HA H 12 5.046 5.046 4.585 0.461 17919 52258 1 128 . 1 1 12 12 THR C C 12 174.320 174.320 174.824 -0.504 17919 52259 1 128 . 1 1 12 12 THR CA C 12 62.390 62.390 62.817 -0.427 17919 52260 1 128 . 1 1 12 12 THR CB C 12 69.910 69.910 69.519 0.391 17919 52261 1 128 . 1 1 12 12 THR H H 12 8.650 8.650 8.306 0.344 17919 52262 1 128 . 1 1 13 13 ILE N N 13 127.110 127.110 126.744 0.366 17919 52263 1 128 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.492 0.052 17919 52264 1 128 . 1 1 13 13 ILE C C 13 175.220 175.220 175.095 0.125 17919 52265 1 128 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.597 -0.617 17919 52266 1 128 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.829 0.121 17919 52267 1 128 . 1 1 13 13 ILE H H 13 9.450 9.450 8.878 0.572 17919 52268 1 128 . 1 1 14 14 THR N N 14 121.520 121.520 123.433 -1.913 17919 52269 1 128 . 1 1 14 14 THR HA H 14 4.964 4.964 4.793 0.171 17919 52270 1 128 . 1 1 14 14 THR C C 14 173.790 173.790 173.870 -0.080 17919 52271 1 128 . 1 1 14 14 THR CA C 14 61.940 61.940 62.529 -0.589 17919 52272 1 128 . 1 1 14 14 THR CB C 14 69.650 69.650 69.685 -0.035 17919 52273 1 128 . 1 1 14 14 THR H H 14 8.710 8.710 8.386 0.324 17919 52274 1 128 . 1 1 15 15 LEU N N 15 124.800 124.800 127.759 -2.959 17919 52275 1 128 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.634 0.146 17919 52276 1 128 . 1 1 15 15 LEU C C 15 174.670 174.670 174.311 0.359 17919 52277 1 128 . 1 1 15 15 LEU CA C 15 52.830 52.830 54.607 -1.777 17919 52278 1 128 . 1 1 15 15 LEU CB C 15 47.070 47.070 46.495 0.576 17919 52279 1 128 . 1 1 15 15 LEU H H 15 8.710 8.710 8.473 0.237 17919 52280 1 128 . 1 1 16 16 GLU N N 16 122.160 122.160 126.004 -3.844 17919 52281 1 128 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.450 0.467 17919 52282 1 128 . 1 1 16 16 GLU C C 16 175.860 175.860 176.114 -0.254 17919 52283 1 128 . 1 1 16 16 GLU CA C 16 54.820 54.820 56.073 -1.253 17919 52284 1 128 . 1 1 16 16 GLU CB C 16 29.450 29.450 29.146 0.304 17919 52285 1 128 . 1 1 16 16 GLU H H 16 8.140 8.140 8.661 -0.521 17919 52286 1 128 . 1 1 17 17 VAL N N 17 117.210 117.210 119.561 -2.351 17919 52287 1 128 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.989 -0.275 17919 52288 1 128 . 1 1 17 17 VAL C C 17 174.160 174.160 174.788 -0.628 17919 52289 1 128 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.002 -0.571 17919 52290 1 128 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.795 0.605 17919 52291 1 128 . 1 1 17 17 VAL H H 17 8.900 8.900 8.589 0.311 17919 52292 1 128 . 1 1 18 18 GLU N N 18 118.990 118.990 118.248 0.742 17919 52293 1 128 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.971 0.108 17919 52294 1 128 . 1 1 18 18 GLU C C 18 176.160 176.160 174.711 1.449 17919 52295 1 128 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.730 -0.010 17919 52296 1 128 . 1 1 18 18 GLU CB C 18 30.310 30.310 31.540 -1.230 17919 52297 1 128 . 1 1 18 18 GLU H H 18 8.640 8.640 8.690 -0.050 17919 52298 1 128 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.292 -0.151 17919 52299 1 128 . 1 1 19 19 PRO C C 19 175.310 175.310 178.632 -3.322 17919 52300 1 128 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.580 -0.110 17919 52301 1 128 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.788 0.162 17919 52302 1 128 . 1 1 20 20 SER N N 20 103.400 103.400 112.015 -8.615 17919 52303 1 128 . 1 1 20 20 SER HA H 20 4.370 4.370 4.170 0.200 17919 52304 1 128 . 1 1 20 20 SER C C 20 174.660 174.660 175.016 -0.356 17919 52305 1 128 . 1 1 20 20 SER CA C 20 57.400 57.400 60.359 -2.959 17919 52306 1 128 . 1 1 20 20 SER CB C 20 63.370 63.370 62.902 0.468 17919 52307 1 128 . 1 1 20 20 SER H H 20 7.040 7.040 8.131 -1.091 17919 52308 1 128 . 1 1 21 21 ASP N N 21 123.480 123.480 122.277 1.203 17919 52309 1 128 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.619 0.076 17919 52310 1 128 . 1 1 21 21 ASP C C 21 176.360 176.360 175.821 0.539 17919 52311 1 128 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.672 0.028 17919 52312 1 128 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.546 -0.746 17919 52313 1 128 . 1 1 21 21 ASP H H 21 8.030 8.030 7.740 0.290 17919 52314 1 128 . 1 1 22 22 THR N N 22 108.800 108.800 112.598 -3.798 17919 52315 1 128 . 1 1 22 22 THR HA H 22 4.920 4.920 4.704 0.216 17919 52316 1 128 . 1 1 22 22 THR C C 22 176.750 176.750 175.845 0.905 17919 52317 1 128 . 1 1 22 22 THR CA C 22 59.690 59.690 61.293 -1.603 17919 52318 1 128 . 1 1 22 22 THR CB C 22 71.200 71.200 70.447 0.753 17919 52319 1 128 . 1 1 22 22 THR H H 22 7.900 7.900 8.191 -0.291 17919 52320 1 128 . 1 1 23 23 ILE N N 23 121.190 121.190 123.679 -2.489 17919 52321 1 128 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.733 -0.076 17919 52322 1 128 . 1 1 23 23 ILE C C 23 179.040 179.040 177.338 1.702 17919 52323 1 128 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.343 -0.083 17919 52324 1 128 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.306 -1.956 17919 52325 1 128 . 1 1 23 23 ILE H H 23 8.560 8.560 9.231 -0.671 17919 52326 1 128 . 1 1 24 24 GLU N N 24 120.830 120.830 120.572 0.258 17919 52327 1 128 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.879 0.038 17919 52328 1 128 . 1 1 24 24 GLU C C 24 178.640 178.640 178.587 0.053 17919 52329 1 128 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.908 0.312 17919 52330 1 128 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.459 -1.179 17919 52331 1 128 . 1 1 24 24 GLU H H 24 9.760 9.760 8.156 1.604 17919 52332 1 128 . 1 1 25 25 ASN N N 25 120.570 120.570 118.079 2.491 17919 52333 1 128 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.578 -0.053 17919 52334 1 128 . 1 1 25 25 ASN C C 25 178.380 178.380 177.787 0.593 17919 52335 1 128 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.438 0.622 17919 52336 1 128 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.416 0.034 17919 52337 1 128 . 1 1 25 25 ASN H H 25 7.920 7.920 7.713 0.207 17919 52338 1 128 . 1 1 26 26 VAL N N 26 121.710 121.710 121.705 0.005 17919 52339 1 128 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.506 -0.109 17919 52340 1 128 . 1 1 26 26 VAL C C 26 177.950 177.950 177.609 0.341 17919 52341 1 128 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.847 0.813 17919 52342 1 128 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.700 -0.860 17919 52343 1 128 . 1 1 26 26 VAL H H 26 8.070 8.070 7.770 0.300 17919 52344 1 128 . 1 1 27 27 LYS N N 27 118.860 118.860 119.624 -0.764 17919 52345 1 128 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.198 0.382 17919 52346 1 128 . 1 1 27 27 LYS C C 27 180.550 180.550 178.959 1.591 17919 52347 1 128 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.804 -0.554 17919 52348 1 128 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.233 1.497 17919 52349 1 128 . 1 1 27 27 LYS H H 27 8.560 8.560 7.772 0.788 17919 52350 1 128 . 1 1 28 28 ALA N N 28 123.440 123.440 122.147 1.293 17919 52351 1 128 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.079 0.081 17919 52352 1 128 . 1 1 28 28 ALA C C 28 180.300 180.300 179.238 1.062 17919 52353 1 128 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.150 0.220 17919 52354 1 128 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.456 -0.746 17919 52355 1 128 . 1 1 28 28 ALA H H 28 8.060 8.060 7.622 0.438 17919 52356 1 128 . 1 1 29 29 LYS N N 29 119.940 119.940 120.016 -0.076 17919 52357 1 128 . 1 1 29 29 LYS HA H 29 4.207 4.207 3.965 0.242 17919 52358 1 128 . 1 1 29 29 LYS C C 29 180.320 180.320 179.319 1.001 17919 52359 1 128 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.653 -0.003 17919 52360 1 128 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.338 0.952 17919 52361 1 128 . 1 1 29 29 LYS H H 29 7.850 7.850 7.924 -0.074 17919 52362 1 128 . 1 1 30 30 ILE N N 30 121.080 121.080 120.216 0.864 17919 52363 1 128 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.515 -0.008 17919 52364 1 128 . 1 1 30 30 ILE C C 30 178.310 178.310 177.352 0.958 17919 52365 1 128 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.811 0.339 17919 52366 1 128 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.903 -1.103 17919 52367 1 128 . 1 1 30 30 ILE H H 30 8.280 8.280 8.331 -0.051 17919 52368 1 128 . 1 1 31 31 GLN N N 31 123.490 123.490 119.731 3.759 17919 52369 1 128 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.959 -0.130 17919 52370 1 128 . 1 1 31 31 GLN C C 31 178.890 178.890 178.479 0.411 17919 52371 1 128 . 1 1 31 31 GLN CA C 31 60.000 60.000 58.873 1.127 17919 52372 1 128 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.527 -0.807 17919 52373 1 128 . 1 1 31 31 GLN H H 31 8.580 8.580 8.311 0.269 17919 52374 1 128 . 1 1 32 32 ASP N N 32 119.360 119.360 119.533 -0.173 17919 52375 1 128 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.569 -0.215 17919 52376 1 128 . 1 1 32 32 ASP C C 32 177.250 177.250 177.239 0.011 17919 52377 1 128 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.170 1.020 17919 52378 1 128 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.674 -0.094 17919 52379 1 128 . 1 1 32 32 ASP H H 32 8.010 8.010 8.095 -0.085 17919 52380 1 128 . 1 1 33 33 LYS N N 33 115.130 115.130 116.869 -1.739 17919 52381 1 128 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.522 -0.185 17919 52382 1 128 . 1 1 33 33 LYS C C 33 177.870 177.870 177.097 0.773 17919 52383 1 128 . 1 1 33 33 LYS CA C 33 58.050 58.050 56.886 1.164 17919 52384 1 128 . 1 1 33 33 LYS CB C 33 34.170 34.170 34.973 -0.803 17919 52385 1 128 . 1 1 33 33 LYS H H 33 7.430 7.430 7.623 -0.193 17919 52386 1 128 . 1 1 34 34 GLU N N 34 113.870 113.870 117.389 -3.519 17919 52387 1 128 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.457 0.168 17919 52388 1 128 . 1 1 34 34 GLU C C 34 177.840 177.840 177.435 0.405 17919 52389 1 128 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.153 -0.983 17919 52390 1 128 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.506 1.154 17919 52391 1 128 . 1 1 34 34 GLU H H 34 8.740 8.740 7.985 0.755 17919 52392 1 128 . 1 1 35 35 GLY N N 35 108.650 108.650 109.655 -1.005 17919 52393 1 128 . 1 1 35 35 GLY C C 35 173.960 173.960 174.546 -0.586 17919 52394 1 128 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.688 0.393 17919 52395 1 128 . 1 1 35 35 GLY H H 35 8.530 8.530 7.992 0.538 17919 52396 1 128 . 1 1 36 36 ILE N N 36 119.880 119.880 120.630 -0.750 17919 52397 1 128 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.239 0.206 17919 52398 1 128 . 1 1 36 36 ILE C C 36 173.590 173.590 174.361 -0.771 17919 52399 1 128 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.226 -0.476 17919 52400 1 128 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.050 2.530 17919 52401 1 128 . 1 1 36 36 ILE H H 36 6.150 6.150 7.733 -1.583 17919 52402 1 128 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.758 -0.124 17919 52403 1 128 . 1 1 37 37 PRO C C 37 176.940 176.940 175.997 0.943 17919 52404 1 128 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.219 0.441 17919 52405 1 128 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.409 0.441 17919 52406 1 128 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.235 -0.118 17919 52407 1 128 . 1 1 38 38 PRO C C 38 178.320 178.320 178.046 0.274 17919 52408 1 128 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.317 0.943 17919 52409 1 128 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.947 0.943 17919 52410 1 128 . 1 1 39 39 ASP N N 39 113.380 113.380 115.936 -2.556 17919 52411 1 128 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.354 0.076 17919 52412 1 128 . 1 1 39 39 ASP C C 39 177.090 177.090 178.140 -1.050 17919 52413 1 128 . 1 1 39 39 ASP CA C 39 55.640 55.640 57.334 -1.694 17919 52414 1 128 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.584 -1.044 17919 52415 1 128 . 1 1 39 39 ASP H H 39 8.550 8.550 8.563 -0.013 17919 52416 1 128 . 1 1 40 40 GLN N N 40 116.780 116.780 117.560 -0.780 17919 52417 1 128 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.162 0.302 17919 52418 1 128 . 1 1 40 40 GLN C C 40 175.380 175.380 176.663 -1.283 17919 52419 1 128 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.653 -1.013 17919 52420 1 128 . 1 1 40 40 GLN CB C 40 30.140 30.140 28.907 1.233 17919 52421 1 128 . 1 1 40 40 GLN H H 40 7.820 7.820 7.675 0.145 17919 52422 1 128 . 1 1 41 41 GLN N N 41 117.720 117.720 118.959 -1.239 17919 52423 1 128 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.161 0.083 17919 52424 1 128 . 1 1 41 41 GLN C C 41 176.300 176.300 174.869 1.431 17919 52425 1 128 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.788 -0.318 17919 52426 1 128 . 1 1 41 41 GLN CB C 41 31.650 31.650 28.842 2.808 17919 52427 1 128 . 1 1 41 41 GLN H H 41 7.480 7.480 7.301 0.179 17919 52428 1 128 . 1 1 42 42 ARG N N 42 122.680 122.680 124.967 -2.287 17919 52429 1 128 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.561 -0.061 17919 52430 1 128 . 1 1 42 42 ARG C C 42 174.050 174.050 173.953 0.097 17919 52431 1 128 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.077 -0.027 17919 52432 1 128 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.329 -0.579 17919 52433 1 128 . 1 1 42 42 ARG H H 42 8.530 8.530 7.900 0.630 17919 52434 1 128 . 1 1 43 43 LEU N N 43 124.040 124.040 126.479 -2.439 17919 52435 1 128 . 1 1 43 43 LEU C C 43 175.290 175.290 176.229 -0.939 17919 52436 1 128 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.777 -0.797 17919 52437 1 128 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.015 1.775 17919 52438 1 128 . 1 1 43 43 LEU H H 43 8.820 8.820 8.636 0.184 17919 52439 1 128 . 1 1 44 44 ILE N N 44 121.920 121.920 122.469 -0.549 17919 52440 1 128 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.052 -0.060 17919 52441 1 128 . 1 1 44 44 ILE C C 44 176.060 176.060 174.363 1.697 17919 52442 1 128 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.385 -1.405 17919 52443 1 128 . 1 1 44 44 ILE CB C 44 41.420 41.420 42.099 -0.679 17919 52444 1 128 . 1 1 44 44 ILE H H 44 9.030 9.030 8.353 0.677 17919 52445 1 128 . 1 1 45 45 PHE N N 45 125.390 125.390 126.315 -0.925 17919 52446 1 128 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.058 -0.013 17919 52447 1 128 . 1 1 45 45 PHE C C 45 174.470 174.470 174.410 0.060 17919 52448 1 128 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.251 0.769 17919 52449 1 128 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.710 1.050 17919 52450 1 128 . 1 1 45 45 PHE H H 45 8.830 8.830 8.991 -0.161 17919 52451 1 128 . 1 1 46 46 ALA N N 46 132.200 132.200 130.370 1.830 17919 52452 1 128 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.614 0.076 17919 52453 1 128 . 1 1 46 46 ALA C C 46 177.290 177.290 177.168 0.122 17919 52454 1 128 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.825 -0.284 17919 52455 1 128 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.084 0.485 17919 52456 1 128 . 1 1 46 46 ALA H H 46 8.810 8.810 8.999 -0.189 17919 52457 1 128 . 1 1 47 47 GLY N N 47 102.340 102.340 104.409 -2.069 17919 52458 1 128 . 1 1 47 47 GLY C C 47 173.810 173.810 174.653 -0.843 17919 52459 1 128 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.512 -0.162 17919 52460 1 128 . 1 1 47 47 GLY H H 47 8.130 8.130 8.549 -0.419 17919 52461 1 128 . 1 1 48 48 LYS N N 48 121.570 121.570 122.382 -0.812 17919 52462 1 128 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.516 0.106 17919 52463 1 128 . 1 1 48 48 LYS C C 48 174.700 174.700 175.409 -0.709 17919 52464 1 128 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.004 -0.454 17919 52465 1 128 . 1 1 48 48 LYS CB C 48 34.530 34.530 33.373 1.157 17919 52466 1 128 . 1 1 48 48 LYS H H 48 7.980 7.980 7.925 0.055 17919 52467 1 128 . 1 1 49 49 GLN N N 49 122.410 122.410 126.381 -3.971 17919 52468 1 128 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.633 -0.073 17919 52469 1 128 . 1 1 49 49 GLN C C 49 175.670 175.670 175.584 0.086 17919 52470 1 128 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.283 0.457 17919 52471 1 128 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.159 -0.159 17919 52472 1 128 . 1 1 49 49 GLN H H 49 8.600 8.600 8.718 -0.118 17919 52473 1 128 . 1 1 50 50 LEU N N 50 125.520 125.520 129.904 -4.384 17919 52474 1 128 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.115 -0.025 17919 52475 1 128 . 1 1 50 50 LEU C C 50 176.660 176.660 176.182 0.478 17919 52476 1 128 . 1 1 50 50 LEU CA C 50 54.240 54.240 55.639 -1.399 17919 52477 1 128 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.281 -0.711 17919 52478 1 128 . 1 1 50 50 LEU H H 50 8.530 8.530 8.562 -0.032 17919 52479 1 128 . 1 1 51 51 GLU N N 51 122.940 122.940 124.915 -1.975 17919 52480 1 128 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.461 0.027 17919 52481 1 128 . 1 1 51 51 GLU C C 51 175.870 175.870 176.785 -0.915 17919 52482 1 128 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.564 0.396 17919 52483 1 128 . 1 1 51 51 GLU CB C 51 31.570 31.570 30.972 0.598 17919 52484 1 128 . 1 1 51 51 GLU H H 51 8.400 8.400 8.658 -0.258 17919 52485 1 128 . 1 1 52 52 ASP N N 52 120.030 120.030 125.695 -5.665 17919 52486 1 128 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.381 -0.022 17919 52487 1 128 . 1 1 52 52 ASP C C 52 177.330 177.330 177.993 -0.663 17919 52488 1 128 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.302 -0.342 17919 52489 1 128 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.646 0.204 17919 52490 1 128 . 1 1 52 52 ASP H H 52 8.160 8.160 8.903 -0.743 17919 52491 1 128 . 1 1 53 53 GLY N N 53 106.660 106.660 105.639 1.021 17919 52492 1 128 . 1 1 53 53 GLY C C 53 174.870 174.870 174.330 0.540 17919 52493 1 128 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.060 0.110 17919 52494 1 128 . 1 1 53 53 GLY H H 53 9.390 9.390 8.504 0.886 17919 52495 1 128 . 1 1 54 54 ARG N N 54 119.050 119.050 120.283 -1.233 17919 52496 1 128 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.743 -0.048 17919 52497 1 128 . 1 1 54 54 ARG C C 54 175.350 175.350 175.036 0.314 17919 52498 1 128 . 1 1 54 54 ARG CA C 54 54.390 54.390 53.941 0.449 17919 52499 1 128 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.261 -0.611 17919 52500 1 128 . 1 1 54 54 ARG H H 54 7.460 7.460 7.547 -0.087 17919 52501 1 128 . 1 1 55 55 THR N N 55 108.400 108.400 113.060 -4.660 17919 52502 1 128 . 1 1 55 55 THR HA H 55 5.240 5.240 4.997 0.243 17919 52503 1 128 . 1 1 55 55 THR C C 55 176.560 176.560 176.886 -0.326 17919 52504 1 128 . 1 1 55 55 THR CA C 55 59.690 59.690 60.921 -1.231 17919 52505 1 128 . 1 1 55 55 THR CB C 55 72.260 72.260 70.371 1.889 17919 52506 1 128 . 1 1 55 55 THR H H 55 8.730 8.730 9.226 -0.496 17919 52507 1 128 . 1 1 56 56 LEU N N 56 117.920 117.920 123.388 -5.468 17919 52508 1 128 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.926 0.134 17919 52509 1 128 . 1 1 56 56 LEU C C 56 180.810 180.810 178.716 2.094 17919 52510 1 128 . 1 1 56 56 LEU CA C 56 58.710 58.710 59.428 -0.718 17919 52511 1 128 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.426 -1.056 17919 52512 1 128 . 1 1 56 56 LEU H H 56 8.140 8.140 8.615 -0.475 17919 52513 1 128 . 1 1 57 57 SER N N 57 113.330 113.330 110.452 2.878 17919 52514 1 128 . 1 1 57 57 SER HA H 57 4.370 4.370 4.335 0.035 17919 52515 1 128 . 1 1 57 57 SER C C 57 178.310 178.310 175.030 3.280 17919 52516 1 128 . 1 1 57 57 SER CA C 57 61.080 61.080 60.110 0.970 17919 52517 1 128 . 1 1 57 57 SER CB C 57 62.530 62.530 62.775 -0.245 17919 52518 1 128 . 1 1 57 57 SER H H 57 8.470 8.470 7.847 0.623 17919 52519 1 128 . 1 1 58 58 ASP N N 58 124.190 124.190 120.468 3.722 17919 52520 1 128 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.388 -0.092 17919 52521 1 128 . 1 1 58 58 ASP C C 58 177.400 177.400 176.523 0.877 17919 52522 1 128 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.378 0.802 17919 52523 1 128 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.554 -0.454 17919 52524 1 128 . 1 1 58 58 ASP H H 58 7.930 7.930 7.935 -0.005 17919 52525 1 128 . 1 1 59 59 TYR N N 59 115.510 115.510 115.147 0.363 17919 52526 1 128 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.718 -0.048 17919 52527 1 128 . 1 1 59 59 TYR C C 59 174.700 174.700 175.185 -0.485 17919 52528 1 128 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.203 1.047 17919 52529 1 128 . 1 1 59 59 TYR CB C 59 40.070 40.070 39.700 0.370 17919 52530 1 128 . 1 1 59 59 TYR H H 59 7.250 7.250 7.419 -0.169 17919 52531 1 128 . 1 1 60 60 ASN N N 60 115.900 115.900 118.503 -2.603 17919 52532 1 128 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.425 -0.070 17919 52533 1 128 . 1 1 60 60 ASN C C 60 174.340 174.340 174.473 -0.133 17919 52534 1 128 . 1 1 60 60 ASN CA C 60 54.120 54.120 53.752 0.368 17919 52535 1 128 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.226 0.184 17919 52536 1 128 . 1 1 60 60 ASN H H 60 8.150 8.150 8.089 0.061 17919 52537 1 128 . 1 1 61 61 ILE N N 61 118.600 118.600 120.705 -2.105 17919 52538 1 128 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.744 -0.351 17919 52539 1 128 . 1 1 61 61 ILE C C 61 174.610 174.610 175.229 -0.619 17919 52540 1 128 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.217 0.203 17919 52541 1 128 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.900 -1.160 17919 52542 1 128 . 1 1 61 61 ILE H H 61 7.250 7.250 7.830 -0.580 17919 52543 1 128 . 1 1 62 62 GLN N N 62 124.740 124.740 124.750 -0.010 17919 52544 1 128 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.614 -0.108 17919 52545 1 128 . 1 1 62 62 GLN C C 62 175.970 175.970 175.286 0.684 17919 52546 1 128 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.828 -0.168 17919 52547 1 128 . 1 1 62 62 GLN CB C 62 31.650 31.650 32.047 -0.397 17919 52548 1 128 . 1 1 62 62 GLN H H 62 7.610 7.610 8.076 -0.466 17919 52549 1 128 . 1 1 63 63 LYS N N 63 120.300 120.300 121.722 -1.422 17919 52550 1 128 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.881 0.120 17919 52551 1 128 . 1 1 63 63 LYS C C 63 175.810 175.810 176.798 -0.988 17919 52552 1 128 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.547 -0.757 17919 52553 1 128 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.890 0.760 17919 52554 1 128 . 1 1 63 63 LYS H H 63 8.490 8.490 8.524 -0.034 17919 52555 1 128 . 1 1 64 64 GLU N N 64 113.950 113.950 121.545 -7.595 17919 52556 1 128 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.766 -0.301 17919 52557 1 128 . 1 1 64 64 GLU C C 64 175.250 175.250 175.678 -0.428 17919 52558 1 128 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.744 0.146 17919 52559 1 128 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.673 -2.773 17919 52560 1 128 . 1 1 64 64 GLU H H 64 9.280 9.280 8.675 0.605 17919 52561 1 128 . 1 1 65 65 SER N N 65 114.730 114.730 114.243 0.487 17919 52562 1 128 . 1 1 65 65 SER HA H 65 4.640 4.640 4.490 0.150 17919 52563 1 128 . 1 1 65 65 SER C C 65 172.160 172.160 173.944 -1.784 17919 52564 1 128 . 1 1 65 65 SER CA C 65 60.890 60.890 60.246 0.644 17919 52565 1 128 . 1 1 65 65 SER CB C 65 64.910 64.910 64.250 0.660 17919 52566 1 128 . 1 1 65 65 SER H H 65 7.670 7.670 7.453 0.217 17919 52567 1 128 . 1 1 66 66 THR N N 66 117.110 117.110 117.165 -0.055 17919 52568 1 128 . 1 1 66 66 THR HA H 66 5.270 5.270 5.158 0.112 17919 52569 1 128 . 1 1 66 66 THR C C 66 173.950 173.950 173.617 0.333 17919 52570 1 128 . 1 1 66 66 THR CA C 66 62.340 62.340 61.634 0.706 17919 52571 1 128 . 1 1 66 66 THR CB C 66 70.080 70.080 71.227 -1.147 17919 52572 1 128 . 1 1 66 66 THR H H 66 8.730 8.730 8.376 0.354 17919 52573 1 128 . 1 1 67 67 LEU N N 67 127.110 127.110 126.551 0.559 17919 52574 1 128 . 1 1 67 67 LEU HA H 67 5.060 5.060 5.185 -0.125 17919 52575 1 128 . 1 1 67 67 LEU C C 67 175.770 175.770 174.991 0.779 17919 52576 1 128 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.538 0.362 17919 52577 1 128 . 1 1 67 67 LEU CB C 67 44.260 44.260 45.371 -1.111 17919 52578 1 128 . 1 1 67 67 LEU H H 67 9.410 9.410 8.760 0.650 17919 52579 1 128 . 1 1 68 68 HIS N N 68 118.380 118.380 120.758 -2.378 17919 52580 1 128 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.535 -0.295 17919 52581 1 128 . 1 1 68 68 HIS C C 68 173.150 173.150 173.768 -0.618 17919 52582 1 128 . 1 1 68 68 HIS CA C 68 55.000 55.000 53.550 1.450 17919 52583 1 128 . 1 1 68 68 HIS CB C 68 30.530 30.530 33.310 -2.780 17919 52584 1 128 . 1 1 68 68 HIS H H 68 9.230 9.230 9.155 0.075 17919 52585 1 128 . 1 1 69 69 LEU N N 69 124.460 124.460 127.398 -2.938 17919 52586 1 128 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.103 0.087 17919 52587 1 128 . 1 1 69 69 LEU C C 69 175.270 175.270 174.314 0.956 17919 52588 1 128 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.014 -0.124 17919 52589 1 128 . 1 1 69 69 LEU CB C 69 44.380 44.380 45.366 -0.986 17919 52590 1 128 . 1 1 69 69 LEU H H 69 8.340 8.340 8.788 -0.448 17919 52591 1 128 . 1 1 70 70 VAL N N 70 126.940 126.940 123.172 3.768 17919 52592 1 128 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.491 -0.141 17919 52593 1 128 . 1 1 70 70 VAL C C 70 174.000 174.000 173.159 0.841 17919 52594 1 128 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.916 -0.116 17919 52595 1 128 . 1 1 70 70 VAL CB C 70 34.910 34.910 36.120 -1.210 17919 52596 1 128 . 1 1 70 70 VAL H H 70 9.200 9.200 8.121 1.079 17919 52597 1 128 . 1 1 71 71 LEU N N 71 123.130 123.130 122.825 0.305 17919 52598 1 128 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.793 0.267 17919 52599 1 128 . 1 1 71 71 LEU C C 71 177.830 177.830 177.291 0.539 17919 52600 1 128 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.150 0.790 17919 52601 1 128 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.923 -0.073 17919 52602 1 128 . 1 1 71 71 LEU H H 71 8.120 8.120 8.168 -0.048 17919 52603 1 128 . 1 1 72 72 ARG N N 72 123.490 123.490 124.531 -1.041 17919 52604 1 128 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.156 0.145 17919 52605 1 128 . 1 1 72 72 ARG C C 72 175.350 175.350 175.543 -0.193 17919 52606 1 128 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.760 -1.150 17919 52607 1 128 . 1 1 72 72 ARG CB C 72 31.350 31.350 29.123 2.227 17919 52608 1 128 . 1 1 72 72 ARG H H 72 8.580 8.580 8.162 0.418 17919 52609 1 129 . 1 1 2 2 GLN N N 2 123.220 123.220 121.923 1.297 17919 52610 1 129 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.199 0.050 17919 52611 1 129 . 1 1 2 2 GLN C C 2 175.920 175.920 175.787 0.133 17919 52612 1 129 . 1 1 2 2 GLN CA C 2 55.080 55.080 55.411 -0.331 17919 52613 1 129 . 1 1 2 2 GLN CB C 2 30.760 30.760 29.222 1.538 17919 52614 1 129 . 1 1 2 2 GLN H H 2 8.900 8.900 8.513 0.387 17919 52615 1 129 . 1 1 3 3 ILE N N 3 115.340 115.340 118.025 -2.685 17919 52616 1 129 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.604 -0.392 17919 52617 1 129 . 1 1 3 3 ILE C C 3 172.450 172.450 173.746 -1.296 17919 52618 1 129 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.578 -0.008 17919 52619 1 129 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.128 1.082 17919 52620 1 129 . 1 1 3 3 ILE H H 3 8.320 8.320 8.733 -0.413 17919 52621 1 129 . 1 1 4 4 PHE N N 4 118.110 118.110 124.593 -6.483 17919 52622 1 129 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.344 0.286 17919 52623 1 129 . 1 1 4 4 PHE C C 4 175.320 175.320 175.204 0.116 17919 52624 1 129 . 1 1 4 4 PHE CA C 4 55.210 55.210 56.211 -1.001 17919 52625 1 129 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.638 -0.158 17919 52626 1 129 . 1 1 4 4 PHE H H 4 8.610 8.610 8.123 0.487 17919 52627 1 129 . 1 1 5 5 VAL N N 5 121.000 121.000 124.708 -3.708 17919 52628 1 129 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.755 -0.030 17919 52629 1 129 . 1 1 5 5 VAL C C 5 174.870 174.870 175.280 -0.410 17919 52630 1 129 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.099 -0.479 17919 52631 1 129 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.042 1.188 17919 52632 1 129 . 1 1 5 5 VAL H H 5 9.300 9.300 9.317 -0.017 17919 52633 1 129 . 1 1 6 6 LYS N N 6 127.520 127.520 130.469 -2.949 17919 52634 1 129 . 1 1 6 6 LYS HA H 6 5.367 5.367 4.929 0.438 17919 52635 1 129 . 1 1 6 6 LYS C C 6 177.140 177.140 176.782 0.358 17919 52636 1 129 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.147 0.373 17919 52637 1 129 . 1 1 6 6 LYS CB C 6 35.050 35.050 33.532 1.518 17919 52638 1 129 . 1 1 6 6 LYS H H 6 8.820 8.820 9.344 -0.524 17919 52639 1 129 . 1 1 7 7 THR N N 7 115.400 115.400 118.953 -3.553 17919 52640 1 129 . 1 1 7 7 THR HA H 7 4.970 4.970 4.306 0.664 17919 52641 1 129 . 1 1 7 7 THR C C 7 176.910 176.910 175.450 1.460 17919 52642 1 129 . 1 1 7 7 THR CA C 7 60.470 60.470 62.559 -2.088 17919 52643 1 129 . 1 1 7 7 THR CB C 7 70.630 70.630 69.593 1.038 17919 52644 1 129 . 1 1 7 7 THR H H 7 8.730 8.730 8.563 0.167 17919 52645 1 129 . 1 1 8 8 LEU N N 8 121.330 121.330 119.741 1.589 17919 52646 1 129 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.325 -0.015 17919 52647 1 129 . 1 1 8 8 LEU C C 8 178.800 178.800 178.642 0.158 17919 52648 1 129 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.512 0.068 17919 52649 1 129 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.106 -0.136 17919 52650 1 129 . 1 1 8 8 LEU H H 8 9.100 9.100 8.652 0.448 17919 52651 1 129 . 1 1 9 9 THR N N 9 105.590 105.590 107.505 -1.915 17919 52652 1 129 . 1 1 9 9 THR HA H 9 4.428 4.428 4.265 0.163 17919 52653 1 129 . 1 1 9 9 THR C C 9 175.520 175.520 175.608 -0.088 17919 52654 1 129 . 1 1 9 9 THR CA C 9 61.400 61.400 62.280 -0.880 17919 52655 1 129 . 1 1 9 9 THR CB C 9 69.140 69.140 68.797 0.343 17919 52656 1 129 . 1 1 9 9 THR H H 9 7.630 7.630 7.756 -0.126 17919 52657 1 129 . 1 1 10 10 GLY N N 10 108.890 108.890 109.966 -1.076 17919 52658 1 129 . 1 1 10 10 GLY C C 10 174.070 174.070 173.942 0.128 17919 52659 1 129 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.704 0.756 17919 52660 1 129 . 1 1 10 10 GLY H H 10 7.810 7.810 7.615 0.195 17919 52661 1 129 . 1 1 11 11 LYS N N 11 121.600 121.600 121.859 -0.259 17919 52662 1 129 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.296 0.065 17919 52663 1 129 . 1 1 11 11 LYS C C 11 175.940 175.940 175.449 0.491 17919 52664 1 129 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.800 -0.520 17919 52665 1 129 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.263 -0.063 17919 52666 1 129 . 1 1 11 11 LYS H H 11 7.280 7.280 7.662 -0.382 17919 52667 1 129 . 1 1 12 12 THR N N 12 120.440 120.440 122.457 -2.017 17919 52668 1 129 . 1 1 12 12 THR HA H 12 5.046 5.046 5.172 -0.126 17919 52669 1 129 . 1 1 12 12 THR C C 12 174.320 174.320 174.311 0.009 17919 52670 1 129 . 1 1 12 12 THR CA C 12 62.390 62.390 62.349 0.041 17919 52671 1 129 . 1 1 12 12 THR CB C 12 69.910 69.910 70.145 -0.235 17919 52672 1 129 . 1 1 12 12 THR H H 12 8.650 8.650 8.306 0.344 17919 52673 1 129 . 1 1 13 13 ILE N N 13 127.110 127.110 128.296 -1.186 17919 52674 1 129 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.409 0.135 17919 52675 1 129 . 1 1 13 13 ILE C C 13 175.220 175.220 174.899 0.321 17919 52676 1 129 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.517 -0.537 17919 52677 1 129 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.118 -0.168 17919 52678 1 129 . 1 1 13 13 ILE H H 13 9.450 9.450 9.156 0.294 17919 52679 1 129 . 1 1 14 14 THR N N 14 121.520 121.520 125.094 -3.574 17919 52680 1 129 . 1 1 14 14 THR HA H 14 4.964 4.964 4.348 0.616 17919 52681 1 129 . 1 1 14 14 THR C C 14 173.790 173.790 173.638 0.152 17919 52682 1 129 . 1 1 14 14 THR CA C 14 61.940 61.940 62.272 -0.332 17919 52683 1 129 . 1 1 14 14 THR CB C 14 69.650 69.650 68.832 0.818 17919 52684 1 129 . 1 1 14 14 THR H H 14 8.710 8.710 8.808 -0.098 17919 52685 1 129 . 1 1 15 15 LEU N N 15 124.800 124.800 127.223 -2.423 17919 52686 1 129 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.696 0.084 17919 52687 1 129 . 1 1 15 15 LEU C C 15 174.670 174.670 175.165 -0.495 17919 52688 1 129 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.496 -0.666 17919 52689 1 129 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.221 1.849 17919 52690 1 129 . 1 1 15 15 LEU H H 15 8.710 8.710 8.243 0.467 17919 52691 1 129 . 1 1 16 16 GLU N N 16 122.160 122.160 124.336 -2.176 17919 52692 1 129 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.719 0.198 17919 52693 1 129 . 1 1 16 16 GLU C C 16 175.860 175.860 175.945 -0.085 17919 52694 1 129 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.406 -0.586 17919 52695 1 129 . 1 1 16 16 GLU CB C 16 29.450 29.450 29.270 0.180 17919 52696 1 129 . 1 1 16 16 GLU H H 16 8.140 8.140 8.580 -0.440 17919 52697 1 129 . 1 1 17 17 VAL N N 17 117.210 117.210 120.894 -3.684 17919 52698 1 129 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.725 -0.011 17919 52699 1 129 . 1 1 17 17 VAL C C 17 174.160 174.160 175.407 -1.247 17919 52700 1 129 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.092 -0.661 17919 52701 1 129 . 1 1 17 17 VAL CB C 17 36.400 36.400 34.729 1.671 17919 52702 1 129 . 1 1 17 17 VAL H H 17 8.900 8.900 8.739 0.161 17919 52703 1 129 . 1 1 18 18 GLU N N 18 118.990 118.990 119.827 -0.837 17919 52704 1 129 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.895 0.184 17919 52705 1 129 . 1 1 18 18 GLU C C 18 176.160 176.160 175.224 0.936 17919 52706 1 129 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.949 -0.229 17919 52707 1 129 . 1 1 18 18 GLU CB C 18 30.310 30.310 32.649 -2.339 17919 52708 1 129 . 1 1 18 18 GLU H H 18 8.640 8.640 8.169 0.471 17919 52709 1 129 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.341 -0.200 17919 52710 1 129 . 1 1 19 19 PRO C C 19 175.310 175.310 177.606 -2.296 17919 52711 1 129 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.082 0.388 17919 52712 1 129 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.920 0.030 17919 52713 1 129 . 1 1 20 20 SER N N 20 103.400 103.400 111.511 -8.111 17919 52714 1 129 . 1 1 20 20 SER HA H 20 4.370 4.370 4.345 0.025 17919 52715 1 129 . 1 1 20 20 SER C C 20 174.660 174.660 174.877 -0.217 17919 52716 1 129 . 1 1 20 20 SER CA C 20 57.400 57.400 58.954 -1.554 17919 52717 1 129 . 1 1 20 20 SER CB C 20 63.370 63.370 62.439 0.931 17919 52718 1 129 . 1 1 20 20 SER H H 20 7.040 7.040 8.035 -0.995 17919 52719 1 129 . 1 1 21 21 ASP N N 21 123.480 123.480 124.537 -1.057 17919 52720 1 129 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.582 0.113 17919 52721 1 129 . 1 1 21 21 ASP C C 21 176.360 176.360 175.659 0.701 17919 52722 1 129 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.786 -0.086 17919 52723 1 129 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.598 -0.798 17919 52724 1 129 . 1 1 21 21 ASP H H 21 8.030 8.030 8.416 -0.386 17919 52725 1 129 . 1 1 22 22 THR N N 22 108.800 108.800 110.749 -1.949 17919 52726 1 129 . 1 1 22 22 THR HA H 22 4.920 4.920 4.895 0.025 17919 52727 1 129 . 1 1 22 22 THR C C 22 176.750 176.750 175.967 0.783 17919 52728 1 129 . 1 1 22 22 THR CA C 22 59.690 59.690 60.403 -0.713 17919 52729 1 129 . 1 1 22 22 THR CB C 22 71.200 71.200 70.644 0.556 17919 52730 1 129 . 1 1 22 22 THR H H 22 7.900 7.900 8.367 -0.467 17919 52731 1 129 . 1 1 23 23 ILE N N 23 121.190 121.190 123.032 -1.842 17919 52732 1 129 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.729 -0.072 17919 52733 1 129 . 1 1 23 23 ILE C C 23 179.040 179.040 177.578 1.462 17919 52734 1 129 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.756 -0.496 17919 52735 1 129 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.391 -2.041 17919 52736 1 129 . 1 1 23 23 ILE H H 23 8.560 8.560 9.161 -0.601 17919 52737 1 129 . 1 1 24 24 GLU N N 24 120.830 120.830 120.512 0.318 17919 52738 1 129 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.880 0.037 17919 52739 1 129 . 1 1 24 24 GLU C C 24 178.640 178.640 178.326 0.314 17919 52740 1 129 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.871 0.349 17919 52741 1 129 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.465 -1.185 17919 52742 1 129 . 1 1 24 24 GLU H H 24 9.760 9.760 8.613 1.147 17919 52743 1 129 . 1 1 25 25 ASN N N 25 120.570 120.570 117.251 3.319 17919 52744 1 129 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.550 -0.025 17919 52745 1 129 . 1 1 25 25 ASN C C 25 178.380 178.380 178.124 0.256 17919 52746 1 129 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.797 0.263 17919 52747 1 129 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.599 -0.149 17919 52748 1 129 . 1 1 25 25 ASN H H 25 7.920 7.920 7.767 0.153 17919 52749 1 129 . 1 1 26 26 VAL N N 26 121.710 121.710 120.477 1.233 17919 52750 1 129 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.506 -0.109 17919 52751 1 129 . 1 1 26 26 VAL C C 26 177.950 177.950 177.693 0.257 17919 52752 1 129 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.877 0.783 17919 52753 1 129 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.328 -0.487 17919 52754 1 129 . 1 1 26 26 VAL H H 26 8.070 8.070 7.869 0.201 17919 52755 1 129 . 1 1 27 27 LYS N N 27 118.860 118.860 119.419 -0.559 17919 52756 1 129 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.162 0.418 17919 52757 1 129 . 1 1 27 27 LYS C C 27 180.550 180.550 179.080 1.470 17919 52758 1 129 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.354 -0.104 17919 52759 1 129 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.294 1.436 17919 52760 1 129 . 1 1 27 27 LYS H H 27 8.560 8.560 7.578 0.982 17919 52761 1 129 . 1 1 28 28 ALA N N 28 123.440 123.440 122.212 1.228 17919 52762 1 129 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.003 0.157 17919 52763 1 129 . 1 1 28 28 ALA C C 28 180.300 180.300 179.108 1.192 17919 52764 1 129 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.595 -0.225 17919 52765 1 129 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.348 -0.638 17919 52766 1 129 . 1 1 28 28 ALA H H 28 8.060 8.060 7.935 0.125 17919 52767 1 129 . 1 1 29 29 LYS N N 29 119.940 119.940 119.179 0.761 17919 52768 1 129 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.002 0.205 17919 52769 1 129 . 1 1 29 29 LYS C C 29 180.320 180.320 179.151 1.169 17919 52770 1 129 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.257 0.393 17919 52771 1 129 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.095 1.195 17919 52772 1 129 . 1 1 29 29 LYS H H 29 7.850 7.850 7.475 0.375 17919 52773 1 129 . 1 1 30 30 ILE N N 30 121.080 121.080 120.263 0.817 17919 52774 1 129 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.574 -0.067 17919 52775 1 129 . 1 1 30 30 ILE C C 30 178.310 178.310 177.314 0.996 17919 52776 1 129 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.451 0.699 17919 52777 1 129 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.678 -0.879 17919 52778 1 129 . 1 1 30 30 ILE H H 30 8.280 8.280 8.321 -0.041 17919 52779 1 129 . 1 1 31 31 GLN N N 31 123.490 123.490 120.134 3.356 17919 52780 1 129 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.108 -0.279 17919 52781 1 129 . 1 1 31 31 GLN C C 31 178.890 178.890 178.366 0.524 17919 52782 1 129 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.006 0.994 17919 52783 1 129 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.496 -0.776 17919 52784 1 129 . 1 1 31 31 GLN H H 31 8.580 8.580 7.928 0.652 17919 52785 1 129 . 1 1 32 32 ASP N N 32 119.360 119.360 119.070 0.290 17919 52786 1 129 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.440 -0.086 17919 52787 1 129 . 1 1 32 32 ASP C C 32 177.250 177.250 177.970 -0.720 17919 52788 1 129 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.731 0.459 17919 52789 1 129 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.770 -0.190 17919 52790 1 129 . 1 1 32 32 ASP H H 32 8.010 8.010 7.948 0.062 17919 52791 1 129 . 1 1 33 33 LYS N N 33 115.130 115.130 118.687 -3.557 17919 52792 1 129 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.185 0.152 17919 52793 1 129 . 1 1 33 33 LYS C C 33 177.870 177.870 178.120 -0.250 17919 52794 1 129 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.599 -0.549 17919 52795 1 129 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.383 0.787 17919 52796 1 129 . 1 1 33 33 LYS H H 33 7.430 7.430 7.523 -0.093 17919 52797 1 129 . 1 1 34 34 GLU N N 34 113.870 113.870 114.485 -0.615 17919 52798 1 129 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.465 0.160 17919 52799 1 129 . 1 1 34 34 GLU C C 34 177.840 177.840 176.948 0.892 17919 52800 1 129 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.973 -0.803 17919 52801 1 129 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.887 0.772 17919 52802 1 129 . 1 1 34 34 GLU H H 34 8.740 8.740 7.856 0.884 17919 52803 1 129 . 1 1 35 35 GLY N N 35 108.650 108.650 109.558 -0.908 17919 52804 1 129 . 1 1 35 35 GLY C C 35 173.960 173.960 174.161 -0.201 17919 52805 1 129 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.834 0.246 17919 52806 1 129 . 1 1 35 35 GLY H H 35 8.530 8.530 8.128 0.402 17919 52807 1 129 . 1 1 36 36 ILE N N 36 119.880 119.880 120.638 -0.758 17919 52808 1 129 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.385 0.060 17919 52809 1 129 . 1 1 36 36 ILE C C 36 173.590 173.590 174.361 -0.771 17919 52810 1 129 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.644 0.106 17919 52811 1 129 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.675 1.905 17919 52812 1 129 . 1 1 36 36 ILE H H 36 6.150 6.150 7.503 -1.353 17919 52813 1 129 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.705 -0.071 17919 52814 1 129 . 1 1 37 37 PRO C C 37 176.940 176.940 176.651 0.289 17919 52815 1 129 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.389 0.271 17919 52816 1 129 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.133 0.717 17919 52817 1 129 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.118 -0.001 17919 52818 1 129 . 1 1 38 38 PRO C C 38 178.320 178.320 178.440 -0.120 17919 52819 1 129 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.688 0.573 17919 52820 1 129 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.639 1.251 17919 52821 1 129 . 1 1 39 39 ASP N N 39 113.380 113.380 117.169 -3.789 17919 52822 1 129 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.282 0.148 17919 52823 1 129 . 1 1 39 39 ASP C C 39 177.090 177.090 177.758 -0.668 17919 52824 1 129 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.894 -1.254 17919 52825 1 129 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.236 -0.696 17919 52826 1 129 . 1 1 39 39 ASP H H 39 8.550 8.550 8.568 -0.018 17919 52827 1 129 . 1 1 40 40 GLN N N 40 116.780 116.780 115.902 0.878 17919 52828 1 129 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.210 0.254 17919 52829 1 129 . 1 1 40 40 GLN C C 40 175.380 175.380 176.197 -0.817 17919 52830 1 129 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.059 -0.419 17919 52831 1 129 . 1 1 40 40 GLN CB C 40 30.140 30.140 28.759 1.381 17919 52832 1 129 . 1 1 40 40 GLN H H 40 7.820 7.820 7.912 -0.092 17919 52833 1 129 . 1 1 41 41 GLN N N 41 117.720 117.720 118.834 -1.114 17919 52834 1 129 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.593 -0.349 17919 52835 1 129 . 1 1 41 41 GLN C C 41 176.300 176.300 175.422 0.878 17919 52836 1 129 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.596 0.874 17919 52837 1 129 . 1 1 41 41 GLN CB C 41 31.650 31.650 30.286 1.364 17919 52838 1 129 . 1 1 41 41 GLN H H 41 7.480 7.480 7.637 -0.157 17919 52839 1 129 . 1 1 42 42 ARG N N 42 122.680 122.680 122.911 -0.231 17919 52840 1 129 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.604 -0.104 17919 52841 1 129 . 1 1 42 42 ARG C C 42 174.050 174.050 174.245 -0.195 17919 52842 1 129 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.153 -0.103 17919 52843 1 129 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.124 -1.374 17919 52844 1 129 . 1 1 42 42 ARG H H 42 8.530 8.530 8.190 0.340 17919 52845 1 129 . 1 1 43 43 LEU N N 43 124.040 124.040 124.833 -0.793 17919 52846 1 129 . 1 1 43 43 LEU C C 43 175.290 175.290 175.669 -0.379 17919 52847 1 129 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.664 -0.684 17919 52848 1 129 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.386 1.404 17919 52849 1 129 . 1 1 43 43 LEU H H 43 8.820 8.820 8.631 0.189 17919 52850 1 129 . 1 1 44 44 ILE N N 44 121.920 121.920 121.636 0.284 17919 52851 1 129 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.972 0.020 17919 52852 1 129 . 1 1 44 44 ILE C C 44 176.060 176.060 174.514 1.546 17919 52853 1 129 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.828 -0.848 17919 52854 1 129 . 1 1 44 44 ILE CB C 44 41.420 41.420 42.364 -0.944 17919 52855 1 129 . 1 1 44 44 ILE H H 44 9.030 9.030 8.186 0.844 17919 52856 1 129 . 1 1 45 45 PHE N N 45 125.390 125.390 126.756 -1.366 17919 52857 1 129 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.960 0.085 17919 52858 1 129 . 1 1 45 45 PHE C C 45 174.470 174.470 174.309 0.161 17919 52859 1 129 . 1 1 45 45 PHE CA C 45 57.020 57.020 57.482 -0.462 17919 52860 1 129 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.326 1.434 17919 52861 1 129 . 1 1 45 45 PHE H H 45 8.830 8.830 8.463 0.367 17919 52862 1 129 . 1 1 46 46 ALA N N 46 132.200 132.200 130.102 2.098 17919 52863 1 129 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.619 0.071 17919 52864 1 129 . 1 1 46 46 ALA C C 46 177.290 177.290 177.174 0.116 17919 52865 1 129 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.866 -0.326 17919 52866 1 129 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.656 -0.086 17919 52867 1 129 . 1 1 46 46 ALA H H 46 8.810 8.810 8.592 0.218 17919 52868 1 129 . 1 1 47 47 GLY N N 47 102.340 102.340 103.358 -1.018 17919 52869 1 129 . 1 1 47 47 GLY C C 47 173.810 173.810 174.265 -0.455 17919 52870 1 129 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.402 -0.052 17919 52871 1 129 . 1 1 47 47 GLY H H 47 8.130 8.130 8.472 -0.342 17919 52872 1 129 . 1 1 48 48 LYS N N 48 121.570 121.570 120.757 0.813 17919 52873 1 129 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.635 -0.013 17919 52874 1 129 . 1 1 48 48 LYS C C 48 174.700 174.700 175.756 -1.056 17919 52875 1 129 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.825 -0.275 17919 52876 1 129 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.401 0.129 17919 52877 1 129 . 1 1 48 48 LYS H H 48 7.980 7.980 8.044 -0.064 17919 52878 1 129 . 1 1 49 49 GLN N N 49 122.410 122.410 122.867 -0.457 17919 52879 1 129 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.352 0.208 17919 52880 1 129 . 1 1 49 49 GLN C C 49 175.670 175.670 175.778 -0.108 17919 52881 1 129 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.333 -0.593 17919 52882 1 129 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.597 -0.597 17919 52883 1 129 . 1 1 49 49 GLN H H 49 8.600 8.600 8.626 -0.026 17919 52884 1 129 . 1 1 50 50 LEU N N 50 125.520 125.520 123.893 1.627 17919 52885 1 129 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.202 -0.112 17919 52886 1 129 . 1 1 50 50 LEU C C 50 176.660 176.660 175.819 0.841 17919 52887 1 129 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.758 0.482 17919 52888 1 129 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.946 -1.376 17919 52889 1 129 . 1 1 50 50 LEU H H 50 8.530 8.530 8.668 -0.138 17919 52890 1 129 . 1 1 51 51 GLU N N 51 122.940 122.940 119.973 2.967 17919 52891 1 129 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.569 -0.081 17919 52892 1 129 . 1 1 51 51 GLU C C 51 175.870 175.870 176.272 -0.402 17919 52893 1 129 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.342 0.618 17919 52894 1 129 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.662 -1.092 17919 52895 1 129 . 1 1 51 51 GLU H H 51 8.400 8.400 8.124 0.276 17919 52896 1 129 . 1 1 52 52 ASP N N 52 120.030 120.030 126.295 -6.265 17919 52897 1 129 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.348 0.011 17919 52898 1 129 . 1 1 52 52 ASP C C 52 177.330 177.330 177.537 -0.207 17919 52899 1 129 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.955 -0.995 17919 52900 1 129 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.748 0.102 17919 52901 1 129 . 1 1 52 52 ASP H H 52 8.160 8.160 8.798 -0.638 17919 52902 1 129 . 1 1 53 53 GLY N N 53 106.660 106.660 104.755 1.905 17919 52903 1 129 . 1 1 53 53 GLY C C 53 174.870 174.870 174.963 -0.093 17919 52904 1 129 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.061 0.109 17919 52905 1 129 . 1 1 53 53 GLY H H 53 9.390 9.390 8.452 0.938 17919 52906 1 129 . 1 1 54 54 ARG N N 54 119.050 119.050 120.539 -1.489 17919 52907 1 129 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.434 0.261 17919 52908 1 129 . 1 1 54 54 ARG C C 54 175.350 175.350 175.247 0.103 17919 52909 1 129 . 1 1 54 54 ARG CA C 54 54.390 54.390 55.896 -1.506 17919 52910 1 129 . 1 1 54 54 ARG CB C 54 32.650 32.650 31.274 1.376 17919 52911 1 129 . 1 1 54 54 ARG H H 54 7.460 7.460 7.684 -0.224 17919 52912 1 129 . 1 1 55 55 THR N N 55 108.400 108.400 110.366 -1.966 17919 52913 1 129 . 1 1 55 55 THR HA H 55 5.240 5.240 5.115 0.125 17919 52914 1 129 . 1 1 55 55 THR C C 55 176.560 176.560 176.124 0.436 17919 52915 1 129 . 1 1 55 55 THR CA C 55 59.690 59.690 59.914 -0.224 17919 52916 1 129 . 1 1 55 55 THR CB C 55 72.260 72.260 72.139 0.121 17919 52917 1 129 . 1 1 55 55 THR H H 55 8.730 8.730 9.051 -0.321 17919 52918 1 129 . 1 1 56 56 LEU N N 56 117.920 117.920 123.136 -5.216 17919 52919 1 129 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.087 -0.027 17919 52920 1 129 . 1 1 56 56 LEU C C 56 180.810 180.810 178.555 2.255 17919 52921 1 129 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.033 0.677 17919 52922 1 129 . 1 1 56 56 LEU CB C 56 40.370 40.370 40.650 -0.280 17919 52923 1 129 . 1 1 56 56 LEU H H 56 8.140 8.140 8.370 -0.230 17919 52924 1 129 . 1 1 57 57 SER N N 57 113.330 113.330 115.005 -1.675 17919 52925 1 129 . 1 1 57 57 SER HA H 57 4.370 4.370 4.131 0.239 17919 52926 1 129 . 1 1 57 57 SER C C 57 178.310 178.310 176.993 1.317 17919 52927 1 129 . 1 1 57 57 SER CA C 57 61.080 61.080 62.159 -1.079 17919 52928 1 129 . 1 1 57 57 SER CB C 57 62.530 62.530 62.667 -0.137 17919 52929 1 129 . 1 1 57 57 SER H H 57 8.470 8.470 7.916 0.554 17919 52930 1 129 . 1 1 58 58 ASP N N 58 124.190 124.190 122.959 1.231 17919 52931 1 129 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.355 -0.059 17919 52932 1 129 . 1 1 58 58 ASP C C 58 177.400 177.400 177.607 -0.207 17919 52933 1 129 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.686 0.494 17919 52934 1 129 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.462 -0.362 17919 52935 1 129 . 1 1 58 58 ASP H H 58 7.930 7.930 8.056 -0.126 17919 52936 1 129 . 1 1 59 59 TYR N N 59 115.510 115.510 116.116 -0.606 17919 52937 1 129 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.649 0.021 17919 52938 1 129 . 1 1 59 59 TYR C C 59 174.700 174.700 175.442 -0.742 17919 52939 1 129 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.897 0.353 17919 52940 1 129 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.765 1.305 17919 52941 1 129 . 1 1 59 59 TYR H H 59 7.250 7.250 7.413 -0.163 17919 52942 1 129 . 1 1 60 60 ASN N N 60 115.900 115.900 116.845 -0.945 17919 52943 1 129 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.389 -0.034 17919 52944 1 129 . 1 1 60 60 ASN C C 60 174.340 174.340 174.501 -0.161 17919 52945 1 129 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.121 -0.001 17919 52946 1 129 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.957 -0.547 17919 52947 1 129 . 1 1 60 60 ASN H H 60 8.150 8.150 7.661 0.489 17919 52948 1 129 . 1 1 61 61 ILE N N 61 118.600 118.600 120.530 -1.930 17919 52949 1 129 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.656 -0.263 17919 52950 1 129 . 1 1 61 61 ILE C C 61 174.610 174.610 175.197 -0.587 17919 52951 1 129 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.194 0.226 17919 52952 1 129 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.196 -0.456 17919 52953 1 129 . 1 1 61 61 ILE H H 61 7.250 7.250 8.265 -1.015 17919 52954 1 129 . 1 1 62 62 GLN N N 62 124.740 124.740 125.602 -0.862 17919 52955 1 129 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.675 -0.169 17919 52956 1 129 . 1 1 62 62 GLN C C 62 175.970 175.970 175.331 0.639 17919 52957 1 129 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.731 -0.071 17919 52958 1 129 . 1 1 62 62 GLN CB C 62 31.650 31.650 32.447 -0.797 17919 52959 1 129 . 1 1 62 62 GLN H H 62 7.610 7.610 7.969 -0.359 17919 52960 1 129 . 1 1 63 63 LYS N N 63 120.300 120.300 122.943 -2.643 17919 52961 1 129 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.934 0.067 17919 52962 1 129 . 1 1 63 63 LYS C C 63 175.810 175.810 176.832 -1.022 17919 52963 1 129 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.977 -0.187 17919 52964 1 129 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.453 0.197 17919 52965 1 129 . 1 1 63 63 LYS H H 63 8.490 8.490 8.711 -0.221 17919 52966 1 129 . 1 1 64 64 GLU N N 64 113.950 113.950 120.794 -6.844 17919 52967 1 129 . 1 1 64 64 GLU HA H 64 3.465 3.465 4.286 -0.821 17919 52968 1 129 . 1 1 64 64 GLU C C 64 175.250 175.250 175.059 0.191 17919 52969 1 129 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.716 0.174 17919 52970 1 129 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.077 -2.177 17919 52971 1 129 . 1 1 64 64 GLU H H 64 9.280 9.280 8.715 0.565 17919 52972 1 129 . 1 1 65 65 SER N N 65 114.730 114.730 113.670 1.060 17919 52973 1 129 . 1 1 65 65 SER HA H 65 4.640 4.640 4.936 -0.296 17919 52974 1 129 . 1 1 65 65 SER C C 65 172.160 172.160 173.670 -1.510 17919 52975 1 129 . 1 1 65 65 SER CA C 65 60.890 60.890 57.418 3.472 17919 52976 1 129 . 1 1 65 65 SER CB C 65 64.910 64.910 66.093 -1.183 17919 52977 1 129 . 1 1 65 65 SER H H 65 7.670 7.670 7.767 -0.097 17919 52978 1 129 . 1 1 66 66 THR N N 66 117.110 117.110 119.990 -2.880 17919 52979 1 129 . 1 1 66 66 THR HA H 66 5.270 5.270 5.446 -0.176 17919 52980 1 129 . 1 1 66 66 THR C C 66 173.950 173.950 174.132 -0.182 17919 52981 1 129 . 1 1 66 66 THR CA C 66 62.340 62.340 62.154 0.186 17919 52982 1 129 . 1 1 66 66 THR CB C 66 70.080 70.080 70.922 -0.842 17919 52983 1 129 . 1 1 66 66 THR H H 66 8.730 8.730 8.604 0.126 17919 52984 1 129 . 1 1 67 67 LEU N N 67 127.110 127.110 125.825 1.285 17919 52985 1 129 . 1 1 67 67 LEU HA H 67 5.060 5.060 5.281 -0.221 17919 52986 1 129 . 1 1 67 67 LEU C C 67 175.770 175.770 175.579 0.191 17919 52987 1 129 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.317 0.583 17919 52988 1 129 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.934 0.326 17919 52989 1 129 . 1 1 67 67 LEU H H 67 9.410 9.410 8.445 0.965 17919 52990 1 129 . 1 1 68 68 HIS N N 68 118.380 118.380 122.501 -4.121 17919 52991 1 129 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.260 -0.020 17919 52992 1 129 . 1 1 68 68 HIS C C 68 173.150 173.150 175.014 -1.864 17919 52993 1 129 . 1 1 68 68 HIS CA C 68 55.000 55.000 53.199 1.802 17919 52994 1 129 . 1 1 68 68 HIS CB C 68 30.530 30.530 31.165 -0.635 17919 52995 1 129 . 1 1 68 68 HIS H H 68 9.230 9.230 8.944 0.286 17919 52996 1 129 . 1 1 69 69 LEU N N 69 124.460 124.460 130.674 -6.214 17919 52997 1 129 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.327 0.863 17919 52998 1 129 . 1 1 69 69 LEU C C 69 175.270 175.270 174.947 0.323 17919 52999 1 129 . 1 1 69 69 LEU CA C 69 53.890 53.890 55.585 -1.695 17919 53000 1 129 . 1 1 69 69 LEU CB C 69 44.380 44.380 41.948 2.432 17919 53001 1 129 . 1 1 69 69 LEU H H 69 8.340 8.340 8.116 0.224 17919 53002 1 129 . 1 1 70 70 VAL N N 70 126.940 126.940 127.003 -0.063 17919 53003 1 129 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.011 0.339 17919 53004 1 129 . 1 1 70 70 VAL C C 70 174.000 174.000 175.103 -1.103 17919 53005 1 129 . 1 1 70 70 VAL CA C 70 60.800 60.800 62.176 -1.376 17919 53006 1 129 . 1 1 70 70 VAL CB C 70 34.910 34.910 32.065 2.845 17919 53007 1 129 . 1 1 70 70 VAL H H 70 9.200 9.200 8.659 0.541 17919 53008 1 129 . 1 1 71 71 LEU N N 71 123.130 123.130 126.659 -3.529 17919 53009 1 129 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.443 0.617 17919 53010 1 129 . 1 1 71 71 LEU C C 71 177.830 177.830 177.600 0.230 17919 53011 1 129 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.827 0.113 17919 53012 1 129 . 1 1 71 71 LEU CB C 71 42.850 42.850 41.941 0.909 17919 53013 1 129 . 1 1 71 71 LEU H H 71 8.120 8.120 8.598 -0.478 17919 53014 1 129 . 1 1 72 72 ARG N N 72 123.490 123.490 122.806 0.684 17919 53015 1 129 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.243 0.058 17919 53016 1 129 . 1 1 72 72 ARG C C 72 175.350 175.350 175.925 -0.575 17919 53017 1 129 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.040 -0.430 17919 53018 1 129 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.657 0.693 17919 53019 1 129 . 1 1 72 72 ARG H H 72 8.580 8.580 8.019 0.561 17919 53020 1 130 . 1 1 2 2 GLN N N 2 123.220 123.220 121.494 1.726 17919 53021 1 130 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.415 -0.166 17919 53022 1 130 . 1 1 2 2 GLN C C 2 175.920 175.920 174.837 1.083 17919 53023 1 130 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.435 0.645 17919 53024 1 130 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.848 -0.088 17919 53025 1 130 . 1 1 2 2 GLN H H 2 8.900 8.900 8.631 0.269 17919 53026 1 130 . 1 1 3 3 ILE N N 3 115.340 115.340 118.002 -2.662 17919 53027 1 130 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.301 -0.088 17919 53028 1 130 . 1 1 3 3 ILE C C 3 172.450 172.450 173.614 -1.164 17919 53029 1 130 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.402 0.168 17919 53030 1 130 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.413 0.797 17919 53031 1 130 . 1 1 3 3 ILE H H 3 8.320 8.320 8.305 0.015 17919 53032 1 130 . 1 1 4 4 PHE N N 4 118.110 118.110 120.110 -2.000 17919 53033 1 130 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.197 0.433 17919 53034 1 130 . 1 1 4 4 PHE C C 4 175.320 175.320 175.357 -0.037 17919 53035 1 130 . 1 1 4 4 PHE CA C 4 55.210 55.210 54.981 0.229 17919 53036 1 130 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.370 0.110 17919 53037 1 130 . 1 1 4 4 PHE H H 4 8.610 8.610 7.784 0.826 17919 53038 1 130 . 1 1 5 5 VAL N N 5 121.000 121.000 122.887 -1.887 17919 53039 1 130 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.563 0.162 17919 53040 1 130 . 1 1 5 5 VAL C C 5 174.870 174.870 175.127 -0.257 17919 53041 1 130 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.162 -0.542 17919 53042 1 130 . 1 1 5 5 VAL CB C 5 34.230 34.230 32.164 2.066 17919 53043 1 130 . 1 1 5 5 VAL H H 5 9.300 9.300 8.591 0.709 17919 53044 1 130 . 1 1 6 6 LYS N N 6 127.520 127.520 129.637 -2.117 17919 53045 1 130 . 1 1 6 6 LYS HA H 6 5.367 5.367 4.861 0.506 17919 53046 1 130 . 1 1 6 6 LYS C C 6 177.140 177.140 176.483 0.657 17919 53047 1 130 . 1 1 6 6 LYS CA C 6 54.520 54.520 55.674 -1.154 17919 53048 1 130 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.767 0.284 17919 53049 1 130 . 1 1 6 6 LYS H H 6 8.820 8.820 8.718 0.102 17919 53050 1 130 . 1 1 7 7 THR N N 7 115.400 115.400 116.981 -1.581 17919 53051 1 130 . 1 1 7 7 THR HA H 7 4.970 4.970 4.626 0.344 17919 53052 1 130 . 1 1 7 7 THR C C 7 176.910 176.910 175.858 1.052 17919 53053 1 130 . 1 1 7 7 THR CA C 7 60.470 60.470 60.524 -0.054 17919 53054 1 130 . 1 1 7 7 THR CB C 7 70.630 70.630 70.296 0.334 17919 53055 1 130 . 1 1 7 7 THR H H 7 8.730 8.730 9.031 -0.301 17919 53056 1 130 . 1 1 8 8 LEU N N 8 121.330 121.330 122.589 -1.259 17919 53057 1 130 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.669 -0.359 17919 53058 1 130 . 1 1 8 8 LEU C C 8 178.800 178.800 177.079 1.721 17919 53059 1 130 . 1 1 8 8 LEU CA C 8 57.580 57.580 55.346 2.233 17919 53060 1 130 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.855 0.115 17919 53061 1 130 . 1 1 8 8 LEU H H 8 9.100 9.100 9.049 0.051 17919 53062 1 130 . 1 1 9 9 THR N N 9 105.590 105.590 110.087 -4.497 17919 53063 1 130 . 1 1 9 9 THR HA H 9 4.428 4.428 4.368 0.060 17919 53064 1 130 . 1 1 9 9 THR C C 9 175.520 175.520 175.704 -0.184 17919 53065 1 130 . 1 1 9 9 THR CA C 9 61.400 61.400 61.877 -0.477 17919 53066 1 130 . 1 1 9 9 THR CB C 9 69.140 69.140 70.317 -1.177 17919 53067 1 130 . 1 1 9 9 THR H H 9 7.630 7.630 7.702 -0.072 17919 53068 1 130 . 1 1 10 10 GLY N N 10 108.890 108.890 111.800 -2.910 17919 53069 1 130 . 1 1 10 10 GLY C C 10 174.070 174.070 173.600 0.470 17919 53070 1 130 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.793 0.667 17919 53071 1 130 . 1 1 10 10 GLY H H 10 7.810 7.810 7.950 -0.140 17919 53072 1 130 . 1 1 11 11 LYS N N 11 121.600 121.600 122.333 -0.733 17919 53073 1 130 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.289 0.072 17919 53074 1 130 . 1 1 11 11 LYS C C 11 175.940 175.940 175.504 0.436 17919 53075 1 130 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.597 -0.318 17919 53076 1 130 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.195 0.005 17919 53077 1 130 . 1 1 11 11 LYS H H 11 7.280 7.280 7.778 -0.498 17919 53078 1 130 . 1 1 12 12 THR N N 12 120.440 120.440 121.279 -0.839 17919 53079 1 130 . 1 1 12 12 THR HA H 12 5.046 5.046 4.926 0.120 17919 53080 1 130 . 1 1 12 12 THR C C 12 174.320 174.320 174.564 -0.244 17919 53081 1 130 . 1 1 12 12 THR CA C 12 62.390 62.390 61.298 1.092 17919 53082 1 130 . 1 1 12 12 THR CB C 12 69.910 69.910 69.251 0.659 17919 53083 1 130 . 1 1 12 12 THR H H 12 8.650 8.650 8.309 0.341 17919 53084 1 130 . 1 1 13 13 ILE N N 13 127.110 127.110 124.153 2.957 17919 53085 1 130 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.774 -0.230 17919 53086 1 130 . 1 1 13 13 ILE C C 13 175.220 175.220 174.734 0.486 17919 53087 1 130 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.637 0.343 17919 53088 1 130 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.412 0.538 17919 53089 1 130 . 1 1 13 13 ILE H H 13 9.450 9.450 8.862 0.588 17919 53090 1 130 . 1 1 14 14 THR N N 14 121.520 121.520 123.793 -2.273 17919 53091 1 130 . 1 1 14 14 THR HA H 14 4.964 4.964 4.772 0.192 17919 53092 1 130 . 1 1 14 14 THR C C 14 173.790 173.790 174.008 -0.218 17919 53093 1 130 . 1 1 14 14 THR CA C 14 61.940 61.940 62.444 -0.504 17919 53094 1 130 . 1 1 14 14 THR CB C 14 69.650 69.650 69.820 -0.170 17919 53095 1 130 . 1 1 14 14 THR H H 14 8.710 8.710 8.364 0.346 17919 53096 1 130 . 1 1 15 15 LEU N N 15 124.800 124.800 128.781 -3.981 17919 53097 1 130 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.635 0.145 17919 53098 1 130 . 1 1 15 15 LEU C C 15 174.670 174.670 175.351 -0.681 17919 53099 1 130 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.870 -1.040 17919 53100 1 130 . 1 1 15 15 LEU CB C 15 47.070 47.070 44.630 2.440 17919 53101 1 130 . 1 1 15 15 LEU H H 15 8.710 8.710 8.613 0.097 17919 53102 1 130 . 1 1 16 16 GLU N N 16 122.160 122.160 124.471 -2.311 17919 53103 1 130 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.057 -0.140 17919 53104 1 130 . 1 1 16 16 GLU C C 16 175.860 175.860 176.293 -0.433 17919 53105 1 130 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.648 -0.828 17919 53106 1 130 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.651 -1.201 17919 53107 1 130 . 1 1 16 16 GLU H H 16 8.140 8.140 8.717 -0.577 17919 53108 1 130 . 1 1 17 17 VAL N N 17 117.210 117.210 121.778 -4.568 17919 53109 1 130 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.766 -0.051 17919 53110 1 130 . 1 1 17 17 VAL C C 17 174.160 174.160 174.714 -0.554 17919 53111 1 130 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.493 -1.063 17919 53112 1 130 . 1 1 17 17 VAL CB C 17 36.400 36.400 34.737 1.663 17919 53113 1 130 . 1 1 17 17 VAL H H 17 8.900 8.900 8.627 0.273 17919 53114 1 130 . 1 1 18 18 GLU N N 18 118.990 118.990 121.165 -2.175 17919 53115 1 130 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.818 0.261 17919 53116 1 130 . 1 1 18 18 GLU C C 18 176.160 176.160 175.654 0.506 17919 53117 1 130 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.044 -0.324 17919 53118 1 130 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.538 -0.228 17919 53119 1 130 . 1 1 18 18 GLU H H 18 8.640 8.640 9.201 -0.561 17919 53120 1 130 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.104 0.037 17919 53121 1 130 . 1 1 19 19 PRO C C 19 175.310 175.310 178.051 -2.741 17919 53122 1 130 . 1 1 19 19 PRO CA C 19 65.470 65.470 66.256 -0.786 17919 53123 1 130 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.920 0.030 17919 53124 1 130 . 1 1 20 20 SER N N 20 103.400 103.400 107.904 -4.504 17919 53125 1 130 . 1 1 20 20 SER HA H 20 4.370 4.370 4.358 0.012 17919 53126 1 130 . 1 1 20 20 SER C C 20 174.660 174.660 174.341 0.319 17919 53127 1 130 . 1 1 20 20 SER CA C 20 57.400 57.400 59.100 -1.700 17919 53128 1 130 . 1 1 20 20 SER CB C 20 63.370 63.370 62.712 0.658 17919 53129 1 130 . 1 1 20 20 SER H H 20 7.040 7.040 8.127 -1.087 17919 53130 1 130 . 1 1 21 21 ASP N N 21 123.480 123.480 124.222 -0.742 17919 53131 1 130 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.698 -0.003 17919 53132 1 130 . 1 1 21 21 ASP C C 21 176.360 176.360 176.018 0.342 17919 53133 1 130 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.147 0.553 17919 53134 1 130 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.735 -0.935 17919 53135 1 130 . 1 1 21 21 ASP H H 21 8.030 8.030 8.275 -0.245 17919 53136 1 130 . 1 1 22 22 THR N N 22 108.800 108.800 111.923 -3.123 17919 53137 1 130 . 1 1 22 22 THR HA H 22 4.920 4.920 4.496 0.424 17919 53138 1 130 . 1 1 22 22 THR C C 22 176.750 176.750 176.107 0.643 17919 53139 1 130 . 1 1 22 22 THR CA C 22 59.690 59.690 61.551 -1.861 17919 53140 1 130 . 1 1 22 22 THR CB C 22 71.200 71.200 70.397 0.803 17919 53141 1 130 . 1 1 22 22 THR H H 22 7.900 7.900 8.460 -0.560 17919 53142 1 130 . 1 1 23 23 ILE N N 23 121.190 121.190 122.035 -0.845 17919 53143 1 130 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.732 -0.075 17919 53144 1 130 . 1 1 23 23 ILE C C 23 179.040 179.040 177.872 1.168 17919 53145 1 130 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.378 -0.118 17919 53146 1 130 . 1 1 23 23 ILE CB C 23 34.350 34.350 35.972 -1.622 17919 53147 1 130 . 1 1 23 23 ILE H H 23 8.560 8.560 9.083 -0.523 17919 53148 1 130 . 1 1 24 24 GLU N N 24 120.830 120.830 119.225 1.605 17919 53149 1 130 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.900 0.017 17919 53150 1 130 . 1 1 24 24 GLU C C 24 178.640 178.640 178.530 0.110 17919 53151 1 130 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.718 0.502 17919 53152 1 130 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.473 -1.193 17919 53153 1 130 . 1 1 24 24 GLU H H 24 9.760 9.760 8.083 1.677 17919 53154 1 130 . 1 1 25 25 ASN N N 25 120.570 120.570 118.011 2.559 17919 53155 1 130 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.578 -0.053 17919 53156 1 130 . 1 1 25 25 ASN C C 25 178.380 178.380 177.828 0.552 17919 53157 1 130 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.405 0.655 17919 53158 1 130 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.180 0.270 17919 53159 1 130 . 1 1 25 25 ASN H H 25 7.920 7.920 7.622 0.298 17919 53160 1 130 . 1 1 26 26 VAL N N 26 121.710 121.710 121.338 0.372 17919 53161 1 130 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.456 -0.059 17919 53162 1 130 . 1 1 26 26 VAL C C 26 177.950 177.950 177.681 0.269 17919 53163 1 130 . 1 1 26 26 VAL CA C 26 67.660 67.660 67.201 0.459 17919 53164 1 130 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.647 -0.807 17919 53165 1 130 . 1 1 26 26 VAL H H 26 8.070 8.070 8.277 -0.207 17919 53166 1 130 . 1 1 27 27 LYS N N 27 118.860 118.860 118.937 -0.077 17919 53167 1 130 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.290 0.290 17919 53168 1 130 . 1 1 27 27 LYS C C 27 180.550 180.550 179.183 1.367 17919 53169 1 130 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.166 0.084 17919 53170 1 130 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.306 1.424 17919 53171 1 130 . 1 1 27 27 LYS H H 27 8.560 8.560 7.876 0.684 17919 53172 1 130 . 1 1 28 28 ALA N N 28 123.440 123.440 123.351 0.089 17919 53173 1 130 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.045 0.115 17919 53174 1 130 . 1 1 28 28 ALA C C 28 180.300 180.300 179.058 1.242 17919 53175 1 130 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.324 0.046 17919 53176 1 130 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.347 -0.637 17919 53177 1 130 . 1 1 28 28 ALA H H 28 8.060 8.060 8.480 -0.420 17919 53178 1 130 . 1 1 29 29 LYS N N 29 119.940 119.940 119.673 0.267 17919 53179 1 130 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.013 0.194 17919 53180 1 130 . 1 1 29 29 LYS C C 29 180.320 180.320 179.049 1.271 17919 53181 1 130 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.435 0.215 17919 53182 1 130 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.344 0.946 17919 53183 1 130 . 1 1 29 29 LYS H H 29 7.850 7.850 7.723 0.127 17919 53184 1 130 . 1 1 30 30 ILE N N 30 121.080 121.080 120.183 0.897 17919 53185 1 130 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.580 -0.073 17919 53186 1 130 . 1 1 30 30 ILE C C 30 178.310 178.310 177.578 0.732 17919 53187 1 130 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.304 0.846 17919 53188 1 130 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.646 -0.846 17919 53189 1 130 . 1 1 30 30 ILE H H 30 8.280 8.280 8.418 -0.138 17919 53190 1 130 . 1 1 31 31 GLN N N 31 123.490 123.490 119.346 4.144 17919 53191 1 130 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.145 -0.316 17919 53192 1 130 . 1 1 31 31 GLN C C 31 178.890 178.890 178.585 0.305 17919 53193 1 130 . 1 1 31 31 GLN CA C 31 60.000 60.000 58.708 1.292 17919 53194 1 130 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.590 -0.870 17919 53195 1 130 . 1 1 31 31 GLN H H 31 8.580 8.580 7.830 0.750 17919 53196 1 130 . 1 1 32 32 ASP N N 32 119.360 119.360 121.705 -2.345 17919 53197 1 130 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.395 -0.041 17919 53198 1 130 . 1 1 32 32 ASP C C 32 177.250 177.250 177.945 -0.695 17919 53199 1 130 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.982 0.208 17919 53200 1 130 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.637 -0.057 17919 53201 1 130 . 1 1 32 32 ASP H H 32 8.010 8.010 8.290 -0.280 17919 53202 1 130 . 1 1 33 33 LYS N N 33 115.130 115.130 117.130 -2.000 17919 53203 1 130 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.291 0.046 17919 53204 1 130 . 1 1 33 33 LYS C C 33 177.870 177.870 177.500 0.370 17919 53205 1 130 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.349 -0.299 17919 53206 1 130 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.328 0.842 17919 53207 1 130 . 1 1 33 33 LYS H H 33 7.430 7.430 7.516 -0.086 17919 53208 1 130 . 1 1 34 34 GLU N N 34 113.870 113.870 114.153 -0.283 17919 53209 1 130 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.496 0.129 17919 53210 1 130 . 1 1 34 34 GLU C C 34 177.840 177.840 177.002 0.838 17919 53211 1 130 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.084 -0.914 17919 53212 1 130 . 1 1 34 34 GLU CB C 34 32.660 32.660 32.656 0.004 17919 53213 1 130 . 1 1 34 34 GLU H H 34 8.740 8.740 7.934 0.806 17919 53214 1 130 . 1 1 35 35 GLY N N 35 108.650 108.650 109.431 -0.781 17919 53215 1 130 . 1 1 35 35 GLY C C 35 173.960 173.960 174.242 -0.282 17919 53216 1 130 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.879 0.201 17919 53217 1 130 . 1 1 35 35 GLY H H 35 8.530 8.530 8.363 0.167 17919 53218 1 130 . 1 1 36 36 ILE N N 36 119.880 119.880 121.942 -2.062 17919 53219 1 130 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.288 0.157 17919 53220 1 130 . 1 1 36 36 ILE C C 36 173.590 173.590 174.235 -0.645 17919 53221 1 130 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.153 -0.403 17919 53222 1 130 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.443 2.137 17919 53223 1 130 . 1 1 36 36 ILE H H 36 6.150 6.150 7.778 -1.628 17919 53224 1 130 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.963 -0.329 17919 53225 1 130 . 1 1 37 37 PRO C C 37 176.940 176.940 176.234 0.706 17919 53226 1 130 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.072 0.588 17919 53227 1 130 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.319 0.531 17919 53228 1 130 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.166 -0.049 17919 53229 1 130 . 1 1 38 38 PRO C C 38 178.320 178.320 178.232 0.088 17919 53230 1 130 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.390 0.870 17919 53231 1 130 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.741 1.149 17919 53232 1 130 . 1 1 39 39 ASP N N 39 113.380 113.380 118.188 -4.808 17919 53233 1 130 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.330 0.100 17919 53234 1 130 . 1 1 39 39 ASP C C 39 177.090 177.090 177.588 -0.498 17919 53235 1 130 . 1 1 39 39 ASP CA C 39 55.640 55.640 57.002 -1.362 17919 53236 1 130 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.410 -0.870 17919 53237 1 130 . 1 1 39 39 ASP H H 39 8.550 8.550 8.757 -0.207 17919 53238 1 130 . 1 1 40 40 GLN N N 40 116.780 116.780 116.919 -0.139 17919 53239 1 130 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.493 -0.029 17919 53240 1 130 . 1 1 40 40 GLN C C 40 175.380 175.380 175.919 -0.539 17919 53241 1 130 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.287 -0.647 17919 53242 1 130 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.360 0.780 17919 53243 1 130 . 1 1 40 40 GLN H H 40 7.820 7.820 7.998 -0.178 17919 53244 1 130 . 1 1 41 41 GLN N N 41 117.720 117.720 118.820 -1.100 17919 53245 1 130 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.849 -0.605 17919 53246 1 130 . 1 1 41 41 GLN C C 41 176.300 176.300 174.334 1.966 17919 53247 1 130 . 1 1 41 41 GLN CA C 41 56.470 56.470 54.758 1.712 17919 53248 1 130 . 1 1 41 41 GLN CB C 41 31.650 31.650 31.057 0.593 17919 53249 1 130 . 1 1 41 41 GLN H H 41 7.480 7.480 7.387 0.093 17919 53250 1 130 . 1 1 42 42 ARG N N 42 122.680 122.680 126.595 -3.915 17919 53251 1 130 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.600 -0.100 17919 53252 1 130 . 1 1 42 42 ARG C C 42 174.050 174.050 173.931 0.119 17919 53253 1 130 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.136 -0.086 17919 53254 1 130 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.092 -0.342 17919 53255 1 130 . 1 1 42 42 ARG H H 42 8.530 8.530 8.796 -0.266 17919 53256 1 130 . 1 1 43 43 LEU N N 43 124.040 124.040 128.891 -4.851 17919 53257 1 130 . 1 1 43 43 LEU C C 43 175.290 175.290 175.240 0.050 17919 53258 1 130 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.697 -0.717 17919 53259 1 130 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.762 2.028 17919 53260 1 130 . 1 1 43 43 LEU H H 43 8.820 8.820 8.811 0.009 17919 53261 1 130 . 1 1 44 44 ILE N N 44 121.920 121.920 123.199 -1.279 17919 53262 1 130 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.853 0.139 17919 53263 1 130 . 1 1 44 44 ILE C C 44 176.060 176.060 174.661 1.399 17919 53264 1 130 . 1 1 44 44 ILE CA C 44 58.980 58.980 58.741 0.239 17919 53265 1 130 . 1 1 44 44 ILE CB C 44 41.420 41.420 40.534 0.886 17919 53266 1 130 . 1 1 44 44 ILE H H 44 9.030 9.030 8.424 0.606 17919 53267 1 130 . 1 1 45 45 PHE N N 45 125.390 125.390 127.915 -2.525 17919 53268 1 130 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.914 0.131 17919 53269 1 130 . 1 1 45 45 PHE C C 45 174.470 174.470 174.237 0.233 17919 53270 1 130 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.378 0.642 17919 53271 1 130 . 1 1 45 45 PHE CB C 45 43.760 43.760 41.643 2.117 17919 53272 1 130 . 1 1 45 45 PHE H H 45 8.830 8.830 8.764 0.066 17919 53273 1 130 . 1 1 46 46 ALA N N 46 132.200 132.200 130.482 1.718 17919 53274 1 130 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.784 -0.094 17919 53275 1 130 . 1 1 46 46 ALA C C 46 177.290 177.290 177.348 -0.058 17919 53276 1 130 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.657 -0.117 17919 53277 1 130 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.696 -0.126 17919 53278 1 130 . 1 1 46 46 ALA H H 46 8.810 8.810 8.655 0.155 17919 53279 1 130 . 1 1 47 47 GLY N N 47 102.340 102.340 104.524 -2.184 17919 53280 1 130 . 1 1 47 47 GLY C C 47 173.810 173.810 174.122 -0.312 17919 53281 1 130 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.318 0.032 17919 53282 1 130 . 1 1 47 47 GLY H H 47 8.130 8.130 8.458 -0.328 17919 53283 1 130 . 1 1 48 48 LYS N N 48 121.570 121.570 119.735 1.835 17919 53284 1 130 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.653 -0.031 17919 53285 1 130 . 1 1 48 48 LYS C C 48 174.700 174.700 174.977 -0.277 17919 53286 1 130 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.666 -0.116 17919 53287 1 130 . 1 1 48 48 LYS CB C 48 34.530 34.530 35.329 -0.799 17919 53288 1 130 . 1 1 48 48 LYS H H 48 7.980 7.980 7.977 0.003 17919 53289 1 130 . 1 1 49 49 GLN N N 49 122.410 122.410 122.791 -0.381 17919 53290 1 130 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.745 -0.185 17919 53291 1 130 . 1 1 49 49 GLN C C 49 175.670 175.670 176.017 -0.347 17919 53292 1 130 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.678 0.062 17919 53293 1 130 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.608 -0.608 17919 53294 1 130 . 1 1 49 49 GLN H H 49 8.600 8.600 8.543 0.057 17919 53295 1 130 . 1 1 50 50 LEU N N 50 125.520 125.520 128.081 -2.561 17919 53296 1 130 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.180 -0.090 17919 53297 1 130 . 1 1 50 50 LEU C C 50 176.660 176.660 176.862 -0.202 17919 53298 1 130 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.491 -0.251 17919 53299 1 130 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.040 -0.470 17919 53300 1 130 . 1 1 50 50 LEU H H 50 8.530 8.530 8.595 -0.065 17919 53301 1 130 . 1 1 51 51 GLU N N 51 122.940 122.940 125.110 -2.170 17919 53302 1 130 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.484 0.004 17919 53303 1 130 . 1 1 51 51 GLU C C 51 175.870 175.870 176.648 -0.778 17919 53304 1 130 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.630 0.330 17919 53305 1 130 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.092 -0.521 17919 53306 1 130 . 1 1 51 51 GLU H H 51 8.400 8.400 9.117 -0.717 17919 53307 1 130 . 1 1 52 52 ASP N N 52 120.030 120.030 125.575 -5.545 17919 53308 1 130 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.550 -0.191 17919 53309 1 130 . 1 1 52 52 ASP C C 52 177.330 177.330 177.832 -0.502 17919 53310 1 130 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.003 -0.043 17919 53311 1 130 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.703 0.147 17919 53312 1 130 . 1 1 52 52 ASP H H 52 8.160 8.160 8.774 -0.614 17919 53313 1 130 . 1 1 53 53 GLY N N 53 106.660 106.660 104.916 1.744 17919 53314 1 130 . 1 1 53 53 GLY C C 53 174.870 174.870 174.277 0.593 17919 53315 1 130 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.842 0.328 17919 53316 1 130 . 1 1 53 53 GLY H H 53 9.390 9.390 8.424 0.966 17919 53317 1 130 . 1 1 54 54 ARG N N 54 119.050 119.050 119.352 -0.302 17919 53318 1 130 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.513 0.182 17919 53319 1 130 . 1 1 54 54 ARG C C 54 175.350 175.350 175.549 -0.199 17919 53320 1 130 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.655 -0.265 17919 53321 1 130 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.609 0.041 17919 53322 1 130 . 1 1 54 54 ARG H H 54 7.460 7.460 7.268 0.192 17919 53323 1 130 . 1 1 55 55 THR N N 55 108.400 108.400 112.712 -4.312 17919 53324 1 130 . 1 1 55 55 THR HA H 55 5.240 5.240 4.758 0.482 17919 53325 1 130 . 1 1 55 55 THR C C 55 176.560 176.560 176.343 0.217 17919 53326 1 130 . 1 1 55 55 THR CA C 55 59.690 59.690 61.215 -1.526 17919 53327 1 130 . 1 1 55 55 THR CB C 55 72.260 72.260 70.848 1.412 17919 53328 1 130 . 1 1 55 55 THR H H 55 8.730 8.730 8.824 -0.094 17919 53329 1 130 . 1 1 56 56 LEU N N 56 117.920 117.920 124.770 -6.850 17919 53330 1 130 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.900 0.160 17919 53331 1 130 . 1 1 56 56 LEU C C 56 180.810 180.810 178.552 2.258 17919 53332 1 130 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.874 -0.164 17919 53333 1 130 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.194 -0.824 17919 53334 1 130 . 1 1 56 56 LEU H H 56 8.140 8.140 8.522 -0.382 17919 53335 1 130 . 1 1 57 57 SER N N 57 113.330 113.330 114.217 -0.887 17919 53336 1 130 . 1 1 57 57 SER HA H 57 4.370 4.370 4.336 0.034 17919 53337 1 130 . 1 1 57 57 SER C C 57 178.310 178.310 176.682 1.628 17919 53338 1 130 . 1 1 57 57 SER CA C 57 61.080 61.080 61.462 -0.382 17919 53339 1 130 . 1 1 57 57 SER CB C 57 62.530 62.530 62.913 -0.383 17919 53340 1 130 . 1 1 57 57 SER H H 57 8.470 8.470 7.873 0.597 17919 53341 1 130 . 1 1 58 58 ASP N N 58 124.190 124.190 122.676 1.514 17919 53342 1 130 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.346 -0.050 17919 53343 1 130 . 1 1 58 58 ASP C C 58 177.400 177.400 176.536 0.864 17919 53344 1 130 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.632 0.548 17919 53345 1 130 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.277 -0.177 17919 53346 1 130 . 1 1 58 58 ASP H H 58 7.930 7.930 7.894 0.036 17919 53347 1 130 . 1 1 59 59 TYR N N 59 115.510 115.510 114.518 0.992 17919 53348 1 130 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.706 -0.036 17919 53349 1 130 . 1 1 59 59 TYR C C 59 174.700 174.700 175.001 -0.301 17919 53350 1 130 . 1 1 59 59 TYR CA C 59 58.250 58.250 56.465 1.785 17919 53351 1 130 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.401 1.669 17919 53352 1 130 . 1 1 59 59 TYR H H 59 7.250 7.250 7.323 -0.073 17919 53353 1 130 . 1 1 60 60 ASN N N 60 115.900 115.900 118.210 -2.310 17919 53354 1 130 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.359 -0.004 17919 53355 1 130 . 1 1 60 60 ASN C C 60 174.340 174.340 174.331 0.009 17919 53356 1 130 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.147 -0.027 17919 53357 1 130 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.552 -0.142 17919 53358 1 130 . 1 1 60 60 ASN H H 60 8.150 8.150 8.058 0.092 17919 53359 1 130 . 1 1 61 61 ILE N N 61 118.600 118.600 120.208 -1.608 17919 53360 1 130 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.926 -0.533 17919 53361 1 130 . 1 1 61 61 ILE C C 61 174.610 174.610 174.621 -0.011 17919 53362 1 130 . 1 1 61 61 ILE CA C 61 62.420 62.420 60.977 1.443 17919 53363 1 130 . 1 1 61 61 ILE CB C 61 36.740 36.740 36.795 -0.055 17919 53364 1 130 . 1 1 61 61 ILE H H 61 7.250 7.250 8.085 -0.835 17919 53365 1 130 . 1 1 62 62 GLN N N 62 124.740 124.740 125.533 -0.793 17919 53366 1 130 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.573 -0.067 17919 53367 1 130 . 1 1 62 62 GLN C C 62 175.970 175.970 175.825 0.145 17919 53368 1 130 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.559 0.101 17919 53369 1 130 . 1 1 62 62 GLN CB C 62 31.650 31.650 30.894 0.756 17919 53370 1 130 . 1 1 62 62 GLN H H 62 7.610 7.610 7.822 -0.212 17919 53371 1 130 . 1 1 63 63 LYS N N 63 120.300 120.300 124.087 -3.787 17919 53372 1 130 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.915 0.086 17919 53373 1 130 . 1 1 63 63 LYS C C 63 175.810 175.810 176.405 -0.595 17919 53374 1 130 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.111 -0.321 17919 53375 1 130 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.431 1.219 17919 53376 1 130 . 1 1 63 63 LYS H H 63 8.490 8.490 8.697 -0.207 17919 53377 1 130 . 1 1 64 64 GLU N N 64 113.950 113.950 119.797 -5.847 17919 53378 1 130 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.719 -0.254 17919 53379 1 130 . 1 1 64 64 GLU C C 64 175.250 175.250 175.231 0.019 17919 53380 1 130 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.414 0.476 17919 53381 1 130 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.264 -2.364 17919 53382 1 130 . 1 1 64 64 GLU H H 64 9.280 9.280 8.879 0.401 17919 53383 1 130 . 1 1 65 65 SER N N 65 114.730 114.730 116.670 -1.940 17919 53384 1 130 . 1 1 65 65 SER HA H 65 4.640 4.640 4.474 0.166 17919 53385 1 130 . 1 1 65 65 SER C C 65 172.160 172.160 174.191 -2.031 17919 53386 1 130 . 1 1 65 65 SER CA C 65 60.890 60.890 59.737 1.153 17919 53387 1 130 . 1 1 65 65 SER CB C 65 64.910 64.910 63.429 1.481 17919 53388 1 130 . 1 1 65 65 SER H H 65 7.670 7.670 7.801 -0.131 17919 53389 1 130 . 1 1 66 66 THR N N 66 117.110 117.110 122.599 -5.489 17919 53390 1 130 . 1 1 66 66 THR HA H 66 5.270 5.270 4.963 0.307 17919 53391 1 130 . 1 1 66 66 THR C C 66 173.950 173.950 174.208 -0.258 17919 53392 1 130 . 1 1 66 66 THR CA C 66 62.340 62.340 62.683 -0.343 17919 53393 1 130 . 1 1 66 66 THR CB C 66 70.080 70.080 69.666 0.414 17919 53394 1 130 . 1 1 66 66 THR H H 66 8.730 8.730 8.646 0.084 17919 53395 1 130 . 1 1 67 67 LEU N N 67 127.110 127.110 126.404 0.706 17919 53396 1 130 . 1 1 67 67 LEU HA H 67 5.060 5.060 5.144 -0.084 17919 53397 1 130 . 1 1 67 67 LEU C C 67 175.770 175.770 175.208 0.562 17919 53398 1 130 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.180 0.720 17919 53399 1 130 . 1 1 67 67 LEU CB C 67 44.260 44.260 45.340 -1.080 17919 53400 1 130 . 1 1 67 67 LEU H H 67 9.410 9.410 8.880 0.530 17919 53401 1 130 . 1 1 68 68 HIS N N 68 118.380 118.380 120.963 -2.583 17919 53402 1 130 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.303 -0.063 17919 53403 1 130 . 1 1 68 68 HIS C C 68 173.150 173.150 173.986 -0.836 17919 53404 1 130 . 1 1 68 68 HIS CA C 68 55.000 55.000 53.575 1.425 17919 53405 1 130 . 1 1 68 68 HIS CB C 68 30.530 30.530 33.137 -2.607 17919 53406 1 130 . 1 1 68 68 HIS H H 68 9.230 9.230 8.584 0.646 17919 53407 1 130 . 1 1 69 69 LEU N N 69 124.460 124.460 129.801 -5.341 17919 53408 1 130 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.841 0.349 17919 53409 1 130 . 1 1 69 69 LEU C C 69 175.270 175.270 174.360 0.910 17919 53410 1 130 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.008 -0.118 17919 53411 1 130 . 1 1 69 69 LEU CB C 69 44.380 44.380 43.587 0.792 17919 53412 1 130 . 1 1 69 69 LEU H H 69 8.340 8.340 8.239 0.101 17919 53413 1 130 . 1 1 70 70 VAL N N 70 126.940 126.940 123.242 3.698 17919 53414 1 130 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.463 -0.113 17919 53415 1 130 . 1 1 70 70 VAL C C 70 174.000 174.000 174.086 -0.086 17919 53416 1 130 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.732 1.068 17919 53417 1 130 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.827 -0.917 17919 53418 1 130 . 1 1 70 70 VAL H H 70 9.200 9.200 8.695 0.505 17919 53419 1 130 . 1 1 71 71 LEU N N 71 123.130 123.130 123.492 -0.362 17919 53420 1 130 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.716 0.344 17919 53421 1 130 . 1 1 71 71 LEU C C 71 177.830 177.830 176.049 1.781 17919 53422 1 130 . 1 1 71 71 LEU CA C 71 53.940 53.940 54.577 -0.637 17919 53423 1 130 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.577 0.273 17919 53424 1 130 . 1 1 71 71 LEU H H 71 8.120 8.120 8.412 -0.292 17919 53425 1 130 . 1 1 72 72 ARG N N 72 123.490 123.490 123.535 -0.045 17919 53426 1 130 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.668 -0.367 17919 53427 1 130 . 1 1 72 72 ARG C C 72 175.350 175.350 174.850 0.500 17919 53428 1 130 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.261 0.349 17919 53429 1 130 . 1 1 72 72 ARG CB C 72 31.350 31.350 33.602 -2.252 17919 53430 1 130 . 1 1 72 72 ARG H H 72 8.580 8.580 8.736 -0.156 17919 53431 1 131 . 1 1 2 2 GLN N N 2 123.220 123.220 125.470 -2.250 17919 53432 1 131 . 1 1 2 2 GLN HA H 2 5.249 5.249 4.788 0.461 17919 53433 1 131 . 1 1 2 2 GLN C C 2 175.920 175.920 175.211 0.709 17919 53434 1 131 . 1 1 2 2 GLN CA C 2 55.080 55.080 55.551 -0.471 17919 53435 1 131 . 1 1 2 2 GLN CB C 2 30.760 30.760 29.634 1.127 17919 53436 1 131 . 1 1 2 2 GLN H H 2 8.900 8.900 8.569 0.331 17919 53437 1 131 . 1 1 3 3 ILE N N 3 115.340 115.340 116.540 -1.200 17919 53438 1 131 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.787 -0.574 17919 53439 1 131 . 1 1 3 3 ILE C C 3 172.450 172.450 173.760 -1.310 17919 53440 1 131 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.025 0.545 17919 53441 1 131 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.200 1.010 17919 53442 1 131 . 1 1 3 3 ILE H H 3 8.320 8.320 8.007 0.313 17919 53443 1 131 . 1 1 4 4 PHE N N 4 118.110 118.110 122.856 -4.746 17919 53444 1 131 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.480 0.150 17919 53445 1 131 . 1 1 4 4 PHE C C 4 175.320 175.320 174.877 0.443 17919 53446 1 131 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.312 -0.102 17919 53447 1 131 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.202 -0.722 17919 53448 1 131 . 1 1 4 4 PHE H H 4 8.610 8.610 8.744 -0.134 17919 53449 1 131 . 1 1 5 5 VAL N N 5 121.000 121.000 122.710 -1.710 17919 53450 1 131 . 1 1 5 5 VAL HA H 5 4.725 4.725 5.159 -0.434 17919 53451 1 131 . 1 1 5 5 VAL C C 5 174.870 174.870 174.645 0.225 17919 53452 1 131 . 1 1 5 5 VAL CA C 5 60.620 60.620 60.609 0.011 17919 53453 1 131 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.923 0.307 17919 53454 1 131 . 1 1 5 5 VAL H H 5 9.300 9.300 8.967 0.333 17919 53455 1 131 . 1 1 6 6 LYS N N 6 127.520 127.520 129.729 -2.209 17919 53456 1 131 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.172 0.195 17919 53457 1 131 . 1 1 6 6 LYS C C 6 177.140 177.140 176.087 1.053 17919 53458 1 131 . 1 1 6 6 LYS CA C 6 54.520 54.520 53.679 0.841 17919 53459 1 131 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.266 0.784 17919 53460 1 131 . 1 1 6 6 LYS H H 6 8.820 8.820 8.570 0.250 17919 53461 1 131 . 1 1 7 7 THR N N 7 115.400 115.400 117.536 -2.136 17919 53462 1 131 . 1 1 7 7 THR HA H 7 4.970 4.970 4.411 0.559 17919 53463 1 131 . 1 1 7 7 THR C C 7 176.910 176.910 176.131 0.779 17919 53464 1 131 . 1 1 7 7 THR CA C 7 60.470 60.470 60.823 -0.353 17919 53465 1 131 . 1 1 7 7 THR CB C 7 70.630 70.630 70.051 0.579 17919 53466 1 131 . 1 1 7 7 THR H H 7 8.730 8.730 8.729 0.001 17919 53467 1 131 . 1 1 8 8 LEU N N 8 121.330 121.330 120.435 0.895 17919 53468 1 131 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.222 0.088 17919 53469 1 131 . 1 1 8 8 LEU C C 8 178.800 178.800 178.221 0.579 17919 53470 1 131 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.427 0.153 17919 53471 1 131 . 1 1 8 8 LEU CB C 8 41.970 41.970 40.771 1.199 17919 53472 1 131 . 1 1 8 8 LEU H H 8 9.100 9.100 8.967 0.133 17919 53473 1 131 . 1 1 9 9 THR N N 9 105.590 105.590 106.086 -0.496 17919 53474 1 131 . 1 1 9 9 THR HA H 9 4.428 4.428 4.323 0.105 17919 53475 1 131 . 1 1 9 9 THR C C 9 175.520 175.520 175.724 -0.204 17919 53476 1 131 . 1 1 9 9 THR CA C 9 61.400 61.400 61.840 -0.440 17919 53477 1 131 . 1 1 9 9 THR CB C 9 69.140 69.140 69.194 -0.054 17919 53478 1 131 . 1 1 9 9 THR H H 9 7.630 7.630 7.559 0.071 17919 53479 1 131 . 1 1 10 10 GLY N N 10 108.890 108.890 111.201 -2.311 17919 53480 1 131 . 1 1 10 10 GLY C C 10 174.070 174.070 174.612 -0.542 17919 53481 1 131 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.162 0.298 17919 53482 1 131 . 1 1 10 10 GLY H H 10 7.810 7.810 7.669 0.141 17919 53483 1 131 . 1 1 11 11 LYS N N 11 121.600 121.600 122.847 -1.247 17919 53484 1 131 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.104 0.257 17919 53485 1 131 . 1 1 11 11 LYS C C 11 175.940 175.940 175.947 -0.007 17919 53486 1 131 . 1 1 11 11 LYS CA C 11 56.280 56.280 57.179 -0.899 17919 53487 1 131 . 1 1 11 11 LYS CB C 11 33.200 33.200 32.852 0.348 17919 53488 1 131 . 1 1 11 11 LYS H H 11 7.280 7.280 7.671 -0.391 17919 53489 1 131 . 1 1 12 12 THR N N 12 120.440 120.440 117.107 3.333 17919 53490 1 131 . 1 1 12 12 THR HA H 12 5.046 5.046 5.070 -0.024 17919 53491 1 131 . 1 1 12 12 THR C C 12 174.320 174.320 174.716 -0.396 17919 53492 1 131 . 1 1 12 12 THR CA C 12 62.390 62.390 61.371 1.019 17919 53493 1 131 . 1 1 12 12 THR CB C 12 69.910 69.910 70.192 -0.282 17919 53494 1 131 . 1 1 12 12 THR H H 12 8.650 8.650 8.381 0.269 17919 53495 1 131 . 1 1 13 13 ILE N N 13 127.110 127.110 127.574 -0.464 17919 53496 1 131 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.197 0.347 17919 53497 1 131 . 1 1 13 13 ILE C C 13 175.220 175.220 175.359 -0.139 17919 53498 1 131 . 1 1 13 13 ILE CA C 13 59.980 59.980 61.832 -1.852 17919 53499 1 131 . 1 1 13 13 ILE CB C 13 40.950 40.950 39.016 1.934 17919 53500 1 131 . 1 1 13 13 ILE H H 13 9.450 9.450 9.027 0.423 17919 53501 1 131 . 1 1 14 14 THR N N 14 121.520 121.520 123.359 -1.839 17919 53502 1 131 . 1 1 14 14 THR HA H 14 4.964 4.964 4.637 0.327 17919 53503 1 131 . 1 1 14 14 THR C C 14 173.790 173.790 173.439 0.351 17919 53504 1 131 . 1 1 14 14 THR CA C 14 61.940 61.940 62.588 -0.648 17919 53505 1 131 . 1 1 14 14 THR CB C 14 69.650 69.650 69.231 0.419 17919 53506 1 131 . 1 1 14 14 THR H H 14 8.710 8.710 8.650 0.060 17919 53507 1 131 . 1 1 15 15 LEU N N 15 124.800 124.800 127.502 -2.702 17919 53508 1 131 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.664 0.116 17919 53509 1 131 . 1 1 15 15 LEU C C 15 174.670 174.670 175.470 -0.800 17919 53510 1 131 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.520 -0.690 17919 53511 1 131 . 1 1 15 15 LEU CB C 15 47.070 47.070 43.669 3.401 17919 53512 1 131 . 1 1 15 15 LEU H H 15 8.710 8.710 8.179 0.531 17919 53513 1 131 . 1 1 16 16 GLU N N 16 122.160 122.160 123.677 -1.517 17919 53514 1 131 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.449 0.468 17919 53515 1 131 . 1 1 16 16 GLU C C 16 175.860 175.860 176.040 -0.180 17919 53516 1 131 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.290 -0.470 17919 53517 1 131 . 1 1 16 16 GLU CB C 16 29.450 29.450 29.803 -0.353 17919 53518 1 131 . 1 1 16 16 GLU H H 16 8.140 8.140 8.549 -0.409 17919 53519 1 131 . 1 1 17 17 VAL N N 17 117.210 117.210 120.844 -3.634 17919 53520 1 131 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.735 -0.021 17919 53521 1 131 . 1 1 17 17 VAL C C 17 174.160 174.160 174.055 0.105 17919 53522 1 131 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.536 -1.106 17919 53523 1 131 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.111 1.289 17919 53524 1 131 . 1 1 17 17 VAL H H 17 8.900 8.900 8.572 0.328 17919 53525 1 131 . 1 1 18 18 GLU N N 18 118.990 118.990 119.285 -0.295 17919 53526 1 131 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.842 0.237 17919 53527 1 131 . 1 1 18 18 GLU C C 18 176.160 176.160 174.964 1.196 17919 53528 1 131 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.565 0.155 17919 53529 1 131 . 1 1 18 18 GLU CB C 18 30.310 30.310 32.744 -2.434 17919 53530 1 131 . 1 1 18 18 GLU H H 18 8.640 8.640 8.225 0.415 17919 53531 1 131 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.129 0.012 17919 53532 1 131 . 1 1 19 19 PRO C C 19 175.310 175.310 177.906 -2.596 17919 53533 1 131 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.890 -0.420 17919 53534 1 131 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.047 -0.097 17919 53535 1 131 . 1 1 20 20 SER N N 20 103.400 103.400 110.152 -6.752 17919 53536 1 131 . 1 1 20 20 SER HA H 20 4.370 4.370 4.147 0.223 17919 53537 1 131 . 1 1 20 20 SER C C 20 174.660 174.660 174.518 0.142 17919 53538 1 131 . 1 1 20 20 SER CA C 20 57.400 57.400 60.077 -2.677 17919 53539 1 131 . 1 1 20 20 SER CB C 20 63.370 63.370 62.956 0.414 17919 53540 1 131 . 1 1 20 20 SER H H 20 7.040 7.040 8.229 -1.189 17919 53541 1 131 . 1 1 21 21 ASP N N 21 123.480 123.480 122.244 1.236 17919 53542 1 131 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.677 0.018 17919 53543 1 131 . 1 1 21 21 ASP C C 21 176.360 176.360 176.188 0.172 17919 53544 1 131 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.141 0.559 17919 53545 1 131 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.455 -0.655 17919 53546 1 131 . 1 1 21 21 ASP H H 21 8.030 8.030 7.685 0.345 17919 53547 1 131 . 1 1 22 22 THR N N 22 108.800 108.800 114.700 -5.900 17919 53548 1 131 . 1 1 22 22 THR HA H 22 4.920 4.920 4.257 0.663 17919 53549 1 131 . 1 1 22 22 THR C C 22 176.750 176.750 175.600 1.150 17919 53550 1 131 . 1 1 22 22 THR CA C 22 59.690 59.690 63.093 -3.403 17919 53551 1 131 . 1 1 22 22 THR CB C 22 71.200 71.200 70.087 1.113 17919 53552 1 131 . 1 1 22 22 THR H H 22 7.900 7.900 8.364 -0.464 17919 53553 1 131 . 1 1 23 23 ILE N N 23 121.190 121.190 124.630 -3.440 17919 53554 1 131 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.880 -0.223 17919 53555 1 131 . 1 1 23 23 ILE C C 23 179.040 179.040 177.535 1.505 17919 53556 1 131 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.461 -0.201 17919 53557 1 131 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.797 -2.447 17919 53558 1 131 . 1 1 23 23 ILE H H 23 8.560 8.560 8.561 -0.001 17919 53559 1 131 . 1 1 24 24 GLU N N 24 120.830 120.830 120.800 0.030 17919 53560 1 131 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.873 0.044 17919 53561 1 131 . 1 1 24 24 GLU C C 24 178.640 178.640 178.484 0.156 17919 53562 1 131 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.920 0.300 17919 53563 1 131 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.530 -1.250 17919 53564 1 131 . 1 1 24 24 GLU H H 24 9.760 9.760 8.461 1.299 17919 53565 1 131 . 1 1 25 25 ASN N N 25 120.570 120.570 117.255 3.315 17919 53566 1 131 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.598 -0.072 17919 53567 1 131 . 1 1 25 25 ASN C C 25 178.380 178.380 177.578 0.802 17919 53568 1 131 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.440 0.620 17919 53569 1 131 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.791 -0.341 17919 53570 1 131 . 1 1 25 25 ASN H H 25 7.920 7.920 7.524 0.396 17919 53571 1 131 . 1 1 26 26 VAL N N 26 121.710 121.710 120.788 0.922 17919 53572 1 131 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.750 -0.353 17919 53573 1 131 . 1 1 26 26 VAL C C 26 177.950 177.950 176.806 1.144 17919 53574 1 131 . 1 1 26 26 VAL CA C 26 67.660 67.660 65.019 2.641 17919 53575 1 131 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.687 -0.847 17919 53576 1 131 . 1 1 26 26 VAL H H 26 8.070 8.070 8.065 0.005 17919 53577 1 131 . 1 1 27 27 LYS N N 27 118.860 118.860 120.554 -1.694 17919 53578 1 131 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.325 0.255 17919 53579 1 131 . 1 1 27 27 LYS C C 27 180.550 180.550 178.998 1.552 17919 53580 1 131 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.456 -0.206 17919 53581 1 131 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.282 1.448 17919 53582 1 131 . 1 1 27 27 LYS H H 27 8.560 8.560 8.179 0.381 17919 53583 1 131 . 1 1 28 28 ALA N N 28 123.440 123.440 123.094 0.346 17919 53584 1 131 . 1 1 28 28 ALA HA H 28 4.160 4.160 3.940 0.220 17919 53585 1 131 . 1 1 28 28 ALA C C 28 180.300 180.300 179.136 1.164 17919 53586 1 131 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.368 0.002 17919 53587 1 131 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.139 -0.429 17919 53588 1 131 . 1 1 28 28 ALA H H 28 8.060 8.060 7.754 0.306 17919 53589 1 131 . 1 1 29 29 LYS N N 29 119.940 119.940 119.481 0.459 17919 53590 1 131 . 1 1 29 29 LYS HA H 29 4.207 4.207 3.963 0.244 17919 53591 1 131 . 1 1 29 29 LYS C C 29 180.320 180.320 179.054 1.266 17919 53592 1 131 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.582 0.068 17919 53593 1 131 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.307 0.983 17919 53594 1 131 . 1 1 29 29 LYS H H 29 7.850 7.850 7.655 0.195 17919 53595 1 131 . 1 1 30 30 ILE N N 30 121.080 121.080 119.379 1.701 17919 53596 1 131 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.601 -0.094 17919 53597 1 131 . 1 1 30 30 ILE C C 30 178.310 178.310 177.841 0.469 17919 53598 1 131 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.203 0.948 17919 53599 1 131 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.120 -0.320 17919 53600 1 131 . 1 1 30 30 ILE H H 30 8.280 8.280 8.170 0.110 17919 53601 1 131 . 1 1 31 31 GLN N N 31 123.490 123.490 119.871 3.619 17919 53602 1 131 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.039 -0.210 17919 53603 1 131 . 1 1 31 31 GLN C C 31 178.890 178.890 178.297 0.593 17919 53604 1 131 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.287 0.713 17919 53605 1 131 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.384 -0.664 17919 53606 1 131 . 1 1 31 31 GLN H H 31 8.580 8.580 7.825 0.755 17919 53607 1 131 . 1 1 32 32 ASP N N 32 119.360 119.360 119.291 0.069 17919 53608 1 131 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.452 -0.098 17919 53609 1 131 . 1 1 32 32 ASP C C 32 177.250 177.250 177.986 -0.736 17919 53610 1 131 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.660 0.530 17919 53611 1 131 . 1 1 32 32 ASP CB C 32 40.580 40.580 41.028 -0.448 17919 53612 1 131 . 1 1 32 32 ASP H H 32 8.010 8.010 8.310 -0.300 17919 53613 1 131 . 1 1 33 33 LYS N N 33 115.130 115.130 118.892 -3.762 17919 53614 1 131 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.240 0.097 17919 53615 1 131 . 1 1 33 33 LYS C C 33 177.870 177.870 178.644 -0.774 17919 53616 1 131 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.384 -0.334 17919 53617 1 131 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.541 0.629 17919 53618 1 131 . 1 1 33 33 LYS H H 33 7.430 7.430 7.686 -0.256 17919 53619 1 131 . 1 1 34 34 GLU N N 34 113.870 113.870 116.525 -2.655 17919 53620 1 131 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.349 0.276 17919 53621 1 131 . 1 1 34 34 GLU C C 34 177.840 177.840 177.638 0.202 17919 53622 1 131 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.364 -1.194 17919 53623 1 131 . 1 1 34 34 GLU CB C 34 32.660 32.660 30.341 2.319 17919 53624 1 131 . 1 1 34 34 GLU H H 34 8.740 8.740 8.123 0.617 17919 53625 1 131 . 1 1 35 35 GLY N N 35 108.650 108.650 108.266 0.384 17919 53626 1 131 . 1 1 35 35 GLY C C 35 173.960 173.960 174.440 -0.480 17919 53627 1 131 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.601 0.479 17919 53628 1 131 . 1 1 35 35 GLY H H 35 8.530 8.530 7.864 0.666 17919 53629 1 131 . 1 1 36 36 ILE N N 36 119.880 119.880 122.043 -2.163 17919 53630 1 131 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.269 0.176 17919 53631 1 131 . 1 1 36 36 ILE C C 36 173.590 173.590 174.037 -0.447 17919 53632 1 131 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.355 -0.605 17919 53633 1 131 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.109 2.471 17919 53634 1 131 . 1 1 36 36 ILE H H 36 6.150 6.150 7.508 -1.358 17919 53635 1 131 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.756 -0.122 17919 53636 1 131 . 1 1 37 37 PRO C C 37 176.940 176.940 176.449 0.491 17919 53637 1 131 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.314 0.346 17919 53638 1 131 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.567 0.283 17919 53639 1 131 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.205 -0.088 17919 53640 1 131 . 1 1 38 38 PRO C C 38 178.320 178.320 177.751 0.569 17919 53641 1 131 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.825 0.435 17919 53642 1 131 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.801 1.089 17919 53643 1 131 . 1 1 39 39 ASP N N 39 113.380 113.380 114.828 -1.448 17919 53644 1 131 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.532 -0.102 17919 53645 1 131 . 1 1 39 39 ASP C C 39 177.090 177.090 176.327 0.763 17919 53646 1 131 . 1 1 39 39 ASP CA C 39 55.640 55.640 54.376 1.264 17919 53647 1 131 . 1 1 39 39 ASP CB C 39 39.540 39.540 39.778 -0.238 17919 53648 1 131 . 1 1 39 39 ASP H H 39 8.550 8.550 8.641 -0.091 17919 53649 1 131 . 1 1 40 40 GLN N N 40 116.780 116.780 116.027 0.753 17919 53650 1 131 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.546 -0.082 17919 53651 1 131 . 1 1 40 40 GLN C C 40 175.380 175.380 175.417 -0.037 17919 53652 1 131 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.408 0.232 17919 53653 1 131 . 1 1 40 40 GLN CB C 40 30.140 30.140 30.032 0.108 17919 53654 1 131 . 1 1 40 40 GLN H H 40 7.820 7.820 7.647 0.173 17919 53655 1 131 . 1 1 41 41 GLN N N 41 117.720 117.720 119.448 -1.728 17919 53656 1 131 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.580 -0.336 17919 53657 1 131 . 1 1 41 41 GLN C C 41 176.300 176.300 174.800 1.500 17919 53658 1 131 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.354 1.116 17919 53659 1 131 . 1 1 41 41 GLN CB C 41 31.650 31.650 30.672 0.978 17919 53660 1 131 . 1 1 41 41 GLN H H 41 7.480 7.480 7.495 -0.015 17919 53661 1 131 . 1 1 42 42 ARG N N 42 122.680 122.680 123.211 -0.531 17919 53662 1 131 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.607 -0.107 17919 53663 1 131 . 1 1 42 42 ARG C C 42 174.050 174.050 174.343 -0.293 17919 53664 1 131 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.011 0.039 17919 53665 1 131 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.620 -0.870 17919 53666 1 131 . 1 1 42 42 ARG H H 42 8.530 8.530 8.132 0.398 17919 53667 1 131 . 1 1 43 43 LEU N N 43 124.040 124.040 125.067 -1.027 17919 53668 1 131 . 1 1 43 43 LEU C C 43 175.290 175.290 175.901 -0.611 17919 53669 1 131 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.892 -0.911 17919 53670 1 131 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.132 1.659 17919 53671 1 131 . 1 1 43 43 LEU H H 43 8.820 8.820 8.663 0.157 17919 53672 1 131 . 1 1 44 44 ILE N N 44 121.920 121.920 122.387 -0.467 17919 53673 1 131 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.877 0.115 17919 53674 1 131 . 1 1 44 44 ILE C C 44 176.060 176.060 174.418 1.642 17919 53675 1 131 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.287 -1.307 17919 53676 1 131 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.846 -0.426 17919 53677 1 131 . 1 1 44 44 ILE H H 44 9.030 9.030 8.084 0.946 17919 53678 1 131 . 1 1 45 45 PHE N N 45 125.390 125.390 127.849 -2.459 17919 53679 1 131 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.011 0.034 17919 53680 1 131 . 1 1 45 45 PHE C C 45 174.470 174.470 174.490 -0.020 17919 53681 1 131 . 1 1 45 45 PHE CA C 45 57.020 57.020 55.752 1.268 17919 53682 1 131 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.128 0.632 17919 53683 1 131 . 1 1 45 45 PHE H H 45 8.830 8.830 8.160 0.670 17919 53684 1 131 . 1 1 46 46 ALA N N 46 132.200 132.200 129.045 3.155 17919 53685 1 131 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.607 0.083 17919 53686 1 131 . 1 1 46 46 ALA C C 46 177.290 177.290 177.278 0.012 17919 53687 1 131 . 1 1 46 46 ALA CA C 46 52.540 52.540 53.087 -0.547 17919 53688 1 131 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.585 -0.015 17919 53689 1 131 . 1 1 46 46 ALA H H 46 8.810 8.810 8.601 0.209 17919 53690 1 131 . 1 1 47 47 GLY N N 47 102.340 102.340 104.674 -2.334 17919 53691 1 131 . 1 1 47 47 GLY C C 47 173.810 173.810 174.529 -0.719 17919 53692 1 131 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.442 -0.092 17919 53693 1 131 . 1 1 47 47 GLY H H 47 8.130 8.130 8.382 -0.252 17919 53694 1 131 . 1 1 48 48 LYS N N 48 121.570 121.570 122.938 -1.368 17919 53695 1 131 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.601 0.021 17919 53696 1 131 . 1 1 48 48 LYS C C 48 174.700 174.700 175.356 -0.656 17919 53697 1 131 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.005 0.545 17919 53698 1 131 . 1 1 48 48 LYS CB C 48 34.530 34.530 33.962 0.567 17919 53699 1 131 . 1 1 48 48 LYS H H 48 7.980 7.980 7.919 0.061 17919 53700 1 131 . 1 1 49 49 GLN N N 49 122.410 122.410 125.525 -3.115 17919 53701 1 131 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.457 0.103 17919 53702 1 131 . 1 1 49 49 GLN C C 49 175.670 175.670 175.712 -0.042 17919 53703 1 131 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.397 -0.657 17919 53704 1 131 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.135 -0.135 17919 53705 1 131 . 1 1 49 49 GLN H H 49 8.600 8.600 8.630 -0.030 17919 53706 1 131 . 1 1 50 50 LEU N N 50 125.520 125.520 128.966 -3.446 17919 53707 1 131 . 1 1 50 50 LEU HA H 50 4.090 4.090 3.856 0.234 17919 53708 1 131 . 1 1 50 50 LEU C C 50 176.660 176.660 176.419 0.241 17919 53709 1 131 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.007 0.234 17919 53710 1 131 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.160 0.410 17919 53711 1 131 . 1 1 50 50 LEU H H 50 8.530 8.530 8.558 -0.028 17919 53712 1 131 . 1 1 51 51 GLU N N 51 122.940 122.940 125.789 -2.849 17919 53713 1 131 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.291 0.197 17919 53714 1 131 . 1 1 51 51 GLU C C 51 175.870 175.870 177.057 -1.187 17919 53715 1 131 . 1 1 51 51 GLU CA C 51 55.960 55.960 56.781 -0.821 17919 53716 1 131 . 1 1 51 51 GLU CB C 51 31.570 31.570 30.460 1.110 17919 53717 1 131 . 1 1 51 51 GLU H H 51 8.400 8.400 8.477 -0.077 17919 53718 1 131 . 1 1 52 52 ASP N N 52 120.030 120.030 124.661 -4.631 17919 53719 1 131 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.403 -0.044 17919 53720 1 131 . 1 1 52 52 ASP C C 52 177.330 177.330 178.350 -1.020 17919 53721 1 131 . 1 1 52 52 ASP CA C 52 56.960 56.960 58.032 -1.072 17919 53722 1 131 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.757 0.093 17919 53723 1 131 . 1 1 52 52 ASP H H 52 8.160 8.160 8.792 -0.632 17919 53724 1 131 . 1 1 53 53 GLY N N 53 106.660 106.660 104.340 2.320 17919 53725 1 131 . 1 1 53 53 GLY C C 53 174.870 174.870 174.586 0.284 17919 53726 1 131 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.994 0.176 17919 53727 1 131 . 1 1 53 53 GLY H H 53 9.390 9.390 8.302 1.088 17919 53728 1 131 . 1 1 54 54 ARG N N 54 119.050 119.050 121.164 -2.114 17919 53729 1 131 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.512 0.183 17919 53730 1 131 . 1 1 54 54 ARG C C 54 175.350 175.350 176.722 -1.372 17919 53731 1 131 . 1 1 54 54 ARG CA C 54 54.390 54.390 55.675 -1.285 17919 53732 1 131 . 1 1 54 54 ARG CB C 54 32.650 32.650 31.076 1.574 17919 53733 1 131 . 1 1 54 54 ARG H H 54 7.460 7.460 7.685 -0.225 17919 53734 1 131 . 1 1 55 55 THR N N 55 108.400 108.400 113.148 -4.748 17919 53735 1 131 . 1 1 55 55 THR HA H 55 5.240 5.240 4.396 0.844 17919 53736 1 131 . 1 1 55 55 THR C C 55 176.560 176.560 175.930 0.630 17919 53737 1 131 . 1 1 55 55 THR CA C 55 59.690 59.690 61.856 -2.166 17919 53738 1 131 . 1 1 55 55 THR CB C 55 72.260 72.260 70.267 1.993 17919 53739 1 131 . 1 1 55 55 THR H H 55 8.730 8.730 9.003 -0.273 17919 53740 1 131 . 1 1 56 56 LEU N N 56 117.920 117.920 122.313 -4.393 17919 53741 1 131 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.091 -0.031 17919 53742 1 131 . 1 1 56 56 LEU C C 56 180.810 180.810 178.210 2.600 17919 53743 1 131 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.290 0.420 17919 53744 1 131 . 1 1 56 56 LEU CB C 56 40.370 40.370 42.052 -1.682 17919 53745 1 131 . 1 1 56 56 LEU H H 56 8.140 8.140 8.923 -0.783 17919 53746 1 131 . 1 1 57 57 SER N N 57 113.330 113.330 112.588 0.742 17919 53747 1 131 . 1 1 57 57 SER HA H 57 4.370 4.370 4.179 0.191 17919 53748 1 131 . 1 1 57 57 SER C C 57 178.310 178.310 176.418 1.892 17919 53749 1 131 . 1 1 57 57 SER CA C 57 61.080 61.080 60.582 0.498 17919 53750 1 131 . 1 1 57 57 SER CB C 57 62.530 62.530 62.633 -0.103 17919 53751 1 131 . 1 1 57 57 SER H H 57 8.470 8.470 7.817 0.653 17919 53752 1 131 . 1 1 58 58 ASP N N 58 124.190 124.190 121.474 2.716 17919 53753 1 131 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.261 0.035 17919 53754 1 131 . 1 1 58 58 ASP C C 58 177.400 177.400 176.055 1.345 17919 53755 1 131 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.633 0.547 17919 53756 1 131 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.394 -0.294 17919 53757 1 131 . 1 1 58 58 ASP H H 58 7.930 7.930 7.844 0.086 17919 53758 1 131 . 1 1 59 59 TYR N N 59 115.510 115.510 115.223 0.287 17919 53759 1 131 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.657 0.013 17919 53760 1 131 . 1 1 59 59 TYR C C 59 174.700 174.700 175.011 -0.311 17919 53761 1 131 . 1 1 59 59 TYR CA C 59 58.250 58.250 56.897 1.353 17919 53762 1 131 . 1 1 59 59 TYR CB C 59 40.070 40.070 39.264 0.806 17919 53763 1 131 . 1 1 59 59 TYR H H 59 7.250 7.250 7.164 0.086 17919 53764 1 131 . 1 1 60 60 ASN N N 60 115.900 115.900 118.372 -2.472 17919 53765 1 131 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.379 -0.024 17919 53766 1 131 . 1 1 60 60 ASN C C 60 174.340 174.340 174.505 -0.165 17919 53767 1 131 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.390 -0.270 17919 53768 1 131 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.455 -0.045 17919 53769 1 131 . 1 1 60 60 ASN H H 60 8.150 8.150 8.086 0.064 17919 53770 1 131 . 1 1 61 61 ILE N N 61 118.600 118.600 119.981 -1.381 17919 53771 1 131 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.649 -0.256 17919 53772 1 131 . 1 1 61 61 ILE C C 61 174.610 174.610 174.881 -0.271 17919 53773 1 131 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.821 0.599 17919 53774 1 131 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.152 -0.412 17919 53775 1 131 . 1 1 61 61 ILE H H 61 7.250 7.250 7.466 -0.216 17919 53776 1 131 . 1 1 62 62 GLN N N 62 124.740 124.740 126.210 -1.470 17919 53777 1 131 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.725 -0.219 17919 53778 1 131 . 1 1 62 62 GLN C C 62 175.970 175.970 175.349 0.621 17919 53779 1 131 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.692 -0.032 17919 53780 1 131 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.406 0.244 17919 53781 1 131 . 1 1 62 62 GLN H H 62 7.610 7.610 8.027 -0.417 17919 53782 1 131 . 1 1 63 63 LYS N N 63 120.300 120.300 119.591 0.709 17919 53783 1 131 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.148 -0.147 17919 53784 1 131 . 1 1 63 63 LYS C C 63 175.810 175.810 177.222 -1.412 17919 53785 1 131 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.215 0.575 17919 53786 1 131 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.099 0.551 17919 53787 1 131 . 1 1 63 63 LYS H H 63 8.490 8.490 8.465 0.025 17919 53788 1 131 . 1 1 64 64 GLU N N 64 113.950 113.950 117.748 -3.798 17919 53789 1 131 . 1 1 64 64 GLU HA H 64 3.465 3.465 4.019 -0.554 17919 53790 1 131 . 1 1 64 64 GLU C C 64 175.250 175.250 175.721 -0.471 17919 53791 1 131 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.867 0.022 17919 53792 1 131 . 1 1 64 64 GLU CB C 64 25.900 25.900 27.926 -2.026 17919 53793 1 131 . 1 1 64 64 GLU H H 64 9.280 9.280 8.818 0.462 17919 53794 1 131 . 1 1 65 65 SER N N 65 114.730 114.730 114.707 0.023 17919 53795 1 131 . 1 1 65 65 SER HA H 65 4.640 4.640 4.612 0.028 17919 53796 1 131 . 1 1 65 65 SER C C 65 172.160 172.160 174.106 -1.946 17919 53797 1 131 . 1 1 65 65 SER CA C 65 60.890 60.890 59.276 1.614 17919 53798 1 131 . 1 1 65 65 SER CB C 65 64.910 64.910 64.267 0.643 17919 53799 1 131 . 1 1 65 65 SER H H 65 7.670 7.670 7.530 0.140 17919 53800 1 131 . 1 1 66 66 THR N N 66 117.110 117.110 117.548 -0.438 17919 53801 1 131 . 1 1 66 66 THR HA H 66 5.270 5.270 5.179 0.091 17919 53802 1 131 . 1 1 66 66 THR C C 66 173.950 173.950 174.047 -0.097 17919 53803 1 131 . 1 1 66 66 THR CA C 66 62.340 62.340 61.781 0.559 17919 53804 1 131 . 1 1 66 66 THR CB C 66 70.080 70.080 70.427 -0.347 17919 53805 1 131 . 1 1 66 66 THR H H 66 8.730 8.730 8.610 0.120 17919 53806 1 131 . 1 1 67 67 LEU N N 67 127.110 127.110 128.030 -0.920 17919 53807 1 131 . 1 1 67 67 LEU HA H 67 5.060 5.060 5.155 -0.095 17919 53808 1 131 . 1 1 67 67 LEU C C 67 175.770 175.770 176.230 -0.460 17919 53809 1 131 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.303 -0.403 17919 53810 1 131 . 1 1 67 67 LEU CB C 67 44.260 44.260 42.885 1.375 17919 53811 1 131 . 1 1 67 67 LEU H H 67 9.410 9.410 8.770 0.640 17919 53812 1 131 . 1 1 68 68 HIS N N 68 118.380 118.380 121.579 -3.199 17919 53813 1 131 . 1 1 68 68 HIS HA H 68 5.240 5.240 4.981 0.259 17919 53814 1 131 . 1 1 68 68 HIS C C 68 173.150 173.150 174.166 -1.016 17919 53815 1 131 . 1 1 68 68 HIS CA C 68 55.000 55.000 55.037 -0.037 17919 53816 1 131 . 1 1 68 68 HIS CB C 68 30.530 30.530 33.104 -2.574 17919 53817 1 131 . 1 1 68 68 HIS H H 68 9.230 9.230 9.257 -0.027 17919 53818 1 131 . 1 1 69 69 LEU N N 69 124.460 124.460 122.656 1.804 17919 53819 1 131 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.050 0.140 17919 53820 1 131 . 1 1 69 69 LEU C C 69 175.270 175.270 174.303 0.967 17919 53821 1 131 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.749 -0.859 17919 53822 1 131 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.795 -0.415 17919 53823 1 131 . 1 1 69 69 LEU H H 69 8.340 8.340 7.086 1.254 17919 53824 1 131 . 1 1 70 70 VAL N N 70 126.940 126.940 126.581 0.359 17919 53825 1 131 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.268 0.082 17919 53826 1 131 . 1 1 70 70 VAL C C 70 174.000 174.000 174.607 -0.607 17919 53827 1 131 . 1 1 70 70 VAL CA C 70 60.800 60.800 61.634 -0.834 17919 53828 1 131 . 1 1 70 70 VAL CB C 70 34.910 34.910 33.046 1.864 17919 53829 1 131 . 1 1 70 70 VAL H H 70 9.200 9.200 8.739 0.461 17919 53830 1 131 . 1 1 71 71 LEU N N 71 123.130 123.130 127.363 -4.233 17919 53831 1 131 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.673 0.387 17919 53832 1 131 . 1 1 71 71 LEU C C 71 177.830 177.830 177.477 0.353 17919 53833 1 131 . 1 1 71 71 LEU CA C 71 53.940 53.940 54.379 -0.439 17919 53834 1 131 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.605 0.245 17919 53835 1 131 . 1 1 71 71 LEU H H 71 8.120 8.120 8.524 -0.404 17919 53836 1 131 . 1 1 72 72 ARG N N 72 123.490 123.490 123.276 0.214 17919 53837 1 131 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.261 0.040 17919 53838 1 131 . 1 1 72 72 ARG C C 72 175.350 175.350 176.347 -0.997 17919 53839 1 131 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.563 -0.953 17919 53840 1 131 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.990 0.360 17919 53841 1 131 . 1 1 72 72 ARG H H 72 8.580 8.580 8.090 0.490 17919 53842 1 132 . 1 1 2 2 GLN N N 2 123.220 123.220 120.559 2.661 17919 53843 1 132 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.476 -0.227 17919 53844 1 132 . 1 1 2 2 GLN C C 2 175.920 175.920 175.272 0.648 17919 53845 1 132 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.174 0.906 17919 53846 1 132 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.956 -0.196 17919 53847 1 132 . 1 1 2 2 GLN H H 2 8.900 8.900 8.311 0.589 17919 53848 1 132 . 1 1 3 3 ILE N N 3 115.340 115.340 117.475 -2.135 17919 53849 1 132 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.267 -0.054 17919 53850 1 132 . 1 1 3 3 ILE C C 3 172.450 172.450 173.805 -1.355 17919 53851 1 132 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.933 -0.363 17919 53852 1 132 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.084 1.126 17919 53853 1 132 . 1 1 3 3 ILE H H 3 8.320 8.320 8.033 0.287 17919 53854 1 132 . 1 1 4 4 PHE N N 4 118.110 118.110 122.306 -4.196 17919 53855 1 132 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.225 0.405 17919 53856 1 132 . 1 1 4 4 PHE C C 4 175.320 175.320 175.804 -0.484 17919 53857 1 132 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.272 -0.062 17919 53858 1 132 . 1 1 4 4 PHE CB C 4 41.480 41.480 40.930 0.550 17919 53859 1 132 . 1 1 4 4 PHE H H 4 8.610 8.610 7.764 0.846 17919 53860 1 132 . 1 1 5 5 VAL N N 5 121.000 121.000 122.433 -1.433 17919 53861 1 132 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.956 -0.231 17919 53862 1 132 . 1 1 5 5 VAL C C 5 174.870 174.870 175.354 -0.484 17919 53863 1 132 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.422 -0.802 17919 53864 1 132 . 1 1 5 5 VAL CB C 5 34.230 34.230 32.399 1.831 17919 53865 1 132 . 1 1 5 5 VAL H H 5 9.300 9.300 8.372 0.928 17919 53866 1 132 . 1 1 6 6 LYS N N 6 127.520 127.520 128.876 -1.356 17919 53867 1 132 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.227 0.140 17919 53868 1 132 . 1 1 6 6 LYS C C 6 177.140 177.140 176.861 0.279 17919 53869 1 132 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.948 -0.428 17919 53870 1 132 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.916 0.134 17919 53871 1 132 . 1 1 6 6 LYS H H 6 8.820 8.820 8.133 0.687 17919 53872 1 132 . 1 1 7 7 THR N N 7 115.400 115.400 117.802 -2.402 17919 53873 1 132 . 1 1 7 7 THR HA H 7 4.970 4.970 4.628 0.342 17919 53874 1 132 . 1 1 7 7 THR C C 7 176.910 176.910 176.534 0.376 17919 53875 1 132 . 1 1 7 7 THR CA C 7 60.470 60.470 61.428 -0.958 17919 53876 1 132 . 1 1 7 7 THR CB C 7 70.630 70.630 70.041 0.589 17919 53877 1 132 . 1 1 7 7 THR H H 7 8.730 8.730 8.901 -0.171 17919 53878 1 132 . 1 1 8 8 LEU N N 8 121.330 121.330 120.418 0.912 17919 53879 1 132 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.318 -0.008 17919 53880 1 132 . 1 1 8 8 LEU C C 8 178.800 178.800 178.075 0.725 17919 53881 1 132 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.417 0.163 17919 53882 1 132 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.164 -0.194 17919 53883 1 132 . 1 1 8 8 LEU H H 8 9.100 9.100 8.931 0.169 17919 53884 1 132 . 1 1 9 9 THR N N 9 105.590 105.590 107.612 -2.022 17919 53885 1 132 . 1 1 9 9 THR HA H 9 4.428 4.428 4.343 0.085 17919 53886 1 132 . 1 1 9 9 THR C C 9 175.520 175.520 175.527 -0.007 17919 53887 1 132 . 1 1 9 9 THR CA C 9 61.400 61.400 62.048 -0.648 17919 53888 1 132 . 1 1 9 9 THR CB C 9 69.140 69.140 69.659 -0.519 17919 53889 1 132 . 1 1 9 9 THR H H 9 7.630 7.630 7.557 0.073 17919 53890 1 132 . 1 1 10 10 GLY N N 10 108.890 108.890 110.722 -1.832 17919 53891 1 132 . 1 1 10 10 GLY C C 10 174.070 174.070 173.545 0.525 17919 53892 1 132 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.706 0.753 17919 53893 1 132 . 1 1 10 10 GLY H H 10 7.810 7.810 7.572 0.238 17919 53894 1 132 . 1 1 11 11 LYS N N 11 121.600 121.600 122.964 -1.364 17919 53895 1 132 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.231 0.130 17919 53896 1 132 . 1 1 11 11 LYS C C 11 175.940 175.940 175.230 0.710 17919 53897 1 132 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.944 -0.664 17919 53898 1 132 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.303 -0.103 17919 53899 1 132 . 1 1 11 11 LYS H H 11 7.280 7.280 7.552 -0.272 17919 53900 1 132 . 1 1 12 12 THR N N 12 120.440 120.440 119.737 0.703 17919 53901 1 132 . 1 1 12 12 THR HA H 12 5.046 5.046 5.171 -0.125 17919 53902 1 132 . 1 1 12 12 THR C C 12 174.320 174.320 174.415 -0.095 17919 53903 1 132 . 1 1 12 12 THR CA C 12 62.390 62.390 61.212 1.178 17919 53904 1 132 . 1 1 12 12 THR CB C 12 69.910 69.910 69.918 -0.008 17919 53905 1 132 . 1 1 12 12 THR H H 12 8.650 8.650 8.141 0.509 17919 53906 1 132 . 1 1 13 13 ILE N N 13 127.110 127.110 122.108 5.002 17919 53907 1 132 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.787 -0.243 17919 53908 1 132 . 1 1 13 13 ILE C C 13 175.220 175.220 174.216 1.004 17919 53909 1 132 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.106 0.874 17919 53910 1 132 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.837 0.113 17919 53911 1 132 . 1 1 13 13 ILE H H 13 9.450 9.450 8.881 0.569 17919 53912 1 132 . 1 1 14 14 THR N N 14 121.520 121.520 120.125 1.395 17919 53913 1 132 . 1 1 14 14 THR HA H 14 4.964 4.964 4.844 0.120 17919 53914 1 132 . 1 1 14 14 THR C C 14 173.790 173.790 173.701 0.089 17919 53915 1 132 . 1 1 14 14 THR CA C 14 61.940 61.940 62.508 -0.568 17919 53916 1 132 . 1 1 14 14 THR CB C 14 69.650 69.650 69.482 0.168 17919 53917 1 132 . 1 1 14 14 THR H H 14 8.710 8.710 8.272 0.438 17919 53918 1 132 . 1 1 15 15 LEU N N 15 124.800 124.800 126.482 -1.682 17919 53919 1 132 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.763 0.017 17919 53920 1 132 . 1 1 15 15 LEU C C 15 174.670 174.670 175.746 -1.076 17919 53921 1 132 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.418 -0.588 17919 53922 1 132 . 1 1 15 15 LEU CB C 15 47.070 47.070 44.638 2.432 17919 53923 1 132 . 1 1 15 15 LEU H H 15 8.710 8.710 7.998 0.712 17919 53924 1 132 . 1 1 16 16 GLU N N 16 122.160 122.160 123.156 -0.996 17919 53925 1 132 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.769 0.148 17919 53926 1 132 . 1 1 16 16 GLU C C 16 175.860 175.860 176.576 -0.716 17919 53927 1 132 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.701 -0.881 17919 53928 1 132 . 1 1 16 16 GLU CB C 16 29.450 29.450 29.910 -0.460 17919 53929 1 132 . 1 1 16 16 GLU H H 16 8.140 8.140 8.620 -0.480 17919 53930 1 132 . 1 1 17 17 VAL N N 17 117.210 117.210 120.356 -3.146 17919 53931 1 132 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.464 0.250 17919 53932 1 132 . 1 1 17 17 VAL C C 17 174.160 174.160 174.940 -0.780 17919 53933 1 132 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.177 -0.747 17919 53934 1 132 . 1 1 17 17 VAL CB C 17 36.400 36.400 34.917 1.483 17919 53935 1 132 . 1 1 17 17 VAL H H 17 8.900 8.900 8.807 0.093 17919 53936 1 132 . 1 1 18 18 GLU N N 18 118.990 118.990 121.018 -2.028 17919 53937 1 132 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.872 0.207 17919 53938 1 132 . 1 1 18 18 GLU C C 18 176.160 176.160 175.734 0.426 17919 53939 1 132 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.723 -0.003 17919 53940 1 132 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.223 0.087 17919 53941 1 132 . 1 1 18 18 GLU H H 18 8.640 8.640 8.313 0.327 17919 53942 1 132 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.098 0.043 17919 53943 1 132 . 1 1 19 19 PRO C C 19 175.310 175.310 178.436 -3.126 17919 53944 1 132 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.931 -0.461 17919 53945 1 132 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.847 0.103 17919 53946 1 132 . 1 1 20 20 SER N N 20 103.400 103.400 109.838 -6.438 17919 53947 1 132 . 1 1 20 20 SER HA H 20 4.370 4.370 4.277 0.093 17919 53948 1 132 . 1 1 20 20 SER C C 20 174.660 174.660 174.862 -0.202 17919 53949 1 132 . 1 1 20 20 SER CA C 20 57.400 57.400 59.364 -1.964 17919 53950 1 132 . 1 1 20 20 SER CB C 20 63.370 63.370 63.132 0.238 17919 53951 1 132 . 1 1 20 20 SER H H 20 7.040 7.040 7.958 -0.918 17919 53952 1 132 . 1 1 21 21 ASP N N 21 123.480 123.480 122.224 1.256 17919 53953 1 132 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.723 -0.028 17919 53954 1 132 . 1 1 21 21 ASP C C 21 176.360 176.360 176.101 0.259 17919 53955 1 132 . 1 1 21 21 ASP CA C 21 55.700 55.700 56.162 -0.462 17919 53956 1 132 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.813 -1.013 17919 53957 1 132 . 1 1 21 21 ASP H H 21 8.030 8.030 7.737 0.293 17919 53958 1 132 . 1 1 22 22 THR N N 22 108.800 108.800 111.597 -2.797 17919 53959 1 132 . 1 1 22 22 THR HA H 22 4.920 4.920 4.541 0.379 17919 53960 1 132 . 1 1 22 22 THR C C 22 176.750 176.750 175.833 0.917 17919 53961 1 132 . 1 1 22 22 THR CA C 22 59.690 59.690 61.212 -1.522 17919 53962 1 132 . 1 1 22 22 THR CB C 22 71.200 71.200 70.927 0.273 17919 53963 1 132 . 1 1 22 22 THR H H 22 7.900 7.900 8.304 -0.404 17919 53964 1 132 . 1 1 23 23 ILE N N 23 121.190 121.190 123.803 -2.613 17919 53965 1 132 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.665 -0.008 17919 53966 1 132 . 1 1 23 23 ILE C C 23 179.040 179.040 177.583 1.457 17919 53967 1 132 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.253 -0.993 17919 53968 1 132 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.767 -2.417 17919 53969 1 132 . 1 1 23 23 ILE H H 23 8.560 8.560 8.666 -0.106 17919 53970 1 132 . 1 1 24 24 GLU N N 24 120.830 120.830 120.398 0.432 17919 53971 1 132 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.934 -0.017 17919 53972 1 132 . 1 1 24 24 GLU C C 24 178.640 178.640 178.794 -0.154 17919 53973 1 132 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.858 0.362 17919 53974 1 132 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.494 -1.214 17919 53975 1 132 . 1 1 24 24 GLU H H 24 9.760 9.760 8.486 1.274 17919 53976 1 132 . 1 1 25 25 ASN N N 25 120.570 120.570 118.385 2.185 17919 53977 1 132 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.459 0.066 17919 53978 1 132 . 1 1 25 25 ASN C C 25 178.380 178.380 178.278 0.102 17919 53979 1 132 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.829 0.231 17919 53980 1 132 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.625 -0.175 17919 53981 1 132 . 1 1 25 25 ASN H H 25 7.920 7.920 7.694 0.226 17919 53982 1 132 . 1 1 26 26 VAL N N 26 121.710 121.710 120.531 1.179 17919 53983 1 132 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.577 -0.180 17919 53984 1 132 . 1 1 26 26 VAL C C 26 177.950 177.950 177.580 0.370 17919 53985 1 132 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.681 0.979 17919 53986 1 132 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.267 -0.427 17919 53987 1 132 . 1 1 26 26 VAL H H 26 8.070 8.070 7.969 0.101 17919 53988 1 132 . 1 1 27 27 LYS N N 27 118.860 118.860 120.483 -1.623 17919 53989 1 132 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.130 0.450 17919 53990 1 132 . 1 1 27 27 LYS C C 27 180.550 180.550 179.064 1.486 17919 53991 1 132 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.737 -0.487 17919 53992 1 132 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.181 1.549 17919 53993 1 132 . 1 1 27 27 LYS H H 27 8.560 8.560 7.590 0.970 17919 53994 1 132 . 1 1 28 28 ALA N N 28 123.440 123.440 119.467 3.973 17919 53995 1 132 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.012 0.148 17919 53996 1 132 . 1 1 28 28 ALA C C 28 180.300 180.300 179.323 0.977 17919 53997 1 132 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.150 0.220 17919 53998 1 132 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.357 -0.647 17919 53999 1 132 . 1 1 28 28 ALA H H 28 8.060 8.060 8.460 -0.400 17919 54000 1 132 . 1 1 29 29 LYS N N 29 119.940 119.940 118.933 1.007 17919 54001 1 132 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.127 0.080 17919 54002 1 132 . 1 1 29 29 LYS C C 29 180.320 180.320 179.024 1.296 17919 54003 1 132 . 1 1 29 29 LYS CA C 29 59.650 59.650 58.866 0.784 17919 54004 1 132 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.491 0.799 17919 54005 1 132 . 1 1 29 29 LYS H H 29 7.850 7.850 7.345 0.505 17919 54006 1 132 . 1 1 30 30 ILE N N 30 121.080 121.080 120.426 0.654 17919 54007 1 132 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.557 -0.050 17919 54008 1 132 . 1 1 30 30 ILE C C 30 178.310 178.310 177.546 0.764 17919 54009 1 132 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.191 0.959 17919 54010 1 132 . 1 1 30 30 ILE CB C 30 36.800 36.800 36.990 -0.190 17919 54011 1 132 . 1 1 30 30 ILE H H 30 8.280 8.280 8.038 0.242 17919 54012 1 132 . 1 1 31 31 GLN N N 31 123.490 123.490 119.832 3.658 17919 54013 1 132 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.905 -0.076 17919 54014 1 132 . 1 1 31 31 GLN C C 31 178.890 178.890 178.085 0.805 17919 54015 1 132 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.295 0.705 17919 54016 1 132 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.435 -0.715 17919 54017 1 132 . 1 1 31 31 GLN H H 31 8.580 8.580 8.129 0.451 17919 54018 1 132 . 1 1 32 32 ASP N N 32 119.360 119.360 118.064 1.296 17919 54019 1 132 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.427 -0.073 17919 54020 1 132 . 1 1 32 32 ASP C C 32 177.250 177.250 177.625 -0.375 17919 54021 1 132 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.382 0.808 17919 54022 1 132 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.711 -0.131 17919 54023 1 132 . 1 1 32 32 ASP H H 32 8.010 8.010 7.868 0.142 17919 54024 1 132 . 1 1 33 33 LYS N N 33 115.130 115.130 118.173 -3.043 17919 54025 1 132 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.375 -0.038 17919 54026 1 132 . 1 1 33 33 LYS C C 33 177.870 177.870 178.362 -0.492 17919 54027 1 132 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.411 0.639 17919 54028 1 132 . 1 1 33 33 LYS CB C 33 34.170 34.170 34.531 -0.361 17919 54029 1 132 . 1 1 33 33 LYS H H 33 7.430 7.430 7.548 -0.118 17919 54030 1 132 . 1 1 34 34 GLU N N 34 113.870 113.870 116.602 -2.732 17919 54031 1 132 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.385 0.240 17919 54032 1 132 . 1 1 34 34 GLU C C 34 177.840 177.840 177.586 0.254 17919 54033 1 132 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.572 -1.402 17919 54034 1 132 . 1 1 34 34 GLU CB C 34 32.660 32.660 30.244 2.416 17919 54035 1 132 . 1 1 34 34 GLU H H 34 8.740 8.740 8.057 0.683 17919 54036 1 132 . 1 1 35 35 GLY N N 35 108.650 108.650 108.707 -0.057 17919 54037 1 132 . 1 1 35 35 GLY C C 35 173.960 173.960 174.861 -0.901 17919 54038 1 132 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.645 0.435 17919 54039 1 132 . 1 1 35 35 GLY H H 35 8.530 8.530 7.670 0.860 17919 54040 1 132 . 1 1 36 36 ILE N N 36 119.880 119.880 122.776 -2.896 17919 54041 1 132 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.162 0.283 17919 54042 1 132 . 1 1 36 36 ILE C C 36 173.590 173.590 174.812 -1.222 17919 54043 1 132 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.778 -1.028 17919 54044 1 132 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.080 2.500 17919 54045 1 132 . 1 1 36 36 ILE H H 36 6.150 6.150 7.802 -1.652 17919 54046 1 132 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.799 -0.165 17919 54047 1 132 . 1 1 37 37 PRO C C 37 176.940 176.940 176.185 0.755 17919 54048 1 132 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.120 0.540 17919 54049 1 132 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.124 0.726 17919 54050 1 132 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.170 -0.053 17919 54051 1 132 . 1 1 38 38 PRO C C 38 178.320 178.320 178.348 -0.028 17919 54052 1 132 . 1 1 38 38 PRO CA C 38 66.260 66.260 66.141 0.119 17919 54053 1 132 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.743 1.147 17919 54054 1 132 . 1 1 39 39 ASP N N 39 113.380 113.380 115.118 -1.738 17919 54055 1 132 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.455 -0.025 17919 54056 1 132 . 1 1 39 39 ASP C C 39 177.090 177.090 176.996 0.094 17919 54057 1 132 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.047 -0.407 17919 54058 1 132 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.140 -0.600 17919 54059 1 132 . 1 1 39 39 ASP H H 39 8.550 8.550 8.489 0.061 17919 54060 1 132 . 1 1 40 40 GLN N N 40 116.780 116.780 116.805 -0.025 17919 54061 1 132 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.417 0.047 17919 54062 1 132 . 1 1 40 40 GLN C C 40 175.380 175.380 174.956 0.424 17919 54063 1 132 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.361 0.279 17919 54064 1 132 . 1 1 40 40 GLN CB C 40 30.140 30.140 28.909 1.232 17919 54065 1 132 . 1 1 40 40 GLN H H 40 7.820 7.820 7.991 -0.171 17919 54066 1 132 . 1 1 41 41 GLN N N 41 117.720 117.720 118.743 -1.023 17919 54067 1 132 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.675 -0.431 17919 54068 1 132 . 1 1 41 41 GLN C C 41 176.300 176.300 174.908 1.392 17919 54069 1 132 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.090 1.380 17919 54070 1 132 . 1 1 41 41 GLN CB C 41 31.650 31.650 31.518 0.132 17919 54071 1 132 . 1 1 41 41 GLN H H 41 7.480 7.480 7.889 -0.409 17919 54072 1 132 . 1 1 42 42 ARG N N 42 122.680 122.680 121.854 0.826 17919 54073 1 132 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.589 -0.089 17919 54074 1 132 . 1 1 42 42 ARG C C 42 174.050 174.050 173.983 0.067 17919 54075 1 132 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.921 0.129 17919 54076 1 132 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.842 -1.091 17919 54077 1 132 . 1 1 42 42 ARG H H 42 8.530 8.530 8.376 0.154 17919 54078 1 132 . 1 1 43 43 LEU N N 43 124.040 124.040 125.432 -1.392 17919 54079 1 132 . 1 1 43 43 LEU C C 43 175.290 175.290 175.768 -0.478 17919 54080 1 132 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.565 -0.584 17919 54081 1 132 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.928 1.862 17919 54082 1 132 . 1 1 43 43 LEU H H 43 8.820 8.820 8.826 -0.006 17919 54083 1 132 . 1 1 44 44 ILE N N 44 121.920 121.920 122.198 -0.278 17919 54084 1 132 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.225 -0.233 17919 54085 1 132 . 1 1 44 44 ILE C C 44 176.060 176.060 174.425 1.635 17919 54086 1 132 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.853 -0.874 17919 54087 1 132 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.623 -0.203 17919 54088 1 132 . 1 1 44 44 ILE H H 44 9.030 9.030 9.041 -0.011 17919 54089 1 132 . 1 1 45 45 PHE N N 45 125.390 125.390 126.663 -1.273 17919 54090 1 132 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.979 0.066 17919 54091 1 132 . 1 1 45 45 PHE C C 45 174.470 174.470 174.439 0.031 17919 54092 1 132 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.342 0.678 17919 54093 1 132 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.805 0.955 17919 54094 1 132 . 1 1 45 45 PHE H H 45 8.830 8.830 8.705 0.125 17919 54095 1 132 . 1 1 46 46 ALA N N 46 132.200 132.200 130.179 2.021 17919 54096 1 132 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.645 0.045 17919 54097 1 132 . 1 1 46 46 ALA C C 46 177.290 177.290 177.247 0.043 17919 54098 1 132 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.804 -0.264 17919 54099 1 132 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.475 0.095 17919 54100 1 132 . 1 1 46 46 ALA H H 46 8.810 8.810 8.808 0.002 17919 54101 1 132 . 1 1 47 47 GLY N N 47 102.340 102.340 103.834 -1.494 17919 54102 1 132 . 1 1 47 47 GLY C C 47 173.810 173.810 174.321 -0.511 17919 54103 1 132 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.415 -0.065 17919 54104 1 132 . 1 1 47 47 GLY H H 47 8.130 8.130 8.550 -0.420 17919 54105 1 132 . 1 1 48 48 LYS N N 48 121.570 121.570 120.881 0.689 17919 54106 1 132 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.548 0.074 17919 54107 1 132 . 1 1 48 48 LYS C C 48 174.700 174.700 175.561 -0.861 17919 54108 1 132 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.606 -0.056 17919 54109 1 132 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.071 0.459 17919 54110 1 132 . 1 1 48 48 LYS H H 48 7.980 7.980 7.433 0.547 17919 54111 1 132 . 1 1 49 49 GLN N N 49 122.410 122.410 125.020 -2.610 17919 54112 1 132 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.258 0.302 17919 54113 1 132 . 1 1 49 49 GLN C C 49 175.670 175.670 175.534 0.136 17919 54114 1 132 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.876 -1.136 17919 54115 1 132 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.191 -0.191 17919 54116 1 132 . 1 1 49 49 GLN H H 49 8.600 8.600 8.583 0.017 17919 54117 1 132 . 1 1 50 50 LEU N N 50 125.520 125.520 128.056 -2.536 17919 54118 1 132 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.459 -0.369 17919 54119 1 132 . 1 1 50 50 LEU C C 50 176.660 176.660 176.413 0.247 17919 54120 1 132 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.783 0.457 17919 54121 1 132 . 1 1 50 50 LEU CB C 50 41.570 41.570 43.610 -2.040 17919 54122 1 132 . 1 1 50 50 LEU H H 50 8.530 8.530 8.536 -0.006 17919 54123 1 132 . 1 1 51 51 GLU N N 51 122.940 122.940 121.933 1.007 17919 54124 1 132 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.586 -0.098 17919 54125 1 132 . 1 1 51 51 GLU C C 51 175.870 175.870 176.686 -0.816 17919 54126 1 132 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.610 0.350 17919 54127 1 132 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.122 0.448 17919 54128 1 132 . 1 1 51 51 GLU H H 51 8.400 8.400 8.823 -0.423 17919 54129 1 132 . 1 1 52 52 ASP N N 52 120.030 120.030 125.259 -5.229 17919 54130 1 132 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.375 -0.016 17919 54131 1 132 . 1 1 52 52 ASP C C 52 177.330 177.330 178.426 -1.096 17919 54132 1 132 . 1 1 52 52 ASP CA C 52 56.960 56.960 58.529 -1.569 17919 54133 1 132 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.610 0.240 17919 54134 1 132 . 1 1 52 52 ASP H H 52 8.160 8.160 8.894 -0.734 17919 54135 1 132 . 1 1 53 53 GLY N N 53 106.660 106.660 105.463 1.197 17919 54136 1 132 . 1 1 53 53 GLY C C 53 174.870 174.870 174.564 0.306 17919 54137 1 132 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.326 -0.156 17919 54138 1 132 . 1 1 53 53 GLY H H 53 9.390 9.390 8.220 1.170 17919 54139 1 132 . 1 1 54 54 ARG N N 54 119.050 119.050 122.471 -3.421 17919 54140 1 132 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.300 0.395 17919 54141 1 132 . 1 1 54 54 ARG C C 54 175.350 175.350 176.179 -0.829 17919 54142 1 132 . 1 1 54 54 ARG CA C 54 54.390 54.390 56.527 -2.137 17919 54143 1 132 . 1 1 54 54 ARG CB C 54 32.650 32.650 31.103 1.547 17919 54144 1 132 . 1 1 54 54 ARG H H 54 7.460 7.460 7.655 -0.195 17919 54145 1 132 . 1 1 55 55 THR N N 55 108.400 108.400 116.025 -7.625 17919 54146 1 132 . 1 1 55 55 THR HA H 55 5.240 5.240 5.089 0.151 17919 54147 1 132 . 1 1 55 55 THR C C 55 176.560 176.560 176.281 0.279 17919 54148 1 132 . 1 1 55 55 THR CA C 55 59.690 59.690 60.426 -0.736 17919 54149 1 132 . 1 1 55 55 THR CB C 55 72.260 72.260 70.722 1.538 17919 54150 1 132 . 1 1 55 55 THR H H 55 8.730 8.730 8.238 0.492 17919 54151 1 132 . 1 1 56 56 LEU N N 56 117.920 117.920 122.711 -4.791 17919 54152 1 132 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.047 0.013 17919 54153 1 132 . 1 1 56 56 LEU C C 56 180.810 180.810 179.058 1.752 17919 54154 1 132 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.754 -0.044 17919 54155 1 132 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.158 -0.788 17919 54156 1 132 . 1 1 56 56 LEU H H 56 8.140 8.140 8.501 -0.361 17919 54157 1 132 . 1 1 57 57 SER N N 57 113.330 113.330 112.436 0.894 17919 54158 1 132 . 1 1 57 57 SER HA H 57 4.370 4.370 4.099 0.271 17919 54159 1 132 . 1 1 57 57 SER C C 57 178.310 178.310 176.262 2.048 17919 54160 1 132 . 1 1 57 57 SER CA C 57 61.080 61.080 61.028 0.052 17919 54161 1 132 . 1 1 57 57 SER CB C 57 62.530 62.530 62.549 -0.019 17919 54162 1 132 . 1 1 57 57 SER H H 57 8.470 8.470 7.917 0.553 17919 54163 1 132 . 1 1 58 58 ASP N N 58 124.190 124.190 121.733 2.457 17919 54164 1 132 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.386 -0.090 17919 54165 1 132 . 1 1 58 58 ASP C C 58 177.400 177.400 177.050 0.350 17919 54166 1 132 . 1 1 58 58 ASP CA C 58 57.180 57.180 55.998 1.183 17919 54167 1 132 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.914 -0.814 17919 54168 1 132 . 1 1 58 58 ASP H H 58 7.930 7.930 7.697 0.233 17919 54169 1 132 . 1 1 59 59 TYR N N 59 115.510 115.510 116.079 -0.569 17919 54170 1 132 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.654 0.016 17919 54171 1 132 . 1 1 59 59 TYR C C 59 174.700 174.700 174.918 -0.218 17919 54172 1 132 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.711 0.539 17919 54173 1 132 . 1 1 59 59 TYR CB C 59 40.070 40.070 37.823 2.247 17919 54174 1 132 . 1 1 59 59 TYR H H 59 7.250 7.250 7.368 -0.118 17919 54175 1 132 . 1 1 60 60 ASN N N 60 115.900 115.900 117.501 -1.601 17919 54176 1 132 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.360 -0.005 17919 54177 1 132 . 1 1 60 60 ASN C C 60 174.340 174.340 174.427 -0.087 17919 54178 1 132 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.378 -0.258 17919 54179 1 132 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.083 0.327 17919 54180 1 132 . 1 1 60 60 ASN H H 60 8.150 8.150 7.686 0.464 17919 54181 1 132 . 1 1 61 61 ILE N N 61 118.600 118.600 119.645 -1.045 17919 54182 1 132 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.907 -0.514 17919 54183 1 132 . 1 1 61 61 ILE C C 61 174.610 174.610 175.215 -0.605 17919 54184 1 132 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.506 0.914 17919 54185 1 132 . 1 1 61 61 ILE CB C 61 36.740 36.740 39.041 -2.300 17919 54186 1 132 . 1 1 61 61 ILE H H 61 7.250 7.250 7.855 -0.605 17919 54187 1 132 . 1 1 62 62 GLN N N 62 124.740 124.740 123.696 1.044 17919 54188 1 132 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.697 -0.191 17919 54189 1 132 . 1 1 62 62 GLN C C 62 175.970 175.970 175.744 0.226 17919 54190 1 132 . 1 1 62 62 GLN CA C 62 53.660 53.660 52.753 0.907 17919 54191 1 132 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.827 -0.177 17919 54192 1 132 . 1 1 62 62 GLN H H 62 7.610 7.610 8.159 -0.549 17919 54193 1 132 . 1 1 63 63 LYS N N 63 120.300 120.300 123.449 -3.149 17919 54194 1 132 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.946 0.055 17919 54195 1 132 . 1 1 63 63 LYS C C 63 175.810 175.810 176.817 -1.007 17919 54196 1 132 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.916 -0.126 17919 54197 1 132 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.952 0.698 17919 54198 1 132 . 1 1 63 63 LYS H H 63 8.490 8.490 8.722 -0.232 17919 54199 1 132 . 1 1 64 64 GLU N N 64 113.950 113.950 119.793 -5.843 17919 54200 1 132 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.430 0.035 17919 54201 1 132 . 1 1 64 64 GLU C C 64 175.250 175.250 175.288 -0.038 17919 54202 1 132 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.440 0.450 17919 54203 1 132 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.687 -2.787 17919 54204 1 132 . 1 1 64 64 GLU H H 64 9.280 9.280 8.940 0.340 17919 54205 1 132 . 1 1 65 65 SER N N 65 114.730 114.730 117.031 -2.301 17919 54206 1 132 . 1 1 65 65 SER HA H 65 4.640 4.640 4.185 0.455 17919 54207 1 132 . 1 1 65 65 SER C C 65 172.160 172.160 173.770 -1.610 17919 54208 1 132 . 1 1 65 65 SER CA C 65 60.890 60.890 60.132 0.758 17919 54209 1 132 . 1 1 65 65 SER CB C 65 64.910 64.910 63.126 1.784 17919 54210 1 132 . 1 1 65 65 SER H H 65 7.670 7.670 7.886 -0.216 17919 54211 1 132 . 1 1 66 66 THR N N 66 117.110 117.110 122.985 -5.875 17919 54212 1 132 . 1 1 66 66 THR HA H 66 5.270 5.270 4.799 0.471 17919 54213 1 132 . 1 1 66 66 THR C C 66 173.950 173.950 174.599 -0.649 17919 54214 1 132 . 1 1 66 66 THR CA C 66 62.340 62.340 62.766 -0.426 17919 54215 1 132 . 1 1 66 66 THR CB C 66 70.080 70.080 69.359 0.721 17919 54216 1 132 . 1 1 66 66 THR H H 66 8.730 8.730 8.333 0.397 17919 54217 1 132 . 1 1 67 67 LEU N N 67 127.110 127.110 127.759 -0.649 17919 54218 1 132 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.843 0.217 17919 54219 1 132 . 1 1 67 67 LEU C C 67 175.770 175.770 175.764 0.006 17919 54220 1 132 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.127 -0.227 17919 54221 1 132 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.700 0.560 17919 54222 1 132 . 1 1 67 67 LEU H H 67 9.410 9.410 8.845 0.565 17919 54223 1 132 . 1 1 68 68 HIS N N 68 118.380 118.380 121.665 -3.285 17919 54224 1 132 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.447 -0.207 17919 54225 1 132 . 1 1 68 68 HIS C C 68 173.150 173.150 173.932 -0.782 17919 54226 1 132 . 1 1 68 68 HIS CA C 68 55.000 55.000 53.196 1.804 17919 54227 1 132 . 1 1 68 68 HIS CB C 68 30.530 30.530 33.096 -2.566 17919 54228 1 132 . 1 1 68 68 HIS H H 68 9.230 9.230 9.132 0.098 17919 54229 1 132 . 1 1 69 69 LEU N N 69 124.460 124.460 130.182 -5.722 17919 54230 1 132 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.960 0.230 17919 54231 1 132 . 1 1 69 69 LEU C C 69 175.270 175.270 174.487 0.783 17919 54232 1 132 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.878 0.012 17919 54233 1 132 . 1 1 69 69 LEU CB C 69 44.380 44.380 43.360 1.020 17919 54234 1 132 . 1 1 69 69 LEU H H 69 8.340 8.340 8.072 0.268 17919 54235 1 132 . 1 1 70 70 VAL N N 70 126.940 126.940 125.320 1.620 17919 54236 1 132 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.259 0.091 17919 54237 1 132 . 1 1 70 70 VAL C C 70 174.000 174.000 174.762 -0.762 17919 54238 1 132 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.662 0.138 17919 54239 1 132 . 1 1 70 70 VAL CB C 70 34.910 34.910 33.822 1.088 17919 54240 1 132 . 1 1 70 70 VAL H H 70 9.200 9.200 8.767 0.433 17919 54241 1 132 . 1 1 71 71 LEU N N 71 123.130 123.130 123.789 -0.659 17919 54242 1 132 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.115 -0.055 17919 54243 1 132 . 1 1 71 71 LEU C C 71 177.830 177.830 177.175 0.655 17919 54244 1 132 . 1 1 71 71 LEU CA C 71 53.940 53.940 52.724 1.216 17919 54245 1 132 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.975 -1.125 17919 54246 1 132 . 1 1 71 71 LEU H H 71 8.120 8.120 8.169 -0.049 17919 54247 1 132 . 1 1 72 72 ARG N N 72 123.490 123.490 120.477 3.013 17919 54248 1 132 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.488 -0.187 17919 54249 1 132 . 1 1 72 72 ARG C C 72 175.350 175.350 176.571 -1.221 17919 54250 1 132 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.242 0.368 17919 54251 1 132 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.988 0.362 17919 54252 1 132 . 1 1 72 72 ARG H H 72 8.580 8.580 8.368 0.212 17919 54253 1 133 . 1 1 2 2 GLN N N 2 123.220 123.220 118.136 5.084 17919 54254 1 133 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.300 -0.051 17919 54255 1 133 . 1 1 2 2 GLN C C 2 175.920 175.920 174.683 1.237 17919 54256 1 133 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.759 0.321 17919 54257 1 133 . 1 1 2 2 GLN CB C 2 30.760 30.760 32.356 -1.596 17919 54258 1 133 . 1 1 2 2 GLN H H 2 8.900 8.900 8.044 0.856 17919 54259 1 133 . 1 1 3 3 ILE N N 3 115.340 115.340 117.099 -1.759 17919 54260 1 133 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.332 -0.119 17919 54261 1 133 . 1 1 3 3 ILE C C 3 172.450 172.450 173.630 -1.180 17919 54262 1 133 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.081 0.489 17919 54263 1 133 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.341 0.869 17919 54264 1 133 . 1 1 3 3 ILE H H 3 8.320 8.320 8.726 -0.406 17919 54265 1 133 . 1 1 4 4 PHE N N 4 118.110 118.110 116.290 1.820 17919 54266 1 133 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.185 0.445 17919 54267 1 133 . 1 1 4 4 PHE C C 4 175.320 175.320 174.494 0.826 17919 54268 1 133 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.978 -0.768 17919 54269 1 133 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.091 -0.611 17919 54270 1 133 . 1 1 4 4 PHE H H 4 8.610 8.610 7.833 0.777 17919 54271 1 133 . 1 1 5 5 VAL N N 5 121.000 121.000 121.609 -0.609 17919 54272 1 133 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.834 -0.109 17919 54273 1 133 . 1 1 5 5 VAL C C 5 174.870 174.870 174.840 0.030 17919 54274 1 133 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.133 -0.513 17919 54275 1 133 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.908 -0.678 17919 54276 1 133 . 1 1 5 5 VAL H H 5 9.300 9.300 8.727 0.573 17919 54277 1 133 . 1 1 6 6 LYS N N 6 127.520 127.520 129.074 -1.554 17919 54278 1 133 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.273 0.094 17919 54279 1 133 . 1 1 6 6 LYS C C 6 177.140 177.140 176.782 0.358 17919 54280 1 133 . 1 1 6 6 LYS CA C 6 54.520 54.520 55.050 -0.530 17919 54281 1 133 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.332 -0.282 17919 54282 1 133 . 1 1 6 6 LYS H H 6 8.820 8.820 8.959 -0.139 17919 54283 1 133 . 1 1 7 7 THR N N 7 115.400 115.400 116.173 -0.773 17919 54284 1 133 . 1 1 7 7 THR HA H 7 4.970 4.970 4.291 0.679 17919 54285 1 133 . 1 1 7 7 THR C C 7 176.910 176.910 176.257 0.653 17919 54286 1 133 . 1 1 7 7 THR CA C 7 60.470 60.470 61.641 -1.171 17919 54287 1 133 . 1 1 7 7 THR CB C 7 70.630 70.630 69.950 0.680 17919 54288 1 133 . 1 1 7 7 THR H H 7 8.730 8.730 8.793 -0.063 17919 54289 1 133 . 1 1 8 8 LEU N N 8 121.330 121.330 120.957 0.373 17919 54290 1 133 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.112 0.198 17919 54291 1 133 . 1 1 8 8 LEU C C 8 178.800 178.800 178.330 0.470 17919 54292 1 133 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.704 -0.124 17919 54293 1 133 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.295 0.674 17919 54294 1 133 . 1 1 8 8 LEU H H 8 9.100 9.100 8.679 0.421 17919 54295 1 133 . 1 1 9 9 THR N N 9 105.590 105.590 108.053 -2.463 17919 54296 1 133 . 1 1 9 9 THR HA H 9 4.428 4.428 4.350 0.078 17919 54297 1 133 . 1 1 9 9 THR C C 9 175.520 175.520 175.130 0.390 17919 54298 1 133 . 1 1 9 9 THR CA C 9 61.400 61.400 62.509 -1.109 17919 54299 1 133 . 1 1 9 9 THR CB C 9 69.140 69.140 69.114 0.026 17919 54300 1 133 . 1 1 9 9 THR H H 9 7.630 7.630 8.005 -0.375 17919 54301 1 133 . 1 1 10 10 GLY N N 10 108.890 108.890 110.644 -1.754 17919 54302 1 133 . 1 1 10 10 GLY C C 10 174.070 174.070 173.629 0.441 17919 54303 1 133 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.605 0.855 17919 54304 1 133 . 1 1 10 10 GLY H H 10 7.810 7.810 7.630 0.180 17919 54305 1 133 . 1 1 11 11 LYS N N 11 121.600 121.600 122.271 -0.671 17919 54306 1 133 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.464 -0.103 17919 54307 1 133 . 1 1 11 11 LYS C C 11 175.940 175.940 175.439 0.501 17919 54308 1 133 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.128 0.152 17919 54309 1 133 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.762 -0.562 17919 54310 1 133 . 1 1 11 11 LYS H H 11 7.280 7.280 8.243 -0.963 17919 54311 1 133 . 1 1 12 12 THR N N 12 120.440 120.440 117.206 3.234 17919 54312 1 133 . 1 1 12 12 THR HA H 12 5.046 5.046 5.319 -0.273 17919 54313 1 133 . 1 1 12 12 THR C C 12 174.320 174.320 174.251 0.069 17919 54314 1 133 . 1 1 12 12 THR CA C 12 62.390 62.390 61.381 1.009 17919 54315 1 133 . 1 1 12 12 THR CB C 12 69.910 69.910 71.046 -1.136 17919 54316 1 133 . 1 1 12 12 THR H H 12 8.650 8.650 8.307 0.343 17919 54317 1 133 . 1 1 13 13 ILE N N 13 127.110 127.110 124.212 2.898 17919 54318 1 133 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.410 0.134 17919 54319 1 133 . 1 1 13 13 ILE C C 13 175.220 175.220 174.975 0.245 17919 54320 1 133 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.651 -0.671 17919 54321 1 133 . 1 1 13 13 ILE CB C 13 40.950 40.950 39.669 1.281 17919 54322 1 133 . 1 1 13 13 ILE H H 13 9.450 9.450 9.083 0.367 17919 54323 1 133 . 1 1 14 14 THR N N 14 121.520 121.520 124.166 -2.646 17919 54324 1 133 . 1 1 14 14 THR HA H 14 4.964 4.964 4.496 0.468 17919 54325 1 133 . 1 1 14 14 THR C C 14 173.790 173.790 174.121 -0.331 17919 54326 1 133 . 1 1 14 14 THR CA C 14 61.940 61.940 63.936 -1.996 17919 54327 1 133 . 1 1 14 14 THR CB C 14 69.650 69.650 68.556 1.094 17919 54328 1 133 . 1 1 14 14 THR H H 14 8.710 8.710 8.726 -0.016 17919 54329 1 133 . 1 1 15 15 LEU N N 15 124.800 124.800 128.837 -4.037 17919 54330 1 133 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.689 0.091 17919 54331 1 133 . 1 1 15 15 LEU C C 15 174.670 174.670 175.771 -1.101 17919 54332 1 133 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.879 -1.049 17919 54333 1 133 . 1 1 15 15 LEU CB C 15 47.070 47.070 43.227 3.843 17919 54334 1 133 . 1 1 15 15 LEU H H 15 8.710 8.710 7.924 0.786 17919 54335 1 133 . 1 1 16 16 GLU N N 16 122.160 122.160 124.901 -2.741 17919 54336 1 133 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.834 0.083 17919 54337 1 133 . 1 1 16 16 GLU C C 16 175.860 175.860 175.581 0.279 17919 54338 1 133 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.461 -0.641 17919 54339 1 133 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.547 -1.097 17919 54340 1 133 . 1 1 16 16 GLU H H 16 8.140 8.140 8.809 -0.669 17919 54341 1 133 . 1 1 17 17 VAL N N 17 117.210 117.210 120.252 -3.042 17919 54342 1 133 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.378 0.336 17919 54343 1 133 . 1 1 17 17 VAL C C 17 174.160 174.160 175.050 -0.890 17919 54344 1 133 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.928 -1.498 17919 54345 1 133 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.181 1.218 17919 54346 1 133 . 1 1 17 17 VAL H H 17 8.900 8.900 8.266 0.634 17919 54347 1 133 . 1 1 18 18 GLU N N 18 118.990 118.990 122.953 -3.963 17919 54348 1 133 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.748 0.331 17919 54349 1 133 . 1 1 18 18 GLU C C 18 176.160 176.160 176.293 -0.133 17919 54350 1 133 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.219 -0.499 17919 54351 1 133 . 1 1 18 18 GLU CB C 18 30.310 30.310 29.936 0.374 17919 54352 1 133 . 1 1 18 18 GLU H H 18 8.640 8.640 9.515 -0.875 17919 54353 1 133 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.152 -0.011 17919 54354 1 133 . 1 1 19 19 PRO C C 19 175.310 175.310 178.495 -3.185 17919 54355 1 133 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.846 -0.375 17919 54356 1 133 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.860 0.090 17919 54357 1 133 . 1 1 20 20 SER N N 20 103.400 103.400 111.416 -8.016 17919 54358 1 133 . 1 1 20 20 SER HA H 20 4.370 4.370 4.162 0.208 17919 54359 1 133 . 1 1 20 20 SER C C 20 174.660 174.660 174.611 0.049 17919 54360 1 133 . 1 1 20 20 SER CA C 20 57.400 57.400 59.369 -1.969 17919 54361 1 133 . 1 1 20 20 SER CB C 20 63.370 63.370 62.766 0.604 17919 54362 1 133 . 1 1 20 20 SER H H 20 7.040 7.040 8.189 -1.149 17919 54363 1 133 . 1 1 21 21 ASP N N 21 123.480 123.480 122.506 0.974 17919 54364 1 133 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.645 0.050 17919 54365 1 133 . 1 1 21 21 ASP C C 21 176.360 176.360 175.799 0.561 17919 54366 1 133 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.264 0.436 17919 54367 1 133 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.241 -0.441 17919 54368 1 133 . 1 1 21 21 ASP H H 21 8.030 8.030 7.551 0.479 17919 54369 1 133 . 1 1 22 22 THR N N 22 108.800 108.800 115.246 -6.446 17919 54370 1 133 . 1 1 22 22 THR HA H 22 4.920 4.920 4.400 0.520 17919 54371 1 133 . 1 1 22 22 THR C C 22 176.750 176.750 175.816 0.934 17919 54372 1 133 . 1 1 22 22 THR CA C 22 59.690 59.690 62.531 -2.841 17919 54373 1 133 . 1 1 22 22 THR CB C 22 71.200 71.200 69.741 1.459 17919 54374 1 133 . 1 1 22 22 THR H H 22 7.900 7.900 8.318 -0.418 17919 54375 1 133 . 1 1 23 23 ILE N N 23 121.190 121.190 123.230 -2.040 17919 54376 1 133 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.868 -0.211 17919 54377 1 133 . 1 1 23 23 ILE C C 23 179.040 179.040 177.683 1.357 17919 54378 1 133 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.712 -0.452 17919 54379 1 133 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.496 -2.146 17919 54380 1 133 . 1 1 23 23 ILE H H 23 8.560 8.560 9.086 -0.526 17919 54381 1 133 . 1 1 24 24 GLU N N 24 120.830 120.830 120.603 0.227 17919 54382 1 133 . 1 1 24 24 GLU HA H 24 3.917 3.917 4.003 -0.086 17919 54383 1 133 . 1 1 24 24 GLU C C 24 178.640 178.640 178.587 0.053 17919 54384 1 133 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.001 0.219 17919 54385 1 133 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.449 -1.169 17919 54386 1 133 . 1 1 24 24 GLU H H 24 9.760 9.760 7.985 1.775 17919 54387 1 133 . 1 1 25 25 ASN N N 25 120.570 120.570 117.750 2.820 17919 54388 1 133 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.490 0.035 17919 54389 1 133 . 1 1 25 25 ASN C C 25 178.380 178.380 178.011 0.369 17919 54390 1 133 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.875 0.185 17919 54391 1 133 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.122 0.328 17919 54392 1 133 . 1 1 25 25 ASN H H 25 7.920 7.920 7.502 0.418 17919 54393 1 133 . 1 1 26 26 VAL N N 26 121.710 121.710 120.341 1.369 17919 54394 1 133 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.614 -0.217 17919 54395 1 133 . 1 1 26 26 VAL C C 26 177.950 177.950 178.117 -0.167 17919 54396 1 133 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.644 1.016 17919 54397 1 133 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.242 -0.402 17919 54398 1 133 . 1 1 26 26 VAL H H 26 8.070 8.070 8.094 -0.024 17919 54399 1 133 . 1 1 27 27 LYS N N 27 118.860 118.860 119.051 -0.191 17919 54400 1 133 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.266 0.314 17919 54401 1 133 . 1 1 27 27 LYS C C 27 180.550 180.550 179.144 1.406 17919 54402 1 133 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.527 -0.277 17919 54403 1 133 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.202 1.528 17919 54404 1 133 . 1 1 27 27 LYS H H 27 8.560 8.560 8.002 0.558 17919 54405 1 133 . 1 1 28 28 ALA N N 28 123.440 123.440 122.372 1.068 17919 54406 1 133 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.024 0.136 17919 54407 1 133 . 1 1 28 28 ALA C C 28 180.300 180.300 179.086 1.214 17919 54408 1 133 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.272 0.098 17919 54409 1 133 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.265 -0.555 17919 54410 1 133 . 1 1 28 28 ALA H H 28 8.060 8.060 7.911 0.149 17919 54411 1 133 . 1 1 29 29 LYS N N 29 119.940 119.940 119.515 0.425 17919 54412 1 133 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.059 0.148 17919 54413 1 133 . 1 1 29 29 LYS C C 29 180.320 180.320 178.994 1.326 17919 54414 1 133 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.355 0.295 17919 54415 1 133 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.401 0.889 17919 54416 1 133 . 1 1 29 29 LYS H H 29 7.850 7.850 7.538 0.312 17919 54417 1 133 . 1 1 30 30 ILE N N 30 121.080 121.080 120.239 0.841 17919 54418 1 133 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.569 -0.062 17919 54419 1 133 . 1 1 30 30 ILE C C 30 178.310 178.310 177.510 0.800 17919 54420 1 133 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.605 0.545 17919 54421 1 133 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.203 -0.403 17919 54422 1 133 . 1 1 30 30 ILE H H 30 8.280 8.280 8.543 -0.263 17919 54423 1 133 . 1 1 31 31 GLN N N 31 123.490 123.490 119.772 3.718 17919 54424 1 133 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.089 -0.260 17919 54425 1 133 . 1 1 31 31 GLN C C 31 178.890 178.890 178.568 0.322 17919 54426 1 133 . 1 1 31 31 GLN CA C 31 60.000 60.000 58.803 1.198 17919 54427 1 133 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.628 -0.908 17919 54428 1 133 . 1 1 31 31 GLN H H 31 8.580 8.580 8.228 0.352 17919 54429 1 133 . 1 1 32 32 ASP N N 32 119.360 119.360 121.131 -1.771 17919 54430 1 133 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.364 -0.010 17919 54431 1 133 . 1 1 32 32 ASP C C 32 177.250 177.250 177.790 -0.540 17919 54432 1 133 . 1 1 32 32 ASP CA C 32 57.190 57.190 57.124 0.066 17919 54433 1 133 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.781 -0.201 17919 54434 1 133 . 1 1 32 32 ASP H H 32 8.010 8.010 8.247 -0.237 17919 54435 1 133 . 1 1 33 33 LYS N N 33 115.130 115.130 118.397 -3.267 17919 54436 1 133 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.309 0.028 17919 54437 1 133 . 1 1 33 33 LYS C C 33 177.870 177.870 178.696 -0.826 17919 54438 1 133 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.856 0.194 17919 54439 1 133 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.150 1.020 17919 54440 1 133 . 1 1 33 33 LYS H H 33 7.430 7.430 7.550 -0.120 17919 54441 1 133 . 1 1 34 34 GLU N N 34 113.870 113.870 115.421 -1.551 17919 54442 1 133 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.455 0.170 17919 54443 1 133 . 1 1 34 34 GLU C C 34 177.840 177.840 177.444 0.396 17919 54444 1 133 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.817 -0.647 17919 54445 1 133 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.192 1.468 17919 54446 1 133 . 1 1 34 34 GLU H H 34 8.740 8.740 8.279 0.461 17919 54447 1 133 . 1 1 35 35 GLY N N 35 108.650 108.650 109.388 -0.738 17919 54448 1 133 . 1 1 35 35 GLY C C 35 173.960 173.960 174.476 -0.516 17919 54449 1 133 . 1 1 35 35 GLY CA C 35 46.080 46.080 46.029 0.052 17919 54450 1 133 . 1 1 35 35 GLY H H 35 8.530 8.530 8.221 0.309 17919 54451 1 133 . 1 1 36 36 ILE N N 36 119.880 119.880 118.819 1.061 17919 54452 1 133 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.384 0.061 17919 54453 1 133 . 1 1 36 36 ILE C C 36 173.590 173.590 174.248 -0.658 17919 54454 1 133 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.063 -0.313 17919 54455 1 133 . 1 1 36 36 ILE CB C 36 40.580 40.580 37.993 2.587 17919 54456 1 133 . 1 1 36 36 ILE H H 36 6.150 6.150 7.605 -1.455 17919 54457 1 133 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.954 -0.320 17919 54458 1 133 . 1 1 37 37 PRO C C 37 176.940 176.940 176.404 0.536 17919 54459 1 133 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.000 0.660 17919 54460 1 133 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.074 0.776 17919 54461 1 133 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.037 0.080 17919 54462 1 133 . 1 1 38 38 PRO C C 38 178.320 178.320 178.406 -0.086 17919 54463 1 133 . 1 1 38 38 PRO CA C 38 66.260 66.260 66.248 0.012 17919 54464 1 133 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.770 1.120 17919 54465 1 133 . 1 1 39 39 ASP N N 39 113.380 113.380 114.943 -1.563 17919 54466 1 133 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.260 0.170 17919 54467 1 133 . 1 1 39 39 ASP C C 39 177.090 177.090 177.753 -0.663 17919 54468 1 133 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.729 -1.089 17919 54469 1 133 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.472 -0.932 17919 54470 1 133 . 1 1 39 39 ASP H H 39 8.550 8.550 8.659 -0.109 17919 54471 1 133 . 1 1 40 40 GLN N N 40 116.780 116.780 116.360 0.420 17919 54472 1 133 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.248 0.216 17919 54473 1 133 . 1 1 40 40 GLN C C 40 175.380 175.380 176.659 -1.279 17919 54474 1 133 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.186 -0.546 17919 54475 1 133 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.198 0.942 17919 54476 1 133 . 1 1 40 40 GLN H H 40 7.820 7.820 7.905 -0.085 17919 54477 1 133 . 1 1 41 41 GLN N N 41 117.720 117.720 118.996 -1.276 17919 54478 1 133 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.320 -0.076 17919 54479 1 133 . 1 1 41 41 GLN C C 41 176.300 176.300 174.990 1.310 17919 54480 1 133 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.420 0.050 17919 54481 1 133 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.917 1.733 17919 54482 1 133 . 1 1 41 41 GLN H H 41 7.480 7.480 7.639 -0.159 17919 54483 1 133 . 1 1 42 42 ARG N N 42 122.680 122.680 123.107 -0.427 17919 54484 1 133 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.596 -0.096 17919 54485 1 133 . 1 1 42 42 ARG C C 42 174.050 174.050 173.788 0.262 17919 54486 1 133 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.836 0.214 17919 54487 1 133 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.625 -0.875 17919 54488 1 133 . 1 1 42 42 ARG H H 42 8.530 8.530 8.293 0.237 17919 54489 1 133 . 1 1 43 43 LEU N N 43 124.040 124.040 128.184 -4.144 17919 54490 1 133 . 1 1 43 43 LEU C C 43 175.290 175.290 175.643 -0.353 17919 54491 1 133 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.645 -0.665 17919 54492 1 133 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.031 2.759 17919 54493 1 133 . 1 1 43 43 LEU H H 43 8.820 8.820 8.779 0.041 17919 54494 1 133 . 1 1 44 44 ILE N N 44 121.920 121.920 122.660 -0.740 17919 54495 1 133 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.967 0.025 17919 54496 1 133 . 1 1 44 44 ILE C C 44 176.060 176.060 174.488 1.572 17919 54497 1 133 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.879 -0.899 17919 54498 1 133 . 1 1 44 44 ILE CB C 44 41.420 41.420 40.870 0.550 17919 54499 1 133 . 1 1 44 44 ILE H H 44 9.030 9.030 8.185 0.845 17919 54500 1 133 . 1 1 45 45 PHE N N 45 125.390 125.390 127.574 -2.184 17919 54501 1 133 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.957 0.088 17919 54502 1 133 . 1 1 45 45 PHE C C 45 174.470 174.470 174.073 0.397 17919 54503 1 133 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.610 0.410 17919 54504 1 133 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.969 0.791 17919 54505 1 133 . 1 1 45 45 PHE H H 45 8.830 8.830 9.179 -0.349 17919 54506 1 133 . 1 1 46 46 ALA N N 46 132.200 132.200 129.714 2.486 17919 54507 1 133 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.611 0.079 17919 54508 1 133 . 1 1 46 46 ALA C C 46 177.290 177.290 177.885 -0.595 17919 54509 1 133 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.055 0.485 17919 54510 1 133 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.365 0.205 17919 54511 1 133 . 1 1 46 46 ALA H H 46 8.810 8.810 8.462 0.348 17919 54512 1 133 . 1 1 47 47 GLY N N 47 102.340 102.340 104.295 -1.955 17919 54513 1 133 . 1 1 47 47 GLY C C 47 173.810 173.810 174.331 -0.521 17919 54514 1 133 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.122 0.228 17919 54515 1 133 . 1 1 47 47 GLY H H 47 8.130 8.130 8.505 -0.375 17919 54516 1 133 . 1 1 48 48 LYS N N 48 121.570 121.570 121.032 0.538 17919 54517 1 133 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.584 0.038 17919 54518 1 133 . 1 1 48 48 LYS C C 48 174.700 174.700 175.509 -0.809 17919 54519 1 133 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.011 -0.461 17919 54520 1 133 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.580 -0.050 17919 54521 1 133 . 1 1 48 48 LYS H H 48 7.980 7.980 7.856 0.124 17919 54522 1 133 . 1 1 49 49 GLN N N 49 122.410 122.410 123.010 -0.600 17919 54523 1 133 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.861 -0.301 17919 54524 1 133 . 1 1 49 49 GLN C C 49 175.670 175.670 175.510 0.160 17919 54525 1 133 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.358 0.382 17919 54526 1 133 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.988 -0.988 17919 54527 1 133 . 1 1 49 49 GLN H H 49 8.600 8.600 8.582 0.018 17919 54528 1 133 . 1 1 50 50 LEU N N 50 125.520 125.520 127.959 -2.439 17919 54529 1 133 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.085 0.005 17919 54530 1 133 . 1 1 50 50 LEU C C 50 176.660 176.660 175.685 0.975 17919 54531 1 133 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.645 0.595 17919 54532 1 133 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.734 -0.164 17919 54533 1 133 . 1 1 50 50 LEU H H 50 8.530 8.530 8.121 0.409 17919 54534 1 133 . 1 1 51 51 GLU N N 51 122.940 122.940 123.733 -0.793 17919 54535 1 133 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.387 0.101 17919 54536 1 133 . 1 1 51 51 GLU C C 51 175.870 175.870 176.985 -1.115 17919 54537 1 133 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.362 0.598 17919 54538 1 133 . 1 1 51 51 GLU CB C 51 31.570 31.570 30.445 1.125 17919 54539 1 133 . 1 1 51 51 GLU H H 51 8.400 8.400 7.830 0.570 17919 54540 1 133 . 1 1 52 52 ASP N N 52 120.030 120.030 124.690 -4.660 17919 54541 1 133 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.484 -0.125 17919 54542 1 133 . 1 1 52 52 ASP C C 52 177.330 177.330 177.750 -0.420 17919 54543 1 133 . 1 1 52 52 ASP CA C 52 56.960 56.960 56.870 0.090 17919 54544 1 133 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.974 -0.124 17919 54545 1 133 . 1 1 52 52 ASP H H 52 8.160 8.160 8.756 -0.596 17919 54546 1 133 . 1 1 53 53 GLY N N 53 106.660 106.660 106.847 -0.187 17919 54547 1 133 . 1 1 53 53 GLY C C 53 174.870 174.870 174.221 0.649 17919 54548 1 133 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.288 -0.118 17919 54549 1 133 . 1 1 53 53 GLY H H 53 9.390 9.390 8.525 0.865 17919 54550 1 133 . 1 1 54 54 ARG N N 54 119.050 119.050 119.342 -0.292 17919 54551 1 133 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.638 0.057 17919 54552 1 133 . 1 1 54 54 ARG C C 54 175.350 175.350 175.387 -0.037 17919 54553 1 133 . 1 1 54 54 ARG CA C 54 54.390 54.390 53.482 0.908 17919 54554 1 133 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.197 -0.547 17919 54555 1 133 . 1 1 54 54 ARG H H 54 7.460 7.460 7.205 0.255 17919 54556 1 133 . 1 1 55 55 THR N N 55 108.400 108.400 111.882 -3.482 17919 54557 1 133 . 1 1 55 55 THR HA H 55 5.240 5.240 4.895 0.345 17919 54558 1 133 . 1 1 55 55 THR C C 55 176.560 176.560 176.420 0.140 17919 54559 1 133 . 1 1 55 55 THR CA C 55 59.690 59.690 60.215 -0.525 17919 54560 1 133 . 1 1 55 55 THR CB C 55 72.260 72.260 70.890 1.370 17919 54561 1 133 . 1 1 55 55 THR H H 55 8.730 8.730 9.026 -0.296 17919 54562 1 133 . 1 1 56 56 LEU N N 56 117.920 117.920 121.301 -3.381 17919 54563 1 133 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.853 0.207 17919 54564 1 133 . 1 1 56 56 LEU C C 56 180.810 180.810 178.776 2.034 17919 54565 1 133 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.727 -0.017 17919 54566 1 133 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.314 -0.944 17919 54567 1 133 . 1 1 56 56 LEU H H 56 8.140 8.140 8.262 -0.122 17919 54568 1 133 . 1 1 57 57 SER N N 57 113.330 113.330 115.502 -2.172 17919 54569 1 133 . 1 1 57 57 SER HA H 57 4.370 4.370 3.988 0.382 17919 54570 1 133 . 1 1 57 57 SER C C 57 178.310 178.310 176.940 1.370 17919 54571 1 133 . 1 1 57 57 SER CA C 57 61.080 61.080 62.129 -1.049 17919 54572 1 133 . 1 1 57 57 SER CB C 57 62.530 62.530 62.596 -0.066 17919 54573 1 133 . 1 1 57 57 SER H H 57 8.470 8.470 7.995 0.475 17919 54574 1 133 . 1 1 58 58 ASP N N 58 124.190 124.190 122.004 2.186 17919 54575 1 133 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.296 0.000 17919 54576 1 133 . 1 1 58 58 ASP C C 58 177.400 177.400 177.464 -0.064 17919 54577 1 133 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.579 0.601 17919 54578 1 133 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.461 -0.361 17919 54579 1 133 . 1 1 58 58 ASP H H 58 7.930 7.930 7.986 -0.056 17919 54580 1 133 . 1 1 59 59 TYR N N 59 115.510 115.510 116.251 -0.741 17919 54581 1 133 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.607 0.063 17919 54582 1 133 . 1 1 59 59 TYR C C 59 174.700 174.700 175.173 -0.473 17919 54583 1 133 . 1 1 59 59 TYR CA C 59 58.250 58.250 56.487 1.763 17919 54584 1 133 . 1 1 59 59 TYR CB C 59 40.070 40.070 37.816 2.254 17919 54585 1 133 . 1 1 59 59 TYR H H 59 7.250 7.250 7.350 -0.100 17919 54586 1 133 . 1 1 60 60 ASN N N 60 115.900 115.900 117.547 -1.647 17919 54587 1 133 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.324 0.031 17919 54588 1 133 . 1 1 60 60 ASN C C 60 174.340 174.340 174.376 -0.036 17919 54589 1 133 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.558 -0.438 17919 54590 1 133 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.510 -0.100 17919 54591 1 133 . 1 1 60 60 ASN H H 60 8.150 8.150 8.093 0.057 17919 54592 1 133 . 1 1 61 61 ILE N N 61 118.600 118.600 119.085 -0.485 17919 54593 1 133 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.679 -0.286 17919 54594 1 133 . 1 1 61 61 ILE C C 61 174.610 174.610 175.396 -0.786 17919 54595 1 133 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.721 0.699 17919 54596 1 133 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.140 -0.400 17919 54597 1 133 . 1 1 61 61 ILE H H 61 7.250 7.250 8.158 -0.908 17919 54598 1 133 . 1 1 62 62 GLN N N 62 124.740 124.740 126.089 -1.349 17919 54599 1 133 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.509 -0.003 17919 54600 1 133 . 1 1 62 62 GLN C C 62 175.970 175.970 176.162 -0.192 17919 54601 1 133 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.837 -0.177 17919 54602 1 133 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.566 0.084 17919 54603 1 133 . 1 1 62 62 GLN H H 62 7.610 7.610 8.011 -0.401 17919 54604 1 133 . 1 1 63 63 LYS N N 63 120.300 120.300 124.525 -4.225 17919 54605 1 133 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.827 0.174 17919 54606 1 133 . 1 1 63 63 LYS C C 63 175.810 175.810 176.959 -1.149 17919 54607 1 133 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.016 -0.225 17919 54608 1 133 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.254 1.396 17919 54609 1 133 . 1 1 63 63 LYS H H 63 8.490 8.490 8.727 -0.237 17919 54610 1 133 . 1 1 64 64 GLU N N 64 113.950 113.950 120.186 -6.236 17919 54611 1 133 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.639 -0.173 17919 54612 1 133 . 1 1 64 64 GLU C C 64 175.250 175.250 175.400 -0.150 17919 54613 1 133 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.584 0.305 17919 54614 1 133 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.071 -2.171 17919 54615 1 133 . 1 1 64 64 GLU H H 64 9.280 9.280 8.470 0.810 17919 54616 1 133 . 1 1 65 65 SER N N 65 114.730 114.730 115.164 -0.434 17919 54617 1 133 . 1 1 65 65 SER HA H 65 4.640 4.640 4.392 0.248 17919 54618 1 133 . 1 1 65 65 SER C C 65 172.160 172.160 174.108 -1.948 17919 54619 1 133 . 1 1 65 65 SER CA C 65 60.890 60.890 60.449 0.441 17919 54620 1 133 . 1 1 65 65 SER CB C 65 64.910 64.910 63.960 0.950 17919 54621 1 133 . 1 1 65 65 SER H H 65 7.670 7.670 7.951 -0.281 17919 54622 1 133 . 1 1 66 66 THR N N 66 117.110 117.110 118.291 -1.181 17919 54623 1 133 . 1 1 66 66 THR HA H 66 5.270 5.270 5.186 0.084 17919 54624 1 133 . 1 1 66 66 THR C C 66 173.950 173.950 174.159 -0.209 17919 54625 1 133 . 1 1 66 66 THR CA C 66 62.340 62.340 61.921 0.419 17919 54626 1 133 . 1 1 66 66 THR CB C 66 70.080 70.080 70.638 -0.558 17919 54627 1 133 . 1 1 66 66 THR H H 66 8.730 8.730 8.291 0.439 17919 54628 1 133 . 1 1 67 67 LEU N N 67 127.110 127.110 125.744 1.366 17919 54629 1 133 . 1 1 67 67 LEU HA H 67 5.060 5.060 5.383 -0.323 17919 54630 1 133 . 1 1 67 67 LEU C C 67 175.770 175.770 175.554 0.216 17919 54631 1 133 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.178 0.722 17919 54632 1 133 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.781 -0.521 17919 54633 1 133 . 1 1 67 67 LEU H H 67 9.410 9.410 8.972 0.438 17919 54634 1 133 . 1 1 68 68 HIS N N 68 118.380 118.380 119.499 -1.119 17919 54635 1 133 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.661 -0.421 17919 54636 1 133 . 1 1 68 68 HIS C C 68 173.150 173.150 174.392 -1.242 17919 54637 1 133 . 1 1 68 68 HIS CA C 68 55.000 55.000 53.804 1.196 17919 54638 1 133 . 1 1 68 68 HIS CB C 68 30.530 30.530 33.465 -2.935 17919 54639 1 133 . 1 1 68 68 HIS H H 68 9.230 9.230 8.683 0.547 17919 54640 1 133 . 1 1 69 69 LEU N N 69 124.460 124.460 121.004 3.456 17919 54641 1 133 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.149 0.041 17919 54642 1 133 . 1 1 69 69 LEU C C 69 175.270 175.270 174.066 1.204 17919 54643 1 133 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.644 -0.754 17919 54644 1 133 . 1 1 69 69 LEU CB C 69 44.380 44.380 45.711 -1.331 17919 54645 1 133 . 1 1 69 69 LEU H H 69 8.340 8.340 7.419 0.921 17919 54646 1 133 . 1 1 70 70 VAL N N 70 126.940 126.940 125.050 1.890 17919 54647 1 133 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.410 -0.060 17919 54648 1 133 . 1 1 70 70 VAL C C 70 174.000 174.000 174.645 -0.645 17919 54649 1 133 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.946 0.854 17919 54650 1 133 . 1 1 70 70 VAL CB C 70 34.910 34.910 34.335 0.575 17919 54651 1 133 . 1 1 70 70 VAL H H 70 9.200 9.200 8.647 0.553 17919 54652 1 133 . 1 1 71 71 LEU N N 71 123.130 123.130 125.623 -2.493 17919 54653 1 133 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.567 0.493 17919 54654 1 133 . 1 1 71 71 LEU C C 71 177.830 177.830 177.525 0.305 17919 54655 1 133 . 1 1 71 71 LEU CA C 71 53.940 53.940 54.541 -0.601 17919 54656 1 133 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.797 0.053 17919 54657 1 133 . 1 1 71 71 LEU H H 71 8.120 8.120 8.545 -0.425 17919 54658 1 133 . 1 1 72 72 ARG N N 72 123.490 123.490 123.592 -0.102 17919 54659 1 133 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.271 0.030 17919 54660 1 133 . 1 1 72 72 ARG C C 72 175.350 175.350 175.122 0.228 17919 54661 1 133 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.446 -0.836 17919 54662 1 133 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.790 0.560 17919 54663 1 133 . 1 1 72 72 ARG H H 72 8.580 8.580 8.377 0.203 17919 54664 1 134 . 1 1 2 2 GLN N N 2 123.220 123.220 126.725 -3.505 17919 54665 1 134 . 1 1 2 2 GLN HA H 2 5.249 5.249 4.834 0.415 17919 54666 1 134 . 1 1 2 2 GLN C C 2 175.920 175.920 174.829 1.091 17919 54667 1 134 . 1 1 2 2 GLN CA C 2 55.080 55.080 55.956 -0.876 17919 54668 1 134 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.034 0.727 17919 54669 1 134 . 1 1 2 2 GLN H H 2 8.900 8.900 8.536 0.364 17919 54670 1 134 . 1 1 3 3 ILE N N 3 115.340 115.340 118.303 -2.963 17919 54671 1 134 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.067 0.146 17919 54672 1 134 . 1 1 3 3 ILE C C 3 172.450 172.450 172.780 -0.330 17919 54673 1 134 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.410 0.160 17919 54674 1 134 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.637 0.573 17919 54675 1 134 . 1 1 3 3 ILE H H 3 8.320 8.320 8.729 -0.409 17919 54676 1 134 . 1 1 4 4 PHE N N 4 118.110 118.110 119.425 -1.315 17919 54677 1 134 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.483 0.147 17919 54678 1 134 . 1 1 4 4 PHE C C 4 175.320 175.320 175.512 -0.192 17919 54679 1 134 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.697 -0.487 17919 54680 1 134 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.663 -0.183 17919 54681 1 134 . 1 1 4 4 PHE H H 4 8.610 8.610 7.779 0.831 17919 54682 1 134 . 1 1 5 5 VAL N N 5 121.000 121.000 121.518 -0.518 17919 54683 1 134 . 1 1 5 5 VAL HA H 5 4.725 4.725 5.199 -0.474 17919 54684 1 134 . 1 1 5 5 VAL C C 5 174.870 174.870 174.608 0.262 17919 54685 1 134 . 1 1 5 5 VAL CA C 5 60.620 60.620 60.993 -0.373 17919 54686 1 134 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.554 -0.325 17919 54687 1 134 . 1 1 5 5 VAL H H 5 9.300 9.300 9.026 0.274 17919 54688 1 134 . 1 1 6 6 LYS N N 6 127.520 127.520 126.701 0.819 17919 54689 1 134 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.457 -0.090 17919 54690 1 134 . 1 1 6 6 LYS C C 6 177.140 177.140 175.985 1.155 17919 54691 1 134 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.132 0.388 17919 54692 1 134 . 1 1 6 6 LYS CB C 6 35.050 35.050 36.403 -1.353 17919 54693 1 134 . 1 1 6 6 LYS H H 6 8.820 8.820 9.100 -0.280 17919 54694 1 134 . 1 1 7 7 THR N N 7 115.400 115.400 116.407 -1.007 17919 54695 1 134 . 1 1 7 7 THR HA H 7 4.970 4.970 4.529 0.441 17919 54696 1 134 . 1 1 7 7 THR C C 7 176.910 176.910 175.851 1.059 17919 54697 1 134 . 1 1 7 7 THR CA C 7 60.470 60.470 60.741 -0.271 17919 54698 1 134 . 1 1 7 7 THR CB C 7 70.630 70.630 70.704 -0.074 17919 54699 1 134 . 1 1 7 7 THR H H 7 8.730 8.730 8.560 0.170 17919 54700 1 134 . 1 1 8 8 LEU N N 8 121.330 121.330 123.723 -2.393 17919 54701 1 134 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.412 -0.102 17919 54702 1 134 . 1 1 8 8 LEU C C 8 178.800 178.800 177.798 1.002 17919 54703 1 134 . 1 1 8 8 LEU CA C 8 57.580 57.580 56.786 0.794 17919 54704 1 134 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.205 -0.235 17919 54705 1 134 . 1 1 8 8 LEU H H 8 9.100 9.100 8.535 0.565 17919 54706 1 134 . 1 1 9 9 THR N N 9 105.590 105.590 108.139 -2.549 17919 54707 1 134 . 1 1 9 9 THR HA H 9 4.428 4.428 4.268 0.160 17919 54708 1 134 . 1 1 9 9 THR C C 9 175.520 175.520 175.517 0.003 17919 54709 1 134 . 1 1 9 9 THR CA C 9 61.400 61.400 62.151 -0.751 17919 54710 1 134 . 1 1 9 9 THR CB C 9 69.140 69.140 68.500 0.640 17919 54711 1 134 . 1 1 9 9 THR H H 9 7.630 7.630 7.754 -0.124 17919 54712 1 134 . 1 1 10 10 GLY N N 10 108.890 108.890 111.122 -2.232 17919 54713 1 134 . 1 1 10 10 GLY C C 10 174.070 174.070 173.653 0.417 17919 54714 1 134 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.859 0.601 17919 54715 1 134 . 1 1 10 10 GLY H H 10 7.810 7.810 7.837 -0.027 17919 54716 1 134 . 1 1 11 11 LYS N N 11 121.600 121.600 122.065 -0.465 17919 54717 1 134 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.348 0.013 17919 54718 1 134 . 1 1 11 11 LYS C C 11 175.940 175.940 175.409 0.531 17919 54719 1 134 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.240 0.040 17919 54720 1 134 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.689 -0.489 17919 54721 1 134 . 1 1 11 11 LYS H H 11 7.280 7.280 7.578 -0.298 17919 54722 1 134 . 1 1 12 12 THR N N 12 120.440 120.440 118.112 2.328 17919 54723 1 134 . 1 1 12 12 THR HA H 12 5.046 5.046 5.159 -0.113 17919 54724 1 134 . 1 1 12 12 THR C C 12 174.320 174.320 174.051 0.269 17919 54725 1 134 . 1 1 12 12 THR CA C 12 62.390 62.390 61.206 1.183 17919 54726 1 134 . 1 1 12 12 THR CB C 12 69.910 69.910 70.566 -0.656 17919 54727 1 134 . 1 1 12 12 THR H H 12 8.650 8.650 8.299 0.351 17919 54728 1 134 . 1 1 13 13 ILE N N 13 127.110 127.110 127.908 -0.798 17919 54729 1 134 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.512 0.032 17919 54730 1 134 . 1 1 13 13 ILE C C 13 175.220 175.220 175.145 0.075 17919 54731 1 134 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.425 -0.445 17919 54732 1 134 . 1 1 13 13 ILE CB C 13 40.950 40.950 39.717 1.233 17919 54733 1 134 . 1 1 13 13 ILE H H 13 9.450 9.450 9.313 0.137 17919 54734 1 134 . 1 1 14 14 THR N N 14 121.520 121.520 123.505 -1.985 17919 54735 1 134 . 1 1 14 14 THR HA H 14 4.964 4.964 5.014 -0.050 17919 54736 1 134 . 1 1 14 14 THR C C 14 173.790 173.790 173.602 0.188 17919 54737 1 134 . 1 1 14 14 THR CA C 14 61.940 61.940 62.208 -0.268 17919 54738 1 134 . 1 1 14 14 THR CB C 14 69.650 69.650 70.176 -0.526 17919 54739 1 134 . 1 1 14 14 THR H H 14 8.710 8.710 8.562 0.148 17919 54740 1 134 . 1 1 15 15 LEU N N 15 124.800 124.800 128.174 -3.374 17919 54741 1 134 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.680 0.100 17919 54742 1 134 . 1 1 15 15 LEU C C 15 174.670 174.670 174.304 0.366 17919 54743 1 134 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.931 -1.101 17919 54744 1 134 . 1 1 15 15 LEU CB C 15 47.070 47.070 46.445 0.625 17919 54745 1 134 . 1 1 15 15 LEU H H 15 8.710 8.710 9.055 -0.345 17919 54746 1 134 . 1 1 16 16 GLU N N 16 122.160 122.160 125.854 -3.694 17919 54747 1 134 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.455 0.462 17919 54748 1 134 . 1 1 16 16 GLU C C 16 175.860 175.860 175.217 0.643 17919 54749 1 134 . 1 1 16 16 GLU CA C 16 54.820 54.820 54.807 0.013 17919 54750 1 134 . 1 1 16 16 GLU CB C 16 29.450 29.450 29.532 -0.082 17919 54751 1 134 . 1 1 16 16 GLU H H 16 8.140 8.140 8.544 -0.404 17919 54752 1 134 . 1 1 17 17 VAL N N 17 117.210 117.210 122.013 -4.803 17919 54753 1 134 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.434 0.280 17919 54754 1 134 . 1 1 17 17 VAL C C 17 174.160 174.160 175.157 -0.997 17919 54755 1 134 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.132 -0.702 17919 54756 1 134 . 1 1 17 17 VAL CB C 17 36.400 36.400 34.808 1.592 17919 54757 1 134 . 1 1 17 17 VAL H H 17 8.900 8.900 8.113 0.787 17919 54758 1 134 . 1 1 18 18 GLU N N 18 118.990 118.990 119.750 -0.760 17919 54759 1 134 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.804 0.275 17919 54760 1 134 . 1 1 18 18 GLU C C 18 176.160 176.160 175.814 0.346 17919 54761 1 134 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.010 -0.290 17919 54762 1 134 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.992 -0.682 17919 54763 1 134 . 1 1 18 18 GLU H H 18 8.640 8.640 8.137 0.503 17919 54764 1 134 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.191 -0.050 17919 54765 1 134 . 1 1 19 19 PRO C C 19 175.310 175.310 178.090 -2.780 17919 54766 1 134 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.715 -0.245 17919 54767 1 134 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.048 -0.098 17919 54768 1 134 . 1 1 20 20 SER N N 20 103.400 103.400 109.732 -6.332 17919 54769 1 134 . 1 1 20 20 SER HA H 20 4.370 4.370 4.208 0.162 17919 54770 1 134 . 1 1 20 20 SER C C 20 174.660 174.660 174.972 -0.312 17919 54771 1 134 . 1 1 20 20 SER CA C 20 57.400 57.400 58.946 -1.546 17919 54772 1 134 . 1 1 20 20 SER CB C 20 63.370 63.370 62.722 0.648 17919 54773 1 134 . 1 1 20 20 SER H H 20 7.040 7.040 7.979 -0.939 17919 54774 1 134 . 1 1 21 21 ASP N N 21 123.480 123.480 124.751 -1.271 17919 54775 1 134 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.556 0.139 17919 54776 1 134 . 1 1 21 21 ASP C C 21 176.360 176.360 175.902 0.458 17919 54777 1 134 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.679 0.021 17919 54778 1 134 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.783 -0.984 17919 54779 1 134 . 1 1 21 21 ASP H H 21 8.030 8.030 7.653 0.377 17919 54780 1 134 . 1 1 22 22 THR N N 22 108.800 108.800 116.200 -7.400 17919 54781 1 134 . 1 1 22 22 THR HA H 22 4.920 4.920 4.562 0.358 17919 54782 1 134 . 1 1 22 22 THR C C 22 176.750 176.750 175.853 0.897 17919 54783 1 134 . 1 1 22 22 THR CA C 22 59.690 59.690 61.456 -1.766 17919 54784 1 134 . 1 1 22 22 THR CB C 22 71.200 71.200 70.068 1.132 17919 54785 1 134 . 1 1 22 22 THR H H 22 7.900 7.900 8.187 -0.287 17919 54786 1 134 . 1 1 23 23 ILE N N 23 121.190 121.190 122.963 -1.773 17919 54787 1 134 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.818 -0.161 17919 54788 1 134 . 1 1 23 23 ILE C C 23 179.040 179.040 177.802 1.238 17919 54789 1 134 . 1 1 23 23 ILE CA C 23 62.260 62.260 61.361 0.899 17919 54790 1 134 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.192 -1.842 17919 54791 1 134 . 1 1 23 23 ILE H H 23 8.560 8.560 8.989 -0.429 17919 54792 1 134 . 1 1 24 24 GLU N N 24 120.830 120.830 120.996 -0.166 17919 54793 1 134 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.850 0.067 17919 54794 1 134 . 1 1 24 24 GLU C C 24 178.640 178.640 178.493 0.147 17919 54795 1 134 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.297 -0.077 17919 54796 1 134 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.471 -1.192 17919 54797 1 134 . 1 1 24 24 GLU H H 24 9.760 9.760 8.646 1.114 17919 54798 1 134 . 1 1 25 25 ASN N N 25 120.570 120.570 116.688 3.882 17919 54799 1 134 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.535 -0.010 17919 54800 1 134 . 1 1 25 25 ASN C C 25 178.380 178.380 177.953 0.427 17919 54801 1 134 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.960 0.100 17919 54802 1 134 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.376 0.074 17919 54803 1 134 . 1 1 25 25 ASN H H 25 7.920 7.920 7.424 0.496 17919 54804 1 134 . 1 1 26 26 VAL N N 26 121.710 121.710 121.207 0.503 17919 54805 1 134 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.508 -0.111 17919 54806 1 134 . 1 1 26 26 VAL C C 26 177.950 177.950 177.882 0.068 17919 54807 1 134 . 1 1 26 26 VAL CA C 26 67.660 67.660 67.096 0.564 17919 54808 1 134 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.522 -0.682 17919 54809 1 134 . 1 1 26 26 VAL H H 26 8.070 8.070 7.874 0.196 17919 54810 1 134 . 1 1 27 27 LYS N N 27 118.860 118.860 119.415 -0.555 17919 54811 1 134 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.137 0.443 17919 54812 1 134 . 1 1 27 27 LYS C C 27 180.550 180.550 179.089 1.461 17919 54813 1 134 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.548 -0.298 17919 54814 1 134 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.185 1.545 17919 54815 1 134 . 1 1 27 27 LYS H H 27 8.560 8.560 8.179 0.381 17919 54816 1 134 . 1 1 28 28 ALA N N 28 123.440 123.440 122.768 0.672 17919 54817 1 134 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.000 0.160 17919 54818 1 134 . 1 1 28 28 ALA C C 28 180.300 180.300 179.073 1.227 17919 54819 1 134 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.344 0.026 17919 54820 1 134 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.338 -0.628 17919 54821 1 134 . 1 1 28 28 ALA H H 28 8.060 8.060 8.109 -0.049 17919 54822 1 134 . 1 1 29 29 LYS N N 29 119.940 119.940 119.545 0.395 17919 54823 1 134 . 1 1 29 29 LYS HA H 29 4.207 4.207 3.988 0.219 17919 54824 1 134 . 1 1 29 29 LYS C C 29 180.320 180.320 179.498 0.822 17919 54825 1 134 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.420 0.230 17919 54826 1 134 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.309 0.981 17919 54827 1 134 . 1 1 29 29 LYS H H 29 7.850 7.850 7.524 0.326 17919 54828 1 134 . 1 1 30 30 ILE N N 30 121.080 121.080 120.051 1.029 17919 54829 1 134 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.556 -0.049 17919 54830 1 134 . 1 1 30 30 ILE C C 30 178.310 178.310 177.466 0.844 17919 54831 1 134 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.456 0.695 17919 54832 1 134 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.766 -0.966 17919 54833 1 134 . 1 1 30 30 ILE H H 30 8.280 8.280 8.314 -0.034 17919 54834 1 134 . 1 1 31 31 GLN N N 31 123.490 123.490 120.332 3.158 17919 54835 1 134 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.907 -0.078 17919 54836 1 134 . 1 1 31 31 GLN C C 31 178.890 178.890 178.164 0.726 17919 54837 1 134 . 1 1 31 31 GLN CA C 31 60.000 60.000 58.987 1.013 17919 54838 1 134 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.582 -0.862 17919 54839 1 134 . 1 1 31 31 GLN H H 31 8.580 8.580 8.029 0.551 17919 54840 1 134 . 1 1 32 32 ASP N N 32 119.360 119.360 117.763 1.597 17919 54841 1 134 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.514 -0.160 17919 54842 1 134 . 1 1 32 32 ASP C C 32 177.250 177.250 177.173 0.077 17919 54843 1 134 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.250 0.940 17919 54844 1 134 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.681 -0.101 17919 54845 1 134 . 1 1 32 32 ASP H H 32 8.010 8.010 8.558 -0.548 17919 54846 1 134 . 1 1 33 33 LYS N N 33 115.130 115.130 118.975 -3.845 17919 54847 1 134 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.321 0.016 17919 54848 1 134 . 1 1 33 33 LYS C C 33 177.870 177.870 177.980 -0.110 17919 54849 1 134 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.881 0.169 17919 54850 1 134 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.909 0.261 17919 54851 1 134 . 1 1 33 33 LYS H H 33 7.430 7.430 7.302 0.128 17919 54852 1 134 . 1 1 34 34 GLU N N 34 113.870 113.870 117.157 -3.287 17919 54853 1 134 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.390 0.235 17919 54854 1 134 . 1 1 34 34 GLU C C 34 177.840 177.840 177.816 0.024 17919 54855 1 134 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.447 -1.277 17919 54856 1 134 . 1 1 34 34 GLU CB C 34 32.660 32.660 30.274 2.386 17919 54857 1 134 . 1 1 34 34 GLU H H 34 8.740 8.740 8.112 0.628 17919 54858 1 134 . 1 1 35 35 GLY N N 35 108.650 108.650 109.532 -0.882 17919 54859 1 134 . 1 1 35 35 GLY C C 35 173.960 173.960 174.287 -0.327 17919 54860 1 134 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.821 0.259 17919 54861 1 134 . 1 1 35 35 GLY H H 35 8.530 8.530 8.175 0.355 17919 54862 1 134 . 1 1 36 36 ILE N N 36 119.880 119.880 121.650 -1.770 17919 54863 1 134 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.239 0.206 17919 54864 1 134 . 1 1 36 36 ILE C C 36 173.590 173.590 174.351 -0.761 17919 54865 1 134 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.982 -0.232 17919 54866 1 134 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.549 2.031 17919 54867 1 134 . 1 1 36 36 ILE H H 36 6.150 6.150 7.604 -1.454 17919 54868 1 134 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.675 -0.041 17919 54869 1 134 . 1 1 37 37 PRO C C 37 176.940 176.940 176.333 0.607 17919 54870 1 134 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.331 0.329 17919 54871 1 134 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.202 0.648 17919 54872 1 134 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.200 -0.083 17919 54873 1 134 . 1 1 38 38 PRO C C 38 178.320 178.320 178.449 -0.129 17919 54874 1 134 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.793 0.467 17919 54875 1 134 . 1 1 38 38 PRO CB C 38 32.890 32.890 32.018 0.872 17919 54876 1 134 . 1 1 39 39 ASP N N 39 113.380 113.380 116.104 -2.724 17919 54877 1 134 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.463 -0.033 17919 54878 1 134 . 1 1 39 39 ASP C C 39 177.090 177.090 177.357 -0.267 17919 54879 1 134 . 1 1 39 39 ASP CA C 39 55.640 55.640 55.854 -0.214 17919 54880 1 134 . 1 1 39 39 ASP CB C 39 39.540 39.540 39.923 -0.383 17919 54881 1 134 . 1 1 39 39 ASP H H 39 8.550 8.550 8.758 -0.208 17919 54882 1 134 . 1 1 40 40 GLN N N 40 116.780 116.780 116.932 -0.152 17919 54883 1 134 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.250 0.214 17919 54884 1 134 . 1 1 40 40 GLN C C 40 175.380 175.380 176.136 -0.756 17919 54885 1 134 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.280 -0.640 17919 54886 1 134 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.087 1.053 17919 54887 1 134 . 1 1 40 40 GLN H H 40 7.820 7.820 7.670 0.150 17919 54888 1 134 . 1 1 41 41 GLN N N 41 117.720 117.720 119.227 -1.507 17919 54889 1 134 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.439 -0.195 17919 54890 1 134 . 1 1 41 41 GLN C C 41 176.300 176.300 174.853 1.447 17919 54891 1 134 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.636 0.834 17919 54892 1 134 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.575 2.075 17919 54893 1 134 . 1 1 41 41 GLN H H 41 7.480 7.480 7.646 -0.166 17919 54894 1 134 . 1 1 42 42 ARG N N 42 122.680 122.680 126.232 -3.552 17919 54895 1 134 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.541 -0.041 17919 54896 1 134 . 1 1 42 42 ARG C C 42 174.050 174.050 174.179 -0.129 17919 54897 1 134 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.540 -0.490 17919 54898 1 134 . 1 1 42 42 ARG CB C 42 31.750 31.750 31.593 0.157 17919 54899 1 134 . 1 1 42 42 ARG H H 42 8.530 8.530 7.978 0.552 17919 54900 1 134 . 1 1 43 43 LEU N N 43 124.040 124.040 128.476 -4.436 17919 54901 1 134 . 1 1 43 43 LEU C C 43 175.290 175.290 175.846 -0.556 17919 54902 1 134 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.767 -0.787 17919 54903 1 134 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.221 1.569 17919 54904 1 134 . 1 1 43 43 LEU H H 43 8.820 8.820 8.732 0.088 17919 54905 1 134 . 1 1 44 44 ILE N N 44 121.920 121.920 121.977 -0.057 17919 54906 1 134 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.062 -0.070 17919 54907 1 134 . 1 1 44 44 ILE C C 44 176.060 176.060 174.688 1.372 17919 54908 1 134 . 1 1 44 44 ILE CA C 44 58.980 58.980 58.797 0.183 17919 54909 1 134 . 1 1 44 44 ILE CB C 44 41.420 41.420 40.484 0.936 17919 54910 1 134 . 1 1 44 44 ILE H H 44 9.030 9.030 9.264 -0.234 17919 54911 1 134 . 1 1 45 45 PHE N N 45 125.390 125.390 125.825 -0.435 17919 54912 1 134 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.859 0.186 17919 54913 1 134 . 1 1 45 45 PHE C C 45 174.470 174.470 173.880 0.590 17919 54914 1 134 . 1 1 45 45 PHE CA C 45 57.020 57.020 57.664 -0.644 17919 54915 1 134 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.726 1.034 17919 54916 1 134 . 1 1 45 45 PHE H H 45 8.830 8.830 9.108 -0.278 17919 54917 1 134 . 1 1 46 46 ALA N N 46 132.200 132.200 130.132 2.068 17919 54918 1 134 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.558 0.132 17919 54919 1 134 . 1 1 46 46 ALA C C 46 177.290 177.290 177.475 -0.185 17919 54920 1 134 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.944 -0.404 17919 54921 1 134 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.539 0.031 17919 54922 1 134 . 1 1 46 46 ALA H H 46 8.810 8.810 8.675 0.135 17919 54923 1 134 . 1 1 47 47 GLY N N 47 102.340 102.340 103.741 -1.401 17919 54924 1 134 . 1 1 47 47 GLY C C 47 173.810 173.810 174.570 -0.760 17919 54925 1 134 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.280 0.070 17919 54926 1 134 . 1 1 47 47 GLY H H 47 8.130 8.130 8.378 -0.248 17919 54927 1 134 . 1 1 48 48 LYS N N 48 121.570 121.570 121.966 -0.396 17919 54928 1 134 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.462 0.160 17919 54929 1 134 . 1 1 48 48 LYS C C 48 174.700 174.700 175.732 -1.032 17919 54930 1 134 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.279 -0.729 17919 54931 1 134 . 1 1 48 48 LYS CB C 48 34.530 34.530 33.833 0.697 17919 54932 1 134 . 1 1 48 48 LYS H H 48 7.980 7.980 7.840 0.140 17919 54933 1 134 . 1 1 49 49 GLN N N 49 122.410 122.410 125.738 -3.328 17919 54934 1 134 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.525 0.035 17919 54935 1 134 . 1 1 49 49 GLN C C 49 175.670 175.670 175.259 0.411 17919 54936 1 134 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.376 -0.636 17919 54937 1 134 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.529 -0.529 17919 54938 1 134 . 1 1 49 49 GLN H H 49 8.600 8.600 8.605 -0.005 17919 54939 1 134 . 1 1 50 50 LEU N N 50 125.520 125.520 128.036 -2.516 17919 54940 1 134 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.211 -0.121 17919 54941 1 134 . 1 1 50 50 LEU C C 50 176.660 176.660 175.866 0.794 17919 54942 1 134 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.901 0.339 17919 54943 1 134 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.621 -1.051 17919 54944 1 134 . 1 1 50 50 LEU H H 50 8.530 8.530 8.571 -0.041 17919 54945 1 134 . 1 1 51 51 GLU N N 51 122.940 122.940 123.631 -0.691 17919 54946 1 134 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.452 0.036 17919 54947 1 134 . 1 1 51 51 GLU C C 51 175.870 175.870 176.270 -0.400 17919 54948 1 134 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.441 0.519 17919 54949 1 134 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.157 0.413 17919 54950 1 134 . 1 1 51 51 GLU H H 51 8.400 8.400 8.057 0.343 17919 54951 1 134 . 1 1 52 52 ASP N N 52 120.030 120.030 122.822 -2.792 17919 54952 1 134 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.547 -0.188 17919 54953 1 134 . 1 1 52 52 ASP C C 52 177.330 177.330 177.704 -0.374 17919 54954 1 134 . 1 1 52 52 ASP CA C 52 56.960 56.960 56.055 0.905 17919 54955 1 134 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.792 0.058 17919 54956 1 134 . 1 1 52 52 ASP H H 52 8.160 8.160 8.810 -0.650 17919 54957 1 134 . 1 1 53 53 GLY N N 53 106.660 106.660 106.343 0.317 17919 54958 1 134 . 1 1 53 53 GLY C C 53 174.870 174.870 174.467 0.403 17919 54959 1 134 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.762 0.408 17919 54960 1 134 . 1 1 53 53 GLY H H 53 9.390 9.390 8.432 0.958 17919 54961 1 134 . 1 1 54 54 ARG N N 54 119.050 119.050 120.514 -1.464 17919 54962 1 134 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.509 0.186 17919 54963 1 134 . 1 1 54 54 ARG C C 54 175.350 175.350 175.592 -0.242 17919 54964 1 134 . 1 1 54 54 ARG CA C 54 54.390 54.390 55.020 -0.630 17919 54965 1 134 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.450 0.200 17919 54966 1 134 . 1 1 54 54 ARG H H 54 7.460 7.460 7.409 0.051 17919 54967 1 134 . 1 1 55 55 THR N N 55 108.400 108.400 113.411 -5.011 17919 54968 1 134 . 1 1 55 55 THR HA H 55 5.240 5.240 4.887 0.353 17919 54969 1 134 . 1 1 55 55 THR C C 55 176.560 176.560 176.003 0.557 17919 54970 1 134 . 1 1 55 55 THR CA C 55 59.690 59.690 60.818 -1.128 17919 54971 1 134 . 1 1 55 55 THR CB C 55 72.260 72.260 70.285 1.975 17919 54972 1 134 . 1 1 55 55 THR H H 55 8.730 8.730 8.950 -0.220 17919 54973 1 134 . 1 1 56 56 LEU N N 56 117.920 117.920 121.634 -3.714 17919 54974 1 134 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.026 0.034 17919 54975 1 134 . 1 1 56 56 LEU C C 56 180.810 180.810 178.664 2.146 17919 54976 1 134 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.261 0.449 17919 54977 1 134 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.466 -1.096 17919 54978 1 134 . 1 1 56 56 LEU H H 56 8.140 8.140 8.552 -0.412 17919 54979 1 134 . 1 1 57 57 SER N N 57 113.330 113.330 115.369 -2.039 17919 54980 1 134 . 1 1 57 57 SER HA H 57 4.370 4.370 4.155 0.215 17919 54981 1 134 . 1 1 57 57 SER C C 57 178.310 178.310 176.693 1.617 17919 54982 1 134 . 1 1 57 57 SER CA C 57 61.080 61.080 62.058 -0.978 17919 54983 1 134 . 1 1 57 57 SER CB C 57 62.530 62.530 62.423 0.107 17919 54984 1 134 . 1 1 57 57 SER H H 57 8.470 8.470 8.011 0.460 17919 54985 1 134 . 1 1 58 58 ASP N N 58 124.190 124.190 122.894 1.296 17919 54986 1 134 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.181 0.115 17919 54987 1 134 . 1 1 58 58 ASP C C 58 177.400 177.400 177.694 -0.294 17919 54988 1 134 . 1 1 58 58 ASP CA C 58 57.180 57.180 57.037 0.143 17919 54989 1 134 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.226 -0.126 17919 54990 1 134 . 1 1 58 58 ASP H H 58 7.930 7.930 7.579 0.351 17919 54991 1 134 . 1 1 59 59 TYR N N 59 115.510 115.510 115.087 0.423 17919 54992 1 134 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.735 -0.065 17919 54993 1 134 . 1 1 59 59 TYR C C 59 174.700 174.700 174.853 -0.153 17919 54994 1 134 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.101 1.149 17919 54995 1 134 . 1 1 59 59 TYR CB C 59 40.070 40.070 37.908 2.162 17919 54996 1 134 . 1 1 59 59 TYR H H 59 7.250 7.250 7.211 0.039 17919 54997 1 134 . 1 1 60 60 ASN N N 60 115.900 115.900 115.182 0.718 17919 54998 1 134 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.327 0.028 17919 54999 1 134 . 1 1 60 60 ASN C C 60 174.340 174.340 174.487 -0.147 17919 55000 1 134 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.249 -0.129 17919 55001 1 134 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.138 0.272 17919 55002 1 134 . 1 1 60 60 ASN H H 60 8.150 8.150 8.133 0.017 17919 55003 1 134 . 1 1 61 61 ILE N N 61 118.600 118.600 120.175 -1.575 17919 55004 1 134 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.907 -0.514 17919 55005 1 134 . 1 1 61 61 ILE C C 61 174.610 174.610 175.655 -1.045 17919 55006 1 134 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.490 0.930 17919 55007 1 134 . 1 1 61 61 ILE CB C 61 36.740 36.740 36.767 -0.027 17919 55008 1 134 . 1 1 61 61 ILE H H 61 7.250 7.250 7.894 -0.644 17919 55009 1 134 . 1 1 62 62 GLN N N 62 124.740 124.740 126.431 -1.691 17919 55010 1 134 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.637 -0.131 17919 55011 1 134 . 1 1 62 62 GLN C C 62 175.970 175.970 176.165 -0.195 17919 55012 1 134 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.908 -0.248 17919 55013 1 134 . 1 1 62 62 GLN CB C 62 31.650 31.650 30.957 0.693 17919 55014 1 134 . 1 1 62 62 GLN H H 62 7.610 7.610 7.881 -0.271 17919 55015 1 134 . 1 1 63 63 LYS N N 63 120.300 120.300 119.996 0.304 17919 55016 1 134 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.813 0.188 17919 55017 1 134 . 1 1 63 63 LYS C C 63 175.810 175.810 176.294 -0.484 17919 55018 1 134 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.903 -0.113 17919 55019 1 134 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.832 0.818 17919 55020 1 134 . 1 1 63 63 LYS H H 63 8.490 8.490 8.432 0.058 17919 55021 1 134 . 1 1 64 64 GLU N N 64 113.950 113.950 117.301 -3.351 17919 55022 1 134 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.718 -0.253 17919 55023 1 134 . 1 1 64 64 GLU C C 64 175.250 175.250 176.007 -0.757 17919 55024 1 134 . 1 1 64 64 GLU CA C 64 57.890 57.890 58.463 -0.573 17919 55025 1 134 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.182 -2.282 17919 55026 1 134 . 1 1 64 64 GLU H H 64 9.280 9.280 8.589 0.691 17919 55027 1 134 . 1 1 65 65 SER N N 65 114.730 114.730 115.756 -1.026 17919 55028 1 134 . 1 1 65 65 SER HA H 65 4.640 4.640 4.479 0.161 17919 55029 1 134 . 1 1 65 65 SER C C 65 172.160 172.160 174.623 -2.463 17919 55030 1 134 . 1 1 65 65 SER CA C 65 60.890 60.890 59.972 0.918 17919 55031 1 134 . 1 1 65 65 SER CB C 65 64.910 64.910 63.624 1.286 17919 55032 1 134 . 1 1 65 65 SER H H 65 7.670 7.670 7.613 0.057 17919 55033 1 134 . 1 1 66 66 THR N N 66 117.110 117.110 121.998 -4.888 17919 55034 1 134 . 1 1 66 66 THR HA H 66 5.270 5.270 4.635 0.635 17919 55035 1 134 . 1 1 66 66 THR C C 66 173.950 173.950 174.627 -0.677 17919 55036 1 134 . 1 1 66 66 THR CA C 66 62.340 62.340 63.151 -0.811 17919 55037 1 134 . 1 1 66 66 THR CB C 66 70.080 70.080 68.973 1.107 17919 55038 1 134 . 1 1 66 66 THR H H 66 8.730 8.730 8.504 0.226 17919 55039 1 134 . 1 1 67 67 LEU N N 67 127.110 127.110 129.367 -2.257 17919 55040 1 134 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.425 0.635 17919 55041 1 134 . 1 1 67 67 LEU C C 67 175.770 175.770 175.889 -0.119 17919 55042 1 134 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.880 -0.980 17919 55043 1 134 . 1 1 67 67 LEU CB C 67 44.260 44.260 42.842 1.418 17919 55044 1 134 . 1 1 67 67 LEU H H 67 9.410 9.410 9.011 0.399 17919 55045 1 134 . 1 1 68 68 HIS N N 68 118.380 118.380 123.288 -4.908 17919 55046 1 134 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.624 -0.384 17919 55047 1 134 . 1 1 68 68 HIS C C 68 173.150 173.150 173.226 -0.076 17919 55048 1 134 . 1 1 68 68 HIS CA C 68 55.000 55.000 53.990 1.010 17919 55049 1 134 . 1 1 68 68 HIS CB C 68 30.530 30.530 33.995 -3.465 17919 55050 1 134 . 1 1 68 68 HIS H H 68 9.230 9.230 9.276 -0.046 17919 55051 1 134 . 1 1 69 69 LEU N N 69 124.460 124.460 125.605 -1.145 17919 55052 1 134 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.077 0.113 17919 55053 1 134 . 1 1 69 69 LEU C C 69 175.270 175.270 174.007 1.263 17919 55054 1 134 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.642 0.248 17919 55055 1 134 . 1 1 69 69 LEU CB C 69 44.380 44.380 45.643 -1.263 17919 55056 1 134 . 1 1 69 69 LEU H H 69 8.340 8.340 7.734 0.606 17919 55057 1 134 . 1 1 70 70 VAL N N 70 126.940 126.940 121.398 5.542 17919 55058 1 134 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.639 -0.289 17919 55059 1 134 . 1 1 70 70 VAL C C 70 174.000 174.000 173.897 0.103 17919 55060 1 134 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.617 1.183 17919 55061 1 134 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.586 -0.676 17919 55062 1 134 . 1 1 70 70 VAL H H 70 9.200 9.200 8.359 0.841 17919 55063 1 134 . 1 1 71 71 LEU N N 71 123.130 123.130 123.403 -0.273 17919 55064 1 134 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.683 0.377 17919 55065 1 134 . 1 1 71 71 LEU C C 71 177.830 177.830 177.357 0.473 17919 55066 1 134 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.189 0.751 17919 55067 1 134 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.969 -0.119 17919 55068 1 134 . 1 1 71 71 LEU H H 71 8.120 8.120 8.336 -0.216 17919 55069 1 134 . 1 1 72 72 ARG N N 72 123.490 123.490 124.020 -0.530 17919 55070 1 134 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.250 0.051 17919 55071 1 134 . 1 1 72 72 ARG C C 72 175.350 175.350 175.454 -0.104 17919 55072 1 134 . 1 1 72 72 ARG CA C 72 55.610 55.610 57.483 -1.873 17919 55073 1 134 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.109 1.241 17919 55074 1 134 . 1 1 72 72 ARG H H 72 8.580 8.580 8.230 0.350 17919 55075 1 135 . 1 1 2 2 GLN N N 2 123.220 123.220 125.181 -1.961 17919 55076 1 135 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.061 0.188 17919 55077 1 135 . 1 1 2 2 GLN C C 2 175.920 175.920 175.296 0.624 17919 55078 1 135 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.452 0.628 17919 55079 1 135 . 1 1 2 2 GLN CB C 2 30.760 30.760 29.129 1.631 17919 55080 1 135 . 1 1 2 2 GLN H H 2 8.900 8.900 8.457 0.443 17919 55081 1 135 . 1 1 3 3 ILE N N 3 115.340 115.340 115.907 -0.567 17919 55082 1 135 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.093 0.120 17919 55083 1 135 . 1 1 3 3 ILE C C 3 172.450 172.450 173.010 -0.560 17919 55084 1 135 . 1 1 3 3 ILE CA C 3 59.570 59.570 60.245 -0.675 17919 55085 1 135 . 1 1 3 3 ILE CB C 3 42.210 42.210 42.308 -0.098 17919 55086 1 135 . 1 1 3 3 ILE H H 3 8.320 8.320 8.657 -0.337 17919 55087 1 135 . 1 1 4 4 PHE N N 4 118.110 118.110 118.076 0.034 17919 55088 1 135 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.441 0.189 17919 55089 1 135 . 1 1 4 4 PHE C C 4 175.320 175.320 175.505 -0.185 17919 55090 1 135 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.682 -0.472 17919 55091 1 135 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.568 -0.088 17919 55092 1 135 . 1 1 4 4 PHE H H 4 8.610 8.610 7.830 0.780 17919 55093 1 135 . 1 1 5 5 VAL N N 5 121.000 121.000 123.973 -2.973 17919 55094 1 135 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.588 0.137 17919 55095 1 135 . 1 1 5 5 VAL C C 5 174.870 174.870 175.112 -0.242 17919 55096 1 135 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.903 -1.283 17919 55097 1 135 . 1 1 5 5 VAL CB C 5 34.230 34.230 32.927 1.303 17919 55098 1 135 . 1 1 5 5 VAL H H 5 9.300 9.300 8.950 0.350 17919 55099 1 135 . 1 1 6 6 LYS N N 6 127.520 127.520 129.896 -2.376 17919 55100 1 135 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.098 0.269 17919 55101 1 135 . 1 1 6 6 LYS C C 6 177.140 177.140 176.741 0.399 17919 55102 1 135 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.817 -0.297 17919 55103 1 135 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.152 0.898 17919 55104 1 135 . 1 1 6 6 LYS H H 6 8.820 8.820 9.262 -0.442 17919 55105 1 135 . 1 1 7 7 THR N N 7 115.400 115.400 119.010 -3.610 17919 55106 1 135 . 1 1 7 7 THR HA H 7 4.970 4.970 4.445 0.525 17919 55107 1 135 . 1 1 7 7 THR C C 7 176.910 176.910 176.491 0.419 17919 55108 1 135 . 1 1 7 7 THR CA C 7 60.470 60.470 61.681 -1.211 17919 55109 1 135 . 1 1 7 7 THR CB C 7 70.630 70.630 69.772 0.858 17919 55110 1 135 . 1 1 7 7 THR H H 7 8.730 8.730 8.627 0.103 17919 55111 1 135 . 1 1 8 8 LEU N N 8 121.330 121.330 122.616 -1.286 17919 55112 1 135 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.217 0.093 17919 55113 1 135 . 1 1 8 8 LEU C C 8 178.800 178.800 178.621 0.179 17919 55114 1 135 . 1 1 8 8 LEU CA C 8 57.580 57.580 58.077 -0.496 17919 55115 1 135 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.806 0.165 17919 55116 1 135 . 1 1 8 8 LEU H H 8 9.100 9.100 8.848 0.252 17919 55117 1 135 . 1 1 9 9 THR N N 9 105.590 105.590 107.851 -2.261 17919 55118 1 135 . 1 1 9 9 THR HA H 9 4.428 4.428 4.248 0.180 17919 55119 1 135 . 1 1 9 9 THR C C 9 175.520 175.520 175.836 -0.316 17919 55120 1 135 . 1 1 9 9 THR CA C 9 61.400 61.400 62.101 -0.701 17919 55121 1 135 . 1 1 9 9 THR CB C 9 69.140 69.140 68.837 0.303 17919 55122 1 135 . 1 1 9 9 THR H H 9 7.630 7.630 8.011 -0.381 17919 55123 1 135 . 1 1 10 10 GLY N N 10 108.890 108.890 109.557 -0.667 17919 55124 1 135 . 1 1 10 10 GLY C C 10 174.070 174.070 174.033 0.037 17919 55125 1 135 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.928 0.532 17919 55126 1 135 . 1 1 10 10 GLY H H 10 7.810 7.810 7.708 0.102 17919 55127 1 135 . 1 1 11 11 LYS N N 11 121.600 121.600 122.258 -0.658 17919 55128 1 135 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.284 0.077 17919 55129 1 135 . 1 1 11 11 LYS C C 11 175.940 175.940 176.256 -0.316 17919 55130 1 135 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.274 0.006 17919 55131 1 135 . 1 1 11 11 LYS CB C 11 33.200 33.200 32.956 0.243 17919 55132 1 135 . 1 1 11 11 LYS H H 11 7.280 7.280 8.050 -0.770 17919 55133 1 135 . 1 1 12 12 THR N N 12 120.440 120.440 119.338 1.102 17919 55134 1 135 . 1 1 12 12 THR HA H 12 5.046 5.046 4.631 0.415 17919 55135 1 135 . 1 1 12 12 THR C C 12 174.320 174.320 174.685 -0.365 17919 55136 1 135 . 1 1 12 12 THR CA C 12 62.390 62.390 60.654 1.736 17919 55137 1 135 . 1 1 12 12 THR CB C 12 69.910 69.910 68.125 1.785 17919 55138 1 135 . 1 1 12 12 THR H H 12 8.650 8.650 8.489 0.161 17919 55139 1 135 . 1 1 13 13 ILE N N 13 127.110 127.110 127.989 -0.879 17919 55140 1 135 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.072 0.472 17919 55141 1 135 . 1 1 13 13 ILE C C 13 175.220 175.220 176.258 -1.038 17919 55142 1 135 . 1 1 13 13 ILE CA C 13 59.980 59.980 61.684 -1.704 17919 55143 1 135 . 1 1 13 13 ILE CB C 13 40.950 40.950 37.950 3.000 17919 55144 1 135 . 1 1 13 13 ILE H H 13 9.450 9.450 8.832 0.618 17919 55145 1 135 . 1 1 14 14 THR N N 14 121.520 121.520 124.807 -3.287 17919 55146 1 135 . 1 1 14 14 THR HA H 14 4.964 4.964 4.612 0.352 17919 55147 1 135 . 1 1 14 14 THR C C 14 173.790 173.790 174.152 -0.362 17919 55148 1 135 . 1 1 14 14 THR CA C 14 61.940 61.940 63.781 -1.841 17919 55149 1 135 . 1 1 14 14 THR CB C 14 69.650 69.650 68.963 0.687 17919 55150 1 135 . 1 1 14 14 THR H H 14 8.710 8.710 8.616 0.094 17919 55151 1 135 . 1 1 15 15 LEU N N 15 124.800 124.800 128.151 -3.351 17919 55152 1 135 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.847 -0.067 17919 55153 1 135 . 1 1 15 15 LEU C C 15 174.670 174.670 175.696 -1.026 17919 55154 1 135 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.166 -0.335 17919 55155 1 135 . 1 1 15 15 LEU CB C 15 47.070 47.070 46.282 0.788 17919 55156 1 135 . 1 1 15 15 LEU H H 15 8.710 8.710 8.630 0.080 17919 55157 1 135 . 1 1 16 16 GLU N N 16 122.160 122.160 120.830 1.330 17919 55158 1 135 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.235 -0.318 17919 55159 1 135 . 1 1 16 16 GLU C C 16 175.860 175.860 175.791 0.069 17919 55160 1 135 . 1 1 16 16 GLU CA C 16 54.820 54.820 54.736 0.084 17919 55161 1 135 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.821 -1.371 17919 55162 1 135 . 1 1 16 16 GLU H H 16 8.140 8.140 8.484 -0.344 17919 55163 1 135 . 1 1 17 17 VAL N N 17 117.210 117.210 119.529 -2.319 17919 55164 1 135 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.449 0.265 17919 55165 1 135 . 1 1 17 17 VAL C C 17 174.160 174.160 173.976 0.184 17919 55166 1 135 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.235 -0.805 17919 55167 1 135 . 1 1 17 17 VAL CB C 17 36.400 36.400 34.735 1.665 17919 55168 1 135 . 1 1 17 17 VAL H H 17 8.900 8.900 8.686 0.214 17919 55169 1 135 . 1 1 18 18 GLU N N 18 118.990 118.990 117.552 1.438 17919 55170 1 135 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.734 0.345 17919 55171 1 135 . 1 1 18 18 GLU C C 18 176.160 176.160 176.145 0.015 17919 55172 1 135 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.245 -0.525 17919 55173 1 135 . 1 1 18 18 GLU CB C 18 30.310 30.310 31.394 -1.084 17919 55174 1 135 . 1 1 18 18 GLU H H 18 8.640 8.640 8.484 0.156 17919 55175 1 135 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.251 -0.110 17919 55176 1 135 . 1 1 19 19 PRO C C 19 175.310 175.310 177.695 -2.385 17919 55177 1 135 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.698 -0.228 17919 55178 1 135 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.062 -0.112 17919 55179 1 135 . 1 1 20 20 SER N N 20 103.400 103.400 109.416 -6.016 17919 55180 1 135 . 1 1 20 20 SER HA H 20 4.370 4.370 4.393 -0.023 17919 55181 1 135 . 1 1 20 20 SER C C 20 174.660 174.660 174.361 0.299 17919 55182 1 135 . 1 1 20 20 SER CA C 20 57.400 57.400 58.124 -0.724 17919 55183 1 135 . 1 1 20 20 SER CB C 20 63.370 63.370 62.948 0.422 17919 55184 1 135 . 1 1 20 20 SER H H 20 7.040 7.040 8.077 -1.037 17919 55185 1 135 . 1 1 21 21 ASP N N 21 123.480 123.480 123.270 0.210 17919 55186 1 135 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.656 0.039 17919 55187 1 135 . 1 1 21 21 ASP C C 21 176.360 176.360 175.452 0.908 17919 55188 1 135 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.743 0.957 17919 55189 1 135 . 1 1 21 21 ASP CB C 21 40.800 40.800 42.489 -1.689 17919 55190 1 135 . 1 1 21 21 ASP H H 21 8.030 8.030 7.902 0.128 17919 55191 1 135 . 1 1 22 22 THR N N 22 108.800 108.800 111.936 -3.136 17919 55192 1 135 . 1 1 22 22 THR HA H 22 4.920 4.920 4.890 0.030 17919 55193 1 135 . 1 1 22 22 THR C C 22 176.750 176.750 175.720 1.030 17919 55194 1 135 . 1 1 22 22 THR CA C 22 59.690 59.690 60.002 -0.312 17919 55195 1 135 . 1 1 22 22 THR CB C 22 71.200 71.200 72.254 -1.054 17919 55196 1 135 . 1 1 22 22 THR H H 22 7.900 7.900 7.946 -0.046 17919 55197 1 135 . 1 1 23 23 ILE N N 23 121.190 121.190 123.543 -2.353 17919 55198 1 135 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.710 -0.053 17919 55199 1 135 . 1 1 23 23 ILE C C 23 179.040 179.040 177.656 1.384 17919 55200 1 135 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.870 -0.610 17919 55201 1 135 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.264 -1.914 17919 55202 1 135 . 1 1 23 23 ILE H H 23 8.560 8.560 9.172 -0.612 17919 55203 1 135 . 1 1 24 24 GLU N N 24 120.830 120.830 120.055 0.775 17919 55204 1 135 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.831 0.086 17919 55205 1 135 . 1 1 24 24 GLU C C 24 178.640 178.640 178.619 0.021 17919 55206 1 135 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.035 0.185 17919 55207 1 135 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.444 -1.164 17919 55208 1 135 . 1 1 24 24 GLU H H 24 9.760 9.760 8.267 1.493 17919 55209 1 135 . 1 1 25 25 ASN N N 25 120.570 120.570 117.313 3.257 17919 55210 1 135 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.631 -0.106 17919 55211 1 135 . 1 1 25 25 ASN C C 25 178.380 178.380 177.935 0.445 17919 55212 1 135 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.305 0.755 17919 55213 1 135 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.463 -0.013 17919 55214 1 135 . 1 1 25 25 ASN H H 25 7.920 7.920 7.512 0.408 17919 55215 1 135 . 1 1 26 26 VAL N N 26 121.710 121.710 121.100 0.610 17919 55216 1 135 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.436 -0.039 17919 55217 1 135 . 1 1 26 26 VAL C C 26 177.950 177.950 177.875 0.075 17919 55218 1 135 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.973 0.687 17919 55219 1 135 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.256 -0.416 17919 55220 1 135 . 1 1 26 26 VAL H H 26 8.070 8.070 8.027 0.043 17919 55221 1 135 . 1 1 27 27 LYS N N 27 118.860 118.860 119.644 -0.784 17919 55222 1 135 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.262 0.318 17919 55223 1 135 . 1 1 27 27 LYS C C 27 180.550 180.550 179.154 1.396 17919 55224 1 135 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.529 -0.279 17919 55225 1 135 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.172 1.558 17919 55226 1 135 . 1 1 27 27 LYS H H 27 8.560 8.560 8.186 0.374 17919 55227 1 135 . 1 1 28 28 ALA N N 28 123.440 123.440 122.380 1.060 17919 55228 1 135 . 1 1 28 28 ALA HA H 28 4.160 4.160 3.967 0.193 17919 55229 1 135 . 1 1 28 28 ALA C C 28 180.300 180.300 179.343 0.957 17919 55230 1 135 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.299 0.071 17919 55231 1 135 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.314 -0.604 17919 55232 1 135 . 1 1 28 28 ALA H H 28 8.060 8.060 7.758 0.302 17919 55233 1 135 . 1 1 29 29 LYS N N 29 119.940 119.940 119.086 0.854 17919 55234 1 135 . 1 1 29 29 LYS HA H 29 4.207 4.207 3.950 0.257 17919 55235 1 135 . 1 1 29 29 LYS C C 29 180.320 180.320 179.144 1.176 17919 55236 1 135 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.251 0.399 17919 55237 1 135 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.342 0.948 17919 55238 1 135 . 1 1 29 29 LYS H H 29 7.850 7.850 7.525 0.325 17919 55239 1 135 . 1 1 30 30 ILE N N 30 121.080 121.080 119.649 1.431 17919 55240 1 135 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.582 -0.075 17919 55241 1 135 . 1 1 30 30 ILE C C 30 178.310 178.310 177.390 0.920 17919 55242 1 135 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.273 0.877 17919 55243 1 135 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.806 -1.006 17919 55244 1 135 . 1 1 30 30 ILE H H 30 8.280 8.280 8.253 0.027 17919 55245 1 135 . 1 1 31 31 GLN N N 31 123.490 123.490 119.514 3.976 17919 55246 1 135 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.961 -0.132 17919 55247 1 135 . 1 1 31 31 GLN C C 31 178.890 178.890 178.497 0.393 17919 55248 1 135 . 1 1 31 31 GLN CA C 31 60.000 60.000 58.914 1.086 17919 55249 1 135 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.408 -0.688 17919 55250 1 135 . 1 1 31 31 GLN H H 31 8.580 8.580 8.388 0.192 17919 55251 1 135 . 1 1 32 32 ASP N N 32 119.360 119.360 119.607 -0.247 17919 55252 1 135 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.415 -0.061 17919 55253 1 135 . 1 1 32 32 ASP C C 32 177.250 177.250 177.370 -0.120 17919 55254 1 135 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.670 0.520 17919 55255 1 135 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.758 -0.178 17919 55256 1 135 . 1 1 32 32 ASP H H 32 8.010 8.010 7.950 0.060 17919 55257 1 135 . 1 1 33 33 LYS N N 33 115.130 115.130 117.872 -2.742 17919 55258 1 135 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.447 -0.110 17919 55259 1 135 . 1 1 33 33 LYS C C 33 177.870 177.870 178.574 -0.704 17919 55260 1 135 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.635 0.415 17919 55261 1 135 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.392 0.778 17919 55262 1 135 . 1 1 33 33 LYS H H 33 7.430 7.430 7.543 -0.113 17919 55263 1 135 . 1 1 34 34 GLU N N 34 113.870 113.870 116.357 -2.487 17919 55264 1 135 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.383 0.242 17919 55265 1 135 . 1 1 34 34 GLU C C 34 177.840 177.840 177.858 -0.018 17919 55266 1 135 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.252 -1.082 17919 55267 1 135 . 1 1 34 34 GLU CB C 34 32.660 32.660 30.694 1.966 17919 55268 1 135 . 1 1 34 34 GLU H H 34 8.740 8.740 8.460 0.280 17919 55269 1 135 . 1 1 35 35 GLY N N 35 108.650 108.650 109.195 -0.545 17919 55270 1 135 . 1 1 35 35 GLY C C 35 173.960 173.960 174.395 -0.435 17919 55271 1 135 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.910 0.170 17919 55272 1 135 . 1 1 35 35 GLY H H 35 8.530 8.530 7.978 0.552 17919 55273 1 135 . 1 1 36 36 ILE N N 36 119.880 119.880 120.601 -0.721 17919 55274 1 135 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.383 0.062 17919 55275 1 135 . 1 1 36 36 ILE C C 36 173.590 173.590 174.199 -0.609 17919 55276 1 135 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.689 0.061 17919 55277 1 135 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.828 1.752 17919 55278 1 135 . 1 1 36 36 ILE H H 36 6.150 6.150 7.632 -1.482 17919 55279 1 135 . 1 1 37 37 PRO HA H 37 4.634 4.634 5.242 -0.608 17919 55280 1 135 . 1 1 37 37 PRO C C 37 176.940 176.940 176.257 0.683 17919 55281 1 135 . 1 1 37 37 PRO CA C 37 61.660 61.660 60.506 1.154 17919 55282 1 135 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.271 0.579 17919 55283 1 135 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.105 0.012 17919 55284 1 135 . 1 1 38 38 PRO C C 38 178.320 178.320 178.890 -0.570 17919 55285 1 135 . 1 1 38 38 PRO CA C 38 66.260 66.260 66.212 0.049 17919 55286 1 135 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.768 1.122 17919 55287 1 135 . 1 1 39 39 ASP N N 39 113.380 113.380 116.827 -3.447 17919 55288 1 135 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.304 0.126 17919 55289 1 135 . 1 1 39 39 ASP C C 39 177.090 177.090 178.194 -1.104 17919 55290 1 135 . 1 1 39 39 ASP CA C 39 55.640 55.640 57.558 -1.918 17919 55291 1 135 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.691 -1.151 17919 55292 1 135 . 1 1 39 39 ASP H H 39 8.550 8.550 8.842 -0.292 17919 55293 1 135 . 1 1 40 40 GLN N N 40 116.780 116.780 116.463 0.317 17919 55294 1 135 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.385 0.079 17919 55295 1 135 . 1 1 40 40 GLN C C 40 175.380 175.380 176.307 -0.927 17919 55296 1 135 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.336 -0.696 17919 55297 1 135 . 1 1 40 40 GLN CB C 40 30.140 30.140 30.156 -0.016 17919 55298 1 135 . 1 1 40 40 GLN H H 40 7.820 7.820 8.130 -0.310 17919 55299 1 135 . 1 1 41 41 GLN N N 41 117.720 117.720 119.763 -2.043 17919 55300 1 135 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.125 0.119 17919 55301 1 135 . 1 1 41 41 GLN C C 41 176.300 176.300 174.603 1.697 17919 55302 1 135 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.947 -0.477 17919 55303 1 135 . 1 1 41 41 GLN CB C 41 31.650 31.650 28.707 2.943 17919 55304 1 135 . 1 1 41 41 GLN H H 41 7.480 7.480 7.439 0.041 17919 55305 1 135 . 1 1 42 42 ARG N N 42 122.680 122.680 121.608 1.072 17919 55306 1 135 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.655 -0.155 17919 55307 1 135 . 1 1 42 42 ARG C C 42 174.050 174.050 173.817 0.233 17919 55308 1 135 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.357 0.693 17919 55309 1 135 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.658 -0.908 17919 55310 1 135 . 1 1 42 42 ARG H H 42 8.530 8.530 7.772 0.758 17919 55311 1 135 . 1 1 43 43 LEU N N 43 124.040 124.040 125.635 -1.595 17919 55312 1 135 . 1 1 43 43 LEU C C 43 175.290 175.290 175.697 -0.407 17919 55313 1 135 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.690 -0.710 17919 55314 1 135 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.884 0.906 17919 55315 1 135 . 1 1 43 43 LEU H H 43 8.820 8.820 8.689 0.131 17919 55316 1 135 . 1 1 44 44 ILE N N 44 121.920 121.920 121.083 0.837 17919 55317 1 135 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.046 -0.054 17919 55318 1 135 . 1 1 44 44 ILE C C 44 176.060 176.060 174.396 1.664 17919 55319 1 135 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.897 -0.917 17919 55320 1 135 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.483 -0.063 17919 55321 1 135 . 1 1 44 44 ILE H H 44 9.030 9.030 8.967 0.063 17919 55322 1 135 . 1 1 45 45 PHE N N 45 125.390 125.390 126.824 -1.434 17919 55323 1 135 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.041 0.004 17919 55324 1 135 . 1 1 45 45 PHE C C 45 174.470 174.470 174.598 -0.128 17919 55325 1 135 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.329 0.691 17919 55326 1 135 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.921 0.839 17919 55327 1 135 . 1 1 45 45 PHE H H 45 8.830 8.830 8.451 0.379 17919 55328 1 135 . 1 1 46 46 ALA N N 46 132.200 132.200 129.408 2.792 17919 55329 1 135 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.502 0.188 17919 55330 1 135 . 1 1 46 46 ALA C C 46 177.290 177.290 177.062 0.228 17919 55331 1 135 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.733 -0.193 17919 55332 1 135 . 1 1 46 46 ALA CB C 46 16.570 16.570 15.971 0.599 17919 55333 1 135 . 1 1 46 46 ALA H H 46 8.810 8.810 8.710 0.100 17919 55334 1 135 . 1 1 47 47 GLY N N 47 102.340 102.340 103.397 -1.057 17919 55335 1 135 . 1 1 47 47 GLY C C 47 173.810 173.810 174.074 -0.264 17919 55336 1 135 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.110 0.240 17919 55337 1 135 . 1 1 47 47 GLY H H 47 8.130 8.130 8.402 -0.272 17919 55338 1 135 . 1 1 48 48 LYS N N 48 121.570 121.570 121.357 0.213 17919 55339 1 135 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.583 0.039 17919 55340 1 135 . 1 1 48 48 LYS C C 48 174.700 174.700 174.992 -0.292 17919 55341 1 135 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.050 -0.500 17919 55342 1 135 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.600 -0.070 17919 55343 1 135 . 1 1 48 48 LYS H H 48 7.980 7.980 7.554 0.426 17919 55344 1 135 . 1 1 49 49 GLN N N 49 122.410 122.410 126.940 -4.530 17919 55345 1 135 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.613 -0.053 17919 55346 1 135 . 1 1 49 49 GLN C C 49 175.670 175.670 175.583 0.087 17919 55347 1 135 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.724 0.016 17919 55348 1 135 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.631 -0.631 17919 55349 1 135 . 1 1 49 49 GLN H H 49 8.600 8.600 8.643 -0.043 17919 55350 1 135 . 1 1 50 50 LEU N N 50 125.520 125.520 129.089 -3.569 17919 55351 1 135 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.351 -0.261 17919 55352 1 135 . 1 1 50 50 LEU C C 50 176.660 176.660 176.484 0.176 17919 55353 1 135 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.196 0.044 17919 55354 1 135 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.617 -0.047 17919 55355 1 135 . 1 1 50 50 LEU H H 50 8.530 8.530 8.994 -0.464 17919 55356 1 135 . 1 1 51 51 GLU N N 51 122.940 122.940 123.744 -0.804 17919 55357 1 135 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.577 -0.089 17919 55358 1 135 . 1 1 51 51 GLU C C 51 175.870 175.870 176.598 -0.728 17919 55359 1 135 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.109 0.851 17919 55360 1 135 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.359 0.211 17919 55361 1 135 . 1 1 51 51 GLU H H 51 8.400 8.400 8.226 0.174 17919 55362 1 135 . 1 1 52 52 ASP N N 52 120.030 120.030 123.129 -3.099 17919 55363 1 135 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.457 -0.098 17919 55364 1 135 . 1 1 52 52 ASP C C 52 177.330 177.330 177.949 -0.619 17919 55365 1 135 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.103 -0.143 17919 55366 1 135 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.541 0.309 17919 55367 1 135 . 1 1 52 52 ASP H H 52 8.160 8.160 8.758 -0.598 17919 55368 1 135 . 1 1 53 53 GLY N N 53 106.660 106.660 105.699 0.961 17919 55369 1 135 . 1 1 53 53 GLY C C 53 174.870 174.870 174.206 0.664 17919 55370 1 135 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.816 0.354 17919 55371 1 135 . 1 1 53 53 GLY H H 53 9.390 9.390 8.467 0.923 17919 55372 1 135 . 1 1 54 54 ARG N N 54 119.050 119.050 120.461 -1.411 17919 55373 1 135 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.968 -0.273 17919 55374 1 135 . 1 1 54 54 ARG C C 54 175.350 175.350 175.518 -0.168 17919 55375 1 135 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.321 0.069 17919 55376 1 135 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.242 -0.592 17919 55377 1 135 . 1 1 54 54 ARG H H 54 7.460 7.460 7.422 0.038 17919 55378 1 135 . 1 1 55 55 THR N N 55 108.400 108.400 111.238 -2.838 17919 55379 1 135 . 1 1 55 55 THR HA H 55 5.240 5.240 5.269 -0.029 17919 55380 1 135 . 1 1 55 55 THR C C 55 176.560 176.560 176.237 0.323 17919 55381 1 135 . 1 1 55 55 THR CA C 55 59.690 59.690 59.663 0.027 17919 55382 1 135 . 1 1 55 55 THR CB C 55 72.260 72.260 71.692 0.568 17919 55383 1 135 . 1 1 55 55 THR H H 55 8.730 8.730 9.059 -0.329 17919 55384 1 135 . 1 1 56 56 LEU N N 56 117.920 117.920 121.225 -3.305 17919 55385 1 135 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.212 -0.152 17919 55386 1 135 . 1 1 56 56 LEU C C 56 180.810 180.810 178.872 1.938 17919 55387 1 135 . 1 1 56 56 LEU CA C 56 58.710 58.710 57.736 0.974 17919 55388 1 135 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.645 -1.275 17919 55389 1 135 . 1 1 56 56 LEU H H 56 8.140 8.140 8.581 -0.441 17919 55390 1 135 . 1 1 57 57 SER N N 57 113.330 113.330 116.401 -3.071 17919 55391 1 135 . 1 1 57 57 SER HA H 57 4.370 4.370 4.147 0.223 17919 55392 1 135 . 1 1 57 57 SER C C 57 178.310 178.310 176.651 1.659 17919 55393 1 135 . 1 1 57 57 SER CA C 57 61.080 61.080 62.697 -1.617 17919 55394 1 135 . 1 1 57 57 SER CB C 57 62.530 62.530 62.743 -0.213 17919 55395 1 135 . 1 1 57 57 SER H H 57 8.470 8.470 8.239 0.231 17919 55396 1 135 . 1 1 58 58 ASP N N 58 124.190 124.190 121.535 2.655 17919 55397 1 135 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.314 -0.018 17919 55398 1 135 . 1 1 58 58 ASP C C 58 177.400 177.400 177.138 0.262 17919 55399 1 135 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.325 0.855 17919 55400 1 135 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.169 -0.070 17919 55401 1 135 . 1 1 58 58 ASP H H 58 7.930 7.930 7.804 0.126 17919 55402 1 135 . 1 1 59 59 TYR N N 59 115.510 115.510 115.468 0.042 17919 55403 1 135 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.663 0.007 17919 55404 1 135 . 1 1 59 59 TYR C C 59 174.700 174.700 175.594 -0.894 17919 55405 1 135 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.543 0.707 17919 55406 1 135 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.956 1.114 17919 55407 1 135 . 1 1 59 59 TYR H H 59 7.250 7.250 7.356 -0.106 17919 55408 1 135 . 1 1 60 60 ASN N N 60 115.900 115.900 117.601 -1.701 17919 55409 1 135 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.384 -0.029 17919 55410 1 135 . 1 1 60 60 ASN C C 60 174.340 174.340 174.446 -0.106 17919 55411 1 135 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.681 -0.561 17919 55412 1 135 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.668 -0.258 17919 55413 1 135 . 1 1 60 60 ASN H H 60 8.150 8.150 8.190 -0.040 17919 55414 1 135 . 1 1 61 61 ILE N N 61 118.600 118.600 119.728 -1.128 17919 55415 1 135 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.687 -0.294 17919 55416 1 135 . 1 1 61 61 ILE C C 61 174.610 174.610 175.028 -0.418 17919 55417 1 135 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.361 0.059 17919 55418 1 135 . 1 1 61 61 ILE CB C 61 36.740 36.740 38.148 -1.408 17919 55419 1 135 . 1 1 61 61 ILE H H 61 7.250 7.250 8.471 -1.221 17919 55420 1 135 . 1 1 62 62 GLN N N 62 124.740 124.740 124.149 0.591 17919 55421 1 135 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.748 -0.242 17919 55422 1 135 . 1 1 62 62 GLN C C 62 175.970 175.970 175.498 0.472 17919 55423 1 135 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.451 0.209 17919 55424 1 135 . 1 1 62 62 GLN CB C 62 31.650 31.650 33.030 -1.380 17919 55425 1 135 . 1 1 62 62 GLN H H 62 7.610 7.610 8.031 -0.421 17919 55426 1 135 . 1 1 63 63 LYS N N 63 120.300 120.300 120.242 0.058 17919 55427 1 135 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.051 -0.050 17919 55428 1 135 . 1 1 63 63 LYS C C 63 175.810 175.810 176.901 -1.091 17919 55429 1 135 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.435 0.355 17919 55430 1 135 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.748 0.902 17919 55431 1 135 . 1 1 63 63 LYS H H 63 8.490 8.490 8.663 -0.173 17919 55432 1 135 . 1 1 64 64 GLU N N 64 113.950 113.950 119.961 -6.011 17919 55433 1 135 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.554 -0.089 17919 55434 1 135 . 1 1 64 64 GLU C C 64 175.250 175.250 175.692 -0.442 17919 55435 1 135 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.858 0.033 17919 55436 1 135 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.323 -2.423 17919 55437 1 135 . 1 1 64 64 GLU H H 64 9.280 9.280 8.610 0.670 17919 55438 1 135 . 1 1 65 65 SER N N 65 114.730 114.730 115.250 -0.520 17919 55439 1 135 . 1 1 65 65 SER HA H 65 4.640 4.640 4.486 0.154 17919 55440 1 135 . 1 1 65 65 SER C C 65 172.160 172.160 174.799 -2.639 17919 55441 1 135 . 1 1 65 65 SER CA C 65 60.890 60.890 59.002 1.888 17919 55442 1 135 . 1 1 65 65 SER CB C 65 64.910 64.910 63.371 1.539 17919 55443 1 135 . 1 1 65 65 SER H H 65 7.670 7.670 7.717 -0.047 17919 55444 1 135 . 1 1 66 66 THR N N 66 117.110 117.110 123.468 -6.358 17919 55445 1 135 . 1 1 66 66 THR HA H 66 5.270 5.270 4.948 0.322 17919 55446 1 135 . 1 1 66 66 THR C C 66 173.950 173.950 174.736 -0.786 17919 55447 1 135 . 1 1 66 66 THR CA C 66 62.340 62.340 62.885 -0.545 17919 55448 1 135 . 1 1 66 66 THR CB C 66 70.080 70.080 69.014 1.066 17919 55449 1 135 . 1 1 66 66 THR H H 66 8.730 8.730 8.779 -0.049 17919 55450 1 135 . 1 1 67 67 LEU N N 67 127.110 127.110 128.021 -0.911 17919 55451 1 135 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.775 0.285 17919 55452 1 135 . 1 1 67 67 LEU C C 67 175.770 175.770 175.699 0.071 17919 55453 1 135 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.290 -0.390 17919 55454 1 135 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.566 0.695 17919 55455 1 135 . 1 1 67 67 LEU H H 67 9.410 9.410 8.851 0.559 17919 55456 1 135 . 1 1 68 68 HIS N N 68 118.380 118.380 121.944 -3.564 17919 55457 1 135 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.325 -0.085 17919 55458 1 135 . 1 1 68 68 HIS C C 68 173.150 173.150 173.698 -0.548 17919 55459 1 135 . 1 1 68 68 HIS CA C 68 55.000 55.000 53.844 1.156 17919 55460 1 135 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.407 -1.877 17919 55461 1 135 . 1 1 68 68 HIS H H 68 9.230 9.230 9.154 0.076 17919 55462 1 135 . 1 1 69 69 LEU N N 69 124.460 124.460 130.202 -5.742 17919 55463 1 135 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.265 -0.075 17919 55464 1 135 . 1 1 69 69 LEU C C 69 175.270 175.270 174.083 1.187 17919 55465 1 135 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.277 0.613 17919 55466 1 135 . 1 1 69 69 LEU CB C 69 44.380 44.380 45.237 -0.857 17919 55467 1 135 . 1 1 69 69 LEU H H 69 8.340 8.340 8.131 0.209 17919 55468 1 135 . 1 1 70 70 VAL N N 70 126.940 126.940 122.980 3.960 17919 55469 1 135 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.452 -0.102 17919 55470 1 135 . 1 1 70 70 VAL C C 70 174.000 174.000 173.483 0.517 17919 55471 1 135 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.064 1.736 17919 55472 1 135 . 1 1 70 70 VAL CB C 70 34.910 34.910 36.098 -1.188 17919 55473 1 135 . 1 1 70 70 VAL H H 70 9.200 9.200 8.058 1.142 17919 55474 1 135 . 1 1 71 71 LEU N N 71 123.130 123.130 125.431 -2.301 17919 55475 1 135 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.291 0.769 17919 55476 1 135 . 1 1 71 71 LEU C C 71 177.830 177.830 176.565 1.265 17919 55477 1 135 . 1 1 71 71 LEU CA C 71 53.940 53.940 54.653 -0.713 17919 55478 1 135 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.166 0.683 17919 55479 1 135 . 1 1 71 71 LEU H H 71 8.120 8.120 8.458 -0.338 17919 55480 1 135 . 1 1 72 72 ARG N N 72 123.490 123.490 129.044 -5.554 17919 55481 1 135 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.218 0.083 17919 55482 1 135 . 1 1 72 72 ARG C C 72 175.350 175.350 175.235 0.115 17919 55483 1 135 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.510 -0.900 17919 55484 1 135 . 1 1 72 72 ARG CB C 72 31.350 31.350 29.980 1.370 17919 55485 1 135 . 1 1 72 72 ARG H H 72 8.580 8.580 8.309 0.271 17919 55486 1 136 . 1 1 2 2 GLN N N 2 123.220 123.220 125.201 -1.981 17919 55487 1 136 . 1 1 2 2 GLN HA H 2 5.249 5.249 4.292 0.957 17919 55488 1 136 . 1 1 2 2 GLN C C 2 175.920 175.920 173.825 2.095 17919 55489 1 136 . 1 1 2 2 GLN CA C 2 55.080 55.080 56.206 -1.127 17919 55490 1 136 . 1 1 2 2 GLN CB C 2 30.760 30.760 29.970 0.790 17919 55491 1 136 . 1 1 2 2 GLN H H 2 8.900 8.900 8.378 0.522 17919 55492 1 136 . 1 1 3 3 ILE N N 3 115.340 115.340 118.164 -2.824 17919 55493 1 136 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.270 -0.057 17919 55494 1 136 . 1 1 3 3 ILE C C 3 172.450 172.450 173.353 -0.903 17919 55495 1 136 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.265 0.305 17919 55496 1 136 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.376 0.834 17919 55497 1 136 . 1 1 3 3 ILE H H 3 8.320 8.320 7.522 0.798 17919 55498 1 136 . 1 1 4 4 PHE N N 4 118.110 118.110 119.454 -1.344 17919 55499 1 136 . 1 1 4 4 PHE HA H 4 5.630 5.630 4.990 0.640 17919 55500 1 136 . 1 1 4 4 PHE C C 4 175.320 175.320 175.211 0.109 17919 55501 1 136 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.553 -0.343 17919 55502 1 136 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.299 0.181 17919 55503 1 136 . 1 1 4 4 PHE H H 4 8.610 8.610 8.288 0.322 17919 55504 1 136 . 1 1 5 5 VAL N N 5 121.000 121.000 121.298 -0.298 17919 55505 1 136 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.516 0.209 17919 55506 1 136 . 1 1 5 5 VAL C C 5 174.870 174.870 174.722 0.148 17919 55507 1 136 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.423 -0.803 17919 55508 1 136 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.686 0.544 17919 55509 1 136 . 1 1 5 5 VAL H H 5 9.300 9.300 8.402 0.898 17919 55510 1 136 . 1 1 6 6 LYS N N 6 127.520 127.520 129.321 -1.801 17919 55511 1 136 . 1 1 6 6 LYS HA H 6 5.367 5.367 4.702 0.665 17919 55512 1 136 . 1 1 6 6 LYS C C 6 177.140 177.140 176.846 0.294 17919 55513 1 136 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.738 -0.218 17919 55514 1 136 . 1 1 6 6 LYS CB C 6 35.050 35.050 33.825 1.225 17919 55515 1 136 . 1 1 6 6 LYS H H 6 8.820 8.820 8.932 -0.112 17919 55516 1 136 . 1 1 7 7 THR N N 7 115.400 115.400 118.628 -3.228 17919 55517 1 136 . 1 1 7 7 THR HA H 7 4.970 4.970 4.261 0.709 17919 55518 1 136 . 1 1 7 7 THR C C 7 176.910 176.910 176.210 0.700 17919 55519 1 136 . 1 1 7 7 THR CA C 7 60.470 60.470 62.561 -2.091 17919 55520 1 136 . 1 1 7 7 THR CB C 7 70.630 70.630 69.632 0.998 17919 55521 1 136 . 1 1 7 7 THR H H 7 8.730 8.730 8.250 0.480 17919 55522 1 136 . 1 1 8 8 LEU N N 8 121.330 121.330 120.677 0.653 17919 55523 1 136 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.321 -0.011 17919 55524 1 136 . 1 1 8 8 LEU C C 8 178.800 178.800 177.996 0.804 17919 55525 1 136 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.472 0.108 17919 55526 1 136 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.966 0.004 17919 55527 1 136 . 1 1 8 8 LEU H H 8 9.100 9.100 8.939 0.161 17919 55528 1 136 . 1 1 9 9 THR N N 9 105.590 105.590 109.643 -4.053 17919 55529 1 136 . 1 1 9 9 THR HA H 9 4.428 4.428 4.290 0.138 17919 55530 1 136 . 1 1 9 9 THR C C 9 175.520 175.520 175.911 -0.391 17919 55531 1 136 . 1 1 9 9 THR CA C 9 61.400 61.400 61.775 -0.375 17919 55532 1 136 . 1 1 9 9 THR CB C 9 69.140 69.140 68.179 0.961 17919 55533 1 136 . 1 1 9 9 THR H H 9 7.630 7.630 7.854 -0.224 17919 55534 1 136 . 1 1 10 10 GLY N N 10 108.890 108.890 110.423 -1.533 17919 55535 1 136 . 1 1 10 10 GLY C C 10 174.070 174.070 174.298 -0.228 17919 55536 1 136 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.542 -0.082 17919 55537 1 136 . 1 1 10 10 GLY H H 10 7.810 7.810 7.650 0.160 17919 55538 1 136 . 1 1 11 11 LYS N N 11 121.600 121.600 122.278 -0.678 17919 55539 1 136 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.376 -0.015 17919 55540 1 136 . 1 1 11 11 LYS C C 11 175.940 175.940 176.192 -0.252 17919 55541 1 136 . 1 1 11 11 LYS CA C 11 56.280 56.280 55.915 0.365 17919 55542 1 136 . 1 1 11 11 LYS CB C 11 33.200 33.200 32.620 0.580 17919 55543 1 136 . 1 1 11 11 LYS H H 11 7.280 7.280 7.595 -0.315 17919 55544 1 136 . 1 1 12 12 THR N N 12 120.440 120.440 122.969 -2.529 17919 55545 1 136 . 1 1 12 12 THR HA H 12 5.046 5.046 4.387 0.659 17919 55546 1 136 . 1 1 12 12 THR C C 12 174.320 174.320 175.259 -0.939 17919 55547 1 136 . 1 1 12 12 THR CA C 12 62.390 62.390 63.782 -1.392 17919 55548 1 136 . 1 1 12 12 THR CB C 12 69.910 69.910 68.421 1.489 17919 55549 1 136 . 1 1 12 12 THR H H 12 8.650 8.650 8.362 0.288 17919 55550 1 136 . 1 1 13 13 ILE N N 13 127.110 127.110 125.043 2.067 17919 55551 1 136 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.729 -0.185 17919 55552 1 136 . 1 1 13 13 ILE C C 13 175.220 175.220 174.607 0.613 17919 55553 1 136 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.786 0.194 17919 55554 1 136 . 1 1 13 13 ILE CB C 13 40.950 40.950 39.645 1.305 17919 55555 1 136 . 1 1 13 13 ILE H H 13 9.450 9.450 8.572 0.878 17919 55556 1 136 . 1 1 14 14 THR N N 14 121.520 121.520 121.256 0.264 17919 55557 1 136 . 1 1 14 14 THR HA H 14 4.964 4.964 4.679 0.285 17919 55558 1 136 . 1 1 14 14 THR C C 14 173.790 173.790 173.975 -0.185 17919 55559 1 136 . 1 1 14 14 THR CA C 14 61.940 61.940 62.206 -0.266 17919 55560 1 136 . 1 1 14 14 THR CB C 14 69.650 69.650 69.354 0.296 17919 55561 1 136 . 1 1 14 14 THR H H 14 8.710 8.710 8.341 0.369 17919 55562 1 136 . 1 1 15 15 LEU N N 15 124.800 124.800 124.758 0.042 17919 55563 1 136 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.989 -0.209 17919 55564 1 136 . 1 1 15 15 LEU C C 15 174.670 174.670 174.784 -0.114 17919 55565 1 136 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.062 -0.232 17919 55566 1 136 . 1 1 15 15 LEU CB C 15 47.070 47.070 44.941 2.129 17919 55567 1 136 . 1 1 15 15 LEU H H 15 8.710 8.710 8.209 0.501 17919 55568 1 136 . 1 1 16 16 GLU N N 16 122.160 122.160 121.652 0.508 17919 55569 1 136 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.681 0.236 17919 55570 1 136 . 1 1 16 16 GLU C C 16 175.860 175.860 175.185 0.675 17919 55571 1 136 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.370 -0.549 17919 55572 1 136 . 1 1 16 16 GLU CB C 16 29.450 29.450 29.700 -0.250 17919 55573 1 136 . 1 1 16 16 GLU H H 16 8.140 8.140 8.637 -0.497 17919 55574 1 136 . 1 1 17 17 VAL N N 17 117.210 117.210 120.373 -3.163 17919 55575 1 136 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.499 0.215 17919 55576 1 136 . 1 1 17 17 VAL C C 17 174.160 174.160 174.975 -0.815 17919 55577 1 136 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.692 -1.262 17919 55578 1 136 . 1 1 17 17 VAL CB C 17 36.400 36.400 34.930 1.470 17919 55579 1 136 . 1 1 17 17 VAL H H 17 8.900 8.900 8.165 0.735 17919 55580 1 136 . 1 1 18 18 GLU N N 18 118.990 118.990 119.052 -0.062 17919 55581 1 136 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.886 0.193 17919 55582 1 136 . 1 1 18 18 GLU C C 18 176.160 176.160 175.331 0.829 17919 55583 1 136 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.015 -0.295 17919 55584 1 136 . 1 1 18 18 GLU CB C 18 30.310 30.310 32.658 -2.349 17919 55585 1 136 . 1 1 18 18 GLU H H 18 8.640 8.640 8.253 0.387 17919 55586 1 136 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.243 -0.102 17919 55587 1 136 . 1 1 19 19 PRO C C 19 175.310 175.310 177.514 -2.204 17919 55588 1 136 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.282 0.188 17919 55589 1 136 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.981 -0.031 17919 55590 1 136 . 1 1 20 20 SER N N 20 103.400 103.400 109.199 -5.799 17919 55591 1 136 . 1 1 20 20 SER HA H 20 4.370 4.370 4.327 0.043 17919 55592 1 136 . 1 1 20 20 SER C C 20 174.660 174.660 174.437 0.223 17919 55593 1 136 . 1 1 20 20 SER CA C 20 57.400 57.400 57.963 -0.563 17919 55594 1 136 . 1 1 20 20 SER CB C 20 63.370 63.370 63.012 0.358 17919 55595 1 136 . 1 1 20 20 SER H H 20 7.040 7.040 7.937 -0.897 17919 55596 1 136 . 1 1 21 21 ASP N N 21 123.480 123.480 124.587 -1.107 17919 55597 1 136 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.741 -0.046 17919 55598 1 136 . 1 1 21 21 ASP C C 21 176.360 176.360 175.708 0.652 17919 55599 1 136 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.468 0.233 17919 55600 1 136 . 1 1 21 21 ASP CB C 21 40.800 40.800 42.199 -1.399 17919 55601 1 136 . 1 1 21 21 ASP H H 21 8.030 8.030 7.856 0.174 17919 55602 1 136 . 1 1 22 22 THR N N 22 108.800 108.800 111.559 -2.759 17919 55603 1 136 . 1 1 22 22 THR HA H 22 4.920 4.920 4.725 0.195 17919 55604 1 136 . 1 1 22 22 THR C C 22 176.750 176.750 176.124 0.626 17919 55605 1 136 . 1 1 22 22 THR CA C 22 59.690 59.690 61.134 -1.444 17919 55606 1 136 . 1 1 22 22 THR CB C 22 71.200 71.200 70.169 1.031 17919 55607 1 136 . 1 1 22 22 THR H H 22 7.900 7.900 8.339 -0.439 17919 55608 1 136 . 1 1 23 23 ILE N N 23 121.190 121.190 123.110 -1.920 17919 55609 1 136 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.751 -0.094 17919 55610 1 136 . 1 1 23 23 ILE C C 23 179.040 179.040 177.644 1.396 17919 55611 1 136 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.898 -0.638 17919 55612 1 136 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.288 -1.938 17919 55613 1 136 . 1 1 23 23 ILE H H 23 8.560 8.560 9.094 -0.534 17919 55614 1 136 . 1 1 24 24 GLU N N 24 120.830 120.830 120.717 0.113 17919 55615 1 136 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.850 0.067 17919 55616 1 136 . 1 1 24 24 GLU C C 24 178.640 178.640 178.358 0.282 17919 55617 1 136 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.248 -0.028 17919 55618 1 136 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.458 -1.178 17919 55619 1 136 . 1 1 24 24 GLU H H 24 9.760 9.760 8.330 1.430 17919 55620 1 136 . 1 1 25 25 ASN N N 25 120.570 120.570 117.334 3.236 17919 55621 1 136 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.535 -0.010 17919 55622 1 136 . 1 1 25 25 ASN C C 25 178.380 178.380 178.167 0.213 17919 55623 1 136 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.899 0.161 17919 55624 1 136 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.226 0.224 17919 55625 1 136 . 1 1 25 25 ASN H H 25 7.920 7.920 7.529 0.391 17919 55626 1 136 . 1 1 26 26 VAL N N 26 121.710 121.710 120.614 1.096 17919 55627 1 136 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.679 -0.282 17919 55628 1 136 . 1 1 26 26 VAL C C 26 177.950 177.950 177.753 0.197 17919 55629 1 136 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.247 1.413 17919 55630 1 136 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.116 -0.276 17919 55631 1 136 . 1 1 26 26 VAL H H 26 8.070 8.070 8.197 -0.127 17919 55632 1 136 . 1 1 27 27 LYS N N 27 118.860 118.860 120.006 -1.146 17919 55633 1 136 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.292 0.288 17919 55634 1 136 . 1 1 27 27 LYS C C 27 180.550 180.550 179.331 1.219 17919 55635 1 136 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.708 -0.458 17919 55636 1 136 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.255 1.475 17919 55637 1 136 . 1 1 27 27 LYS H H 27 8.560 8.560 8.015 0.545 17919 55638 1 136 . 1 1 28 28 ALA N N 28 123.440 123.440 122.079 1.361 17919 55639 1 136 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.261 -0.101 17919 55640 1 136 . 1 1 28 28 ALA C C 28 180.300 180.300 179.322 0.978 17919 55641 1 136 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.614 0.756 17919 55642 1 136 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.502 -0.792 17919 55643 1 136 . 1 1 28 28 ALA H H 28 8.060 8.060 8.024 0.036 17919 55644 1 136 . 1 1 29 29 LYS N N 29 119.940 119.940 119.795 0.145 17919 55645 1 136 . 1 1 29 29 LYS HA H 29 4.207 4.207 3.972 0.235 17919 55646 1 136 . 1 1 29 29 LYS C C 29 180.320 180.320 178.597 1.723 17919 55647 1 136 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.474 0.176 17919 55648 1 136 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.356 0.934 17919 55649 1 136 . 1 1 29 29 LYS H H 29 7.850 7.850 7.607 0.243 17919 55650 1 136 . 1 1 30 30 ILE N N 30 121.080 121.080 118.258 2.822 17919 55651 1 136 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.739 -0.232 17919 55652 1 136 . 1 1 30 30 ILE C C 30 178.310 178.310 177.270 1.040 17919 55653 1 136 . 1 1 30 30 ILE CA C 30 66.150 66.150 64.543 1.607 17919 55654 1 136 . 1 1 30 30 ILE CB C 30 36.800 36.800 38.113 -1.313 17919 55655 1 136 . 1 1 30 30 ILE H H 30 8.280 8.280 7.988 0.292 17919 55656 1 136 . 1 1 31 31 GLN N N 31 123.490 123.490 121.428 2.062 17919 55657 1 136 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.083 -0.254 17919 55658 1 136 . 1 1 31 31 GLN C C 31 178.890 178.890 178.227 0.663 17919 55659 1 136 . 1 1 31 31 GLN CA C 31 60.000 60.000 58.951 1.049 17919 55660 1 136 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.627 -0.907 17919 55661 1 136 . 1 1 31 31 GLN H H 31 8.580 8.580 8.145 0.435 17919 55662 1 136 . 1 1 32 32 ASP N N 32 119.360 119.360 117.367 1.993 17919 55663 1 136 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.484 -0.130 17919 55664 1 136 . 1 1 32 32 ASP C C 32 177.250 177.250 176.894 0.356 17919 55665 1 136 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.071 1.119 17919 55666 1 136 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.670 -0.090 17919 55667 1 136 . 1 1 32 32 ASP H H 32 8.010 8.010 8.232 -0.222 17919 55668 1 136 . 1 1 33 33 LYS N N 33 115.130 115.130 117.783 -2.653 17919 55669 1 136 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.485 -0.148 17919 55670 1 136 . 1 1 33 33 LYS C C 33 177.870 177.870 177.664 0.206 17919 55671 1 136 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.115 0.934 17919 55672 1 136 . 1 1 33 33 LYS CB C 33 34.170 34.170 35.111 -0.941 17919 55673 1 136 . 1 1 33 33 LYS H H 33 7.430 7.430 7.443 -0.013 17919 55674 1 136 . 1 1 34 34 GLU N N 34 113.870 113.870 117.006 -3.136 17919 55675 1 136 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.487 0.138 17919 55676 1 136 . 1 1 34 34 GLU C C 34 177.840 177.840 177.469 0.371 17919 55677 1 136 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.876 -0.706 17919 55678 1 136 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.064 1.596 17919 55679 1 136 . 1 1 34 34 GLU H H 34 8.740 8.740 8.338 0.402 17919 55680 1 136 . 1 1 35 35 GLY N N 35 108.650 108.650 108.382 0.268 17919 55681 1 136 . 1 1 35 35 GLY C C 35 173.960 173.960 174.507 -0.547 17919 55682 1 136 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.697 0.383 17919 55683 1 136 . 1 1 35 35 GLY H H 35 8.530 8.530 7.758 0.772 17919 55684 1 136 . 1 1 36 36 ILE N N 36 119.880 119.880 118.675 1.205 17919 55685 1 136 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.508 -0.063 17919 55686 1 136 . 1 1 36 36 ILE C C 36 173.590 173.590 174.038 -0.448 17919 55687 1 136 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.875 -0.125 17919 55688 1 136 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.137 2.443 17919 55689 1 136 . 1 1 36 36 ILE H H 36 6.150 6.150 7.643 -1.493 17919 55690 1 136 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.484 0.150 17919 55691 1 136 . 1 1 37 37 PRO C C 37 176.940 176.940 176.352 0.588 17919 55692 1 136 . 1 1 37 37 PRO CA C 37 61.660 61.660 62.293 -0.633 17919 55693 1 136 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.071 0.779 17919 55694 1 136 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.347 -0.230 17919 55695 1 136 . 1 1 38 38 PRO C C 38 178.320 178.320 177.783 0.537 17919 55696 1 136 . 1 1 38 38 PRO CA C 38 66.260 66.260 64.978 1.282 17919 55697 1 136 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.941 0.949 17919 55698 1 136 . 1 1 39 39 ASP N N 39 113.380 113.380 116.638 -3.258 17919 55699 1 136 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.325 0.105 17919 55700 1 136 . 1 1 39 39 ASP C C 39 177.090 177.090 177.481 -0.391 17919 55701 1 136 . 1 1 39 39 ASP CA C 39 55.640 55.640 57.045 -1.405 17919 55702 1 136 . 1 1 39 39 ASP CB C 39 39.540 39.540 39.529 0.011 17919 55703 1 136 . 1 1 39 39 ASP H H 39 8.550 8.550 8.736 -0.186 17919 55704 1 136 . 1 1 40 40 GLN N N 40 116.780 116.780 117.350 -0.570 17919 55705 1 136 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.447 0.017 17919 55706 1 136 . 1 1 40 40 GLN C C 40 175.380 175.380 176.343 -0.963 17919 55707 1 136 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.525 0.115 17919 55708 1 136 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.355 0.785 17919 55709 1 136 . 1 1 40 40 GLN H H 40 7.820 7.820 7.474 0.346 17919 55710 1 136 . 1 1 41 41 GLN N N 41 117.720 117.720 120.030 -2.310 17919 55711 1 136 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.258 -0.014 17919 55712 1 136 . 1 1 41 41 GLN C C 41 176.300 176.300 174.807 1.493 17919 55713 1 136 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.303 0.167 17919 55714 1 136 . 1 1 41 41 GLN CB C 41 31.650 31.650 28.381 3.269 17919 55715 1 136 . 1 1 41 41 GLN H H 41 7.480 7.480 7.629 -0.149 17919 55716 1 136 . 1 1 42 42 ARG N N 42 122.680 122.680 125.335 -2.655 17919 55717 1 136 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.400 0.100 17919 55718 1 136 . 1 1 42 42 ARG C C 42 174.050 174.050 174.382 -0.332 17919 55719 1 136 . 1 1 42 42 ARG CA C 42 55.050 55.050 56.025 -0.975 17919 55720 1 136 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.245 -0.495 17919 55721 1 136 . 1 1 42 42 ARG H H 42 8.530 8.530 8.581 -0.051 17919 55722 1 136 . 1 1 43 43 LEU N N 43 124.040 124.040 124.929 -0.889 17919 55723 1 136 . 1 1 43 43 LEU C C 43 175.290 175.290 175.397 -0.107 17919 55724 1 136 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.711 -0.731 17919 55725 1 136 . 1 1 43 43 LEU CB C 43 45.790 45.790 45.904 -0.114 17919 55726 1 136 . 1 1 43 43 LEU H H 43 8.820 8.820 8.548 0.272 17919 55727 1 136 . 1 1 44 44 ILE N N 44 121.920 121.920 122.690 -0.770 17919 55728 1 136 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.107 -0.115 17919 55729 1 136 . 1 1 44 44 ILE C C 44 176.060 176.060 174.230 1.830 17919 55730 1 136 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.328 -1.348 17919 55731 1 136 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.116 0.304 17919 55732 1 136 . 1 1 44 44 ILE H H 44 9.030 9.030 8.866 0.164 17919 55733 1 136 . 1 1 45 45 PHE N N 45 125.390 125.390 128.414 -3.024 17919 55734 1 136 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.167 -0.122 17919 55735 1 136 . 1 1 45 45 PHE C C 45 174.470 174.470 174.571 -0.101 17919 55736 1 136 . 1 1 45 45 PHE CA C 45 57.020 57.020 55.197 1.823 17919 55737 1 136 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.969 0.791 17919 55738 1 136 . 1 1 45 45 PHE H H 45 8.830 8.830 8.806 0.024 17919 55739 1 136 . 1 1 46 46 ALA N N 46 132.200 132.200 130.397 1.803 17919 55740 1 136 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.662 0.028 17919 55741 1 136 . 1 1 46 46 ALA C C 46 177.290 177.290 177.240 0.050 17919 55742 1 136 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.498 0.042 17919 55743 1 136 . 1 1 46 46 ALA CB C 46 16.570 16.570 15.808 0.762 17919 55744 1 136 . 1 1 46 46 ALA H H 46 8.810 8.810 9.126 -0.316 17919 55745 1 136 . 1 1 47 47 GLY N N 47 102.340 102.340 104.291 -1.951 17919 55746 1 136 . 1 1 47 47 GLY C C 47 173.810 173.810 174.454 -0.644 17919 55747 1 136 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.574 -0.224 17919 55748 1 136 . 1 1 47 47 GLY H H 47 8.130 8.130 8.541 -0.411 17919 55749 1 136 . 1 1 48 48 LYS N N 48 121.570 121.570 120.937 0.633 17919 55750 1 136 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.501 0.121 17919 55751 1 136 . 1 1 48 48 LYS C C 48 174.700 174.700 175.659 -0.959 17919 55752 1 136 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.632 -0.082 17919 55753 1 136 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.009 0.521 17919 55754 1 136 . 1 1 48 48 LYS H H 48 7.980 7.980 7.557 0.423 17919 55755 1 136 . 1 1 49 49 GLN N N 49 122.410 122.410 122.405 0.005 17919 55756 1 136 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.427 0.133 17919 55757 1 136 . 1 1 49 49 GLN C C 49 175.670 175.670 175.693 -0.023 17919 55758 1 136 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.812 -1.072 17919 55759 1 136 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.333 -0.333 17919 55760 1 136 . 1 1 49 49 GLN H H 49 8.600 8.600 8.488 0.112 17919 55761 1 136 . 1 1 50 50 LEU N N 50 125.520 125.520 125.303 0.217 17919 55762 1 136 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.197 -0.107 17919 55763 1 136 . 1 1 50 50 LEU C C 50 176.660 176.660 175.248 1.412 17919 55764 1 136 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.831 0.409 17919 55765 1 136 . 1 1 50 50 LEU CB C 50 41.570 41.570 43.006 -1.436 17919 55766 1 136 . 1 1 50 50 LEU H H 50 8.530 8.530 8.647 -0.117 17919 55767 1 136 . 1 1 51 51 GLU N N 51 122.940 122.940 121.860 1.080 17919 55768 1 136 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.653 -0.165 17919 55769 1 136 . 1 1 51 51 GLU C C 51 175.870 175.870 176.073 -0.203 17919 55770 1 136 . 1 1 51 51 GLU CA C 51 55.960 55.960 54.831 1.129 17919 55771 1 136 . 1 1 51 51 GLU CB C 51 31.570 31.570 33.874 -2.304 17919 55772 1 136 . 1 1 51 51 GLU H H 51 8.400 8.400 8.246 0.154 17919 55773 1 136 . 1 1 52 52 ASP N N 52 120.030 120.030 124.171 -4.141 17919 55774 1 136 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.549 -0.190 17919 55775 1 136 . 1 1 52 52 ASP C C 52 177.330 177.330 177.980 -0.650 17919 55776 1 136 . 1 1 52 52 ASP CA C 52 56.960 56.960 56.638 0.322 17919 55777 1 136 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.779 0.071 17919 55778 1 136 . 1 1 52 52 ASP H H 52 8.160 8.160 8.847 -0.687 17919 55779 1 136 . 1 1 53 53 GLY N N 53 106.660 106.660 106.479 0.181 17919 55780 1 136 . 1 1 53 53 GLY C C 53 174.870 174.870 174.526 0.344 17919 55781 1 136 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.995 0.175 17919 55782 1 136 . 1 1 53 53 GLY H H 53 9.390 9.390 8.417 0.973 17919 55783 1 136 . 1 1 54 54 ARG N N 54 119.050 119.050 120.911 -1.861 17919 55784 1 136 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.669 0.026 17919 55785 1 136 . 1 1 54 54 ARG C C 54 175.350 175.350 175.104 0.246 17919 55786 1 136 . 1 1 54 54 ARG CA C 54 54.390 54.390 53.270 1.120 17919 55787 1 136 . 1 1 54 54 ARG CB C 54 32.650 32.650 31.905 0.745 17919 55788 1 136 . 1 1 54 54 ARG H H 54 7.460 7.460 7.696 -0.236 17919 55789 1 136 . 1 1 55 55 THR N N 55 108.400 108.400 111.932 -3.532 17919 55790 1 136 . 1 1 55 55 THR HA H 55 5.240 5.240 5.083 0.157 17919 55791 1 136 . 1 1 55 55 THR C C 55 176.560 176.560 176.216 0.344 17919 55792 1 136 . 1 1 55 55 THR CA C 55 59.690 59.690 59.821 -0.131 17919 55793 1 136 . 1 1 55 55 THR CB C 55 72.260 72.260 71.149 1.111 17919 55794 1 136 . 1 1 55 55 THR H H 55 8.730 8.730 8.998 -0.268 17919 55795 1 136 . 1 1 56 56 LEU N N 56 117.920 117.920 120.644 -2.724 17919 55796 1 136 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.211 -0.151 17919 55797 1 136 . 1 1 56 56 LEU C C 56 180.810 180.810 178.772 2.038 17919 55798 1 136 . 1 1 56 56 LEU CA C 56 58.710 58.710 57.267 1.443 17919 55799 1 136 . 1 1 56 56 LEU CB C 56 40.370 40.370 40.518 -0.148 17919 55800 1 136 . 1 1 56 56 LEU H H 56 8.140 8.140 8.214 -0.074 17919 55801 1 136 . 1 1 57 57 SER N N 57 113.330 113.330 114.599 -1.269 17919 55802 1 136 . 1 1 57 57 SER HA H 57 4.370 4.370 4.114 0.256 17919 55803 1 136 . 1 1 57 57 SER C C 57 178.310 178.310 175.981 2.329 17919 55804 1 136 . 1 1 57 57 SER CA C 57 61.080 61.080 61.406 -0.326 17919 55805 1 136 . 1 1 57 57 SER CB C 57 62.530 62.530 62.754 -0.224 17919 55806 1 136 . 1 1 57 57 SER H H 57 8.470 8.470 7.717 0.753 17919 55807 1 136 . 1 1 58 58 ASP N N 58 124.190 124.190 120.477 3.713 17919 55808 1 136 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.286 0.010 17919 55809 1 136 . 1 1 58 58 ASP C C 58 177.400 177.400 177.045 0.355 17919 55810 1 136 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.563 0.617 17919 55811 1 136 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.470 -0.370 17919 55812 1 136 . 1 1 58 58 ASP H H 58 7.930 7.930 7.469 0.461 17919 55813 1 136 . 1 1 59 59 TYR N N 59 115.510 115.510 115.484 0.026 17919 55814 1 136 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.770 -0.100 17919 55815 1 136 . 1 1 59 59 TYR C C 59 174.700 174.700 174.767 -0.067 17919 55816 1 136 . 1 1 59 59 TYR CA C 59 58.250 58.250 56.720 1.530 17919 55817 1 136 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.421 1.649 17919 55818 1 136 . 1 1 59 59 TYR H H 59 7.250 7.250 7.125 0.125 17919 55819 1 136 . 1 1 60 60 ASN N N 60 115.900 115.900 114.646 1.254 17919 55820 1 136 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.342 0.013 17919 55821 1 136 . 1 1 60 60 ASN C C 60 174.340 174.340 174.734 -0.394 17919 55822 1 136 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.054 0.066 17919 55823 1 136 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.397 0.013 17919 55824 1 136 . 1 1 60 60 ASN H H 60 8.150 8.150 7.608 0.542 17919 55825 1 136 . 1 1 61 61 ILE N N 61 118.600 118.600 119.611 -1.011 17919 55826 1 136 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.543 -0.150 17919 55827 1 136 . 1 1 61 61 ILE C C 61 174.610 174.610 175.110 -0.500 17919 55828 1 136 . 1 1 61 61 ILE CA C 61 62.420 62.420 63.082 -0.662 17919 55829 1 136 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.301 -0.561 17919 55830 1 136 . 1 1 61 61 ILE H H 61 7.250 7.250 7.879 -0.629 17919 55831 1 136 . 1 1 62 62 GLN N N 62 124.740 124.740 124.958 -0.218 17919 55832 1 136 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.727 -0.221 17919 55833 1 136 . 1 1 62 62 GLN C C 62 175.970 175.970 175.361 0.609 17919 55834 1 136 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.594 0.066 17919 55835 1 136 . 1 1 62 62 GLN CB C 62 31.650 31.650 33.485 -1.835 17919 55836 1 136 . 1 1 62 62 GLN H H 62 7.610 7.610 7.911 -0.301 17919 55837 1 136 . 1 1 63 63 LYS N N 63 120.300 120.300 120.696 -0.396 17919 55838 1 136 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.297 -0.296 17919 55839 1 136 . 1 1 63 63 LYS C C 63 175.810 175.810 176.898 -1.088 17919 55840 1 136 . 1 1 63 63 LYS CA C 63 57.790 57.790 56.873 0.917 17919 55841 1 136 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.146 0.504 17919 55842 1 136 . 1 1 63 63 LYS H H 63 8.490 8.490 8.671 -0.181 17919 55843 1 136 . 1 1 64 64 GLU N N 64 113.950 113.950 119.863 -5.913 17919 55844 1 136 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.853 -0.388 17919 55845 1 136 . 1 1 64 64 GLU C C 64 175.250 175.250 175.803 -0.553 17919 55846 1 136 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.680 0.210 17919 55847 1 136 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.323 -2.422 17919 55848 1 136 . 1 1 64 64 GLU H H 64 9.280 9.280 8.810 0.470 17919 55849 1 136 . 1 1 65 65 SER N N 65 114.730 114.730 114.334 0.396 17919 55850 1 136 . 1 1 65 65 SER HA H 65 4.640 4.640 4.689 -0.049 17919 55851 1 136 . 1 1 65 65 SER C C 65 172.160 172.160 173.607 -1.447 17919 55852 1 136 . 1 1 65 65 SER CA C 65 60.890 60.890 58.852 2.038 17919 55853 1 136 . 1 1 65 65 SER CB C 65 64.910 64.910 64.719 0.191 17919 55854 1 136 . 1 1 65 65 SER H H 65 7.670 7.670 7.645 0.025 17919 55855 1 136 . 1 1 66 66 THR N N 66 117.110 117.110 116.790 0.320 17919 55856 1 136 . 1 1 66 66 THR HA H 66 5.270 5.270 5.374 -0.104 17919 55857 1 136 . 1 1 66 66 THR C C 66 173.950 173.950 173.595 0.355 17919 55858 1 136 . 1 1 66 66 THR CA C 66 62.340 62.340 61.861 0.479 17919 55859 1 136 . 1 1 66 66 THR CB C 66 70.080 70.080 70.672 -0.592 17919 55860 1 136 . 1 1 66 66 THR H H 66 8.730 8.730 8.247 0.483 17919 55861 1 136 . 1 1 67 67 LEU N N 67 127.110 127.110 125.135 1.975 17919 55862 1 136 . 1 1 67 67 LEU HA H 67 5.060 5.060 5.094 -0.034 17919 55863 1 136 . 1 1 67 67 LEU C C 67 175.770 175.770 175.692 0.078 17919 55864 1 136 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.016 -0.116 17919 55865 1 136 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.303 -0.043 17919 55866 1 136 . 1 1 67 67 LEU H H 67 9.410 9.410 8.493 0.917 17919 55867 1 136 . 1 1 68 68 HIS N N 68 118.380 118.380 120.316 -1.936 17919 55868 1 136 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.148 0.092 17919 55869 1 136 . 1 1 68 68 HIS C C 68 173.150 173.150 174.902 -1.752 17919 55870 1 136 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.572 0.428 17919 55871 1 136 . 1 1 68 68 HIS CB C 68 30.530 30.530 29.846 0.684 17919 55872 1 136 . 1 1 68 68 HIS H H 68 9.230 9.230 9.307 -0.077 17919 55873 1 136 . 1 1 69 69 LEU N N 69 124.460 124.460 127.759 -3.299 17919 55874 1 136 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.988 0.202 17919 55875 1 136 . 1 1 69 69 LEU C C 69 175.270 175.270 174.862 0.408 17919 55876 1 136 . 1 1 69 69 LEU CA C 69 53.890 53.890 55.367 -1.477 17919 55877 1 136 . 1 1 69 69 LEU CB C 69 44.380 44.380 42.637 1.743 17919 55878 1 136 . 1 1 69 69 LEU H H 69 8.340 8.340 7.926 0.414 17919 55879 1 136 . 1 1 70 70 VAL N N 70 126.940 126.940 127.934 -0.994 17919 55880 1 136 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.414 -0.064 17919 55881 1 136 . 1 1 70 70 VAL C C 70 174.000 174.000 174.490 -0.490 17919 55882 1 136 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.969 -0.169 17919 55883 1 136 . 1 1 70 70 VAL CB C 70 34.910 34.910 34.462 0.448 17919 55884 1 136 . 1 1 70 70 VAL H H 70 9.200 9.200 9.043 0.157 17919 55885 1 136 . 1 1 71 71 LEU N N 71 123.130 123.130 126.133 -3.003 17919 55886 1 136 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.456 -0.396 17919 55887 1 136 . 1 1 71 71 LEU C C 71 177.830 177.830 177.439 0.391 17919 55888 1 136 . 1 1 71 71 LEU CA C 71 53.940 53.940 52.666 1.274 17919 55889 1 136 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.433 -0.583 17919 55890 1 136 . 1 1 71 71 LEU H H 71 8.120 8.120 8.498 -0.378 17919 55891 1 136 . 1 1 72 72 ARG N N 72 123.490 123.490 120.521 2.969 17919 55892 1 136 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.734 -0.433 17919 55893 1 136 . 1 1 72 72 ARG C C 72 175.350 175.350 174.188 1.162 17919 55894 1 136 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.053 0.557 17919 55895 1 136 . 1 1 72 72 ARG CB C 72 31.350 31.350 33.587 -2.237 17919 55896 1 136 . 1 1 72 72 ARG H H 72 8.580 8.580 8.384 0.196 17919 55897 1 137 . 1 1 2 2 GLN N N 2 123.220 123.220 119.258 3.962 17919 55898 1 137 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.269 -0.020 17919 55899 1 137 . 1 1 2 2 GLN C C 2 175.920 175.920 175.285 0.635 17919 55900 1 137 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.624 0.456 17919 55901 1 137 . 1 1 2 2 GLN CB C 2 30.760 30.760 31.237 -0.477 17919 55902 1 137 . 1 1 2 2 GLN H H 2 8.900 8.900 8.401 0.499 17919 55903 1 137 . 1 1 3 3 ILE N N 3 115.340 115.340 115.823 -0.483 17919 55904 1 137 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.139 0.074 17919 55905 1 137 . 1 1 3 3 ILE C C 3 172.450 172.450 173.856 -1.406 17919 55906 1 137 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.354 0.216 17919 55907 1 137 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.082 1.128 17919 55908 1 137 . 1 1 3 3 ILE H H 3 8.320 8.320 8.381 -0.061 17919 55909 1 137 . 1 1 4 4 PHE N N 4 118.110 118.110 118.922 -0.812 17919 55910 1 137 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.319 0.311 17919 55911 1 137 . 1 1 4 4 PHE C C 4 175.320 175.320 174.974 0.346 17919 55912 1 137 . 1 1 4 4 PHE CA C 4 55.210 55.210 54.436 0.774 17919 55913 1 137 . 1 1 4 4 PHE CB C 4 41.480 41.480 40.404 1.076 17919 55914 1 137 . 1 1 4 4 PHE H H 4 8.610 8.610 7.896 0.714 17919 55915 1 137 . 1 1 5 5 VAL N N 5 121.000 121.000 123.297 -2.297 17919 55916 1 137 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.400 0.325 17919 55917 1 137 . 1 1 5 5 VAL C C 5 174.870 174.870 174.740 0.130 17919 55918 1 137 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.033 -0.413 17919 55919 1 137 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.453 -0.223 17919 55920 1 137 . 1 1 5 5 VAL H H 5 9.300 9.300 9.177 0.123 17919 55921 1 137 . 1 1 6 6 LYS N N 6 127.520 127.520 129.223 -1.703 17919 55922 1 137 . 1 1 6 6 LYS HA H 6 5.367 5.367 4.910 0.457 17919 55923 1 137 . 1 1 6 6 LYS C C 6 177.140 177.140 176.447 0.693 17919 55924 1 137 . 1 1 6 6 LYS CA C 6 54.520 54.520 55.191 -0.671 17919 55925 1 137 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.093 0.957 17919 55926 1 137 . 1 1 6 6 LYS H H 6 8.820 8.820 8.564 0.256 17919 55927 1 137 . 1 1 7 7 THR N N 7 115.400 115.400 118.597 -3.197 17919 55928 1 137 . 1 1 7 7 THR HA H 7 4.970 4.970 4.637 0.333 17919 55929 1 137 . 1 1 7 7 THR C C 7 176.910 176.910 175.686 1.224 17919 55930 1 137 . 1 1 7 7 THR CA C 7 60.470 60.470 60.249 0.221 17919 55931 1 137 . 1 1 7 7 THR CB C 7 70.630 70.630 70.856 -0.226 17919 55932 1 137 . 1 1 7 7 THR H H 7 8.730 8.730 8.009 0.721 17919 55933 1 137 . 1 1 8 8 LEU N N 8 121.330 121.330 119.970 1.360 17919 55934 1 137 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.225 0.085 17919 55935 1 137 . 1 1 8 8 LEU C C 8 178.800 178.800 178.474 0.326 17919 55936 1 137 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.602 -0.022 17919 55937 1 137 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.470 0.500 17919 55938 1 137 . 1 1 8 8 LEU H H 8 9.100 9.100 8.644 0.456 17919 55939 1 137 . 1 1 9 9 THR N N 9 105.590 105.590 106.961 -1.371 17919 55940 1 137 . 1 1 9 9 THR HA H 9 4.428 4.428 4.206 0.222 17919 55941 1 137 . 1 1 9 9 THR C C 9 175.520 175.520 176.011 -0.491 17919 55942 1 137 . 1 1 9 9 THR CA C 9 61.400 61.400 62.086 -0.686 17919 55943 1 137 . 1 1 9 9 THR CB C 9 69.140 69.140 68.889 0.251 17919 55944 1 137 . 1 1 9 9 THR H H 9 7.630 7.630 7.835 -0.205 17919 55945 1 137 . 1 1 10 10 GLY N N 10 108.890 108.890 110.601 -1.711 17919 55946 1 137 . 1 1 10 10 GLY C C 10 174.070 174.070 174.338 -0.268 17919 55947 1 137 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.213 0.247 17919 55948 1 137 . 1 1 10 10 GLY H H 10 7.810 7.810 7.850 -0.040 17919 55949 1 137 . 1 1 11 11 LYS N N 11 121.600 121.600 121.741 -0.141 17919 55950 1 137 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.060 0.301 17919 55951 1 137 . 1 1 11 11 LYS C C 11 175.940 175.940 175.682 0.258 17919 55952 1 137 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.897 -0.617 17919 55953 1 137 . 1 1 11 11 LYS CB C 11 33.200 33.200 32.432 0.768 17919 55954 1 137 . 1 1 11 11 LYS H H 11 7.280 7.280 7.971 -0.691 17919 55955 1 137 . 1 1 12 12 THR N N 12 120.440 120.440 118.499 1.941 17919 55956 1 137 . 1 1 12 12 THR HA H 12 5.046 5.046 4.379 0.667 17919 55957 1 137 . 1 1 12 12 THR C C 12 174.320 174.320 174.564 -0.244 17919 55958 1 137 . 1 1 12 12 THR CA C 12 62.390 62.390 62.412 -0.022 17919 55959 1 137 . 1 1 12 12 THR CB C 12 69.910 69.910 69.144 0.766 17919 55960 1 137 . 1 1 12 12 THR H H 12 8.650 8.650 8.236 0.414 17919 55961 1 137 . 1 1 13 13 ILE N N 13 127.110 127.110 125.211 1.899 17919 55962 1 137 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.674 -0.130 17919 55963 1 137 . 1 1 13 13 ILE C C 13 175.220 175.220 174.183 1.037 17919 55964 1 137 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.615 0.365 17919 55965 1 137 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.594 0.355 17919 55966 1 137 . 1 1 13 13 ILE H H 13 9.450 9.450 8.718 0.732 17919 55967 1 137 . 1 1 14 14 THR N N 14 121.520 121.520 123.818 -2.298 17919 55968 1 137 . 1 1 14 14 THR HA H 14 4.964 4.964 5.082 -0.118 17919 55969 1 137 . 1 1 14 14 THR C C 14 173.790 173.790 174.320 -0.530 17919 55970 1 137 . 1 1 14 14 THR CA C 14 61.940 61.940 61.948 -0.008 17919 55971 1 137 . 1 1 14 14 THR CB C 14 69.650 69.650 69.710 -0.060 17919 55972 1 137 . 1 1 14 14 THR H H 14 8.710 8.710 8.403 0.307 17919 55973 1 137 . 1 1 15 15 LEU N N 15 124.800 124.800 127.481 -2.681 17919 55974 1 137 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.668 0.112 17919 55975 1 137 . 1 1 15 15 LEU C C 15 174.670 174.670 175.730 -1.060 17919 55976 1 137 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.612 -0.782 17919 55977 1 137 . 1 1 15 15 LEU CB C 15 47.070 47.070 43.747 3.323 17919 55978 1 137 . 1 1 15 15 LEU H H 15 8.710 8.710 8.578 0.132 17919 55979 1 137 . 1 1 16 16 GLU N N 16 122.160 122.160 123.509 -1.349 17919 55980 1 137 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.995 -0.078 17919 55981 1 137 . 1 1 16 16 GLU C C 16 175.860 175.860 175.775 0.085 17919 55982 1 137 . 1 1 16 16 GLU CA C 16 54.820 54.820 54.065 0.756 17919 55983 1 137 . 1 1 16 16 GLU CB C 16 29.450 29.450 29.442 0.008 17919 55984 1 137 . 1 1 16 16 GLU H H 16 8.140 8.140 8.608 -0.468 17919 55985 1 137 . 1 1 17 17 VAL N N 17 117.210 117.210 118.464 -1.254 17919 55986 1 137 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.431 0.283 17919 55987 1 137 . 1 1 17 17 VAL C C 17 174.160 174.160 174.963 -0.803 17919 55988 1 137 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.296 -0.866 17919 55989 1 137 . 1 1 17 17 VAL CB C 17 36.400 36.400 34.574 1.826 17919 55990 1 137 . 1 1 17 17 VAL H H 17 8.900 8.900 8.277 0.623 17919 55991 1 137 . 1 1 18 18 GLU N N 18 118.990 118.990 121.955 -2.965 17919 55992 1 137 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.926 0.153 17919 55993 1 137 . 1 1 18 18 GLU C C 18 176.160 176.160 175.450 0.710 17919 55994 1 137 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.288 0.432 17919 55995 1 137 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.419 -0.109 17919 55996 1 137 . 1 1 18 18 GLU H H 18 8.640 8.640 8.739 -0.099 17919 55997 1 137 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.091 0.050 17919 55998 1 137 . 1 1 19 19 PRO C C 19 175.310 175.310 178.135 -2.825 17919 55999 1 137 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.941 -0.471 17919 56000 1 137 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.932 0.018 17919 56001 1 137 . 1 1 20 20 SER N N 20 103.400 103.400 109.723 -6.323 17919 56002 1 137 . 1 1 20 20 SER HA H 20 4.370 4.370 4.291 0.079 17919 56003 1 137 . 1 1 20 20 SER C C 20 174.660 174.660 174.613 0.047 17919 56004 1 137 . 1 1 20 20 SER CA C 20 57.400 57.400 58.821 -1.421 17919 56005 1 137 . 1 1 20 20 SER CB C 20 63.370 63.370 62.826 0.544 17919 56006 1 137 . 1 1 20 20 SER H H 20 7.040 7.040 8.069 -1.029 17919 56007 1 137 . 1 1 21 21 ASP N N 21 123.480 123.480 122.776 0.704 17919 56008 1 137 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.600 0.095 17919 56009 1 137 . 1 1 21 21 ASP C C 21 176.360 176.360 176.055 0.305 17919 56010 1 137 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.839 -0.139 17919 56011 1 137 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.559 -0.759 17919 56012 1 137 . 1 1 21 21 ASP H H 21 8.030 8.030 7.883 0.147 17919 56013 1 137 . 1 1 22 22 THR N N 22 108.800 108.800 111.548 -2.748 17919 56014 1 137 . 1 1 22 22 THR HA H 22 4.920 4.920 4.399 0.521 17919 56015 1 137 . 1 1 22 22 THR C C 22 176.750 176.750 175.921 0.829 17919 56016 1 137 . 1 1 22 22 THR CA C 22 59.690 59.690 62.175 -2.485 17919 56017 1 137 . 1 1 22 22 THR CB C 22 71.200 71.200 70.815 0.385 17919 56018 1 137 . 1 1 22 22 THR H H 22 7.900 7.900 8.230 -0.330 17919 56019 1 137 . 1 1 23 23 ILE N N 23 121.190 121.190 124.138 -2.948 17919 56020 1 137 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.839 -0.182 17919 56021 1 137 . 1 1 23 23 ILE C C 23 179.040 179.040 177.410 1.630 17919 56022 1 137 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.822 -0.562 17919 56023 1 137 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.553 -2.203 17919 56024 1 137 . 1 1 23 23 ILE H H 23 8.560 8.560 8.623 -0.063 17919 56025 1 137 . 1 1 24 24 GLU N N 24 120.830 120.830 121.210 -0.380 17919 56026 1 137 . 1 1 24 24 GLU HA H 24 3.917 3.917 4.108 -0.191 17919 56027 1 137 . 1 1 24 24 GLU C C 24 178.640 178.640 178.852 -0.212 17919 56028 1 137 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.468 0.752 17919 56029 1 137 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.609 -1.329 17919 56030 1 137 . 1 1 24 24 GLU H H 24 9.760 9.760 7.796 1.964 17919 56031 1 137 . 1 1 25 25 ASN N N 25 120.570 120.570 117.822 2.748 17919 56032 1 137 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.592 -0.067 17919 56033 1 137 . 1 1 25 25 ASN C C 25 178.380 178.380 177.575 0.805 17919 56034 1 137 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.707 0.353 17919 56035 1 137 . 1 1 25 25 ASN CB C 25 38.450 38.450 39.075 -0.625 17919 56036 1 137 . 1 1 25 25 ASN H H 25 7.920 7.920 7.747 0.173 17919 56037 1 137 . 1 1 26 26 VAL N N 26 121.710 121.710 120.980 0.730 17919 56038 1 137 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.951 -0.554 17919 56039 1 137 . 1 1 26 26 VAL C C 26 177.950 177.950 177.353 0.597 17919 56040 1 137 . 1 1 26 26 VAL CA C 26 67.660 67.660 63.932 3.728 17919 56041 1 137 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.488 -0.648 17919 56042 1 137 . 1 1 26 26 VAL H H 26 8.070 8.070 8.194 -0.124 17919 56043 1 137 . 1 1 27 27 LYS N N 27 118.860 118.860 120.104 -1.244 17919 56044 1 137 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.262 0.318 17919 56045 1 137 . 1 1 27 27 LYS C C 27 180.550 180.550 178.684 1.866 17919 56046 1 137 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.562 -0.312 17919 56047 1 137 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.091 1.639 17919 56048 1 137 . 1 1 27 27 LYS H H 27 8.560 8.560 8.657 -0.097 17919 56049 1 137 . 1 1 28 28 ALA N N 28 123.440 123.440 122.632 0.808 17919 56050 1 137 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.083 0.077 17919 56051 1 137 . 1 1 28 28 ALA C C 28 180.300 180.300 179.051 1.249 17919 56052 1 137 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.047 0.323 17919 56053 1 137 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.260 -0.550 17919 56054 1 137 . 1 1 28 28 ALA H H 28 8.060 8.060 7.569 0.491 17919 56055 1 137 . 1 1 29 29 LYS N N 29 119.940 119.940 119.667 0.273 17919 56056 1 137 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.226 -0.019 17919 56057 1 137 . 1 1 29 29 LYS C C 29 180.320 180.320 179.361 0.959 17919 56058 1 137 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.356 0.294 17919 56059 1 137 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.213 1.077 17919 56060 1 137 . 1 1 29 29 LYS H H 29 7.850 7.850 7.712 0.138 17919 56061 1 137 . 1 1 30 30 ILE N N 30 121.080 121.080 119.883 1.197 17919 56062 1 137 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.617 -0.110 17919 56063 1 137 . 1 1 30 30 ILE C C 30 178.310 178.310 177.510 0.800 17919 56064 1 137 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.081 1.069 17919 56065 1 137 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.340 -0.540 17919 56066 1 137 . 1 1 30 30 ILE H H 30 8.280 8.280 7.932 0.348 17919 56067 1 137 . 1 1 31 31 GLN N N 31 123.490 123.490 120.195 3.295 17919 56068 1 137 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.987 -0.158 17919 56069 1 137 . 1 1 31 31 GLN C C 31 178.890 178.890 178.625 0.265 17919 56070 1 137 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.144 0.856 17919 56071 1 137 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.451 -0.731 17919 56072 1 137 . 1 1 31 31 GLN H H 31 8.580 8.580 7.697 0.883 17919 56073 1 137 . 1 1 32 32 ASP N N 32 119.360 119.360 121.002 -1.642 17919 56074 1 137 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.463 -0.109 17919 56075 1 137 . 1 1 32 32 ASP C C 32 177.250 177.250 178.063 -0.813 17919 56076 1 137 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.663 0.527 17919 56077 1 137 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.459 0.121 17919 56078 1 137 . 1 1 32 32 ASP H H 32 8.010 8.010 8.266 -0.256 17919 56079 1 137 . 1 1 33 33 LYS N N 33 115.130 115.130 119.317 -4.187 17919 56080 1 137 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.216 0.121 17919 56081 1 137 . 1 1 33 33 LYS C C 33 177.870 177.870 178.087 -0.217 17919 56082 1 137 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.343 -0.293 17919 56083 1 137 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.206 0.964 17919 56084 1 137 . 1 1 33 33 LYS H H 33 7.430 7.430 7.840 -0.410 17919 56085 1 137 . 1 1 34 34 GLU N N 34 113.870 113.870 114.841 -0.971 17919 56086 1 137 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.517 0.108 17919 56087 1 137 . 1 1 34 34 GLU C C 34 177.840 177.840 176.839 1.001 17919 56088 1 137 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.122 -0.952 17919 56089 1 137 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.226 1.434 17919 56090 1 137 . 1 1 34 34 GLU H H 34 8.740 8.740 8.238 0.502 17919 56091 1 137 . 1 1 35 35 GLY N N 35 108.650 108.650 109.719 -1.069 17919 56092 1 137 . 1 1 35 35 GLY C C 35 173.960 173.960 174.422 -0.462 17919 56093 1 137 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.892 0.189 17919 56094 1 137 . 1 1 35 35 GLY H H 35 8.530 8.530 8.251 0.279 17919 56095 1 137 . 1 1 36 36 ILE N N 36 119.880 119.880 118.367 1.513 17919 56096 1 137 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.424 0.021 17919 56097 1 137 . 1 1 36 36 ILE C C 36 173.590 173.590 173.902 -0.312 17919 56098 1 137 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.776 -0.026 17919 56099 1 137 . 1 1 36 36 ILE CB C 36 40.580 40.580 37.674 2.906 17919 56100 1 137 . 1 1 36 36 ILE H H 36 6.150 6.150 7.526 -1.376 17919 56101 1 137 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.641 -0.007 17919 56102 1 137 . 1 1 37 37 PRO C C 37 176.940 176.940 176.246 0.694 17919 56103 1 137 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.822 -0.162 17919 56104 1 137 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.312 0.538 17919 56105 1 137 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.127 -0.010 17919 56106 1 137 . 1 1 38 38 PRO C C 38 178.320 178.320 178.746 -0.426 17919 56107 1 137 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.663 0.597 17919 56108 1 137 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.876 1.014 17919 56109 1 137 . 1 1 39 39 ASP N N 39 113.380 113.380 116.530 -3.150 17919 56110 1 137 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.299 0.131 17919 56111 1 137 . 1 1 39 39 ASP C C 39 177.090 177.090 177.451 -0.361 17919 56112 1 137 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.900 -1.260 17919 56113 1 137 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.749 -1.209 17919 56114 1 137 . 1 1 39 39 ASP H H 39 8.550 8.550 8.653 -0.103 17919 56115 1 137 . 1 1 40 40 GLN N N 40 116.780 116.780 115.613 1.167 17919 56116 1 137 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.636 -0.172 17919 56117 1 137 . 1 1 40 40 GLN C C 40 175.380 175.380 176.281 -0.901 17919 56118 1 137 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.875 -0.235 17919 56119 1 137 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.940 0.200 17919 56120 1 137 . 1 1 40 40 GLN H H 40 7.820 7.820 7.580 0.240 17919 56121 1 137 . 1 1 41 41 GLN N N 41 117.720 117.720 119.318 -1.598 17919 56122 1 137 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.440 -0.196 17919 56123 1 137 . 1 1 41 41 GLN C C 41 176.300 176.300 174.586 1.714 17919 56124 1 137 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.924 0.546 17919 56125 1 137 . 1 1 41 41 GLN CB C 41 31.650 31.650 30.234 1.416 17919 56126 1 137 . 1 1 41 41 GLN H H 41 7.480 7.480 7.380 0.100 17919 56127 1 137 . 1 1 42 42 ARG N N 42 122.680 122.680 124.160 -1.480 17919 56128 1 137 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.625 -0.125 17919 56129 1 137 . 1 1 42 42 ARG C C 42 174.050 174.050 174.082 -0.032 17919 56130 1 137 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.773 0.277 17919 56131 1 137 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.254 -0.504 17919 56132 1 137 . 1 1 42 42 ARG H H 42 8.530 8.530 8.348 0.182 17919 56133 1 137 . 1 1 43 43 LEU N N 43 124.040 124.040 127.526 -3.486 17919 56134 1 137 . 1 1 43 43 LEU C C 43 175.290 175.290 176.285 -0.995 17919 56135 1 137 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.449 -1.469 17919 56136 1 137 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.241 2.549 17919 56137 1 137 . 1 1 43 43 LEU H H 43 8.820 8.820 8.732 0.088 17919 56138 1 137 . 1 1 44 44 ILE N N 44 121.920 121.920 122.402 -0.482 17919 56139 1 137 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.047 -0.055 17919 56140 1 137 . 1 1 44 44 ILE C C 44 176.060 176.060 174.504 1.556 17919 56141 1 137 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.386 -1.406 17919 56142 1 137 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.078 0.342 17919 56143 1 137 . 1 1 44 44 ILE H H 44 9.030 9.030 7.973 1.057 17919 56144 1 137 . 1 1 45 45 PHE N N 45 125.390 125.390 127.670 -2.280 17919 56145 1 137 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.070 -0.025 17919 56146 1 137 . 1 1 45 45 PHE C C 45 174.470 174.470 174.452 0.018 17919 56147 1 137 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.259 0.761 17919 56148 1 137 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.402 0.358 17919 56149 1 137 . 1 1 45 45 PHE H H 45 8.830 8.830 8.933 -0.103 17919 56150 1 137 . 1 1 46 46 ALA N N 46 132.200 132.200 129.256 2.944 17919 56151 1 137 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.615 0.075 17919 56152 1 137 . 1 1 46 46 ALA C C 46 177.290 177.290 177.489 -0.199 17919 56153 1 137 . 1 1 46 46 ALA CA C 46 52.540 52.540 53.111 -0.571 17919 56154 1 137 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.536 0.034 17919 56155 1 137 . 1 1 46 46 ALA H H 46 8.810 8.810 8.626 0.184 17919 56156 1 137 . 1 1 47 47 GLY N N 47 102.340 102.340 103.298 -0.958 17919 56157 1 137 . 1 1 47 47 GLY C C 47 173.810 173.810 174.341 -0.531 17919 56158 1 137 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.373 -0.023 17919 56159 1 137 . 1 1 47 47 GLY H H 47 8.130 8.130 8.504 -0.374 17919 56160 1 137 . 1 1 48 48 LYS N N 48 121.570 121.570 121.701 -0.131 17919 56161 1 137 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.559 0.063 17919 56162 1 137 . 1 1 48 48 LYS C C 48 174.700 174.700 175.803 -1.103 17919 56163 1 137 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.732 -0.182 17919 56164 1 137 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.278 0.252 17919 56165 1 137 . 1 1 48 48 LYS H H 48 7.980 7.980 8.011 -0.031 17919 56166 1 137 . 1 1 49 49 GLN N N 49 122.410 122.410 123.550 -1.140 17919 56167 1 137 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.453 0.107 17919 56168 1 137 . 1 1 49 49 GLN C C 49 175.670 175.670 175.871 -0.201 17919 56169 1 137 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.499 -0.759 17919 56170 1 137 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.141 -0.141 17919 56171 1 137 . 1 1 49 49 GLN H H 49 8.600 8.600 8.622 -0.022 17919 56172 1 137 . 1 1 50 50 LEU N N 50 125.520 125.520 127.813 -2.293 17919 56173 1 137 . 1 1 50 50 LEU HA H 50 4.090 4.090 3.829 0.261 17919 56174 1 137 . 1 1 50 50 LEU C C 50 176.660 176.660 176.157 0.503 17919 56175 1 137 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.891 0.349 17919 56176 1 137 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.088 0.482 17919 56177 1 137 . 1 1 50 50 LEU H H 50 8.530 8.530 8.069 0.461 17919 56178 1 137 . 1 1 51 51 GLU N N 51 122.940 122.940 124.990 -2.050 17919 56179 1 137 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.308 0.180 17919 56180 1 137 . 1 1 51 51 GLU C C 51 175.870 175.870 177.194 -1.324 17919 56181 1 137 . 1 1 51 51 GLU CA C 51 55.960 55.960 56.671 -0.711 17919 56182 1 137 . 1 1 51 51 GLU CB C 51 31.570 31.570 30.663 0.907 17919 56183 1 137 . 1 1 51 51 GLU H H 51 8.400 8.400 8.586 -0.186 17919 56184 1 137 . 1 1 52 52 ASP N N 52 120.030 120.030 124.926 -4.896 17919 56185 1 137 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.446 -0.087 17919 56186 1 137 . 1 1 52 52 ASP C C 52 177.330 177.330 178.420 -1.090 17919 56187 1 137 . 1 1 52 52 ASP CA C 52 56.960 56.960 58.172 -1.212 17919 56188 1 137 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.762 0.088 17919 56189 1 137 . 1 1 52 52 ASP H H 52 8.160 8.160 8.919 -0.759 17919 56190 1 137 . 1 1 53 53 GLY N N 53 106.660 106.660 107.097 -0.437 17919 56191 1 137 . 1 1 53 53 GLY C C 53 174.870 174.870 174.072 0.798 17919 56192 1 137 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.070 0.100 17919 56193 1 137 . 1 1 53 53 GLY H H 53 9.390 9.390 8.480 0.910 17919 56194 1 137 . 1 1 54 54 ARG N N 54 119.050 119.050 121.726 -2.676 17919 56195 1 137 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.556 0.139 17919 56196 1 137 . 1 1 54 54 ARG C C 54 175.350 175.350 175.833 -0.483 17919 56197 1 137 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.797 -0.407 17919 56198 1 137 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.492 0.158 17919 56199 1 137 . 1 1 54 54 ARG H H 54 7.460 7.460 7.427 0.033 17919 56200 1 137 . 1 1 55 55 THR N N 55 108.400 108.400 114.596 -6.196 17919 56201 1 137 . 1 1 55 55 THR HA H 55 5.240 5.240 4.699 0.541 17919 56202 1 137 . 1 1 55 55 THR C C 55 176.560 176.560 176.575 -0.015 17919 56203 1 137 . 1 1 55 55 THR CA C 55 59.690 59.690 61.126 -1.436 17919 56204 1 137 . 1 1 55 55 THR CB C 55 72.260 72.260 70.495 1.765 17919 56205 1 137 . 1 1 55 55 THR H H 55 8.730 8.730 8.824 -0.094 17919 56206 1 137 . 1 1 56 56 LEU N N 56 117.920 117.920 121.741 -3.821 17919 56207 1 137 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.024 0.036 17919 56208 1 137 . 1 1 56 56 LEU C C 56 180.810 180.810 178.829 1.981 17919 56209 1 137 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.545 0.165 17919 56210 1 137 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.056 -0.687 17919 56211 1 137 . 1 1 56 56 LEU H H 56 8.140 8.140 8.621 -0.481 17919 56212 1 137 . 1 1 57 57 SER N N 57 113.330 113.330 113.947 -0.617 17919 56213 1 137 . 1 1 57 57 SER HA H 57 4.370 4.370 4.083 0.287 17919 56214 1 137 . 1 1 57 57 SER C C 57 178.310 178.310 177.047 1.263 17919 56215 1 137 . 1 1 57 57 SER CA C 57 61.080 61.080 61.339 -0.259 17919 56216 1 137 . 1 1 57 57 SER CB C 57 62.530 62.530 62.768 -0.238 17919 56217 1 137 . 1 1 57 57 SER H H 57 8.470 8.470 7.930 0.540 17919 56218 1 137 . 1 1 58 58 ASP N N 58 124.190 124.190 122.334 1.856 17919 56219 1 137 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.281 0.015 17919 56220 1 137 . 1 1 58 58 ASP C C 58 177.400 177.400 177.497 -0.097 17919 56221 1 137 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.764 0.416 17919 56222 1 137 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.370 -0.270 17919 56223 1 137 . 1 1 58 58 ASP H H 58 7.930 7.930 8.076 -0.146 17919 56224 1 137 . 1 1 59 59 TYR N N 59 115.510 115.510 114.552 0.958 17919 56225 1 137 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.668 0.002 17919 56226 1 137 . 1 1 59 59 TYR C C 59 174.700 174.700 174.983 -0.283 17919 56227 1 137 . 1 1 59 59 TYR CA C 59 58.250 58.250 56.740 1.510 17919 56228 1 137 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.943 1.127 17919 56229 1 137 . 1 1 59 59 TYR H H 59 7.250 7.250 7.354 -0.104 17919 56230 1 137 . 1 1 60 60 ASN N N 60 115.900 115.900 118.090 -2.190 17919 56231 1 137 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.401 -0.046 17919 56232 1 137 . 1 1 60 60 ASN C C 60 174.340 174.340 175.040 -0.700 17919 56233 1 137 . 1 1 60 60 ASN CA C 60 54.120 54.120 53.891 0.229 17919 56234 1 137 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.598 -0.188 17919 56235 1 137 . 1 1 60 60 ASN H H 60 8.150 8.150 7.640 0.510 17919 56236 1 137 . 1 1 61 61 ILE N N 61 118.600 118.600 120.361 -1.761 17919 56237 1 137 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.726 -0.333 17919 56238 1 137 . 1 1 61 61 ILE C C 61 174.610 174.610 175.567 -0.957 17919 56239 1 137 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.501 -0.081 17919 56240 1 137 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.152 -0.412 17919 56241 1 137 . 1 1 61 61 ILE H H 61 7.250 7.250 7.739 -0.489 17919 56242 1 137 . 1 1 62 62 GLN N N 62 124.740 124.740 126.477 -1.737 17919 56243 1 137 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.606 -0.100 17919 56244 1 137 . 1 1 62 62 GLN C C 62 175.970 175.970 175.226 0.744 17919 56245 1 137 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.367 0.293 17919 56246 1 137 . 1 1 62 62 GLN CB C 62 31.650 31.650 30.937 0.713 17919 56247 1 137 . 1 1 62 62 GLN H H 62 7.610 7.610 8.070 -0.460 17919 56248 1 137 . 1 1 63 63 LYS N N 63 120.300 120.300 121.598 -1.298 17919 56249 1 137 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.791 0.210 17919 56250 1 137 . 1 1 63 63 LYS C C 63 175.810 175.810 177.322 -1.512 17919 56251 1 137 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.508 -0.718 17919 56252 1 137 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.112 0.538 17919 56253 1 137 . 1 1 63 63 LYS H H 63 8.490 8.490 8.569 -0.079 17919 56254 1 137 . 1 1 64 64 GLU N N 64 113.950 113.950 121.612 -7.662 17919 56255 1 137 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.349 0.116 17919 56256 1 137 . 1 1 64 64 GLU C C 64 175.250 175.250 175.364 -0.114 17919 56257 1 137 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.427 0.463 17919 56258 1 137 . 1 1 64 64 GLU CB C 64 25.900 25.900 27.924 -2.024 17919 56259 1 137 . 1 1 64 64 GLU H H 64 9.280 9.280 8.357 0.923 17919 56260 1 137 . 1 1 65 65 SER N N 65 114.730 114.730 114.364 0.366 17919 56261 1 137 . 1 1 65 65 SER HA H 65 4.640 4.640 4.484 0.156 17919 56262 1 137 . 1 1 65 65 SER C C 65 172.160 172.160 174.504 -2.344 17919 56263 1 137 . 1 1 65 65 SER CA C 65 60.890 60.890 59.556 1.334 17919 56264 1 137 . 1 1 65 65 SER CB C 65 64.910 64.910 63.659 1.251 17919 56265 1 137 . 1 1 65 65 SER H H 65 7.670 7.670 7.684 -0.014 17919 56266 1 137 . 1 1 66 66 THR N N 66 117.110 117.110 123.614 -6.504 17919 56267 1 137 . 1 1 66 66 THR HA H 66 5.270 5.270 4.716 0.554 17919 56268 1 137 . 1 1 66 66 THR C C 66 173.950 173.950 174.125 -0.175 17919 56269 1 137 . 1 1 66 66 THR CA C 66 62.340 62.340 62.885 -0.544 17919 56270 1 137 . 1 1 66 66 THR CB C 66 70.080 70.080 69.396 0.684 17919 56271 1 137 . 1 1 66 66 THR H H 66 8.730 8.730 8.503 0.227 17919 56272 1 137 . 1 1 67 67 LEU N N 67 127.110 127.110 128.395 -1.285 17919 56273 1 137 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.640 0.420 17919 56274 1 137 . 1 1 67 67 LEU C C 67 175.770 175.770 176.255 -0.485 17919 56275 1 137 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.235 -0.335 17919 56276 1 137 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.406 0.855 17919 56277 1 137 . 1 1 67 67 LEU H H 67 9.410 9.410 8.675 0.735 17919 56278 1 137 . 1 1 68 68 HIS N N 68 118.380 118.380 117.920 0.460 17919 56279 1 137 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.208 0.032 17919 56280 1 137 . 1 1 68 68 HIS C C 68 173.150 173.150 174.330 -1.180 17919 56281 1 137 . 1 1 68 68 HIS CA C 68 55.000 55.000 55.141 -0.141 17919 56282 1 137 . 1 1 68 68 HIS CB C 68 30.530 30.530 33.415 -2.885 17919 56283 1 137 . 1 1 68 68 HIS H H 68 9.230 9.230 8.874 0.356 17919 56284 1 137 . 1 1 69 69 LEU N N 69 124.460 124.460 121.077 3.383 17919 56285 1 137 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.002 0.188 17919 56286 1 137 . 1 1 69 69 LEU C C 69 175.270 175.270 175.302 -0.032 17919 56287 1 137 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.853 -0.964 17919 56288 1 137 . 1 1 69 69 LEU CB C 69 44.380 44.380 45.533 -1.153 17919 56289 1 137 . 1 1 69 69 LEU H H 69 8.340 8.340 8.198 0.142 17919 56290 1 137 . 1 1 70 70 VAL N N 70 126.940 126.940 126.918 0.022 17919 56291 1 137 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.372 -0.022 17919 56292 1 137 . 1 1 70 70 VAL C C 70 174.000 174.000 174.377 -0.377 17919 56293 1 137 . 1 1 70 70 VAL CA C 70 60.800 60.800 61.025 -0.225 17919 56294 1 137 . 1 1 70 70 VAL CB C 70 34.910 34.910 34.176 0.734 17919 56295 1 137 . 1 1 70 70 VAL H H 70 9.200 9.200 8.751 0.449 17919 56296 1 137 . 1 1 71 71 LEU N N 71 123.130 123.130 126.990 -3.860 17919 56297 1 137 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.121 -0.061 17919 56298 1 137 . 1 1 71 71 LEU C C 71 177.830 177.830 176.803 1.027 17919 56299 1 137 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.812 0.128 17919 56300 1 137 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.349 0.501 17919 56301 1 137 . 1 1 71 71 LEU H H 71 8.120 8.120 8.585 -0.465 17919 56302 1 137 . 1 1 72 72 ARG N N 72 123.490 123.490 124.595 -1.105 17919 56303 1 137 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.693 -0.392 17919 56304 1 137 . 1 1 72 72 ARG C C 72 175.350 175.350 175.875 -0.525 17919 56305 1 137 . 1 1 72 72 ARG CA C 72 55.610 55.610 53.935 1.675 17919 56306 1 137 . 1 1 72 72 ARG CB C 72 31.350 31.350 31.042 0.308 17919 56307 1 137 . 1 1 72 72 ARG H H 72 8.580 8.580 8.880 -0.300 17919 56308 1 138 . 1 1 2 2 GLN N N 2 123.220 123.220 117.694 5.526 17919 56309 1 138 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.451 -0.202 17919 56310 1 138 . 1 1 2 2 GLN C C 2 175.920 175.920 174.812 1.108 17919 56311 1 138 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.288 0.792 17919 56312 1 138 . 1 1 2 2 GLN CB C 2 30.760 30.760 32.238 -1.478 17919 56313 1 138 . 1 1 2 2 GLN H H 2 8.900 8.900 8.231 0.669 17919 56314 1 138 . 1 1 3 3 ILE N N 3 115.340 115.340 115.116 0.224 17919 56315 1 138 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.153 0.060 17919 56316 1 138 . 1 1 3 3 ILE C C 3 172.450 172.450 173.742 -1.292 17919 56317 1 138 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.498 0.072 17919 56318 1 138 . 1 1 3 3 ILE CB C 3 42.210 42.210 40.933 1.277 17919 56319 1 138 . 1 1 3 3 ILE H H 3 8.320 8.320 8.195 0.125 17919 56320 1 138 . 1 1 4 4 PHE N N 4 118.110 118.110 118.181 -0.071 17919 56321 1 138 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.383 0.247 17919 56322 1 138 . 1 1 4 4 PHE C C 4 175.320 175.320 175.184 0.136 17919 56323 1 138 . 1 1 4 4 PHE CA C 4 55.210 55.210 54.805 0.405 17919 56324 1 138 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.639 -0.159 17919 56325 1 138 . 1 1 4 4 PHE H H 4 8.610 8.610 7.735 0.875 17919 56326 1 138 . 1 1 5 5 VAL N N 5 121.000 121.000 120.045 0.955 17919 56327 1 138 . 1 1 5 5 VAL HA H 5 4.725 4.725 5.077 -0.352 17919 56328 1 138 . 1 1 5 5 VAL C C 5 174.870 174.870 174.716 0.154 17919 56329 1 138 . 1 1 5 5 VAL CA C 5 60.620 60.620 60.910 -0.290 17919 56330 1 138 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.454 -0.224 17919 56331 1 138 . 1 1 5 5 VAL H H 5 9.300 9.300 8.942 0.358 17919 56332 1 138 . 1 1 6 6 LYS N N 6 127.520 127.520 127.800 -0.280 17919 56333 1 138 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.407 -0.040 17919 56334 1 138 . 1 1 6 6 LYS C C 6 177.140 177.140 176.438 0.702 17919 56335 1 138 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.167 0.353 17919 56336 1 138 . 1 1 6 6 LYS CB C 6 35.050 35.050 36.034 -0.984 17919 56337 1 138 . 1 1 6 6 LYS H H 6 8.820 8.820 8.760 0.060 17919 56338 1 138 . 1 1 7 7 THR N N 7 115.400 115.400 116.149 -0.749 17919 56339 1 138 . 1 1 7 7 THR HA H 7 4.970 4.970 4.398 0.572 17919 56340 1 138 . 1 1 7 7 THR C C 7 176.910 176.910 175.401 1.509 17919 56341 1 138 . 1 1 7 7 THR CA C 7 60.470 60.470 60.422 0.048 17919 56342 1 138 . 1 1 7 7 THR CB C 7 70.630 70.630 70.112 0.518 17919 56343 1 138 . 1 1 7 7 THR H H 7 8.730 8.730 8.689 0.041 17919 56344 1 138 . 1 1 8 8 LEU N N 8 121.330 121.330 119.611 1.719 17919 56345 1 138 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.267 0.043 17919 56346 1 138 . 1 1 8 8 LEU C C 8 178.800 178.800 177.493 1.307 17919 56347 1 138 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.363 0.217 17919 56348 1 138 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.009 -0.039 17919 56349 1 138 . 1 1 8 8 LEU H H 8 9.100 9.100 8.671 0.429 17919 56350 1 138 . 1 1 9 9 THR N N 9 105.590 105.590 107.596 -2.006 17919 56351 1 138 . 1 1 9 9 THR HA H 9 4.428 4.428 4.426 0.002 17919 56352 1 138 . 1 1 9 9 THR C C 9 175.520 175.520 175.574 -0.054 17919 56353 1 138 . 1 1 9 9 THR CA C 9 61.400 61.400 61.553 -0.153 17919 56354 1 138 . 1 1 9 9 THR CB C 9 69.140 69.140 70.614 -1.474 17919 56355 1 138 . 1 1 9 9 THR H H 9 7.630 7.630 7.744 -0.114 17919 56356 1 138 . 1 1 10 10 GLY N N 10 108.890 108.890 110.829 -1.939 17919 56357 1 138 . 1 1 10 10 GLY C C 10 174.070 174.070 173.811 0.259 17919 56358 1 138 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.879 0.581 17919 56359 1 138 . 1 1 10 10 GLY H H 10 7.810 7.810 7.543 0.267 17919 56360 1 138 . 1 1 11 11 LYS N N 11 121.600 121.600 121.181 0.419 17919 56361 1 138 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.412 -0.051 17919 56362 1 138 . 1 1 11 11 LYS C C 11 175.940 175.940 175.223 0.717 17919 56363 1 138 . 1 1 11 11 LYS CA C 11 56.280 56.280 57.056 -0.776 17919 56364 1 138 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.431 -0.231 17919 56365 1 138 . 1 1 11 11 LYS H H 11 7.280 7.280 8.073 -0.793 17919 56366 1 138 . 1 1 12 12 THR N N 12 120.440 120.440 116.870 3.570 17919 56367 1 138 . 1 1 12 12 THR HA H 12 5.046 5.046 5.515 -0.469 17919 56368 1 138 . 1 1 12 12 THR C C 12 174.320 174.320 174.140 0.180 17919 56369 1 138 . 1 1 12 12 THR CA C 12 62.390 62.390 61.006 1.384 17919 56370 1 138 . 1 1 12 12 THR CB C 12 69.910 69.910 71.044 -1.134 17919 56371 1 138 . 1 1 12 12 THR H H 12 8.650 8.650 8.266 0.384 17919 56372 1 138 . 1 1 13 13 ILE N N 13 127.110 127.110 123.578 3.532 17919 56373 1 138 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.459 0.085 17919 56374 1 138 . 1 1 13 13 ILE C C 13 175.220 175.220 173.893 1.327 17919 56375 1 138 . 1 1 13 13 ILE CA C 13 59.980 59.980 61.330 -1.350 17919 56376 1 138 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.415 -0.465 17919 56377 1 138 . 1 1 13 13 ILE H H 13 9.450 9.450 8.768 0.682 17919 56378 1 138 . 1 1 14 14 THR N N 14 121.520 121.520 122.899 -1.379 17919 56379 1 138 . 1 1 14 14 THR HA H 14 4.964 4.964 4.896 0.068 17919 56380 1 138 . 1 1 14 14 THR C C 14 173.790 173.790 173.736 0.054 17919 56381 1 138 . 1 1 14 14 THR CA C 14 61.940 61.940 61.860 0.080 17919 56382 1 138 . 1 1 14 14 THR CB C 14 69.650 69.650 69.934 -0.284 17919 56383 1 138 . 1 1 14 14 THR H H 14 8.710 8.710 8.363 0.347 17919 56384 1 138 . 1 1 15 15 LEU N N 15 124.800 124.800 127.792 -2.992 17919 56385 1 138 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.756 0.024 17919 56386 1 138 . 1 1 15 15 LEU C C 15 174.670 174.670 175.038 -0.368 17919 56387 1 138 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.871 -1.041 17919 56388 1 138 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.535 1.535 17919 56389 1 138 . 1 1 15 15 LEU H H 15 8.710 8.710 8.521 0.189 17919 56390 1 138 . 1 1 16 16 GLU N N 16 122.160 122.160 123.759 -1.599 17919 56391 1 138 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.135 -0.218 17919 56392 1 138 . 1 1 16 16 GLU C C 16 175.860 175.860 175.952 -0.092 17919 56393 1 138 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.559 -0.739 17919 56394 1 138 . 1 1 16 16 GLU CB C 16 29.450 29.450 31.214 -1.764 17919 56395 1 138 . 1 1 16 16 GLU H H 16 8.140 8.140 8.707 -0.567 17919 56396 1 138 . 1 1 17 17 VAL N N 17 117.210 117.210 121.159 -3.949 17919 56397 1 138 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.804 -0.090 17919 56398 1 138 . 1 1 17 17 VAL C C 17 174.160 174.160 174.626 -0.466 17919 56399 1 138 . 1 1 17 17 VAL CA C 17 58.430 58.430 60.059 -1.629 17919 56400 1 138 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.392 1.008 17919 56401 1 138 . 1 1 17 17 VAL H H 17 8.900 8.900 8.633 0.267 17919 56402 1 138 . 1 1 18 18 GLU N N 18 118.990 118.990 122.572 -3.582 17919 56403 1 138 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.891 0.188 17919 56404 1 138 . 1 1 18 18 GLU C C 18 176.160 176.160 175.822 0.338 17919 56405 1 138 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.776 -0.056 17919 56406 1 138 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.725 -0.415 17919 56407 1 138 . 1 1 18 18 GLU H H 18 8.640 8.640 8.398 0.242 17919 56408 1 138 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.342 -0.201 17919 56409 1 138 . 1 1 19 19 PRO C C 19 175.310 175.310 178.188 -2.878 17919 56410 1 138 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.093 0.377 17919 56411 1 138 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.876 0.074 17919 56412 1 138 . 1 1 20 20 SER N N 20 103.400 103.400 112.771 -9.371 17919 56413 1 138 . 1 1 20 20 SER HA H 20 4.370 4.370 4.219 0.151 17919 56414 1 138 . 1 1 20 20 SER C C 20 174.660 174.660 174.068 0.592 17919 56415 1 138 . 1 1 20 20 SER CA C 20 57.400 57.400 60.270 -2.870 17919 56416 1 138 . 1 1 20 20 SER CB C 20 63.370 63.370 62.809 0.561 17919 56417 1 138 . 1 1 20 20 SER H H 20 7.040 7.040 8.063 -1.023 17919 56418 1 138 . 1 1 21 21 ASP N N 21 123.480 123.480 122.823 0.657 17919 56419 1 138 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.670 0.025 17919 56420 1 138 . 1 1 21 21 ASP C C 21 176.360 176.360 176.349 0.011 17919 56421 1 138 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.832 -0.132 17919 56422 1 138 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.414 -0.614 17919 56423 1 138 . 1 1 21 21 ASP H H 21 8.030 8.030 7.801 0.229 17919 56424 1 138 . 1 1 22 22 THR N N 22 108.800 108.800 116.115 -7.315 17919 56425 1 138 . 1 1 22 22 THR HA H 22 4.920 4.920 4.600 0.320 17919 56426 1 138 . 1 1 22 22 THR C C 22 176.750 176.750 176.537 0.213 17919 56427 1 138 . 1 1 22 22 THR CA C 22 59.690 59.690 61.853 -2.163 17919 56428 1 138 . 1 1 22 22 THR CB C 22 71.200 71.200 70.096 1.104 17919 56429 1 138 . 1 1 22 22 THR H H 22 7.900 7.900 8.598 -0.698 17919 56430 1 138 . 1 1 23 23 ILE N N 23 121.190 121.190 122.915 -1.725 17919 56431 1 138 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.686 -0.029 17919 56432 1 138 . 1 1 23 23 ILE C C 23 179.040 179.040 177.716 1.324 17919 56433 1 138 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.332 -1.072 17919 56434 1 138 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.357 -2.007 17919 56435 1 138 . 1 1 23 23 ILE H H 23 8.560 8.560 9.095 -0.535 17919 56436 1 138 . 1 1 24 24 GLU N N 24 120.830 120.830 119.674 1.156 17919 56437 1 138 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.977 -0.060 17919 56438 1 138 . 1 1 24 24 GLU C C 24 178.640 178.640 178.351 0.289 17919 56439 1 138 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.443 0.777 17919 56440 1 138 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.351 -1.071 17919 56441 1 138 . 1 1 24 24 GLU H H 24 9.760 9.760 7.978 1.782 17919 56442 1 138 . 1 1 25 25 ASN N N 25 120.570 120.570 118.410 2.160 17919 56443 1 138 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.505 0.020 17919 56444 1 138 . 1 1 25 25 ASN C C 25 178.380 178.380 177.807 0.573 17919 56445 1 138 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.815 0.246 17919 56446 1 138 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.526 -0.076 17919 56447 1 138 . 1 1 25 25 ASN H H 25 7.920 7.920 7.565 0.355 17919 56448 1 138 . 1 1 26 26 VAL N N 26 121.710 121.710 121.050 0.660 17919 56449 1 138 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.460 -0.063 17919 56450 1 138 . 1 1 26 26 VAL C C 26 177.950 177.950 177.647 0.303 17919 56451 1 138 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.854 0.806 17919 56452 1 138 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.257 -0.417 17919 56453 1 138 . 1 1 26 26 VAL H H 26 8.070 8.070 7.747 0.323 17919 56454 1 138 . 1 1 27 27 LYS N N 27 118.860 118.860 119.238 -0.378 17919 56455 1 138 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.188 0.392 17919 56456 1 138 . 1 1 27 27 LYS C C 27 180.550 180.550 179.000 1.550 17919 56457 1 138 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.484 -0.234 17919 56458 1 138 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.246 1.484 17919 56459 1 138 . 1 1 27 27 LYS H H 27 8.560 8.560 7.730 0.830 17919 56460 1 138 . 1 1 28 28 ALA N N 28 123.440 123.440 121.160 2.280 17919 56461 1 138 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.098 0.062 17919 56462 1 138 . 1 1 28 28 ALA C C 28 180.300 180.300 179.077 1.223 17919 56463 1 138 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.015 0.355 17919 56464 1 138 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.471 -0.761 17919 56465 1 138 . 1 1 28 28 ALA H H 28 8.060 8.060 8.441 -0.381 17919 56466 1 138 . 1 1 29 29 LYS N N 29 119.940 119.940 118.891 1.049 17919 56467 1 138 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.059 0.148 17919 56468 1 138 . 1 1 29 29 LYS C C 29 180.320 180.320 178.716 1.604 17919 56469 1 138 . 1 1 29 29 LYS CA C 29 59.650 59.650 58.945 0.705 17919 56470 1 138 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.365 0.925 17919 56471 1 138 . 1 1 29 29 LYS H H 29 7.850 7.850 7.492 0.358 17919 56472 1 138 . 1 1 30 30 ILE N N 30 121.080 121.080 120.471 0.609 17919 56473 1 138 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.664 -0.157 17919 56474 1 138 . 1 1 30 30 ILE C C 30 178.310 178.310 177.193 1.117 17919 56475 1 138 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.122 1.028 17919 56476 1 138 . 1 1 30 30 ILE CB C 30 36.800 36.800 38.011 -1.211 17919 56477 1 138 . 1 1 30 30 ILE H H 30 8.280 8.280 8.198 0.082 17919 56478 1 138 . 1 1 31 31 GLN N N 31 123.490 123.490 119.959 3.531 17919 56479 1 138 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.961 -0.132 17919 56480 1 138 . 1 1 31 31 GLN C C 31 178.890 178.890 177.664 1.226 17919 56481 1 138 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.109 0.891 17919 56482 1 138 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.432 -0.712 17919 56483 1 138 . 1 1 31 31 GLN H H 31 8.580 8.580 8.399 0.181 17919 56484 1 138 . 1 1 32 32 ASP N N 32 119.360 119.360 117.466 1.894 17919 56485 1 138 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.467 -0.113 17919 56486 1 138 . 1 1 32 32 ASP C C 32 177.250 177.250 177.546 -0.296 17919 56487 1 138 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.223 0.967 17919 56488 1 138 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.907 -0.327 17919 56489 1 138 . 1 1 32 32 ASP H H 32 8.010 8.010 7.733 0.277 17919 56490 1 138 . 1 1 33 33 LYS N N 33 115.130 115.130 117.255 -2.125 17919 56491 1 138 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.473 -0.136 17919 56492 1 138 . 1 1 33 33 LYS C C 33 177.870 177.870 177.957 -0.087 17919 56493 1 138 . 1 1 33 33 LYS CA C 33 58.050 58.050 56.920 1.130 17919 56494 1 138 . 1 1 33 33 LYS CB C 33 34.170 34.170 34.693 -0.523 17919 56495 1 138 . 1 1 33 33 LYS H H 33 7.430 7.430 7.559 -0.129 17919 56496 1 138 . 1 1 34 34 GLU N N 34 113.870 113.870 116.967 -3.097 17919 56497 1 138 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.371 0.254 17919 56498 1 138 . 1 1 34 34 GLU C C 34 177.840 177.840 177.517 0.323 17919 56499 1 138 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.260 -1.090 17919 56500 1 138 . 1 1 34 34 GLU CB C 34 32.660 32.660 30.539 2.121 17919 56501 1 138 . 1 1 34 34 GLU H H 34 8.740 8.740 8.230 0.510 17919 56502 1 138 . 1 1 35 35 GLY N N 35 108.650 108.650 108.579 0.071 17919 56503 1 138 . 1 1 35 35 GLY C C 35 173.960 173.960 174.222 -0.262 17919 56504 1 138 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.928 0.152 17919 56505 1 138 . 1 1 35 35 GLY H H 35 8.530 8.530 7.939 0.592 17919 56506 1 138 . 1 1 36 36 ILE N N 36 119.880 119.880 121.353 -1.473 17919 56507 1 138 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.409 0.036 17919 56508 1 138 . 1 1 36 36 ILE C C 36 173.590 173.590 174.356 -0.766 17919 56509 1 138 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.789 -0.039 17919 56510 1 138 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.692 1.888 17919 56511 1 138 . 1 1 36 36 ILE H H 36 6.150 6.150 7.672 -1.522 17919 56512 1 138 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.868 -0.234 17919 56513 1 138 . 1 1 37 37 PRO C C 37 176.940 176.940 176.428 0.512 17919 56514 1 138 . 1 1 37 37 PRO CA C 37 61.660 61.660 60.743 0.917 17919 56515 1 138 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.613 0.237 17919 56516 1 138 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.279 -0.162 17919 56517 1 138 . 1 1 38 38 PRO C C 38 178.320 178.320 178.077 0.243 17919 56518 1 138 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.063 1.197 17919 56519 1 138 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.556 1.334 17919 56520 1 138 . 1 1 39 39 ASP N N 39 113.380 113.380 117.319 -3.939 17919 56521 1 138 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.364 0.066 17919 56522 1 138 . 1 1 39 39 ASP C C 39 177.090 177.090 176.921 0.169 17919 56523 1 138 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.832 -1.192 17919 56524 1 138 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.390 -0.850 17919 56525 1 138 . 1 1 39 39 ASP H H 39 8.550 8.550 8.612 -0.062 17919 56526 1 138 . 1 1 40 40 GLN N N 40 116.780 116.780 116.138 0.642 17919 56527 1 138 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.534 -0.070 17919 56528 1 138 . 1 1 40 40 GLN C C 40 175.380 175.380 176.133 -0.753 17919 56529 1 138 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.318 0.322 17919 56530 1 138 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.816 0.324 17919 56531 1 138 . 1 1 40 40 GLN H H 40 7.820 7.820 8.018 -0.198 17919 56532 1 138 . 1 1 41 41 GLN N N 41 117.720 117.720 120.261 -2.541 17919 56533 1 138 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.444 -0.200 17919 56534 1 138 . 1 1 41 41 GLN C C 41 176.300 176.300 175.837 0.463 17919 56535 1 138 . 1 1 41 41 GLN CA C 41 56.470 56.470 57.170 -0.700 17919 56536 1 138 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.180 2.470 17919 56537 1 138 . 1 1 41 41 GLN H H 41 7.480 7.480 7.492 -0.012 17919 56538 1 138 . 1 1 42 42 ARG N N 42 122.680 122.680 121.068 1.612 17919 56539 1 138 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.657 -0.157 17919 56540 1 138 . 1 1 42 42 ARG C C 42 174.050 174.050 174.833 -0.783 17919 56541 1 138 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.637 0.413 17919 56542 1 138 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.600 -1.850 17919 56543 1 138 . 1 1 42 42 ARG H H 42 8.530 8.530 8.229 0.301 17919 56544 1 138 . 1 1 43 43 LEU N N 43 124.040 124.040 123.308 0.732 17919 56545 1 138 . 1 1 43 43 LEU C C 43 175.290 175.290 175.515 -0.225 17919 56546 1 138 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.126 -1.146 17919 56547 1 138 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.468 2.322 17919 56548 1 138 . 1 1 43 43 LEU H H 43 8.820 8.820 8.844 -0.024 17919 56549 1 138 . 1 1 44 44 ILE N N 44 121.920 121.920 122.800 -0.880 17919 56550 1 138 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.827 0.165 17919 56551 1 138 . 1 1 44 44 ILE C C 44 176.060 176.060 174.289 1.771 17919 56552 1 138 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.361 -1.381 17919 56553 1 138 . 1 1 44 44 ILE CB C 44 41.420 41.420 40.732 0.688 17919 56554 1 138 . 1 1 44 44 ILE H H 44 9.030 9.030 8.383 0.647 17919 56555 1 138 . 1 1 45 45 PHE N N 45 125.390 125.390 127.858 -2.468 17919 56556 1 138 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.922 0.123 17919 56557 1 138 . 1 1 45 45 PHE C C 45 174.470 174.470 174.010 0.460 17919 56558 1 138 . 1 1 45 45 PHE CA C 45 57.020 57.020 57.662 -0.642 17919 56559 1 138 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.633 1.127 17919 56560 1 138 . 1 1 45 45 PHE H H 45 8.830 8.830 8.663 0.167 17919 56561 1 138 . 1 1 46 46 ALA N N 46 132.200 132.200 129.623 2.577 17919 56562 1 138 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.647 0.043 17919 56563 1 138 . 1 1 46 46 ALA C C 46 177.290 177.290 177.796 -0.506 17919 56564 1 138 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.215 0.326 17919 56565 1 138 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.587 -0.017 17919 56566 1 138 . 1 1 46 46 ALA H H 46 8.810 8.810 8.296 0.514 17919 56567 1 138 . 1 1 47 47 GLY N N 47 102.340 102.340 103.288 -0.948 17919 56568 1 138 . 1 1 47 47 GLY C C 47 173.810 173.810 174.027 -0.217 17919 56569 1 138 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.088 0.262 17919 56570 1 138 . 1 1 47 47 GLY H H 47 8.130 8.130 8.587 -0.457 17919 56571 1 138 . 1 1 48 48 LYS N N 48 121.570 121.570 119.784 1.786 17919 56572 1 138 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.501 0.121 17919 56573 1 138 . 1 1 48 48 LYS C C 48 174.700 174.700 175.641 -0.941 17919 56574 1 138 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.535 0.015 17919 56575 1 138 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.856 -0.326 17919 56576 1 138 . 1 1 48 48 LYS H H 48 7.980 7.980 7.695 0.285 17919 56577 1 138 . 1 1 49 49 GLN N N 49 122.410 122.410 121.607 0.803 17919 56578 1 138 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.472 0.088 17919 56579 1 138 . 1 1 49 49 GLN C C 49 175.670 175.670 176.355 -0.685 17919 56580 1 138 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.381 -0.641 17919 56581 1 138 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.374 -0.374 17919 56582 1 138 . 1 1 49 49 GLN H H 49 8.600 8.600 8.514 0.086 17919 56583 1 138 . 1 1 50 50 LEU N N 50 125.520 125.520 124.240 1.280 17919 56584 1 138 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.104 -0.014 17919 56585 1 138 . 1 1 50 50 LEU C C 50 176.660 176.660 176.346 0.314 17919 56586 1 138 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.084 0.156 17919 56587 1 138 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.953 -0.383 17919 56588 1 138 . 1 1 50 50 LEU H H 50 8.530 8.530 8.211 0.319 17919 56589 1 138 . 1 1 51 51 GLU N N 51 122.940 122.940 124.862 -1.922 17919 56590 1 138 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.472 0.016 17919 56591 1 138 . 1 1 51 51 GLU C C 51 175.870 175.870 177.006 -1.136 17919 56592 1 138 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.593 0.367 17919 56593 1 138 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.512 0.059 17919 56594 1 138 . 1 1 51 51 GLU H H 51 8.400 8.400 8.460 -0.060 17919 56595 1 138 . 1 1 52 52 ASP N N 52 120.030 120.030 126.988 -6.958 17919 56596 1 138 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.602 -0.243 17919 56597 1 138 . 1 1 52 52 ASP C C 52 177.330 177.330 176.357 0.973 17919 56598 1 138 . 1 1 52 52 ASP CA C 52 56.960 56.960 55.800 1.160 17919 56599 1 138 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.929 -0.079 17919 56600 1 138 . 1 1 52 52 ASP H H 52 8.160 8.160 8.905 -0.745 17919 56601 1 138 . 1 1 53 53 GLY N N 53 106.660 106.660 106.299 0.361 17919 56602 1 138 . 1 1 53 53 GLY C C 53 174.870 174.870 174.394 0.476 17919 56603 1 138 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.890 0.280 17919 56604 1 138 . 1 1 53 53 GLY H H 53 9.390 9.390 8.853 0.537 17919 56605 1 138 . 1 1 54 54 ARG N N 54 119.050 119.050 121.174 -2.124 17919 56606 1 138 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.635 0.060 17919 56607 1 138 . 1 1 54 54 ARG C C 54 175.350 175.350 174.920 0.430 17919 56608 1 138 . 1 1 54 54 ARG CA C 54 54.390 54.390 53.467 0.923 17919 56609 1 138 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.501 0.150 17919 56610 1 138 . 1 1 54 54 ARG H H 54 7.460 7.460 7.498 -0.038 17919 56611 1 138 . 1 1 55 55 THR N N 55 108.400 108.400 110.570 -2.170 17919 56612 1 138 . 1 1 55 55 THR HA H 55 5.240 5.240 5.206 0.034 17919 56613 1 138 . 1 1 55 55 THR C C 55 176.560 176.560 176.193 0.367 17919 56614 1 138 . 1 1 55 55 THR CA C 55 59.690 59.690 59.394 0.296 17919 56615 1 138 . 1 1 55 55 THR CB C 55 72.260 72.260 71.877 0.383 17919 56616 1 138 . 1 1 55 55 THR H H 55 8.730 8.730 7.810 0.920 17919 56617 1 138 . 1 1 56 56 LEU N N 56 117.920 117.920 121.204 -3.284 17919 56618 1 138 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.838 0.222 17919 56619 1 138 . 1 1 56 56 LEU C C 56 180.810 180.810 178.850 1.960 17919 56620 1 138 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.740 -0.030 17919 56621 1 138 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.386 -1.016 17919 56622 1 138 . 1 1 56 56 LEU H H 56 8.140 8.140 8.923 -0.783 17919 56623 1 138 . 1 1 57 57 SER N N 57 113.330 113.330 112.392 0.938 17919 56624 1 138 . 1 1 57 57 SER HA H 57 4.370 4.370 4.300 0.070 17919 56625 1 138 . 1 1 57 57 SER C C 57 178.310 178.310 176.118 2.192 17919 56626 1 138 . 1 1 57 57 SER CA C 57 61.080 61.080 60.113 0.967 17919 56627 1 138 . 1 1 57 57 SER CB C 57 62.530 62.530 62.650 -0.120 17919 56628 1 138 . 1 1 57 57 SER H H 57 8.470 8.470 7.790 0.680 17919 56629 1 138 . 1 1 58 58 ASP N N 58 124.190 124.190 122.418 1.772 17919 56630 1 138 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.295 0.001 17919 56631 1 138 . 1 1 58 58 ASP C C 58 177.400 177.400 177.381 0.019 17919 56632 1 138 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.934 0.246 17919 56633 1 138 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.460 -0.360 17919 56634 1 138 . 1 1 58 58 ASP H H 58 7.930 7.930 7.819 0.111 17919 56635 1 138 . 1 1 59 59 TYR N N 59 115.510 115.510 115.551 -0.041 17919 56636 1 138 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.595 0.075 17919 56637 1 138 . 1 1 59 59 TYR C C 59 174.700 174.700 175.406 -0.706 17919 56638 1 138 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.614 0.636 17919 56639 1 138 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.630 1.440 17919 56640 1 138 . 1 1 59 59 TYR H H 59 7.250 7.250 7.316 -0.066 17919 56641 1 138 . 1 1 60 60 ASN N N 60 115.900 115.900 117.220 -1.320 17919 56642 1 138 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.394 -0.039 17919 56643 1 138 . 1 1 60 60 ASN C C 60 174.340 174.340 174.597 -0.257 17919 56644 1 138 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.226 -0.106 17919 56645 1 138 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.223 0.187 17919 56646 1 138 . 1 1 60 60 ASN H H 60 8.150 8.150 7.688 0.462 17919 56647 1 138 . 1 1 61 61 ILE N N 61 118.600 118.600 119.787 -1.187 17919 56648 1 138 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.874 -0.481 17919 56649 1 138 . 1 1 61 61 ILE C C 61 174.610 174.610 174.880 -0.270 17919 56650 1 138 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.711 0.709 17919 56651 1 138 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.245 -0.505 17919 56652 1 138 . 1 1 61 61 ILE H H 61 7.250 7.250 7.907 -0.657 17919 56653 1 138 . 1 1 62 62 GLN N N 62 124.740 124.740 125.086 -0.346 17919 56654 1 138 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.662 -0.156 17919 56655 1 138 . 1 1 62 62 GLN C C 62 175.970 175.970 175.661 0.309 17919 56656 1 138 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.531 0.129 17919 56657 1 138 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.356 0.294 17919 56658 1 138 . 1 1 62 62 GLN H H 62 7.610 7.610 7.795 -0.185 17919 56659 1 138 . 1 1 63 63 LYS N N 63 120.300 120.300 120.102 0.198 17919 56660 1 138 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.134 -0.133 17919 56661 1 138 . 1 1 63 63 LYS C C 63 175.810 175.810 177.213 -1.403 17919 56662 1 138 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.181 0.610 17919 56663 1 138 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.807 0.843 17919 56664 1 138 . 1 1 63 63 LYS H H 63 8.490 8.490 8.498 -0.008 17919 56665 1 138 . 1 1 64 64 GLU N N 64 113.950 113.950 119.238 -5.288 17919 56666 1 138 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.129 0.336 17919 56667 1 138 . 1 1 64 64 GLU C C 64 175.250 175.250 175.368 -0.118 17919 56668 1 138 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.456 0.434 17919 56669 1 138 . 1 1 64 64 GLU CB C 64 25.900 25.900 27.981 -2.081 17919 56670 1 138 . 1 1 64 64 GLU H H 64 9.280 9.280 8.742 0.538 17919 56671 1 138 . 1 1 65 65 SER N N 65 114.730 114.730 114.865 -0.135 17919 56672 1 138 . 1 1 65 65 SER HA H 65 4.640 4.640 4.521 0.119 17919 56673 1 138 . 1 1 65 65 SER C C 65 172.160 172.160 174.417 -2.257 17919 56674 1 138 . 1 1 65 65 SER CA C 65 60.890 60.890 59.709 1.181 17919 56675 1 138 . 1 1 65 65 SER CB C 65 64.910 64.910 63.635 1.275 17919 56676 1 138 . 1 1 65 65 SER H H 65 7.670 7.670 7.323 0.347 17919 56677 1 138 . 1 1 66 66 THR N N 66 117.110 117.110 122.446 -5.336 17919 56678 1 138 . 1 1 66 66 THR HA H 66 5.270 5.270 4.882 0.388 17919 56679 1 138 . 1 1 66 66 THR C C 66 173.950 173.950 174.474 -0.524 17919 56680 1 138 . 1 1 66 66 THR CA C 66 62.340 62.340 62.585 -0.245 17919 56681 1 138 . 1 1 66 66 THR CB C 66 70.080 70.080 70.065 0.015 17919 56682 1 138 . 1 1 66 66 THR H H 66 8.730 8.730 8.326 0.404 17919 56683 1 138 . 1 1 67 67 LEU N N 67 127.110 127.110 126.980 0.130 17919 56684 1 138 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.898 0.162 17919 56685 1 138 . 1 1 67 67 LEU C C 67 175.770 175.770 175.155 0.615 17919 56686 1 138 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.093 -0.193 17919 56687 1 138 . 1 1 67 67 LEU CB C 67 44.260 44.260 45.055 -0.795 17919 56688 1 138 . 1 1 67 67 LEU H H 67 9.410 9.410 8.842 0.568 17919 56689 1 138 . 1 1 68 68 HIS N N 68 118.380 118.380 121.036 -2.656 17919 56690 1 138 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.309 -0.069 17919 56691 1 138 . 1 1 68 68 HIS C C 68 173.150 173.150 174.917 -1.767 17919 56692 1 138 . 1 1 68 68 HIS CA C 68 55.000 55.000 53.971 1.029 17919 56693 1 138 . 1 1 68 68 HIS CB C 68 30.530 30.530 31.113 -0.584 17919 56694 1 138 . 1 1 68 68 HIS H H 68 9.230 9.230 9.098 0.132 17919 56695 1 138 . 1 1 69 69 LEU N N 69 124.460 124.460 130.065 -5.605 17919 56696 1 138 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.589 0.601 17919 56697 1 138 . 1 1 69 69 LEU C C 69 175.270 175.270 174.716 0.554 17919 56698 1 138 . 1 1 69 69 LEU CA C 69 53.890 53.890 55.927 -2.037 17919 56699 1 138 . 1 1 69 69 LEU CB C 69 44.380 44.380 42.385 1.995 17919 56700 1 138 . 1 1 69 69 LEU H H 69 8.340 8.340 7.749 0.591 17919 56701 1 138 . 1 1 70 70 VAL N N 70 126.940 126.940 123.475 3.465 17919 56702 1 138 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.450 -0.100 17919 56703 1 138 . 1 1 70 70 VAL C C 70 174.000 174.000 174.263 -0.263 17919 56704 1 138 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.863 0.937 17919 56705 1 138 . 1 1 70 70 VAL CB C 70 34.910 34.910 34.946 -0.036 17919 56706 1 138 . 1 1 70 70 VAL H H 70 9.200 9.200 8.767 0.433 17919 56707 1 138 . 1 1 71 71 LEU N N 71 123.130 123.130 123.034 0.096 17919 56708 1 138 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.832 0.228 17919 56709 1 138 . 1 1 71 71 LEU C C 71 177.830 177.830 176.025 1.805 17919 56710 1 138 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.280 0.660 17919 56711 1 138 . 1 1 71 71 LEU CB C 71 42.850 42.850 44.242 -1.392 17919 56712 1 138 . 1 1 71 71 LEU H H 71 8.120 8.120 8.293 -0.173 17919 56713 1 138 . 1 1 72 72 ARG N N 72 123.490 123.490 126.686 -3.196 17919 56714 1 138 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.231 0.070 17919 56715 1 138 . 1 1 72 72 ARG C C 72 175.350 175.350 174.835 0.515 17919 56716 1 138 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.909 -1.299 17919 56717 1 138 . 1 1 72 72 ARG CB C 72 31.350 31.350 31.085 0.265 17919 56718 1 138 . 1 1 72 72 ARG H H 72 8.580 8.580 8.764 -0.184 17919 56719 1 139 . 1 1 2 2 GLN N N 2 123.220 123.220 123.567 -0.347 17919 56720 1 139 . 1 1 2 2 GLN HA H 2 5.249 5.249 4.950 0.299 17919 56721 1 139 . 1 1 2 2 GLN C C 2 175.920 175.920 175.637 0.283 17919 56722 1 139 . 1 1 2 2 GLN CA C 2 55.080 55.080 56.045 -0.965 17919 56723 1 139 . 1 1 2 2 GLN CB C 2 30.760 30.760 29.519 1.241 17919 56724 1 139 . 1 1 2 2 GLN H H 2 8.900 8.900 8.671 0.229 17919 56725 1 139 . 1 1 3 3 ILE N N 3 115.340 115.340 117.151 -1.811 17919 56726 1 139 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.112 0.101 17919 56727 1 139 . 1 1 3 3 ILE C C 3 172.450 172.450 173.330 -0.880 17919 56728 1 139 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.466 0.104 17919 56729 1 139 . 1 1 3 3 ILE CB C 3 42.210 42.210 40.706 1.504 17919 56730 1 139 . 1 1 3 3 ILE H H 3 8.320 8.320 8.438 -0.118 17919 56731 1 139 . 1 1 4 4 PHE N N 4 118.110 118.110 120.573 -2.463 17919 56732 1 139 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.424 0.206 17919 56733 1 139 . 1 1 4 4 PHE C C 4 175.320 175.320 175.687 -0.367 17919 56734 1 139 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.051 0.159 17919 56735 1 139 . 1 1 4 4 PHE CB C 4 41.480 41.480 40.258 1.222 17919 56736 1 139 . 1 1 4 4 PHE H H 4 8.610 8.610 8.037 0.573 17919 56737 1 139 . 1 1 5 5 VAL N N 5 121.000 121.000 124.317 -3.317 17919 56738 1 139 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.708 0.017 17919 56739 1 139 . 1 1 5 5 VAL C C 5 174.870 174.870 175.382 -0.512 17919 56740 1 139 . 1 1 5 5 VAL CA C 5 60.620 60.620 62.041 -1.421 17919 56741 1 139 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.220 1.010 17919 56742 1 139 . 1 1 5 5 VAL H H 5 9.300 9.300 8.617 0.683 17919 56743 1 139 . 1 1 6 6 LYS N N 6 127.520 127.520 128.893 -1.373 17919 56744 1 139 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.296 0.071 17919 56745 1 139 . 1 1 6 6 LYS C C 6 177.140 177.140 176.157 0.983 17919 56746 1 139 . 1 1 6 6 LYS CA C 6 54.520 54.520 53.818 0.702 17919 56747 1 139 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.677 0.373 17919 56748 1 139 . 1 1 6 6 LYS H H 6 8.820 8.820 8.818 0.002 17919 56749 1 139 . 1 1 7 7 THR N N 7 115.400 115.400 117.169 -1.769 17919 56750 1 139 . 1 1 7 7 THR HA H 7 4.970 4.970 4.796 0.174 17919 56751 1 139 . 1 1 7 7 THR C C 7 176.910 176.910 176.299 0.611 17919 56752 1 139 . 1 1 7 7 THR CA C 7 60.470 60.470 60.073 0.397 17919 56753 1 139 . 1 1 7 7 THR CB C 7 70.630 70.630 70.580 0.050 17919 56754 1 139 . 1 1 7 7 THR H H 7 8.730 8.730 7.931 0.799 17919 56755 1 139 . 1 1 8 8 LEU N N 8 121.330 121.330 122.325 -0.995 17919 56756 1 139 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.105 0.205 17919 56757 1 139 . 1 1 8 8 LEU C C 8 178.800 178.800 178.002 0.798 17919 56758 1 139 . 1 1 8 8 LEU CA C 8 57.580 57.580 58.039 -0.459 17919 56759 1 139 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.672 0.298 17919 56760 1 139 . 1 1 8 8 LEU H H 8 9.100 9.100 8.612 0.488 17919 56761 1 139 . 1 1 9 9 THR N N 9 105.590 105.590 106.385 -0.795 17919 56762 1 139 . 1 1 9 9 THR HA H 9 4.428 4.428 4.201 0.227 17919 56763 1 139 . 1 1 9 9 THR C C 9 175.520 175.520 175.802 -0.282 17919 56764 1 139 . 1 1 9 9 THR CA C 9 61.400 61.400 62.642 -1.242 17919 56765 1 139 . 1 1 9 9 THR CB C 9 69.140 69.140 68.728 0.412 17919 56766 1 139 . 1 1 9 9 THR H H 9 7.630 7.630 7.784 -0.154 17919 56767 1 139 . 1 1 10 10 GLY N N 10 108.890 108.890 110.600 -1.710 17919 56768 1 139 . 1 1 10 10 GLY C C 10 174.070 174.070 173.935 0.135 17919 56769 1 139 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.901 0.558 17919 56770 1 139 . 1 1 10 10 GLY H H 10 7.810 7.810 7.793 0.017 17919 56771 1 139 . 1 1 11 11 LYS N N 11 121.600 121.600 121.485 0.115 17919 56772 1 139 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.494 -0.133 17919 56773 1 139 . 1 1 11 11 LYS C C 11 175.940 175.940 175.629 0.311 17919 56774 1 139 . 1 1 11 11 LYS CA C 11 56.280 56.280 55.805 0.475 17919 56775 1 139 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.495 -0.295 17919 56776 1 139 . 1 1 11 11 LYS H H 11 7.280 7.280 7.571 -0.291 17919 56777 1 139 . 1 1 12 12 THR N N 12 120.440 120.440 121.132 -0.692 17919 56778 1 139 . 1 1 12 12 THR HA H 12 5.046 5.046 4.822 0.224 17919 56779 1 139 . 1 1 12 12 THR C C 12 174.320 174.320 174.814 -0.494 17919 56780 1 139 . 1 1 12 12 THR CA C 12 62.390 62.390 62.703 -0.313 17919 56781 1 139 . 1 1 12 12 THR CB C 12 69.910 69.910 69.385 0.525 17919 56782 1 139 . 1 1 12 12 THR H H 12 8.650 8.650 8.341 0.309 17919 56783 1 139 . 1 1 13 13 ILE N N 13 127.110 127.110 127.315 -0.205 17919 56784 1 139 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.458 0.086 17919 56785 1 139 . 1 1 13 13 ILE C C 13 175.220 175.220 174.276 0.944 17919 56786 1 139 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.712 -0.732 17919 56787 1 139 . 1 1 13 13 ILE CB C 13 40.950 40.950 39.247 1.703 17919 56788 1 139 . 1 1 13 13 ILE H H 13 9.450 9.450 8.989 0.461 17919 56789 1 139 . 1 1 14 14 THR N N 14 121.520 121.520 122.655 -1.135 17919 56790 1 139 . 1 1 14 14 THR HA H 14 4.964 4.964 4.925 0.039 17919 56791 1 139 . 1 1 14 14 THR C C 14 173.790 173.790 174.166 -0.376 17919 56792 1 139 . 1 1 14 14 THR CA C 14 61.940 61.940 62.283 -0.343 17919 56793 1 139 . 1 1 14 14 THR CB C 14 69.650 69.650 69.986 -0.336 17919 56794 1 139 . 1 1 14 14 THR H H 14 8.710 8.710 8.335 0.375 17919 56795 1 139 . 1 1 15 15 LEU N N 15 124.800 124.800 124.399 0.401 17919 56796 1 139 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.736 0.044 17919 56797 1 139 . 1 1 15 15 LEU C C 15 174.670 174.670 174.087 0.583 17919 56798 1 139 . 1 1 15 15 LEU CA C 15 52.830 52.830 54.515 -1.685 17919 56799 1 139 . 1 1 15 15 LEU CB C 15 47.070 47.070 46.220 0.850 17919 56800 1 139 . 1 1 15 15 LEU H H 15 8.710 8.710 8.395 0.315 17919 56801 1 139 . 1 1 16 16 GLU N N 16 122.160 122.160 125.912 -3.752 17919 56802 1 139 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.836 0.081 17919 56803 1 139 . 1 1 16 16 GLU C C 16 175.860 175.860 174.881 0.979 17919 56804 1 139 . 1 1 16 16 GLU CA C 16 54.820 54.820 54.779 0.041 17919 56805 1 139 . 1 1 16 16 GLU CB C 16 29.450 29.450 29.364 0.086 17919 56806 1 139 . 1 1 16 16 GLU H H 16 8.140 8.140 8.753 -0.613 17919 56807 1 139 . 1 1 17 17 VAL N N 17 117.210 117.210 120.610 -3.400 17919 56808 1 139 . 1 1 17 17 VAL HA H 17 4.714 4.714 5.198 -0.484 17919 56809 1 139 . 1 1 17 17 VAL C C 17 174.160 174.160 175.408 -1.248 17919 56810 1 139 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.707 -0.277 17919 56811 1 139 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.031 1.369 17919 56812 1 139 . 1 1 17 17 VAL H H 17 8.900 8.900 7.872 1.028 17919 56813 1 139 . 1 1 18 18 GLU N N 18 118.990 118.990 120.675 -1.685 17919 56814 1 139 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.900 0.179 17919 56815 1 139 . 1 1 18 18 GLU C C 18 176.160 176.160 175.841 0.319 17919 56816 1 139 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.850 -0.130 17919 56817 1 139 . 1 1 18 18 GLU CB C 18 30.310 30.310 31.512 -1.202 17919 56818 1 139 . 1 1 18 18 GLU H H 18 8.640 8.640 8.935 -0.295 17919 56819 1 139 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.261 -0.120 17919 56820 1 139 . 1 1 19 19 PRO C C 19 175.310 175.310 177.833 -2.523 17919 56821 1 139 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.590 -0.120 17919 56822 1 139 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.138 -0.188 17919 56823 1 139 . 1 1 20 20 SER N N 20 103.400 103.400 109.574 -6.174 17919 56824 1 139 . 1 1 20 20 SER HA H 20 4.370 4.370 4.272 0.098 17919 56825 1 139 . 1 1 20 20 SER C C 20 174.660 174.660 174.302 0.358 17919 56826 1 139 . 1 1 20 20 SER CA C 20 57.400 57.400 58.461 -1.061 17919 56827 1 139 . 1 1 20 20 SER CB C 20 63.370 63.370 63.151 0.219 17919 56828 1 139 . 1 1 20 20 SER H H 20 7.040 7.040 7.959 -0.919 17919 56829 1 139 . 1 1 21 21 ASP N N 21 123.480 123.480 124.863 -1.383 17919 56830 1 139 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.572 0.123 17919 56831 1 139 . 1 1 21 21 ASP C C 21 176.360 176.360 175.922 0.438 17919 56832 1 139 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.371 0.329 17919 56833 1 139 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.333 -0.533 17919 56834 1 139 . 1 1 21 21 ASP H H 21 8.030 8.030 7.558 0.472 17919 56835 1 139 . 1 1 22 22 THR N N 22 108.800 108.800 112.845 -4.045 17919 56836 1 139 . 1 1 22 22 THR HA H 22 4.920 4.920 4.604 0.316 17919 56837 1 139 . 1 1 22 22 THR C C 22 176.750 176.750 175.900 0.850 17919 56838 1 139 . 1 1 22 22 THR CA C 22 59.690 59.690 61.223 -1.533 17919 56839 1 139 . 1 1 22 22 THR CB C 22 71.200 71.200 70.381 0.819 17919 56840 1 139 . 1 1 22 22 THR H H 22 7.900 7.900 8.385 -0.485 17919 56841 1 139 . 1 1 23 23 ILE N N 23 121.190 121.190 122.726 -1.536 17919 56842 1 139 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.763 -0.106 17919 56843 1 139 . 1 1 23 23 ILE C C 23 179.040 179.040 177.775 1.265 17919 56844 1 139 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.346 -0.086 17919 56845 1 139 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.314 -1.964 17919 56846 1 139 . 1 1 23 23 ILE H H 23 8.560 8.560 9.227 -0.667 17919 56847 1 139 . 1 1 24 24 GLU N N 24 120.830 120.830 120.551 0.279 17919 56848 1 139 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.818 0.099 17919 56849 1 139 . 1 1 24 24 GLU C C 24 178.640 178.640 178.453 0.187 17919 56850 1 139 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.330 -0.110 17919 56851 1 139 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.491 -1.211 17919 56852 1 139 . 1 1 24 24 GLU H H 24 9.760 9.760 8.563 1.197 17919 56853 1 139 . 1 1 25 25 ASN N N 25 120.570 120.570 117.122 3.448 17919 56854 1 139 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.525 0.000 17919 56855 1 139 . 1 1 25 25 ASN C C 25 178.380 178.380 177.762 0.618 17919 56856 1 139 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.656 0.404 17919 56857 1 139 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.039 0.411 17919 56858 1 139 . 1 1 25 25 ASN H H 25 7.920 7.920 8.023 -0.103 17919 56859 1 139 . 1 1 26 26 VAL N N 26 121.710 121.710 121.384 0.326 17919 56860 1 139 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.607 -0.210 17919 56861 1 139 . 1 1 26 26 VAL C C 26 177.950 177.950 177.351 0.599 17919 56862 1 139 . 1 1 26 26 VAL CA C 26 67.660 67.660 65.959 1.702 17919 56863 1 139 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.572 -0.732 17919 56864 1 139 . 1 1 26 26 VAL H H 26 8.070 8.070 7.981 0.089 17919 56865 1 139 . 1 1 27 27 LYS N N 27 118.860 118.860 118.965 -0.105 17919 56866 1 139 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.211 0.369 17919 56867 1 139 . 1 1 27 27 LYS C C 27 180.550 180.550 179.042 1.508 17919 56868 1 139 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.490 -0.240 17919 56869 1 139 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.264 1.466 17919 56870 1 139 . 1 1 27 27 LYS H H 27 8.560 8.560 8.060 0.500 17919 56871 1 139 . 1 1 28 28 ALA N N 28 123.440 123.440 120.650 2.790 17919 56872 1 139 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.129 0.031 17919 56873 1 139 . 1 1 28 28 ALA C C 28 180.300 180.300 178.815 1.485 17919 56874 1 139 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.664 0.706 17919 56875 1 139 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.379 -0.669 17919 56876 1 139 . 1 1 28 28 ALA H H 28 8.060 8.060 7.902 0.158 17919 56877 1 139 . 1 1 29 29 LYS N N 29 119.940 119.940 120.053 -0.113 17919 56878 1 139 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.064 0.143 17919 56879 1 139 . 1 1 29 29 LYS C C 29 180.320 180.320 178.988 1.332 17919 56880 1 139 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.204 0.446 17919 56881 1 139 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.421 0.869 17919 56882 1 139 . 1 1 29 29 LYS H H 29 7.850 7.850 7.532 0.318 17919 56883 1 139 . 1 1 30 30 ILE N N 30 121.080 121.080 120.148 0.932 17919 56884 1 139 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.600 -0.093 17919 56885 1 139 . 1 1 30 30 ILE C C 30 178.310 178.310 177.332 0.978 17919 56886 1 139 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.556 0.594 17919 56887 1 139 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.542 -0.742 17919 56888 1 139 . 1 1 30 30 ILE H H 30 8.280 8.280 8.133 0.147 17919 56889 1 139 . 1 1 31 31 GLN N N 31 123.490 123.490 120.074 3.416 17919 56890 1 139 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.074 -0.244 17919 56891 1 139 . 1 1 31 31 GLN C C 31 178.890 178.890 178.349 0.541 17919 56892 1 139 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.091 0.909 17919 56893 1 139 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.459 -0.739 17919 56894 1 139 . 1 1 31 31 GLN H H 31 8.580 8.580 7.864 0.716 17919 56895 1 139 . 1 1 32 32 ASP N N 32 119.360 119.360 120.525 -1.165 17919 56896 1 139 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.428 -0.074 17919 56897 1 139 . 1 1 32 32 ASP C C 32 177.250 177.250 178.106 -0.856 17919 56898 1 139 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.720 0.470 17919 56899 1 139 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.800 -0.220 17919 56900 1 139 . 1 1 32 32 ASP H H 32 8.010 8.010 7.849 0.161 17919 56901 1 139 . 1 1 33 33 LYS N N 33 115.130 115.130 117.440 -2.310 17919 56902 1 139 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.278 0.059 17919 56903 1 139 . 1 1 33 33 LYS C C 33 177.870 177.870 177.798 0.072 17919 56904 1 139 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.409 -0.359 17919 56905 1 139 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.578 0.592 17919 56906 1 139 . 1 1 33 33 LYS H H 33 7.430 7.430 7.614 -0.184 17919 56907 1 139 . 1 1 34 34 GLU N N 34 113.870 113.870 113.795 0.075 17919 56908 1 139 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.524 0.101 17919 56909 1 139 . 1 1 34 34 GLU C C 34 177.840 177.840 176.729 1.111 17919 56910 1 139 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.806 -0.637 17919 56911 1 139 . 1 1 34 34 GLU CB C 34 32.660 32.660 32.002 0.658 17919 56912 1 139 . 1 1 34 34 GLU H H 34 8.740 8.740 8.300 0.440 17919 56913 1 139 . 1 1 35 35 GLY N N 35 108.650 108.650 108.946 -0.296 17919 56914 1 139 . 1 1 35 35 GLY C C 35 173.960 173.960 174.496 -0.536 17919 56915 1 139 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.861 0.219 17919 56916 1 139 . 1 1 35 35 GLY H H 35 8.530 8.530 8.178 0.352 17919 56917 1 139 . 1 1 36 36 ILE N N 36 119.880 119.880 122.413 -2.533 17919 56918 1 139 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.390 0.055 17919 56919 1 139 . 1 1 36 36 ILE C C 36 173.590 173.590 174.319 -0.729 17919 56920 1 139 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.006 -0.256 17919 56921 1 139 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.783 1.797 17919 56922 1 139 . 1 1 36 36 ILE H H 36 6.150 6.150 7.721 -1.571 17919 56923 1 139 . 1 1 37 37 PRO HA H 37 4.634 4.634 5.122 -0.488 17919 56924 1 139 . 1 1 37 37 PRO C C 37 176.940 176.940 175.801 1.139 17919 56925 1 139 . 1 1 37 37 PRO CA C 37 61.660 61.660 60.531 1.129 17919 56926 1 139 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.403 0.447 17919 56927 1 139 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.239 -0.122 17919 56928 1 139 . 1 1 38 38 PRO C C 38 178.320 178.320 178.297 0.023 17919 56929 1 139 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.632 0.628 17919 56930 1 139 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.829 1.061 17919 56931 1 139 . 1 1 39 39 ASP N N 39 113.380 113.380 115.110 -1.730 17919 56932 1 139 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.295 0.135 17919 56933 1 139 . 1 1 39 39 ASP C C 39 177.090 177.090 176.698 0.392 17919 56934 1 139 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.267 -0.627 17919 56935 1 139 . 1 1 39 39 ASP CB C 39 39.540 39.540 39.925 -0.385 17919 56936 1 139 . 1 1 39 39 ASP H H 39 8.550 8.550 8.586 -0.036 17919 56937 1 139 . 1 1 40 40 GLN N N 40 116.780 116.780 114.578 2.202 17919 56938 1 139 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.452 0.012 17919 56939 1 139 . 1 1 40 40 GLN C C 40 175.380 175.380 175.814 -0.434 17919 56940 1 139 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.380 0.260 17919 56941 1 139 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.629 0.511 17919 56942 1 139 . 1 1 40 40 GLN H H 40 7.820 7.820 7.997 -0.177 17919 56943 1 139 . 1 1 41 41 GLN N N 41 117.720 117.720 119.632 -1.912 17919 56944 1 139 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.578 -0.334 17919 56945 1 139 . 1 1 41 41 GLN C C 41 176.300 176.300 174.935 1.365 17919 56946 1 139 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.374 1.096 17919 56947 1 139 . 1 1 41 41 GLN CB C 41 31.650 31.650 30.636 1.014 17919 56948 1 139 . 1 1 41 41 GLN H H 41 7.480 7.480 7.688 -0.208 17919 56949 1 139 . 1 1 42 42 ARG N N 42 122.680 122.680 124.374 -1.694 17919 56950 1 139 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.617 -0.117 17919 56951 1 139 . 1 1 42 42 ARG C C 42 174.050 174.050 174.814 -0.764 17919 56952 1 139 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.210 -0.160 17919 56953 1 139 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.061 -0.311 17919 56954 1 139 . 1 1 42 42 ARG H H 42 8.530 8.530 8.291 0.239 17919 56955 1 139 . 1 1 43 43 LEU N N 43 124.040 124.040 125.090 -1.050 17919 56956 1 139 . 1 1 43 43 LEU C C 43 175.290 175.290 175.601 -0.311 17919 56957 1 139 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.104 -1.124 17919 56958 1 139 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.888 1.902 17919 56959 1 139 . 1 1 43 43 LEU H H 43 8.820 8.820 8.623 0.197 17919 56960 1 139 . 1 1 44 44 ILE N N 44 121.920 121.920 120.904 1.016 17919 56961 1 139 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.134 -0.142 17919 56962 1 139 . 1 1 44 44 ILE C C 44 176.060 176.060 174.353 1.707 17919 56963 1 139 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.079 -1.099 17919 56964 1 139 . 1 1 44 44 ILE CB C 44 41.420 41.420 42.397 -0.977 17919 56965 1 139 . 1 1 44 44 ILE H H 44 9.030 9.030 8.029 1.001 17919 56966 1 139 . 1 1 45 45 PHE N N 45 125.390 125.390 126.109 -0.719 17919 56967 1 139 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.016 0.029 17919 56968 1 139 . 1 1 45 45 PHE C C 45 174.470 174.470 174.529 -0.059 17919 56969 1 139 . 1 1 45 45 PHE CA C 45 57.020 57.020 55.615 1.405 17919 56970 1 139 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.062 0.698 17919 56971 1 139 . 1 1 45 45 PHE H H 45 8.830 8.830 8.810 0.020 17919 56972 1 139 . 1 1 46 46 ALA N N 46 132.200 132.200 128.434 3.766 17919 56973 1 139 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.569 0.121 17919 56974 1 139 . 1 1 46 46 ALA C C 46 177.290 177.290 177.629 -0.339 17919 56975 1 139 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.649 -0.109 17919 56976 1 139 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.238 0.332 17919 56977 1 139 . 1 1 46 46 ALA H H 46 8.810 8.810 8.812 -0.002 17919 56978 1 139 . 1 1 47 47 GLY N N 47 102.340 102.340 103.838 -1.498 17919 56979 1 139 . 1 1 47 47 GLY C C 47 173.810 173.810 174.308 -0.498 17919 56980 1 139 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.930 0.420 17919 56981 1 139 . 1 1 47 47 GLY H H 47 8.130 8.130 8.323 -0.193 17919 56982 1 139 . 1 1 48 48 LYS N N 48 121.570 121.570 121.717 -0.147 17919 56983 1 139 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.626 -0.004 17919 56984 1 139 . 1 1 48 48 LYS C C 48 174.700 174.700 175.046 -0.346 17919 56985 1 139 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.431 0.119 17919 56986 1 139 . 1 1 48 48 LYS CB C 48 34.530 34.530 33.917 0.613 17919 56987 1 139 . 1 1 48 48 LYS H H 48 7.980 7.980 8.021 -0.041 17919 56988 1 139 . 1 1 49 49 GLN N N 49 122.410 122.410 125.312 -2.902 17919 56989 1 139 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.565 -0.005 17919 56990 1 139 . 1 1 49 49 GLN C C 49 175.670 175.670 175.543 0.127 17919 56991 1 139 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.786 -0.046 17919 56992 1 139 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.504 -0.504 17919 56993 1 139 . 1 1 49 49 GLN H H 49 8.600 8.600 8.696 -0.096 17919 56994 1 139 . 1 1 50 50 LEU N N 50 125.520 125.520 127.231 -1.711 17919 56995 1 139 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.298 -0.208 17919 56996 1 139 . 1 1 50 50 LEU C C 50 176.660 176.660 176.421 0.239 17919 56997 1 139 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.903 -0.663 17919 56998 1 139 . 1 1 50 50 LEU CB C 50 41.570 41.570 43.029 -1.459 17919 56999 1 139 . 1 1 50 50 LEU H H 50 8.530 8.530 8.479 0.051 17919 57000 1 139 . 1 1 51 51 GLU N N 51 122.940 122.940 118.955 3.985 17919 57001 1 139 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.601 -0.113 17919 57002 1 139 . 1 1 51 51 GLU C C 51 175.870 175.870 176.133 -0.263 17919 57003 1 139 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.592 0.368 17919 57004 1 139 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.051 -0.481 17919 57005 1 139 . 1 1 51 51 GLU H H 51 8.400 8.400 8.246 0.154 17919 57006 1 139 . 1 1 52 52 ASP N N 52 120.030 120.030 125.196 -5.166 17919 57007 1 139 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.376 -0.017 17919 57008 1 139 . 1 1 52 52 ASP C C 52 177.330 177.330 178.131 -0.801 17919 57009 1 139 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.874 -0.914 17919 57010 1 139 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.622 0.228 17919 57011 1 139 . 1 1 52 52 ASP H H 52 8.160 8.160 8.921 -0.761 17919 57012 1 139 . 1 1 53 53 GLY N N 53 106.660 106.660 104.904 1.756 17919 57013 1 139 . 1 1 53 53 GLY C C 53 174.870 174.870 174.507 0.363 17919 57014 1 139 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.805 0.365 17919 57015 1 139 . 1 1 53 53 GLY H H 53 9.390 9.390 8.236 1.154 17919 57016 1 139 . 1 1 54 54 ARG N N 54 119.050 119.050 120.915 -1.865 17919 57017 1 139 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.564 0.131 17919 57018 1 139 . 1 1 54 54 ARG C C 54 175.350 175.350 175.877 -0.527 17919 57019 1 139 . 1 1 54 54 ARG CA C 54 54.390 54.390 55.509 -1.119 17919 57020 1 139 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.128 0.522 17919 57021 1 139 . 1 1 54 54 ARG H H 54 7.460 7.460 8.069 -0.609 17919 57022 1 139 . 1 1 55 55 THR N N 55 108.400 108.400 114.045 -5.645 17919 57023 1 139 . 1 1 55 55 THR HA H 55 5.240 5.240 4.878 0.362 17919 57024 1 139 . 1 1 55 55 THR C C 55 176.560 176.560 176.516 0.044 17919 57025 1 139 . 1 1 55 55 THR CA C 55 59.690 59.690 60.923 -1.233 17919 57026 1 139 . 1 1 55 55 THR CB C 55 72.260 72.260 70.497 1.763 17919 57027 1 139 . 1 1 55 55 THR H H 55 8.730 8.730 8.978 -0.248 17919 57028 1 139 . 1 1 56 56 LEU N N 56 117.920 117.920 123.381 -5.461 17919 57029 1 139 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.913 0.147 17919 57030 1 139 . 1 1 56 56 LEU C C 56 180.810 180.810 178.844 1.966 17919 57031 1 139 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.589 0.121 17919 57032 1 139 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.093 -0.723 17919 57033 1 139 . 1 1 56 56 LEU H H 56 8.140 8.140 8.635 -0.495 17919 57034 1 139 . 1 1 57 57 SER N N 57 113.330 113.330 113.021 0.309 17919 57035 1 139 . 1 1 57 57 SER HA H 57 4.370 4.370 4.167 0.203 17919 57036 1 139 . 1 1 57 57 SER C C 57 178.310 178.310 176.744 1.566 17919 57037 1 139 . 1 1 57 57 SER CA C 57 61.080 61.080 61.096 -0.015 17919 57038 1 139 . 1 1 57 57 SER CB C 57 62.530 62.530 61.999 0.530 17919 57039 1 139 . 1 1 57 57 SER H H 57 8.470 8.470 7.871 0.599 17919 57040 1 139 . 1 1 58 58 ASP N N 58 124.190 124.190 123.100 1.090 17919 57041 1 139 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.317 -0.021 17919 57042 1 139 . 1 1 58 58 ASP C C 58 177.400 177.400 178.176 -0.776 17919 57043 1 139 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.987 0.193 17919 57044 1 139 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.435 -0.335 17919 57045 1 139 . 1 1 58 58 ASP H H 58 7.930 7.930 8.072 -0.142 17919 57046 1 139 . 1 1 59 59 TYR N N 59 115.510 115.510 116.963 -1.453 17919 57047 1 139 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.449 0.221 17919 57048 1 139 . 1 1 59 59 TYR C C 59 174.700 174.700 175.303 -0.603 17919 57049 1 139 . 1 1 59 59 TYR CA C 59 58.250 58.250 58.091 0.159 17919 57050 1 139 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.084 1.986 17919 57051 1 139 . 1 1 59 59 TYR H H 59 7.250 7.250 7.325 -0.075 17919 57052 1 139 . 1 1 60 60 ASN N N 60 115.900 115.900 117.021 -1.121 17919 57053 1 139 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.345 0.010 17919 57054 1 139 . 1 1 60 60 ASN C C 60 174.340 174.340 174.729 -0.389 17919 57055 1 139 . 1 1 60 60 ASN CA C 60 54.120 54.120 53.866 0.254 17919 57056 1 139 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.260 0.150 17919 57057 1 139 . 1 1 60 60 ASN H H 60 8.150 8.150 7.479 0.671 17919 57058 1 139 . 1 1 61 61 ILE N N 61 118.600 118.600 120.401 -1.801 17919 57059 1 139 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.729 -0.336 17919 57060 1 139 . 1 1 61 61 ILE C C 61 174.610 174.610 175.418 -0.808 17919 57061 1 139 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.133 0.287 17919 57062 1 139 . 1 1 61 61 ILE CB C 61 36.740 36.740 36.181 0.559 17919 57063 1 139 . 1 1 61 61 ILE H H 61 7.250 7.250 8.229 -0.979 17919 57064 1 139 . 1 1 62 62 GLN N N 62 124.740 124.740 126.175 -1.435 17919 57065 1 139 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.645 -0.139 17919 57066 1 139 . 1 1 62 62 GLN C C 62 175.970 175.970 175.752 0.218 17919 57067 1 139 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.323 0.337 17919 57068 1 139 . 1 1 62 62 GLN CB C 62 31.650 31.650 30.977 0.673 17919 57069 1 139 . 1 1 62 62 GLN H H 62 7.610 7.610 7.871 -0.261 17919 57070 1 139 . 1 1 63 63 LYS N N 63 120.300 120.300 122.820 -2.520 17919 57071 1 139 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.807 0.194 17919 57072 1 139 . 1 1 63 63 LYS C C 63 175.810 175.810 176.404 -0.594 17919 57073 1 139 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.087 -0.298 17919 57074 1 139 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.370 1.280 17919 57075 1 139 . 1 1 63 63 LYS H H 63 8.490 8.490 8.601 -0.111 17919 57076 1 139 . 1 1 64 64 GLU N N 64 113.950 113.950 119.912 -5.962 17919 57077 1 139 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.517 -0.052 17919 57078 1 139 . 1 1 64 64 GLU C C 64 175.250 175.250 174.800 0.450 17919 57079 1 139 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.100 0.790 17919 57080 1 139 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.326 -2.426 17919 57081 1 139 . 1 1 64 64 GLU H H 64 9.280 9.280 8.698 0.582 17919 57082 1 139 . 1 1 65 65 SER N N 65 114.730 114.730 116.479 -1.749 17919 57083 1 139 . 1 1 65 65 SER HA H 65 4.640 4.640 4.501 0.139 17919 57084 1 139 . 1 1 65 65 SER C C 65 172.160 172.160 174.146 -1.986 17919 57085 1 139 . 1 1 65 65 SER CA C 65 60.890 60.890 59.553 1.337 17919 57086 1 139 . 1 1 65 65 SER CB C 65 64.910 64.910 63.549 1.361 17919 57087 1 139 . 1 1 65 65 SER H H 65 7.670 7.670 7.661 0.009 17919 57088 1 139 . 1 1 66 66 THR N N 66 117.110 117.110 121.840 -4.730 17919 57089 1 139 . 1 1 66 66 THR HA H 66 5.270 5.270 4.503 0.767 17919 57090 1 139 . 1 1 66 66 THR C C 66 173.950 173.950 174.408 -0.458 17919 57091 1 139 . 1 1 66 66 THR CA C 66 62.340 62.340 63.914 -1.574 17919 57092 1 139 . 1 1 66 66 THR CB C 66 70.080 70.080 69.664 0.416 17919 57093 1 139 . 1 1 66 66 THR H H 66 8.730 8.730 8.495 0.235 17919 57094 1 139 . 1 1 67 67 LEU N N 67 127.110 127.110 126.004 1.106 17919 57095 1 139 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.894 0.166 17919 57096 1 139 . 1 1 67 67 LEU C C 67 175.770 175.770 175.378 0.392 17919 57097 1 139 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.874 0.026 17919 57098 1 139 . 1 1 67 67 LEU CB C 67 44.260 44.260 45.167 -0.907 17919 57099 1 139 . 1 1 67 67 LEU H H 67 9.410 9.410 8.089 1.321 17919 57100 1 139 . 1 1 68 68 HIS N N 68 118.380 118.380 122.017 -3.637 17919 57101 1 139 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.243 -0.003 17919 57102 1 139 . 1 1 68 68 HIS C C 68 173.150 173.150 174.816 -1.666 17919 57103 1 139 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.057 0.943 17919 57104 1 139 . 1 1 68 68 HIS CB C 68 30.530 30.530 30.521 0.009 17919 57105 1 139 . 1 1 68 68 HIS H H 68 9.230 9.230 8.837 0.393 17919 57106 1 139 . 1 1 69 69 LEU N N 69 124.460 124.460 129.876 -5.416 17919 57107 1 139 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.496 0.694 17919 57108 1 139 . 1 1 69 69 LEU C C 69 175.270 175.270 174.506 0.764 17919 57109 1 139 . 1 1 69 69 LEU CA C 69 53.890 53.890 55.387 -1.497 17919 57110 1 139 . 1 1 69 69 LEU CB C 69 44.380 44.380 42.727 1.653 17919 57111 1 139 . 1 1 69 69 LEU H H 69 8.340 8.340 8.553 -0.213 17919 57112 1 139 . 1 1 70 70 VAL N N 70 126.940 126.940 126.772 0.168 17919 57113 1 139 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.388 -0.038 17919 57114 1 139 . 1 1 70 70 VAL C C 70 174.000 174.000 174.398 -0.398 17919 57115 1 139 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.670 0.130 17919 57116 1 139 . 1 1 70 70 VAL CB C 70 34.910 34.910 34.429 0.481 17919 57117 1 139 . 1 1 70 70 VAL H H 70 9.200 9.200 8.305 0.895 17919 57118 1 139 . 1 1 71 71 LEU N N 71 123.130 123.130 125.199 -2.069 17919 57119 1 139 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.909 0.151 17919 57120 1 139 . 1 1 71 71 LEU C C 71 177.830 177.830 177.034 0.796 17919 57121 1 139 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.046 0.894 17919 57122 1 139 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.260 0.590 17919 57123 1 139 . 1 1 71 71 LEU H H 71 8.120 8.120 8.447 -0.327 17919 57124 1 139 . 1 1 72 72 ARG N N 72 123.490 123.490 125.780 -2.290 17919 57125 1 139 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.405 -0.104 17919 57126 1 139 . 1 1 72 72 ARG C C 72 175.350 175.350 175.757 -0.407 17919 57127 1 139 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.743 -0.133 17919 57128 1 139 . 1 1 72 72 ARG CB C 72 31.350 31.350 31.366 -0.016 17919 57129 1 139 . 1 1 72 72 ARG H H 72 8.580 8.580 8.003 0.577 17919 57130 1 140 . 1 1 2 2 GLN N N 2 123.220 123.220 120.779 2.441 17919 57131 1 140 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.220 0.029 17919 57132 1 140 . 1 1 2 2 GLN C C 2 175.920 175.920 175.345 0.575 17919 57133 1 140 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.767 0.313 17919 57134 1 140 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.070 0.690 17919 57135 1 140 . 1 1 2 2 GLN H H 2 8.900 8.900 8.547 0.353 17919 57136 1 140 . 1 1 3 3 ILE N N 3 115.340 115.340 118.129 -2.789 17919 57137 1 140 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.051 0.162 17919 57138 1 140 . 1 1 3 3 ILE C C 3 172.450 172.450 173.730 -1.280 17919 57139 1 140 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.205 0.365 17919 57140 1 140 . 1 1 3 3 ILE CB C 3 42.210 42.210 40.790 1.420 17919 57141 1 140 . 1 1 3 3 ILE H H 3 8.320 8.320 8.455 -0.135 17919 57142 1 140 . 1 1 4 4 PHE N N 4 118.110 118.110 121.336 -3.226 17919 57143 1 140 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.106 0.524 17919 57144 1 140 . 1 1 4 4 PHE C C 4 175.320 175.320 175.467 -0.147 17919 57145 1 140 . 1 1 4 4 PHE CA C 4 55.210 55.210 54.811 0.399 17919 57146 1 140 . 1 1 4 4 PHE CB C 4 41.480 41.480 39.934 1.546 17919 57147 1 140 . 1 1 4 4 PHE H H 4 8.610 8.610 7.897 0.713 17919 57148 1 140 . 1 1 5 5 VAL N N 5 121.000 121.000 125.392 -4.392 17919 57149 1 140 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.633 0.092 17919 57150 1 140 . 1 1 5 5 VAL C C 5 174.870 174.870 175.193 -0.323 17919 57151 1 140 . 1 1 5 5 VAL CA C 5 60.620 60.620 62.436 -1.816 17919 57152 1 140 . 1 1 5 5 VAL CB C 5 34.230 34.230 32.811 1.419 17919 57153 1 140 . 1 1 5 5 VAL H H 5 9.300 9.300 8.873 0.427 17919 57154 1 140 . 1 1 6 6 LYS N N 6 127.520 127.520 128.582 -1.062 17919 57155 1 140 . 1 1 6 6 LYS HA H 6 5.367 5.367 4.936 0.431 17919 57156 1 140 . 1 1 6 6 LYS C C 6 177.140 177.140 176.706 0.434 17919 57157 1 140 . 1 1 6 6 LYS CA C 6 54.520 54.520 55.249 -0.730 17919 57158 1 140 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.318 -0.268 17919 57159 1 140 . 1 1 6 6 LYS H H 6 8.820 8.820 9.141 -0.321 17919 57160 1 140 . 1 1 7 7 THR N N 7 115.400 115.400 117.223 -1.823 17919 57161 1 140 . 1 1 7 7 THR HA H 7 4.970 4.970 4.424 0.546 17919 57162 1 140 . 1 1 7 7 THR C C 7 176.910 176.910 176.701 0.209 17919 57163 1 140 . 1 1 7 7 THR CA C 7 60.470 60.470 61.444 -0.973 17919 57164 1 140 . 1 1 7 7 THR CB C 7 70.630 70.630 70.007 0.623 17919 57165 1 140 . 1 1 7 7 THR H H 7 8.730 8.730 8.490 0.240 17919 57166 1 140 . 1 1 8 8 LEU N N 8 121.330 121.330 122.750 -1.420 17919 57167 1 140 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.050 0.260 17919 57168 1 140 . 1 1 8 8 LEU C C 8 178.800 178.800 178.102 0.698 17919 57169 1 140 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.836 -0.256 17919 57170 1 140 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.770 0.200 17919 57171 1 140 . 1 1 8 8 LEU H H 8 9.100 9.100 8.251 0.849 17919 57172 1 140 . 1 1 9 9 THR N N 9 105.590 105.590 105.884 -0.294 17919 57173 1 140 . 1 1 9 9 THR HA H 9 4.428 4.428 4.267 0.161 17919 57174 1 140 . 1 1 9 9 THR C C 9 175.520 175.520 175.281 0.239 17919 57175 1 140 . 1 1 9 9 THR CA C 9 61.400 61.400 62.424 -1.024 17919 57176 1 140 . 1 1 9 9 THR CB C 9 69.140 69.140 68.364 0.776 17919 57177 1 140 . 1 1 9 9 THR H H 9 7.630 7.630 7.761 -0.131 17919 57178 1 140 . 1 1 10 10 GLY N N 10 108.890 108.890 110.495 -1.605 17919 57179 1 140 . 1 1 10 10 GLY C C 10 174.070 174.070 173.806 0.264 17919 57180 1 140 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.839 0.621 17919 57181 1 140 . 1 1 10 10 GLY H H 10 7.810 7.810 7.857 -0.047 17919 57182 1 140 . 1 1 11 11 LYS N N 11 121.600 121.600 123.618 -2.018 17919 57183 1 140 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.146 0.215 17919 57184 1 140 . 1 1 11 11 LYS C C 11 175.940 175.940 175.507 0.433 17919 57185 1 140 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.924 -0.644 17919 57186 1 140 . 1 1 11 11 LYS CB C 11 33.200 33.200 32.909 0.291 17919 57187 1 140 . 1 1 11 11 LYS H H 11 7.280 7.280 7.566 -0.286 17919 57188 1 140 . 1 1 12 12 THR N N 12 120.440 120.440 120.509 -0.069 17919 57189 1 140 . 1 1 12 12 THR HA H 12 5.046 5.046 4.917 0.129 17919 57190 1 140 . 1 1 12 12 THR C C 12 174.320 174.320 174.507 -0.187 17919 57191 1 140 . 1 1 12 12 THR CA C 12 62.390 62.390 62.192 0.198 17919 57192 1 140 . 1 1 12 12 THR CB C 12 69.910 69.910 70.133 -0.223 17919 57193 1 140 . 1 1 12 12 THR H H 12 8.650 8.650 8.216 0.434 17919 57194 1 140 . 1 1 13 13 ILE N N 13 127.110 127.110 127.606 -0.496 17919 57195 1 140 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.454 0.090 17919 57196 1 140 . 1 1 13 13 ILE C C 13 175.220 175.220 175.353 -0.133 17919 57197 1 140 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.373 -0.393 17919 57198 1 140 . 1 1 13 13 ILE CB C 13 40.950 40.950 38.466 2.484 17919 57199 1 140 . 1 1 13 13 ILE H H 13 9.450 9.450 9.325 0.125 17919 57200 1 140 . 1 1 14 14 THR N N 14 121.520 121.520 124.180 -2.660 17919 57201 1 140 . 1 1 14 14 THR HA H 14 4.964 4.964 4.701 0.263 17919 57202 1 140 . 1 1 14 14 THR C C 14 173.790 173.790 174.034 -0.244 17919 57203 1 140 . 1 1 14 14 THR CA C 14 61.940 61.940 63.828 -1.888 17919 57204 1 140 . 1 1 14 14 THR CB C 14 69.650 69.650 69.488 0.162 17919 57205 1 140 . 1 1 14 14 THR H H 14 8.710 8.710 8.616 0.094 17919 57206 1 140 . 1 1 15 15 LEU N N 15 124.800 124.800 127.222 -2.422 17919 57207 1 140 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.819 -0.039 17919 57208 1 140 . 1 1 15 15 LEU C C 15 174.670 174.670 174.636 0.034 17919 57209 1 140 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.482 -0.652 17919 57210 1 140 . 1 1 15 15 LEU CB C 15 47.070 47.070 46.071 0.999 17919 57211 1 140 . 1 1 15 15 LEU H H 15 8.710 8.710 8.568 0.142 17919 57212 1 140 . 1 1 16 16 GLU N N 16 122.160 122.160 122.662 -0.502 17919 57213 1 140 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.500 -0.583 17919 57214 1 140 . 1 1 16 16 GLU C C 16 175.860 175.860 175.488 0.372 17919 57215 1 140 . 1 1 16 16 GLU CA C 16 54.820 54.820 54.807 0.013 17919 57216 1 140 . 1 1 16 16 GLU CB C 16 29.450 29.450 31.026 -1.575 17919 57217 1 140 . 1 1 16 16 GLU H H 16 8.140 8.140 8.399 -0.259 17919 57218 1 140 . 1 1 17 17 VAL N N 17 117.210 117.210 118.661 -1.451 17919 57219 1 140 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.851 -0.137 17919 57220 1 140 . 1 1 17 17 VAL C C 17 174.160 174.160 174.031 0.129 17919 57221 1 140 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.608 -1.178 17919 57222 1 140 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.391 1.009 17919 57223 1 140 . 1 1 17 17 VAL H H 17 8.900 8.900 8.699 0.201 17919 57224 1 140 . 1 1 18 18 GLU N N 18 118.990 118.990 119.487 -0.497 17919 57225 1 140 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.865 0.214 17919 57226 1 140 . 1 1 18 18 GLU C C 18 176.160 176.160 175.123 1.037 17919 57227 1 140 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.187 -0.467 17919 57228 1 140 . 1 1 18 18 GLU CB C 18 30.310 30.310 32.753 -2.443 17919 57229 1 140 . 1 1 18 18 GLU H H 18 8.640 8.640 8.189 0.451 17919 57230 1 140 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.225 -0.084 17919 57231 1 140 . 1 1 19 19 PRO C C 19 175.310 175.310 177.912 -2.602 17919 57232 1 140 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.506 -0.036 17919 57233 1 140 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.150 -0.200 17919 57234 1 140 . 1 1 20 20 SER N N 20 103.400 103.400 110.095 -6.695 17919 57235 1 140 . 1 1 20 20 SER HA H 20 4.370 4.370 4.259 0.111 17919 57236 1 140 . 1 1 20 20 SER C C 20 174.660 174.660 174.563 0.097 17919 57237 1 140 . 1 1 20 20 SER CA C 20 57.400 57.400 58.626 -1.226 17919 57238 1 140 . 1 1 20 20 SER CB C 20 63.370 63.370 62.819 0.551 17919 57239 1 140 . 1 1 20 20 SER H H 20 7.040 7.040 7.913 -0.873 17919 57240 1 140 . 1 1 21 21 ASP N N 21 123.480 123.480 124.738 -1.258 17919 57241 1 140 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.611 0.084 17919 57242 1 140 . 1 1 21 21 ASP C C 21 176.360 176.360 176.799 -0.439 17919 57243 1 140 . 1 1 21 21 ASP CA C 21 55.700 55.700 56.095 -0.395 17919 57244 1 140 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.410 -0.610 17919 57245 1 140 . 1 1 21 21 ASP H H 21 8.030 8.030 7.782 0.248 17919 57246 1 140 . 1 1 22 22 THR N N 22 108.800 108.800 113.162 -4.362 17919 57247 1 140 . 1 1 22 22 THR HA H 22 4.920 4.920 4.564 0.356 17919 57248 1 140 . 1 1 22 22 THR C C 22 176.750 176.750 176.156 0.594 17919 57249 1 140 . 1 1 22 22 THR CA C 22 59.690 59.690 61.621 -1.931 17919 57250 1 140 . 1 1 22 22 THR CB C 22 71.200 71.200 70.480 0.720 17919 57251 1 140 . 1 1 22 22 THR H H 22 7.900 7.900 8.542 -0.642 17919 57252 1 140 . 1 1 23 23 ILE N N 23 121.190 121.190 120.926 0.264 17919 57253 1 140 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.887 -0.230 17919 57254 1 140 . 1 1 23 23 ILE C C 23 179.040 179.040 178.028 1.012 17919 57255 1 140 . 1 1 23 23 ILE CA C 23 62.260 62.260 61.214 1.046 17919 57256 1 140 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.182 -1.832 17919 57257 1 140 . 1 1 23 23 ILE H H 23 8.560 8.560 9.161 -0.601 17919 57258 1 140 . 1 1 24 24 GLU N N 24 120.830 120.830 121.248 -0.418 17919 57259 1 140 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.847 0.070 17919 57260 1 140 . 1 1 24 24 GLU C C 24 178.640 178.640 178.353 0.287 17919 57261 1 140 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.385 -0.165 17919 57262 1 140 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.412 -1.132 17919 57263 1 140 . 1 1 24 24 GLU H H 24 9.760 9.760 8.373 1.387 17919 57264 1 140 . 1 1 25 25 ASN N N 25 120.570 120.570 116.984 3.586 17919 57265 1 140 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.518 0.007 17919 57266 1 140 . 1 1 25 25 ASN C C 25 178.380 178.380 178.250 0.130 17919 57267 1 140 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.448 0.612 17919 57268 1 140 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.637 -0.187 17919 57269 1 140 . 1 1 25 25 ASN H H 25 7.920 7.920 7.663 0.257 17919 57270 1 140 . 1 1 26 26 VAL N N 26 121.710 121.710 120.573 1.137 17919 57271 1 140 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.649 -0.252 17919 57272 1 140 . 1 1 26 26 VAL C C 26 177.950 177.950 177.211 0.739 17919 57273 1 140 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.325 1.335 17919 57274 1 140 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.226 -0.386 17919 57275 1 140 . 1 1 26 26 VAL H H 26 8.070 8.070 7.826 0.244 17919 57276 1 140 . 1 1 27 27 LYS N N 27 118.860 118.860 120.573 -1.713 17919 57277 1 140 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.009 0.571 17919 57278 1 140 . 1 1 27 27 LYS C C 27 180.550 180.550 179.026 1.524 17919 57279 1 140 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.822 -0.572 17919 57280 1 140 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.209 1.521 17919 57281 1 140 . 1 1 27 27 LYS H H 27 8.560 8.560 7.817 0.743 17919 57282 1 140 . 1 1 28 28 ALA N N 28 123.440 123.440 121.430 2.010 17919 57283 1 140 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.002 0.158 17919 57284 1 140 . 1 1 28 28 ALA C C 28 180.300 180.300 179.352 0.948 17919 57285 1 140 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.626 -0.256 17919 57286 1 140 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.373 -0.663 17919 57287 1 140 . 1 1 28 28 ALA H H 28 8.060 8.060 7.953 0.107 17919 57288 1 140 . 1 1 29 29 LYS N N 29 119.940 119.940 119.933 0.007 17919 57289 1 140 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.137 0.070 17919 57290 1 140 . 1 1 29 29 LYS C C 29 180.320 180.320 179.146 1.174 17919 57291 1 140 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.324 0.326 17919 57292 1 140 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.232 1.058 17919 57293 1 140 . 1 1 29 29 LYS H H 29 7.850 7.850 7.503 0.347 17919 57294 1 140 . 1 1 30 30 ILE N N 30 121.080 121.080 120.016 1.064 17919 57295 1 140 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.562 -0.055 17919 57296 1 140 . 1 1 30 30 ILE C C 30 178.310 178.310 177.664 0.646 17919 57297 1 140 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.823 0.327 17919 57298 1 140 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.581 -0.781 17919 57299 1 140 . 1 1 30 30 ILE H H 30 8.280 8.280 8.585 -0.305 17919 57300 1 140 . 1 1 31 31 GLN N N 31 123.490 123.490 120.090 3.400 17919 57301 1 140 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.886 -0.057 17919 57302 1 140 . 1 1 31 31 GLN C C 31 178.890 178.890 178.184 0.706 17919 57303 1 140 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.364 0.636 17919 57304 1 140 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.429 -0.709 17919 57305 1 140 . 1 1 31 31 GLN H H 31 8.580 8.580 7.833 0.747 17919 57306 1 140 . 1 1 32 32 ASP N N 32 119.360 119.360 119.445 -0.085 17919 57307 1 140 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.400 -0.046 17919 57308 1 140 . 1 1 32 32 ASP C C 32 177.250 177.250 178.119 -0.869 17919 57309 1 140 . 1 1 32 32 ASP CA C 32 57.190 57.190 57.035 0.155 17919 57310 1 140 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.641 -0.061 17919 57311 1 140 . 1 1 32 32 ASP H H 32 8.010 8.010 8.279 -0.269 17919 57312 1 140 . 1 1 33 33 LYS N N 33 115.130 115.130 118.321 -3.191 17919 57313 1 140 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.377 -0.040 17919 57314 1 140 . 1 1 33 33 LYS C C 33 177.870 177.870 178.019 -0.149 17919 57315 1 140 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.282 0.768 17919 57316 1 140 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.377 0.793 17919 57317 1 140 . 1 1 33 33 LYS H H 33 7.430 7.430 7.863 -0.433 17919 57318 1 140 . 1 1 34 34 GLU N N 34 113.870 113.870 115.400 -1.530 17919 57319 1 140 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.503 0.122 17919 57320 1 140 . 1 1 34 34 GLU C C 34 177.840 177.840 176.994 0.846 17919 57321 1 140 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.153 -0.983 17919 57322 1 140 . 1 1 34 34 GLU CB C 34 32.660 32.660 32.648 0.012 17919 57323 1 140 . 1 1 34 34 GLU H H 34 8.740 8.740 8.290 0.450 17919 57324 1 140 . 1 1 35 35 GLY N N 35 108.650 108.650 109.732 -1.082 17919 57325 1 140 . 1 1 35 35 GLY C C 35 173.960 173.960 174.424 -0.464 17919 57326 1 140 . 1 1 35 35 GLY CA C 35 46.080 46.080 46.161 -0.081 17919 57327 1 140 . 1 1 35 35 GLY H H 35 8.530 8.530 8.410 0.120 17919 57328 1 140 . 1 1 36 36 ILE N N 36 119.880 119.880 119.529 0.351 17919 57329 1 140 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.281 0.164 17919 57330 1 140 . 1 1 36 36 ILE C C 36 173.590 173.590 174.073 -0.483 17919 57331 1 140 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.142 -0.392 17919 57332 1 140 . 1 1 36 36 ILE CB C 36 40.580 40.580 37.919 2.661 17919 57333 1 140 . 1 1 36 36 ILE H H 36 6.150 6.150 7.494 -1.344 17919 57334 1 140 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.739 -0.105 17919 57335 1 140 . 1 1 37 37 PRO C C 37 176.940 176.940 176.289 0.651 17919 57336 1 140 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.233 0.427 17919 57337 1 140 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.247 0.604 17919 57338 1 140 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.205 -0.088 17919 57339 1 140 . 1 1 38 38 PRO C C 38 178.320 178.320 177.857 0.463 17919 57340 1 140 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.685 0.575 17919 57341 1 140 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.911 0.979 17919 57342 1 140 . 1 1 39 39 ASP N N 39 113.380 113.380 115.830 -2.450 17919 57343 1 140 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.325 0.105 17919 57344 1 140 . 1 1 39 39 ASP C C 39 177.090 177.090 177.462 -0.372 17919 57345 1 140 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.500 -0.860 17919 57346 1 140 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.355 -0.815 17919 57347 1 140 . 1 1 39 39 ASP H H 39 8.550 8.550 8.378 0.172 17919 57348 1 140 . 1 1 40 40 GLN N N 40 116.780 116.780 117.345 -0.565 17919 57349 1 140 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.092 0.372 17919 57350 1 140 . 1 1 40 40 GLN C C 40 175.380 175.380 175.895 -0.515 17919 57351 1 140 . 1 1 40 40 GLN CA C 40 55.640 55.640 57.154 -1.514 17919 57352 1 140 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.247 0.893 17919 57353 1 140 . 1 1 40 40 GLN H H 40 7.820 7.820 7.663 0.157 17919 57354 1 140 . 1 1 41 41 GLN N N 41 117.720 117.720 118.449 -0.729 17919 57355 1 140 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.354 -0.111 17919 57356 1 140 . 1 1 41 41 GLN C C 41 176.300 176.300 174.839 1.461 17919 57357 1 140 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.583 0.887 17919 57358 1 140 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.686 1.964 17919 57359 1 140 . 1 1 41 41 GLN H H 41 7.480 7.480 7.313 0.167 17919 57360 1 140 . 1 1 42 42 ARG N N 42 122.680 122.680 122.724 -0.044 17919 57361 1 140 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.602 -0.102 17919 57362 1 140 . 1 1 42 42 ARG C C 42 174.050 174.050 173.923 0.127 17919 57363 1 140 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.066 -0.016 17919 57364 1 140 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.068 -0.318 17919 57365 1 140 . 1 1 42 42 ARG H H 42 8.530 8.530 7.893 0.637 17919 57366 1 140 . 1 1 43 43 LEU N N 43 124.040 124.040 125.070 -1.030 17919 57367 1 140 . 1 1 43 43 LEU C C 43 175.290 175.290 175.334 -0.044 17919 57368 1 140 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.206 -0.226 17919 57369 1 140 . 1 1 43 43 LEU CB C 43 45.790 45.790 45.972 -0.182 17919 57370 1 140 . 1 1 43 43 LEU H H 43 8.820 8.820 8.686 0.134 17919 57371 1 140 . 1 1 44 44 ILE N N 44 121.920 121.920 120.503 1.417 17919 57372 1 140 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.216 -0.224 17919 57373 1 140 . 1 1 44 44 ILE C C 44 176.060 176.060 174.575 1.485 17919 57374 1 140 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.139 -1.159 17919 57375 1 140 . 1 1 44 44 ILE CB C 44 41.420 41.420 42.267 -0.847 17919 57376 1 140 . 1 1 44 44 ILE H H 44 9.030 9.030 8.871 0.159 17919 57377 1 140 . 1 1 45 45 PHE N N 45 125.390 125.390 126.621 -1.231 17919 57378 1 140 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.978 0.067 17919 57379 1 140 . 1 1 45 45 PHE C C 45 174.470 174.470 174.186 0.284 17919 57380 1 140 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.891 0.129 17919 57381 1 140 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.009 0.751 17919 57382 1 140 . 1 1 45 45 PHE H H 45 8.830 8.830 8.562 0.268 17919 57383 1 140 . 1 1 46 46 ALA N N 46 132.200 132.200 128.637 3.563 17919 57384 1 140 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.583 0.107 17919 57385 1 140 . 1 1 46 46 ALA C C 46 177.290 177.290 177.582 -0.292 17919 57386 1 140 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.463 0.077 17919 57387 1 140 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.147 0.423 17919 57388 1 140 . 1 1 46 46 ALA H H 46 8.810 8.810 8.773 0.037 17919 57389 1 140 . 1 1 47 47 GLY N N 47 102.340 102.340 104.166 -1.826 17919 57390 1 140 . 1 1 47 47 GLY C C 47 173.810 173.810 174.098 -0.288 17919 57391 1 140 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.015 0.335 17919 57392 1 140 . 1 1 47 47 GLY H H 47 8.130 8.130 8.501 -0.371 17919 57393 1 140 . 1 1 48 48 LYS N N 48 121.570 121.570 122.110 -0.540 17919 57394 1 140 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.532 0.090 17919 57395 1 140 . 1 1 48 48 LYS C C 48 174.700 174.700 174.810 -0.110 17919 57396 1 140 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.960 -0.410 17919 57397 1 140 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.431 0.099 17919 57398 1 140 . 1 1 48 48 LYS H H 48 7.980 7.980 7.793 0.187 17919 57399 1 140 . 1 1 49 49 GLN N N 49 122.410 122.410 127.165 -4.755 17919 57400 1 140 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.437 0.123 17919 57401 1 140 . 1 1 49 49 GLN C C 49 175.670 175.670 175.251 0.419 17919 57402 1 140 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.870 -0.130 17919 57403 1 140 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.015 -0.015 17919 57404 1 140 . 1 1 49 49 GLN H H 49 8.600 8.600 8.624 -0.024 17919 57405 1 140 . 1 1 50 50 LEU N N 50 125.520 125.520 129.303 -3.783 17919 57406 1 140 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.160 -0.070 17919 57407 1 140 . 1 1 50 50 LEU C C 50 176.660 176.660 176.875 -0.215 17919 57408 1 140 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.627 -0.387 17919 57409 1 140 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.663 -0.093 17919 57410 1 140 . 1 1 50 50 LEU H H 50 8.530 8.530 8.754 -0.224 17919 57411 1 140 . 1 1 51 51 GLU N N 51 122.940 122.940 124.026 -1.086 17919 57412 1 140 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.409 0.079 17919 57413 1 140 . 1 1 51 51 GLU C C 51 175.870 175.870 176.893 -1.023 17919 57414 1 140 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.887 0.073 17919 57415 1 140 . 1 1 51 51 GLU CB C 51 31.570 31.570 30.593 0.977 17919 57416 1 140 . 1 1 51 51 GLU H H 51 8.400 8.400 8.580 -0.180 17919 57417 1 140 . 1 1 52 52 ASP N N 52 120.030 120.030 124.038 -4.008 17919 57418 1 140 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.565 -0.206 17919 57419 1 140 . 1 1 52 52 ASP C C 52 177.330 177.330 177.716 -0.386 17919 57420 1 140 . 1 1 52 52 ASP CA C 52 56.960 56.960 56.701 0.259 17919 57421 1 140 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.789 0.061 17919 57422 1 140 . 1 1 52 52 ASP H H 52 8.160 8.160 8.807 -0.647 17919 57423 1 140 . 1 1 53 53 GLY N N 53 106.660 106.660 105.817 0.843 17919 57424 1 140 . 1 1 53 53 GLY C C 53 174.870 174.870 174.508 0.362 17919 57425 1 140 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.919 0.251 17919 57426 1 140 . 1 1 53 53 GLY H H 53 9.390 9.390 8.530 0.860 17919 57427 1 140 . 1 1 54 54 ARG N N 54 119.050 119.050 121.335 -2.285 17919 57428 1 140 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.516 0.179 17919 57429 1 140 . 1 1 54 54 ARG C C 54 175.350 175.350 175.258 0.092 17919 57430 1 140 . 1 1 54 54 ARG CA C 54 54.390 54.390 55.201 -0.811 17919 57431 1 140 . 1 1 54 54 ARG CB C 54 32.650 32.650 31.865 0.785 17919 57432 1 140 . 1 1 54 54 ARG H H 54 7.460 7.460 7.464 -0.004 17919 57433 1 140 . 1 1 55 55 THR N N 55 108.400 108.400 111.619 -3.219 17919 57434 1 140 . 1 1 55 55 THR HA H 55 5.240 5.240 5.134 0.106 17919 57435 1 140 . 1 1 55 55 THR C C 55 176.560 176.560 175.992 0.568 17919 57436 1 140 . 1 1 55 55 THR CA C 55 59.690 59.690 59.823 -0.133 17919 57437 1 140 . 1 1 55 55 THR CB C 55 72.260 72.260 71.467 0.793 17919 57438 1 140 . 1 1 55 55 THR H H 55 8.730 8.730 8.350 0.380 17919 57439 1 140 . 1 1 56 56 LEU N N 56 117.920 117.920 121.393 -3.473 17919 57440 1 140 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.038 0.022 17919 57441 1 140 . 1 1 56 56 LEU C C 56 180.810 180.810 179.029 1.781 17919 57442 1 140 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.081 0.629 17919 57443 1 140 . 1 1 56 56 LEU CB C 56 40.370 40.370 40.787 -0.417 17919 57444 1 140 . 1 1 56 56 LEU H H 56 8.140 8.140 8.352 -0.212 17919 57445 1 140 . 1 1 57 57 SER N N 57 113.330 113.330 114.901 -1.571 17919 57446 1 140 . 1 1 57 57 SER HA H 57 4.370 4.370 4.068 0.302 17919 57447 1 140 . 1 1 57 57 SER C C 57 178.310 178.310 176.855 1.455 17919 57448 1 140 . 1 1 57 57 SER CA C 57 61.080 61.080 61.769 -0.689 17919 57449 1 140 . 1 1 57 57 SER CB C 57 62.530 62.530 62.445 0.085 17919 57450 1 140 . 1 1 57 57 SER H H 57 8.470 8.470 7.694 0.776 17919 57451 1 140 . 1 1 58 58 ASP N N 58 124.190 124.190 122.335 1.855 17919 57452 1 140 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.303 -0.007 17919 57453 1 140 . 1 1 58 58 ASP C C 58 177.400 177.400 177.215 0.185 17919 57454 1 140 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.846 0.334 17919 57455 1 140 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.529 -0.429 17919 57456 1 140 . 1 1 58 58 ASP H H 58 7.930 7.930 7.842 0.088 17919 57457 1 140 . 1 1 59 59 TYR N N 59 115.510 115.510 115.923 -0.413 17919 57458 1 140 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.729 -0.059 17919 57459 1 140 . 1 1 59 59 TYR C C 59 174.700 174.700 175.166 -0.466 17919 57460 1 140 . 1 1 59 59 TYR CA C 59 58.250 58.250 56.020 2.231 17919 57461 1 140 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.494 1.576 17919 57462 1 140 . 1 1 59 59 TYR H H 59 7.250 7.250 7.363 -0.113 17919 57463 1 140 . 1 1 60 60 ASN N N 60 115.900 115.900 117.271 -1.371 17919 57464 1 140 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.394 -0.039 17919 57465 1 140 . 1 1 60 60 ASN C C 60 174.340 174.340 174.033 0.307 17919 57466 1 140 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.925 -0.805 17919 57467 1 140 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.412 -0.002 17919 57468 1 140 . 1 1 60 60 ASN H H 60 8.150 8.150 8.130 0.020 17919 57469 1 140 . 1 1 61 61 ILE N N 61 118.600 118.600 119.614 -1.014 17919 57470 1 140 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.676 -0.283 17919 57471 1 140 . 1 1 61 61 ILE C C 61 174.610 174.610 174.871 -0.261 17919 57472 1 140 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.189 1.231 17919 57473 1 140 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.087 -0.347 17919 57474 1 140 . 1 1 61 61 ILE H H 61 7.250 7.250 7.859 -0.609 17919 57475 1 140 . 1 1 62 62 GLN N N 62 124.740 124.740 124.962 -0.222 17919 57476 1 140 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.693 -0.187 17919 57477 1 140 . 1 1 62 62 GLN C C 62 175.970 175.970 175.442 0.528 17919 57478 1 140 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.647 0.013 17919 57479 1 140 . 1 1 62 62 GLN CB C 62 31.650 31.650 32.620 -0.970 17919 57480 1 140 . 1 1 62 62 GLN H H 62 7.610 7.610 7.692 -0.082 17919 57481 1 140 . 1 1 63 63 LYS N N 63 120.300 120.300 119.725 0.575 17919 57482 1 140 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.948 0.053 17919 57483 1 140 . 1 1 63 63 LYS C C 63 175.810 175.810 177.276 -1.466 17919 57484 1 140 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.755 0.035 17919 57485 1 140 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.980 0.670 17919 57486 1 140 . 1 1 63 63 LYS H H 63 8.490 8.490 8.523 -0.033 17919 57487 1 140 . 1 1 64 64 GLU N N 64 113.950 113.950 117.752 -3.802 17919 57488 1 140 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.344 0.121 17919 57489 1 140 . 1 1 64 64 GLU C C 64 175.250 175.250 175.331 -0.081 17919 57490 1 140 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.512 0.378 17919 57491 1 140 . 1 1 64 64 GLU CB C 64 25.900 25.900 27.867 -1.967 17919 57492 1 140 . 1 1 64 64 GLU H H 64 9.280 9.280 8.802 0.478 17919 57493 1 140 . 1 1 65 65 SER N N 65 114.730 114.730 115.307 -0.577 17919 57494 1 140 . 1 1 65 65 SER HA H 65 4.640 4.640 4.413 0.227 17919 57495 1 140 . 1 1 65 65 SER C C 65 172.160 172.160 174.511 -2.351 17919 57496 1 140 . 1 1 65 65 SER CA C 65 60.890 60.890 59.553 1.337 17919 57497 1 140 . 1 1 65 65 SER CB C 65 64.910 64.910 63.586 1.324 17919 57498 1 140 . 1 1 65 65 SER H H 65 7.670 7.670 7.233 0.437 17919 57499 1 140 . 1 1 66 66 THR N N 66 117.110 117.110 123.337 -6.227 17919 57500 1 140 . 1 1 66 66 THR HA H 66 5.270 5.270 4.814 0.456 17919 57501 1 140 . 1 1 66 66 THR C C 66 173.950 173.950 174.725 -0.775 17919 57502 1 140 . 1 1 66 66 THR CA C 66 62.340 62.340 63.567 -1.227 17919 57503 1 140 . 1 1 66 66 THR CB C 66 70.080 70.080 69.177 0.903 17919 57504 1 140 . 1 1 66 66 THR H H 66 8.730 8.730 8.463 0.267 17919 57505 1 140 . 1 1 67 67 LEU N N 67 127.110 127.110 128.695 -1.585 17919 57506 1 140 . 1 1 67 67 LEU HA H 67 5.060 5.060 5.163 -0.103 17919 57507 1 140 . 1 1 67 67 LEU C C 67 175.770 175.770 175.725 0.045 17919 57508 1 140 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.136 -0.236 17919 57509 1 140 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.017 0.242 17919 57510 1 140 . 1 1 67 67 LEU H H 67 9.410 9.410 8.639 0.771 17919 57511 1 140 . 1 1 68 68 HIS N N 68 118.380 118.380 121.608 -3.228 17919 57512 1 140 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.645 -0.405 17919 57513 1 140 . 1 1 68 68 HIS C C 68 173.150 173.150 173.514 -0.364 17919 57514 1 140 . 1 1 68 68 HIS CA C 68 55.000 55.000 53.160 1.840 17919 57515 1 140 . 1 1 68 68 HIS CB C 68 30.530 30.530 34.130 -3.600 17919 57516 1 140 . 1 1 68 68 HIS H H 68 9.230 9.230 9.134 0.096 17919 57517 1 140 . 1 1 69 69 LEU N N 69 124.460 124.460 121.889 2.571 17919 57518 1 140 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.900 0.290 17919 57519 1 140 . 1 1 69 69 LEU C C 69 175.270 175.270 173.785 1.485 17919 57520 1 140 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.954 -1.064 17919 57521 1 140 . 1 1 69 69 LEU CB C 69 44.380 44.380 45.875 -1.495 17919 57522 1 140 . 1 1 69 69 LEU H H 69 8.340 8.340 7.579 0.761 17919 57523 1 140 . 1 1 70 70 VAL N N 70 126.940 126.940 124.130 2.810 17919 57524 1 140 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.329 0.021 17919 57525 1 140 . 1 1 70 70 VAL C C 70 174.000 174.000 174.303 -0.303 17919 57526 1 140 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.337 0.464 17919 57527 1 140 . 1 1 70 70 VAL CB C 70 34.910 34.910 34.996 -0.086 17919 57528 1 140 . 1 1 70 70 VAL H H 70 9.200 9.200 8.091 1.109 17919 57529 1 140 . 1 1 71 71 LEU N N 71 123.130 123.130 125.217 -2.087 17919 57530 1 140 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.852 0.208 17919 57531 1 140 . 1 1 71 71 LEU C C 71 177.830 177.830 177.641 0.189 17919 57532 1 140 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.716 0.224 17919 57533 1 140 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.765 0.085 17919 57534 1 140 . 1 1 71 71 LEU H H 71 8.120 8.120 8.519 -0.399 17919 57535 1 140 . 1 1 72 72 ARG N N 72 123.490 123.490 122.996 0.494 17919 57536 1 140 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.534 -0.233 17919 57537 1 140 . 1 1 72 72 ARG C C 72 175.350 175.350 175.386 -0.036 17919 57538 1 140 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.018 -0.408 17919 57539 1 140 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.170 1.180 17919 57540 1 140 . 1 1 72 72 ARG H H 72 8.580 8.580 8.160 0.420 17919 57541 1 141 . 1 1 2 2 GLN N N 2 123.220 123.220 124.148 -0.928 17919 57542 1 141 . 1 1 2 2 GLN HA H 2 5.249 5.249 4.618 0.631 17919 57543 1 141 . 1 1 2 2 GLN C C 2 175.920 175.920 175.862 0.058 17919 57544 1 141 . 1 1 2 2 GLN CA C 2 55.080 55.080 56.287 -1.207 17919 57545 1 141 . 1 1 2 2 GLN CB C 2 30.760 30.760 29.020 1.740 17919 57546 1 141 . 1 1 2 2 GLN H H 2 8.900 8.900 8.584 0.316 17919 57547 1 141 . 1 1 3 3 ILE N N 3 115.340 115.340 116.844 -1.504 17919 57548 1 141 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.175 0.038 17919 57549 1 141 . 1 1 3 3 ILE C C 3 172.450 172.450 174.113 -1.663 17919 57550 1 141 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.315 0.255 17919 57551 1 141 . 1 1 3 3 ILE CB C 3 42.210 42.210 40.680 1.530 17919 57552 1 141 . 1 1 3 3 ILE H H 3 8.320 8.320 7.602 0.718 17919 57553 1 141 . 1 1 4 4 PHE N N 4 118.110 118.110 119.259 -1.149 17919 57554 1 141 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.261 0.369 17919 57555 1 141 . 1 1 4 4 PHE C C 4 175.320 175.320 175.106 0.214 17919 57556 1 141 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.382 -0.172 17919 57557 1 141 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.486 -0.006 17919 57558 1 141 . 1 1 4 4 PHE H H 4 8.610 8.610 8.383 0.227 17919 57559 1 141 . 1 1 5 5 VAL N N 5 121.000 121.000 123.367 -2.367 17919 57560 1 141 . 1 1 5 5 VAL HA H 5 4.725 4.725 5.152 -0.427 17919 57561 1 141 . 1 1 5 5 VAL C C 5 174.870 174.870 175.681 -0.811 17919 57562 1 141 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.098 -0.478 17919 57563 1 141 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.014 0.215 17919 57564 1 141 . 1 1 5 5 VAL H H 5 9.300 9.300 8.950 0.350 17919 57565 1 141 . 1 1 6 6 LYS N N 6 127.520 127.520 128.285 -0.765 17919 57566 1 141 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.271 0.096 17919 57567 1 141 . 1 1 6 6 LYS C C 6 177.140 177.140 177.154 -0.014 17919 57568 1 141 . 1 1 6 6 LYS CA C 6 54.520 54.520 53.670 0.850 17919 57569 1 141 . 1 1 6 6 LYS CB C 6 35.050 35.050 32.650 2.400 17919 57570 1 141 . 1 1 6 6 LYS H H 6 8.820 8.820 9.175 -0.355 17919 57571 1 141 . 1 1 7 7 THR N N 7 115.400 115.400 114.774 0.626 17919 57572 1 141 . 1 1 7 7 THR HA H 7 4.970 4.970 4.630 0.340 17919 57573 1 141 . 1 1 7 7 THR C C 7 176.910 176.910 177.293 -0.383 17919 57574 1 141 . 1 1 7 7 THR CA C 7 60.470 60.470 60.560 -0.090 17919 57575 1 141 . 1 1 7 7 THR CB C 7 70.630 70.630 70.669 -0.039 17919 57576 1 141 . 1 1 7 7 THR H H 7 8.730 8.730 8.086 0.644 17919 57577 1 141 . 1 1 8 8 LEU N N 8 121.330 121.330 119.592 1.738 17919 57578 1 141 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.107 0.203 17919 57579 1 141 . 1 1 8 8 LEU C C 8 178.800 178.800 177.241 1.559 17919 57580 1 141 . 1 1 8 8 LEU CA C 8 57.580 57.580 58.007 -0.427 17919 57581 1 141 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.693 0.277 17919 57582 1 141 . 1 1 8 8 LEU H H 8 9.100 9.100 8.180 0.920 17919 57583 1 141 . 1 1 9 9 THR N N 9 105.590 105.590 106.780 -1.190 17919 57584 1 141 . 1 1 9 9 THR HA H 9 4.428 4.428 4.288 0.140 17919 57585 1 141 . 1 1 9 9 THR C C 9 175.520 175.520 175.683 -0.163 17919 57586 1 141 . 1 1 9 9 THR CA C 9 61.400 61.400 62.233 -0.833 17919 57587 1 141 . 1 1 9 9 THR CB C 9 69.140 69.140 68.833 0.307 17919 57588 1 141 . 1 1 9 9 THR H H 9 7.630 7.630 7.604 0.026 17919 57589 1 141 . 1 1 10 10 GLY N N 10 108.890 108.890 110.533 -1.643 17919 57590 1 141 . 1 1 10 10 GLY C C 10 174.070 174.070 173.924 0.146 17919 57591 1 141 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.741 0.719 17919 57592 1 141 . 1 1 10 10 GLY H H 10 7.810 7.810 7.716 0.094 17919 57593 1 141 . 1 1 11 11 LYS N N 11 121.600 121.600 121.649 -0.049 17919 57594 1 141 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.308 0.053 17919 57595 1 141 . 1 1 11 11 LYS C C 11 175.940 175.940 175.727 0.213 17919 57596 1 141 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.643 -0.363 17919 57597 1 141 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.165 0.035 17919 57598 1 141 . 1 1 11 11 LYS H H 11 7.280 7.280 7.745 -0.465 17919 57599 1 141 . 1 1 12 12 THR N N 12 120.440 120.440 120.851 -0.411 17919 57600 1 141 . 1 1 12 12 THR HA H 12 5.046 5.046 4.582 0.464 17919 57601 1 141 . 1 1 12 12 THR C C 12 174.320 174.320 174.143 0.177 17919 57602 1 141 . 1 1 12 12 THR CA C 12 62.390 62.390 63.058 -0.668 17919 57603 1 141 . 1 1 12 12 THR CB C 12 69.910 69.910 69.620 0.290 17919 57604 1 141 . 1 1 12 12 THR H H 12 8.650 8.650 8.433 0.217 17919 57605 1 141 . 1 1 13 13 ILE N N 13 127.110 127.110 126.185 0.925 17919 57606 1 141 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.651 -0.107 17919 57607 1 141 . 1 1 13 13 ILE C C 13 175.220 175.220 174.346 0.874 17919 57608 1 141 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.252 -0.272 17919 57609 1 141 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.799 -0.849 17919 57610 1 141 . 1 1 13 13 ILE H H 13 9.450 9.450 9.024 0.426 17919 57611 1 141 . 1 1 14 14 THR N N 14 121.520 121.520 122.871 -1.351 17919 57612 1 141 . 1 1 14 14 THR HA H 14 4.964 4.964 5.214 -0.250 17919 57613 1 141 . 1 1 14 14 THR C C 14 173.790 173.790 173.737 0.053 17919 57614 1 141 . 1 1 14 14 THR CA C 14 61.940 61.940 61.451 0.489 17919 57615 1 141 . 1 1 14 14 THR CB C 14 69.650 69.650 70.005 -0.355 17919 57616 1 141 . 1 1 14 14 THR H H 14 8.710 8.710 8.425 0.285 17919 57617 1 141 . 1 1 15 15 LEU N N 15 124.800 124.800 127.527 -2.727 17919 57618 1 141 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.799 -0.019 17919 57619 1 141 . 1 1 15 15 LEU C C 15 174.670 174.670 175.423 -0.753 17919 57620 1 141 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.346 -0.516 17919 57621 1 141 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.068 2.002 17919 57622 1 141 . 1 1 15 15 LEU H H 15 8.710 8.710 8.465 0.245 17919 57623 1 141 . 1 1 16 16 GLU N N 16 122.160 122.160 121.219 0.941 17919 57624 1 141 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.550 0.367 17919 57625 1 141 . 1 1 16 16 GLU C C 16 175.860 175.860 175.504 0.356 17919 57626 1 141 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.254 -0.434 17919 57627 1 141 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.037 -0.587 17919 57628 1 141 . 1 1 16 16 GLU H H 16 8.140 8.140 8.489 -0.349 17919 57629 1 141 . 1 1 17 17 VAL N N 17 117.210 117.210 119.944 -2.734 17919 57630 1 141 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.606 0.108 17919 57631 1 141 . 1 1 17 17 VAL C C 17 174.160 174.160 174.866 -0.706 17919 57632 1 141 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.939 -0.509 17919 57633 1 141 . 1 1 17 17 VAL CB C 17 36.400 36.400 34.533 1.867 17919 57634 1 141 . 1 1 17 17 VAL H H 17 8.900 8.900 7.918 0.982 17919 57635 1 141 . 1 1 18 18 GLU N N 18 118.990 118.990 118.169 0.821 17919 57636 1 141 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.842 0.237 17919 57637 1 141 . 1 1 18 18 GLU C C 18 176.160 176.160 175.056 1.104 17919 57638 1 141 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.278 -0.558 17919 57639 1 141 . 1 1 18 18 GLU CB C 18 30.310 30.310 32.748 -2.438 17919 57640 1 141 . 1 1 18 18 GLU H H 18 8.640 8.640 8.067 0.573 17919 57641 1 141 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.204 -0.063 17919 57642 1 141 . 1 1 19 19 PRO C C 19 175.310 175.310 178.030 -2.720 17919 57643 1 141 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.602 -0.132 17919 57644 1 141 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.990 -0.040 17919 57645 1 141 . 1 1 20 20 SER N N 20 103.400 103.400 109.092 -5.692 17919 57646 1 141 . 1 1 20 20 SER HA H 20 4.370 4.370 4.293 0.077 17919 57647 1 141 . 1 1 20 20 SER C C 20 174.660 174.660 174.610 0.050 17919 57648 1 141 . 1 1 20 20 SER CA C 20 57.400 57.400 59.447 -2.047 17919 57649 1 141 . 1 1 20 20 SER CB C 20 63.370 63.370 62.954 0.416 17919 57650 1 141 . 1 1 20 20 SER H H 20 7.040 7.040 7.976 -0.936 17919 57651 1 141 . 1 1 21 21 ASP N N 21 123.480 123.480 123.512 -0.032 17919 57652 1 141 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.839 -0.144 17919 57653 1 141 . 1 1 21 21 ASP C C 21 176.360 176.360 175.751 0.609 17919 57654 1 141 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.352 1.348 17919 57655 1 141 . 1 1 21 21 ASP CB C 21 40.800 40.800 42.160 -1.360 17919 57656 1 141 . 1 1 21 21 ASP H H 21 8.030 8.030 7.959 0.071 17919 57657 1 141 . 1 1 22 22 THR N N 22 108.800 108.800 111.243 -2.443 17919 57658 1 141 . 1 1 22 22 THR HA H 22 4.920 4.920 4.794 0.126 17919 57659 1 141 . 1 1 22 22 THR C C 22 176.750 176.750 175.966 0.784 17919 57660 1 141 . 1 1 22 22 THR CA C 22 59.690 59.690 60.854 -1.164 17919 57661 1 141 . 1 1 22 22 THR CB C 22 71.200 71.200 71.128 0.072 17919 57662 1 141 . 1 1 22 22 THR H H 22 7.900 7.900 8.208 -0.308 17919 57663 1 141 . 1 1 23 23 ILE N N 23 121.190 121.190 122.966 -1.776 17919 57664 1 141 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.712 -0.055 17919 57665 1 141 . 1 1 23 23 ILE C C 23 179.040 179.040 177.774 1.266 17919 57666 1 141 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.095 -0.835 17919 57667 1 141 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.367 -2.017 17919 57668 1 141 . 1 1 23 23 ILE H H 23 8.560 8.560 9.056 -0.496 17919 57669 1 141 . 1 1 24 24 GLU N N 24 120.830 120.830 119.396 1.434 17919 57670 1 141 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.899 0.018 17919 57671 1 141 . 1 1 24 24 GLU C C 24 178.640 178.640 179.011 -0.371 17919 57672 1 141 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.561 0.659 17919 57673 1 141 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.595 -1.315 17919 57674 1 141 . 1 1 24 24 GLU H H 24 9.760 9.760 8.781 0.979 17919 57675 1 141 . 1 1 25 25 ASN N N 25 120.570 120.570 118.015 2.555 17919 57676 1 141 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.551 -0.026 17919 57677 1 141 . 1 1 25 25 ASN C C 25 178.380 178.380 177.598 0.782 17919 57678 1 141 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.605 0.455 17919 57679 1 141 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.369 0.081 17919 57680 1 141 . 1 1 25 25 ASN H H 25 7.920 7.920 7.775 0.145 17919 57681 1 141 . 1 1 26 26 VAL N N 26 121.710 121.710 120.418 1.292 17919 57682 1 141 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.789 -0.392 17919 57683 1 141 . 1 1 26 26 VAL C C 26 177.950 177.950 177.230 0.720 17919 57684 1 141 . 1 1 26 26 VAL CA C 26 67.660 67.660 65.152 2.508 17919 57685 1 141 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.619 -0.779 17919 57686 1 141 . 1 1 26 26 VAL H H 26 8.070 8.070 7.622 0.448 17919 57687 1 141 . 1 1 27 27 LYS N N 27 118.860 118.860 119.853 -0.993 17919 57688 1 141 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.154 0.426 17919 57689 1 141 . 1 1 27 27 LYS C C 27 180.550 180.550 178.578 1.972 17919 57690 1 141 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.615 -0.365 17919 57691 1 141 . 1 1 27 27 LYS CB C 27 33.730 33.730 31.990 1.740 17919 57692 1 141 . 1 1 27 27 LYS H H 27 8.560 8.560 7.802 0.758 17919 57693 1 141 . 1 1 28 28 ALA N N 28 123.440 123.440 122.387 1.053 17919 57694 1 141 . 1 1 28 28 ALA HA H 28 4.160 4.160 3.982 0.178 17919 57695 1 141 . 1 1 28 28 ALA C C 28 180.300 180.300 179.290 1.010 17919 57696 1 141 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.386 -0.016 17919 57697 1 141 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.081 -0.371 17919 57698 1 141 . 1 1 28 28 ALA H H 28 8.060 8.060 7.601 0.459 17919 57699 1 141 . 1 1 29 29 LYS N N 29 119.940 119.940 118.604 1.336 17919 57700 1 141 . 1 1 29 29 LYS HA H 29 4.207 4.207 3.942 0.265 17919 57701 1 141 . 1 1 29 29 LYS C C 29 180.320 180.320 179.069 1.251 17919 57702 1 141 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.264 0.386 17919 57703 1 141 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.222 1.067 17919 57704 1 141 . 1 1 29 29 LYS H H 29 7.850 7.850 7.427 0.423 17919 57705 1 141 . 1 1 30 30 ILE N N 30 121.080 121.080 120.151 0.929 17919 57706 1 141 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.561 -0.054 17919 57707 1 141 . 1 1 30 30 ILE C C 30 178.310 178.310 177.904 0.406 17919 57708 1 141 . 1 1 30 30 ILE CA C 30 66.150 66.150 64.905 1.245 17919 57709 1 141 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.499 -0.699 17919 57710 1 141 . 1 1 30 30 ILE H H 30 8.280 8.280 7.622 0.658 17919 57711 1 141 . 1 1 31 31 GLN N N 31 123.490 123.490 120.724 2.766 17919 57712 1 141 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.021 -0.192 17919 57713 1 141 . 1 1 31 31 GLN C C 31 178.890 178.890 178.592 0.298 17919 57714 1 141 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.163 0.837 17919 57715 1 141 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.476 -0.756 17919 57716 1 141 . 1 1 31 31 GLN H H 31 8.580 8.580 8.587 -0.007 17919 57717 1 141 . 1 1 32 32 ASP N N 32 119.360 119.360 119.037 0.323 17919 57718 1 141 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.482 -0.128 17919 57719 1 141 . 1 1 32 32 ASP C C 32 177.250 177.250 177.984 -0.734 17919 57720 1 141 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.601 0.589 17919 57721 1 141 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.459 0.121 17919 57722 1 141 . 1 1 32 32 ASP H H 32 8.010 8.010 7.897 0.113 17919 57723 1 141 . 1 1 33 33 LYS N N 33 115.130 115.130 119.957 -4.827 17919 57724 1 141 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.268 0.069 17919 57725 1 141 . 1 1 33 33 LYS C C 33 177.870 177.870 178.167 -0.297 17919 57726 1 141 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.796 0.254 17919 57727 1 141 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.199 0.971 17919 57728 1 141 . 1 1 33 33 LYS H H 33 7.430 7.430 7.470 -0.040 17919 57729 1 141 . 1 1 34 34 GLU N N 34 113.870 113.870 115.936 -2.066 17919 57730 1 141 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.433 0.192 17919 57731 1 141 . 1 1 34 34 GLU C C 34 177.840 177.840 177.359 0.481 17919 57732 1 141 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.381 -1.211 17919 57733 1 141 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.381 1.279 17919 57734 1 141 . 1 1 34 34 GLU H H 34 8.740 8.740 8.260 0.480 17919 57735 1 141 . 1 1 35 35 GLY N N 35 108.650 108.650 109.396 -0.746 17919 57736 1 141 . 1 1 35 35 GLY C C 35 173.960 173.960 174.125 -0.165 17919 57737 1 141 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.575 0.505 17919 57738 1 141 . 1 1 35 35 GLY H H 35 8.530 8.530 8.121 0.409 17919 57739 1 141 . 1 1 36 36 ILE N N 36 119.880 119.880 121.297 -1.417 17919 57740 1 141 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.396 0.049 17919 57741 1 141 . 1 1 36 36 ILE C C 36 173.590 173.590 174.395 -0.805 17919 57742 1 141 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.532 0.218 17919 57743 1 141 . 1 1 36 36 ILE CB C 36 40.580 40.580 39.200 1.380 17919 57744 1 141 . 1 1 36 36 ILE H H 36 6.150 6.150 7.487 -1.337 17919 57745 1 141 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.769 -0.135 17919 57746 1 141 . 1 1 37 37 PRO C C 37 176.940 176.940 176.224 0.716 17919 57747 1 141 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.310 0.350 17919 57748 1 141 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.091 0.759 17919 57749 1 141 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.163 -0.046 17919 57750 1 141 . 1 1 38 38 PRO C C 38 178.320 178.320 178.276 0.044 17919 57751 1 141 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.809 0.451 17919 57752 1 141 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.855 1.035 17919 57753 1 141 . 1 1 39 39 ASP N N 39 113.380 113.380 114.663 -1.283 17919 57754 1 141 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.402 0.028 17919 57755 1 141 . 1 1 39 39 ASP C C 39 177.090 177.090 178.399 -1.309 17919 57756 1 141 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.283 -0.643 17919 57757 1 141 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.129 -0.589 17919 57758 1 141 . 1 1 39 39 ASP H H 39 8.550 8.550 8.684 -0.134 17919 57759 1 141 . 1 1 40 40 GLN N N 40 116.780 116.780 117.510 -0.730 17919 57760 1 141 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.206 0.258 17919 57761 1 141 . 1 1 40 40 GLN C C 40 175.380 175.380 176.320 -0.940 17919 57762 1 141 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.653 -1.013 17919 57763 1 141 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.026 1.114 17919 57764 1 141 . 1 1 40 40 GLN H H 40 7.820 7.820 7.753 0.067 17919 57765 1 141 . 1 1 41 41 GLN N N 41 117.720 117.720 118.610 -0.890 17919 57766 1 141 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.368 -0.124 17919 57767 1 141 . 1 1 41 41 GLN C C 41 176.300 176.300 175.335 0.965 17919 57768 1 141 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.178 0.292 17919 57769 1 141 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.607 2.043 17919 57770 1 141 . 1 1 41 41 GLN H H 41 7.480 7.480 7.266 0.214 17919 57771 1 141 . 1 1 42 42 ARG N N 42 122.680 122.680 124.756 -2.076 17919 57772 1 141 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.615 -0.116 17919 57773 1 141 . 1 1 42 42 ARG C C 42 174.050 174.050 173.840 0.210 17919 57774 1 141 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.268 -0.218 17919 57775 1 141 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.405 -0.655 17919 57776 1 141 . 1 1 42 42 ARG H H 42 8.530 8.530 7.964 0.566 17919 57777 1 141 . 1 1 43 43 LEU N N 43 124.040 124.040 127.948 -3.908 17919 57778 1 141 . 1 1 43 43 LEU C C 43 175.290 175.290 175.445 -0.155 17919 57779 1 141 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.910 -0.930 17919 57780 1 141 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.112 1.678 17919 57781 1 141 . 1 1 43 43 LEU H H 43 8.820 8.820 8.750 0.070 17919 57782 1 141 . 1 1 44 44 ILE N N 44 121.920 121.920 120.503 1.417 17919 57783 1 141 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.736 0.256 17919 57784 1 141 . 1 1 44 44 ILE C C 44 176.060 176.060 174.704 1.356 17919 57785 1 141 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.731 -1.752 17919 57786 1 141 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.919 -0.499 17919 57787 1 141 . 1 1 44 44 ILE H H 44 9.030 9.030 9.092 -0.062 17919 57788 1 141 . 1 1 45 45 PHE N N 45 125.390 125.390 127.087 -1.697 17919 57789 1 141 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.189 -0.144 17919 57790 1 141 . 1 1 45 45 PHE C C 45 174.470 174.470 174.499 -0.029 17919 57791 1 141 . 1 1 45 45 PHE CA C 45 57.020 57.020 57.248 -0.228 17919 57792 1 141 . 1 1 45 45 PHE CB C 45 43.760 43.760 41.945 1.815 17919 57793 1 141 . 1 1 45 45 PHE H H 45 8.830 8.830 8.464 0.366 17919 57794 1 141 . 1 1 46 46 ALA N N 46 132.200 132.200 122.562 9.638 17919 57795 1 141 . 1 1 46 46 ALA HA H 46 3.690 3.690 4.511 -0.821 17919 57796 1 141 . 1 1 46 46 ALA C C 46 177.290 177.290 178.687 -1.397 17919 57797 1 141 . 1 1 46 46 ALA CA C 46 52.540 52.540 51.575 0.965 17919 57798 1 141 . 1 1 46 46 ALA CB C 46 16.570 16.570 19.377 -2.807 17919 57799 1 141 . 1 1 46 46 ALA H H 46 8.810 8.810 7.944 0.866 17919 57800 1 141 . 1 1 47 47 GLY N N 47 102.340 102.340 105.598 -3.258 17919 57801 1 141 . 1 1 47 47 GLY C C 47 173.810 173.810 173.838 -0.028 17919 57802 1 141 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.360 -0.010 17919 57803 1 141 . 1 1 47 47 GLY H H 47 8.130 8.130 8.354 -0.224 17919 57804 1 141 . 1 1 48 48 LYS N N 48 121.570 121.570 118.876 2.694 17919 57805 1 141 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.457 0.165 17919 57806 1 141 . 1 1 48 48 LYS C C 48 174.700 174.700 175.029 -0.329 17919 57807 1 141 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.418 -0.868 17919 57808 1 141 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.738 -0.208 17919 57809 1 141 . 1 1 48 48 LYS H H 48 7.980 7.980 7.154 0.826 17919 57810 1 141 . 1 1 49 49 GLN N N 49 122.410 122.410 119.730 2.680 17919 57811 1 141 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.480 0.080 17919 57812 1 141 . 1 1 49 49 GLN C C 49 175.670 175.670 175.064 0.606 17919 57813 1 141 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.024 -0.284 17919 57814 1 141 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.391 -0.391 17919 57815 1 141 . 1 1 49 49 GLN H H 49 8.600 8.600 8.412 0.188 17919 57816 1 141 . 1 1 50 50 LEU N N 50 125.520 125.520 122.580 2.940 17919 57817 1 141 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.228 -0.138 17919 57818 1 141 . 1 1 50 50 LEU C C 50 176.660 176.660 175.710 0.950 17919 57819 1 141 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.513 0.727 17919 57820 1 141 . 1 1 50 50 LEU CB C 50 41.570 41.570 43.008 -1.438 17919 57821 1 141 . 1 1 50 50 LEU H H 50 8.530 8.530 7.956 0.574 17919 57822 1 141 . 1 1 51 51 GLU N N 51 122.940 122.940 123.739 -0.799 17919 57823 1 141 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.517 -0.029 17919 57824 1 141 . 1 1 51 51 GLU C C 51 175.870 175.870 176.818 -0.948 17919 57825 1 141 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.243 0.717 17919 57826 1 141 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.717 -0.147 17919 57827 1 141 . 1 1 51 51 GLU H H 51 8.400 8.400 8.449 -0.049 17919 57828 1 141 . 1 1 52 52 ASP N N 52 120.030 120.030 126.140 -6.110 17919 57829 1 141 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.425 -0.066 17919 57830 1 141 . 1 1 52 52 ASP C C 52 177.330 177.330 177.688 -0.358 17919 57831 1 141 . 1 1 52 52 ASP CA C 52 56.960 56.960 56.836 0.124 17919 57832 1 141 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.973 -0.123 17919 57833 1 141 . 1 1 52 52 ASP H H 52 8.160 8.160 8.766 -0.606 17919 57834 1 141 . 1 1 53 53 GLY N N 53 106.660 106.660 106.576 0.084 17919 57835 1 141 . 1 1 53 53 GLY C C 53 174.870 174.870 174.763 0.107 17919 57836 1 141 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.043 0.127 17919 57837 1 141 . 1 1 53 53 GLY H H 53 9.390 9.390 8.494 0.896 17919 57838 1 141 . 1 1 54 54 ARG N N 54 119.050 119.050 120.176 -1.126 17919 57839 1 141 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.375 0.320 17919 57840 1 141 . 1 1 54 54 ARG C C 54 175.350 175.350 175.688 -0.338 17919 57841 1 141 . 1 1 54 54 ARG CA C 54 54.390 54.390 56.139 -1.749 17919 57842 1 141 . 1 1 54 54 ARG CB C 54 32.650 32.650 31.528 1.122 17919 57843 1 141 . 1 1 54 54 ARG H H 54 7.460 7.460 7.800 -0.340 17919 57844 1 141 . 1 1 55 55 THR N N 55 108.400 108.400 111.361 -2.961 17919 57845 1 141 . 1 1 55 55 THR HA H 55 5.240 5.240 4.956 0.284 17919 57846 1 141 . 1 1 55 55 THR C C 55 176.560 176.560 176.191 0.369 17919 57847 1 141 . 1 1 55 55 THR CA C 55 59.690 59.690 59.887 -0.197 17919 57848 1 141 . 1 1 55 55 THR CB C 55 72.260 72.260 71.470 0.790 17919 57849 1 141 . 1 1 55 55 THR H H 55 8.730 8.730 8.243 0.487 17919 57850 1 141 . 1 1 56 56 LEU N N 56 117.920 117.920 122.603 -4.683 17919 57851 1 141 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.974 0.086 17919 57852 1 141 . 1 1 56 56 LEU C C 56 180.810 180.810 179.200 1.610 17919 57853 1 141 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.221 0.489 17919 57854 1 141 . 1 1 56 56 LEU CB C 56 40.370 40.370 40.356 0.014 17919 57855 1 141 . 1 1 56 56 LEU H H 56 8.140 8.140 8.553 -0.413 17919 57856 1 141 . 1 1 57 57 SER N N 57 113.330 113.330 115.057 -1.727 17919 57857 1 141 . 1 1 57 57 SER HA H 57 4.370 4.370 4.194 0.176 17919 57858 1 141 . 1 1 57 57 SER C C 57 178.310 178.310 176.777 1.533 17919 57859 1 141 . 1 1 57 57 SER CA C 57 61.080 61.080 62.197 -1.117 17919 57860 1 141 . 1 1 57 57 SER CB C 57 62.530 62.530 62.825 -0.295 17919 57861 1 141 . 1 1 57 57 SER H H 57 8.470 8.470 8.194 0.276 17919 57862 1 141 . 1 1 58 58 ASP N N 58 124.190 124.190 122.490 1.700 17919 57863 1 141 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.214 0.082 17919 57864 1 141 . 1 1 58 58 ASP C C 58 177.400 177.400 177.336 0.064 17919 57865 1 141 . 1 1 58 58 ASP CA C 58 57.180 57.180 57.026 0.154 17919 57866 1 141 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.292 -0.192 17919 57867 1 141 . 1 1 58 58 ASP H H 58 7.930 7.930 7.784 0.146 17919 57868 1 141 . 1 1 59 59 TYR N N 59 115.510 115.510 114.481 1.029 17919 57869 1 141 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.664 0.006 17919 57870 1 141 . 1 1 59 59 TYR C C 59 174.700 174.700 175.194 -0.494 17919 57871 1 141 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.498 0.752 17919 57872 1 141 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.383 1.687 17919 57873 1 141 . 1 1 59 59 TYR H H 59 7.250 7.250 7.094 0.156 17919 57874 1 141 . 1 1 60 60 ASN N N 60 115.900 115.900 115.360 0.540 17919 57875 1 141 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.363 -0.008 17919 57876 1 141 . 1 1 60 60 ASN C C 60 174.340 174.340 174.225 0.115 17919 57877 1 141 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.116 0.004 17919 57878 1 141 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.277 0.133 17919 57879 1 141 . 1 1 60 60 ASN H H 60 8.150 8.150 7.929 0.221 17919 57880 1 141 . 1 1 61 61 ILE N N 61 118.600 118.600 120.567 -1.967 17919 57881 1 141 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.935 -0.542 17919 57882 1 141 . 1 1 61 61 ILE C C 61 174.610 174.610 175.050 -0.440 17919 57883 1 141 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.572 0.848 17919 57884 1 141 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.375 -0.635 17919 57885 1 141 . 1 1 61 61 ILE H H 61 7.250 7.250 7.865 -0.615 17919 57886 1 141 . 1 1 62 62 GLN N N 62 124.740 124.740 125.933 -1.193 17919 57887 1 141 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.759 -0.253 17919 57888 1 141 . 1 1 62 62 GLN C C 62 175.970 175.970 174.865 1.105 17919 57889 1 141 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.103 0.557 17919 57890 1 141 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.935 -0.285 17919 57891 1 141 . 1 1 62 62 GLN H H 62 7.610 7.610 7.732 -0.122 17919 57892 1 141 . 1 1 63 63 LYS N N 63 120.300 120.300 121.657 -1.357 17919 57893 1 141 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.992 0.009 17919 57894 1 141 . 1 1 63 63 LYS C C 63 175.810 175.810 177.209 -1.399 17919 57895 1 141 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.982 -0.192 17919 57896 1 141 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.283 0.367 17919 57897 1 141 . 1 1 63 63 LYS H H 63 8.490 8.490 8.536 -0.046 17919 57898 1 141 . 1 1 64 64 GLU N N 64 113.950 113.950 122.380 -8.430 17919 57899 1 141 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.557 -0.092 17919 57900 1 141 . 1 1 64 64 GLU C C 64 175.250 175.250 175.089 0.161 17919 57901 1 141 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.453 0.437 17919 57902 1 141 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.404 -2.504 17919 57903 1 141 . 1 1 64 64 GLU H H 64 9.280 9.280 8.487 0.793 17919 57904 1 141 . 1 1 65 65 SER N N 65 114.730 114.730 115.115 -0.385 17919 57905 1 141 . 1 1 65 65 SER HA H 65 4.640 4.640 4.552 0.088 17919 57906 1 141 . 1 1 65 65 SER C C 65 172.160 172.160 173.928 -1.768 17919 57907 1 141 . 1 1 65 65 SER CA C 65 60.890 60.890 58.608 2.282 17919 57908 1 141 . 1 1 65 65 SER CB C 65 64.910 64.910 63.831 1.079 17919 57909 1 141 . 1 1 65 65 SER H H 65 7.670 7.670 7.631 0.039 17919 57910 1 141 . 1 1 66 66 THR N N 66 117.110 117.110 122.194 -5.084 17919 57911 1 141 . 1 1 66 66 THR HA H 66 5.270 5.270 5.152 0.118 17919 57912 1 141 . 1 1 66 66 THR C C 66 173.950 173.950 174.040 -0.090 17919 57913 1 141 . 1 1 66 66 THR CA C 66 62.340 62.340 62.303 0.037 17919 57914 1 141 . 1 1 66 66 THR CB C 66 70.080 70.080 69.431 0.649 17919 57915 1 141 . 1 1 66 66 THR H H 66 8.730 8.730 8.703 0.027 17919 57916 1 141 . 1 1 67 67 LEU N N 67 127.110 127.110 128.365 -1.255 17919 57917 1 141 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.920 0.140 17919 57918 1 141 . 1 1 67 67 LEU C C 67 175.770 175.770 175.720 0.050 17919 57919 1 141 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.097 -0.197 17919 57920 1 141 . 1 1 67 67 LEU CB C 67 44.260 44.260 42.964 1.296 17919 57921 1 141 . 1 1 67 67 LEU H H 67 9.410 9.410 9.124 0.286 17919 57922 1 141 . 1 1 68 68 HIS N N 68 118.380 118.380 123.107 -4.727 17919 57923 1 141 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.335 -0.095 17919 57924 1 141 . 1 1 68 68 HIS C C 68 173.150 173.150 173.631 -0.481 17919 57925 1 141 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.689 0.311 17919 57926 1 141 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.797 -2.268 17919 57927 1 141 . 1 1 68 68 HIS H H 68 9.230 9.230 9.295 -0.065 17919 57928 1 141 . 1 1 69 69 LEU N N 69 124.460 124.460 128.434 -3.974 17919 57929 1 141 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.323 -0.133 17919 57930 1 141 . 1 1 69 69 LEU C C 69 175.270 175.270 174.163 1.107 17919 57931 1 141 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.270 0.620 17919 57932 1 141 . 1 1 69 69 LEU CB C 69 44.380 44.380 45.233 -0.853 17919 57933 1 141 . 1 1 69 69 LEU H H 69 8.340 8.340 8.082 0.258 17919 57934 1 141 . 1 1 70 70 VAL N N 70 126.940 126.940 120.541 6.399 17919 57935 1 141 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.566 -0.216 17919 57936 1 141 . 1 1 70 70 VAL C C 70 174.000 174.000 174.360 -0.360 17919 57937 1 141 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.197 1.603 17919 57938 1 141 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.304 -0.394 17919 57939 1 141 . 1 1 70 70 VAL H H 70 9.200 9.200 8.749 0.451 17919 57940 1 141 . 1 1 71 71 LEU N N 71 123.130 123.130 121.594 1.536 17919 57941 1 141 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.768 0.292 17919 57942 1 141 . 1 1 71 71 LEU C C 71 177.830 177.830 177.129 0.701 17919 57943 1 141 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.539 0.401 17919 57944 1 141 . 1 1 71 71 LEU CB C 71 42.850 42.850 41.473 1.377 17919 57945 1 141 . 1 1 71 71 LEU H H 71 8.120 8.120 8.230 -0.110 17919 57946 1 141 . 1 1 72 72 ARG N N 72 123.490 123.490 126.753 -3.263 17919 57947 1 141 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.297 0.004 17919 57948 1 141 . 1 1 72 72 ARG C C 72 175.350 175.350 174.783 0.567 17919 57949 1 141 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.525 -0.915 17919 57950 1 141 . 1 1 72 72 ARG CB C 72 31.350 31.350 31.036 0.314 17919 57951 1 141 . 1 1 72 72 ARG H H 72 8.580 8.580 8.177 0.403 17919 57952 1 142 . 1 1 2 2 GLN N N 2 123.220 123.220 122.495 0.725 17919 57953 1 142 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.169 0.080 17919 57954 1 142 . 1 1 2 2 GLN C C 2 175.920 175.920 174.926 0.994 17919 57955 1 142 . 1 1 2 2 GLN CA C 2 55.080 55.080 55.203 -0.123 17919 57956 1 142 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.910 -0.149 17919 57957 1 142 . 1 1 2 2 GLN H H 2 8.900 8.900 8.437 0.463 17919 57958 1 142 . 1 1 3 3 ILE N N 3 115.340 115.340 118.393 -3.053 17919 57959 1 142 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.542 -0.329 17919 57960 1 142 . 1 1 3 3 ILE C C 3 172.450 172.450 173.559 -1.109 17919 57961 1 142 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.481 0.089 17919 57962 1 142 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.517 0.692 17919 57963 1 142 . 1 1 3 3 ILE H H 3 8.320 8.320 8.906 -0.586 17919 57964 1 142 . 1 1 4 4 PHE N N 4 118.110 118.110 121.860 -3.750 17919 57965 1 142 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.047 0.583 17919 57966 1 142 . 1 1 4 4 PHE C C 4 175.320 175.320 175.199 0.121 17919 57967 1 142 . 1 1 4 4 PHE CA C 4 55.210 55.210 56.209 -0.999 17919 57968 1 142 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.185 0.295 17919 57969 1 142 . 1 1 4 4 PHE H H 4 8.610 8.610 9.184 -0.574 17919 57970 1 142 . 1 1 5 5 VAL N N 5 121.000 121.000 125.243 -4.243 17919 57971 1 142 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.470 0.255 17919 57972 1 142 . 1 1 5 5 VAL C C 5 174.870 174.870 175.167 -0.297 17919 57973 1 142 . 1 1 5 5 VAL CA C 5 60.620 60.620 62.038 -1.418 17919 57974 1 142 . 1 1 5 5 VAL CB C 5 34.230 34.230 32.309 1.921 17919 57975 1 142 . 1 1 5 5 VAL H H 5 9.300 9.300 8.514 0.786 17919 57976 1 142 . 1 1 6 6 LYS N N 6 127.520 127.520 128.505 -0.985 17919 57977 1 142 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.236 0.131 17919 57978 1 142 . 1 1 6 6 LYS C C 6 177.140 177.140 176.258 0.882 17919 57979 1 142 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.535 -0.015 17919 57980 1 142 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.522 0.528 17919 57981 1 142 . 1 1 6 6 LYS H H 6 8.820 8.820 9.171 -0.351 17919 57982 1 142 . 1 1 7 7 THR N N 7 115.400 115.400 116.200 -0.800 17919 57983 1 142 . 1 1 7 7 THR HA H 7 4.970 4.970 4.644 0.326 17919 57984 1 142 . 1 1 7 7 THR C C 7 176.910 176.910 175.930 0.980 17919 57985 1 142 . 1 1 7 7 THR CA C 7 60.470 60.470 59.975 0.495 17919 57986 1 142 . 1 1 7 7 THR CB C 7 70.630 70.630 70.556 0.074 17919 57987 1 142 . 1 1 7 7 THR H H 7 8.730 8.730 8.669 0.061 17919 57988 1 142 . 1 1 8 8 LEU N N 8 121.330 121.330 120.190 1.140 17919 57989 1 142 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.454 -0.144 17919 57990 1 142 . 1 1 8 8 LEU C C 8 178.800 178.800 177.551 1.249 17919 57991 1 142 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.145 0.435 17919 57992 1 142 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.363 -0.393 17919 57993 1 142 . 1 1 8 8 LEU H H 8 9.100 9.100 8.697 0.403 17919 57994 1 142 . 1 1 9 9 THR N N 9 105.590 105.590 107.779 -2.189 17919 57995 1 142 . 1 1 9 9 THR HA H 9 4.428 4.428 4.403 0.025 17919 57996 1 142 . 1 1 9 9 THR C C 9 175.520 175.520 175.326 0.194 17919 57997 1 142 . 1 1 9 9 THR CA C 9 61.400 61.400 61.421 -0.021 17919 57998 1 142 . 1 1 9 9 THR CB C 9 69.140 69.140 69.112 0.028 17919 57999 1 142 . 1 1 9 9 THR H H 9 7.630 7.630 7.645 -0.015 17919 58000 1 142 . 1 1 10 10 GLY N N 10 108.890 108.890 110.563 -1.673 17919 58001 1 142 . 1 1 10 10 GLY C C 10 174.070 174.070 173.717 0.353 17919 58002 1 142 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.885 0.576 17919 58003 1 142 . 1 1 10 10 GLY H H 10 7.810 7.810 8.271 -0.461 17919 58004 1 142 . 1 1 11 11 LYS N N 11 121.600 121.600 120.272 1.328 17919 58005 1 142 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.641 -0.280 17919 58006 1 142 . 1 1 11 11 LYS C C 11 175.940 175.940 175.522 0.418 17919 58007 1 142 . 1 1 11 11 LYS CA C 11 56.280 56.280 54.577 1.703 17919 58008 1 142 . 1 1 11 11 LYS CB C 11 33.200 33.200 34.858 -1.658 17919 58009 1 142 . 1 1 11 11 LYS H H 11 7.280 7.280 7.687 -0.407 17919 58010 1 142 . 1 1 12 12 THR N N 12 120.440 120.440 119.995 0.445 17919 58011 1 142 . 1 1 12 12 THR HA H 12 5.046 5.046 4.957 0.089 17919 58012 1 142 . 1 1 12 12 THR C C 12 174.320 174.320 174.687 -0.367 17919 58013 1 142 . 1 1 12 12 THR CA C 12 62.390 62.390 62.267 0.123 17919 58014 1 142 . 1 1 12 12 THR CB C 12 69.910 69.910 69.311 0.599 17919 58015 1 142 . 1 1 12 12 THR H H 12 8.650 8.650 8.406 0.244 17919 58016 1 142 . 1 1 13 13 ILE N N 13 127.110 127.110 128.700 -1.590 17919 58017 1 142 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.417 0.127 17919 58018 1 142 . 1 1 13 13 ILE C C 13 175.220 175.220 175.583 -0.363 17919 58019 1 142 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.955 -0.975 17919 58020 1 142 . 1 1 13 13 ILE CB C 13 40.950 40.950 39.378 1.572 17919 58021 1 142 . 1 1 13 13 ILE H H 13 9.450 9.450 8.463 0.987 17919 58022 1 142 . 1 1 14 14 THR N N 14 121.520 121.520 114.356 7.164 17919 58023 1 142 . 1 1 14 14 THR HA H 14 4.964 4.964 4.956 0.008 17919 58024 1 142 . 1 1 14 14 THR C C 14 173.790 173.790 173.820 -0.030 17919 58025 1 142 . 1 1 14 14 THR CA C 14 61.940 61.940 60.664 1.276 17919 58026 1 142 . 1 1 14 14 THR CB C 14 69.650 69.650 70.610 -0.960 17919 58027 1 142 . 1 1 14 14 THR H H 14 8.710 8.710 8.038 0.672 17919 58028 1 142 . 1 1 15 15 LEU N N 15 124.800 124.800 125.353 -0.553 17919 58029 1 142 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.705 0.075 17919 58030 1 142 . 1 1 15 15 LEU C C 15 174.670 174.670 175.027 -0.357 17919 58031 1 142 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.878 -1.048 17919 58032 1 142 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.777 1.293 17919 58033 1 142 . 1 1 15 15 LEU H H 15 8.710 8.710 8.621 0.089 17919 58034 1 142 . 1 1 16 16 GLU N N 16 122.160 122.160 122.695 -0.535 17919 58035 1 142 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.991 -0.074 17919 58036 1 142 . 1 1 16 16 GLU C C 16 175.860 175.860 175.925 -0.065 17919 58037 1 142 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.495 -0.675 17919 58038 1 142 . 1 1 16 16 GLU CB C 16 29.450 29.450 31.301 -1.851 17919 58039 1 142 . 1 1 16 16 GLU H H 16 8.140 8.140 8.732 -0.592 17919 58040 1 142 . 1 1 17 17 VAL N N 17 117.210 117.210 120.322 -3.112 17919 58041 1 142 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.931 -0.217 17919 58042 1 142 . 1 1 17 17 VAL C C 17 174.160 174.160 175.299 -1.139 17919 58043 1 142 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.521 -0.091 17919 58044 1 142 . 1 1 17 17 VAL CB C 17 36.400 36.400 34.846 1.554 17919 58045 1 142 . 1 1 17 17 VAL H H 17 8.900 8.900 8.820 0.080 17919 58046 1 142 . 1 1 18 18 GLU N N 18 118.990 118.990 118.550 0.440 17919 58047 1 142 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.819 0.260 17919 58048 1 142 . 1 1 18 18 GLU C C 18 176.160 176.160 174.721 1.439 17919 58049 1 142 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.869 -0.149 17919 58050 1 142 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.551 -0.241 17919 58051 1 142 . 1 1 18 18 GLU H H 18 8.640 8.640 8.100 0.540 17919 58052 1 142 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.203 -0.062 17919 58053 1 142 . 1 1 19 19 PRO C C 19 175.310 175.310 177.759 -2.449 17919 58054 1 142 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.756 -0.286 17919 58055 1 142 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.958 -0.008 17919 58056 1 142 . 1 1 20 20 SER N N 20 103.400 103.400 108.169 -4.769 17919 58057 1 142 . 1 1 20 20 SER HA H 20 4.370 4.370 4.338 0.032 17919 58058 1 142 . 1 1 20 20 SER C C 20 174.660 174.660 174.575 0.085 17919 58059 1 142 . 1 1 20 20 SER CA C 20 57.400 57.400 58.425 -1.025 17919 58060 1 142 . 1 1 20 20 SER CB C 20 63.370 63.370 63.022 0.348 17919 58061 1 142 . 1 1 20 20 SER H H 20 7.040 7.040 7.882 -0.842 17919 58062 1 142 . 1 1 21 21 ASP N N 21 123.480 123.480 124.582 -1.102 17919 58063 1 142 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.692 0.003 17919 58064 1 142 . 1 1 21 21 ASP C C 21 176.360 176.360 175.883 0.477 17919 58065 1 142 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.229 0.471 17919 58066 1 142 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.839 -1.039 17919 58067 1 142 . 1 1 21 21 ASP H H 21 8.030 8.030 8.262 -0.232 17919 58068 1 142 . 1 1 22 22 THR N N 22 108.800 108.800 111.678 -2.878 17919 58069 1 142 . 1 1 22 22 THR HA H 22 4.920 4.920 4.623 0.297 17919 58070 1 142 . 1 1 22 22 THR C C 22 176.750 176.750 176.024 0.726 17919 58071 1 142 . 1 1 22 22 THR CA C 22 59.690 59.690 60.759 -1.069 17919 58072 1 142 . 1 1 22 22 THR CB C 22 71.200 71.200 70.409 0.791 17919 58073 1 142 . 1 1 22 22 THR H H 22 7.900 7.900 8.341 -0.441 17919 58074 1 142 . 1 1 23 23 ILE N N 23 121.190 121.190 121.061 0.129 17919 58075 1 142 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.871 -0.214 17919 58076 1 142 . 1 1 23 23 ILE C C 23 179.040 179.040 177.836 1.204 17919 58077 1 142 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.258 0.002 17919 58078 1 142 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.336 -1.986 17919 58079 1 142 . 1 1 23 23 ILE H H 23 8.560 8.560 8.920 -0.360 17919 58080 1 142 . 1 1 24 24 GLU N N 24 120.830 120.830 120.637 0.193 17919 58081 1 142 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.988 -0.071 17919 58082 1 142 . 1 1 24 24 GLU C C 24 178.640 178.640 178.619 0.021 17919 58083 1 142 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.584 0.636 17919 58084 1 142 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.578 -1.298 17919 58085 1 142 . 1 1 24 24 GLU H H 24 9.760 9.760 7.810 1.950 17919 58086 1 142 . 1 1 25 25 ASN N N 25 120.570 120.570 118.602 1.968 17919 58087 1 142 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.537 -0.012 17919 58088 1 142 . 1 1 25 25 ASN C C 25 178.380 178.380 178.051 0.329 17919 58089 1 142 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.034 0.026 17919 58090 1 142 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.379 0.071 17919 58091 1 142 . 1 1 25 25 ASN H H 25 7.920 7.920 7.580 0.340 17919 58092 1 142 . 1 1 26 26 VAL N N 26 121.710 121.710 119.645 2.065 17919 58093 1 142 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.645 -0.248 17919 58094 1 142 . 1 1 26 26 VAL C C 26 177.950 177.950 177.947 0.003 17919 58095 1 142 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.612 1.048 17919 58096 1 142 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.212 -0.372 17919 58097 1 142 . 1 1 26 26 VAL H H 26 8.070 8.070 8.353 -0.283 17919 58098 1 142 . 1 1 27 27 LYS N N 27 118.860 118.860 119.158 -0.298 17919 58099 1 142 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.242 0.338 17919 58100 1 142 . 1 1 27 27 LYS C C 27 180.550 180.550 179.076 1.474 17919 58101 1 142 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.346 -0.096 17919 58102 1 142 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.270 1.460 17919 58103 1 142 . 1 1 27 27 LYS H H 27 8.560 8.560 7.583 0.977 17919 58104 1 142 . 1 1 28 28 ALA N N 28 123.440 123.440 121.562 1.878 17919 58105 1 142 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.350 -0.190 17919 58106 1 142 . 1 1 28 28 ALA C C 28 180.300 180.300 179.261 1.039 17919 58107 1 142 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.746 0.624 17919 58108 1 142 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.445 -0.735 17919 58109 1 142 . 1 1 28 28 ALA H H 28 8.060 8.060 8.517 -0.457 17919 58110 1 142 . 1 1 29 29 LYS N N 29 119.940 119.940 118.851 1.089 17919 58111 1 142 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.089 0.118 17919 58112 1 142 . 1 1 29 29 LYS C C 29 180.320 180.320 178.232 2.088 17919 58113 1 142 . 1 1 29 29 LYS CA C 29 59.650 59.650 58.854 0.796 17919 58114 1 142 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.418 0.872 17919 58115 1 142 . 1 1 29 29 LYS H H 29 7.850 7.850 7.470 0.380 17919 58116 1 142 . 1 1 30 30 ILE N N 30 121.080 121.080 119.879 1.201 17919 58117 1 142 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.697 -0.190 17919 58118 1 142 . 1 1 30 30 ILE C C 30 178.310 178.310 177.445 0.865 17919 58119 1 142 . 1 1 30 30 ILE CA C 30 66.150 66.150 64.742 1.408 17919 58120 1 142 . 1 1 30 30 ILE CB C 30 36.800 36.800 38.084 -1.284 17919 58121 1 142 . 1 1 30 30 ILE H H 30 8.280 8.280 7.830 0.450 17919 58122 1 142 . 1 1 31 31 GLN N N 31 123.490 123.490 120.844 2.646 17919 58123 1 142 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.090 -0.261 17919 58124 1 142 . 1 1 31 31 GLN C C 31 178.890 178.890 178.343 0.547 17919 58125 1 142 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.166 0.834 17919 58126 1 142 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.525 -0.805 17919 58127 1 142 . 1 1 31 31 GLN H H 31 8.580 8.580 8.746 -0.166 17919 58128 1 142 . 1 1 32 32 ASP N N 32 119.360 119.360 118.736 0.624 17919 58129 1 142 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.431 -0.077 17919 58130 1 142 . 1 1 32 32 ASP C C 32 177.250 177.250 177.557 -0.307 17919 58131 1 142 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.531 0.659 17919 58132 1 142 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.674 -0.094 17919 58133 1 142 . 1 1 32 32 ASP H H 32 8.010 8.010 7.903 0.107 17919 58134 1 142 . 1 1 33 33 LYS N N 33 115.130 115.130 118.372 -3.242 17919 58135 1 142 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.388 -0.051 17919 58136 1 142 . 1 1 33 33 LYS C C 33 177.870 177.870 177.768 0.102 17919 58137 1 142 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.262 0.788 17919 58138 1 142 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.560 0.610 17919 58139 1 142 . 1 1 33 33 LYS H H 33 7.430 7.430 7.468 -0.038 17919 58140 1 142 . 1 1 34 34 GLU N N 34 113.870 113.870 115.368 -1.498 17919 58141 1 142 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.592 0.033 17919 58142 1 142 . 1 1 34 34 GLU C C 34 177.840 177.840 177.107 0.733 17919 58143 1 142 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.731 -0.561 17919 58144 1 142 . 1 1 34 34 GLU CB C 34 32.660 32.660 30.783 1.877 17919 58145 1 142 . 1 1 34 34 GLU H H 34 8.740 8.740 8.244 0.496 17919 58146 1 142 . 1 1 35 35 GLY N N 35 108.650 108.650 108.999 -0.349 17919 58147 1 142 . 1 1 35 35 GLY C C 35 173.960 173.960 174.682 -0.722 17919 58148 1 142 . 1 1 35 35 GLY CA C 35 46.080 46.080 46.094 -0.014 17919 58149 1 142 . 1 1 35 35 GLY H H 35 8.530 8.530 8.264 0.266 17919 58150 1 142 . 1 1 36 36 ILE N N 36 119.880 119.880 122.209 -2.329 17919 58151 1 142 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.177 0.268 17919 58152 1 142 . 1 1 36 36 ILE C C 36 173.590 173.590 174.184 -0.594 17919 58153 1 142 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.723 -0.973 17919 58154 1 142 . 1 1 36 36 ILE CB C 36 40.580 40.580 37.812 2.768 17919 58155 1 142 . 1 1 36 36 ILE H H 36 6.150 6.150 7.780 -1.630 17919 58156 1 142 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.567 0.067 17919 58157 1 142 . 1 1 37 37 PRO C C 37 176.940 176.940 176.021 0.919 17919 58158 1 142 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.855 -0.195 17919 58159 1 142 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.007 0.843 17919 58160 1 142 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.160 -0.043 17919 58161 1 142 . 1 1 38 38 PRO C C 38 178.320 178.320 178.061 0.259 17919 58162 1 142 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.651 0.609 17919 58163 1 142 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.718 1.172 17919 58164 1 142 . 1 1 39 39 ASP N N 39 113.380 113.380 114.139 -0.759 17919 58165 1 142 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.325 0.105 17919 58166 1 142 . 1 1 39 39 ASP C C 39 177.090 177.090 177.145 -0.055 17919 58167 1 142 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.433 -0.793 17919 58168 1 142 . 1 1 39 39 ASP CB C 39 39.540 39.540 39.221 0.319 17919 58169 1 142 . 1 1 39 39 ASP H H 39 8.550 8.550 8.846 -0.296 17919 58170 1 142 . 1 1 40 40 GLN N N 40 116.780 116.780 116.770 0.010 17919 58171 1 142 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.613 -0.149 17919 58172 1 142 . 1 1 40 40 GLN C C 40 175.380 175.380 175.726 -0.346 17919 58173 1 142 . 1 1 40 40 GLN CA C 40 55.640 55.640 54.846 0.794 17919 58174 1 142 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.588 0.552 17919 58175 1 142 . 1 1 40 40 GLN H H 40 7.820 7.820 7.775 0.045 17919 58176 1 142 . 1 1 41 41 GLN N N 41 117.720 117.720 120.713 -2.993 17919 58177 1 142 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.345 -0.101 17919 58178 1 142 . 1 1 41 41 GLN C C 41 176.300 176.300 175.006 1.294 17919 58179 1 142 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.501 -0.031 17919 58180 1 142 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.537 2.113 17919 58181 1 142 . 1 1 41 41 GLN H H 41 7.480 7.480 7.635 -0.155 17919 58182 1 142 . 1 1 42 42 ARG N N 42 122.680 122.680 124.849 -2.169 17919 58183 1 142 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.585 -0.085 17919 58184 1 142 . 1 1 42 42 ARG C C 42 174.050 174.050 174.391 -0.341 17919 58185 1 142 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.820 0.230 17919 58186 1 142 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.306 -0.556 17919 58187 1 142 . 1 1 42 42 ARG H H 42 8.530 8.530 8.346 0.184 17919 58188 1 142 . 1 1 43 43 LEU N N 43 124.040 124.040 127.015 -2.975 17919 58189 1 142 . 1 1 43 43 LEU C C 43 175.290 175.290 175.886 -0.596 17919 58190 1 142 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.066 -1.086 17919 58191 1 142 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.104 2.686 17919 58192 1 142 . 1 1 43 43 LEU H H 43 8.820 8.820 8.802 0.018 17919 58193 1 142 . 1 1 44 44 ILE N N 44 121.920 121.920 120.200 1.720 17919 58194 1 142 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.734 0.258 17919 58195 1 142 . 1 1 44 44 ILE C C 44 176.060 176.060 174.346 1.714 17919 58196 1 142 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.428 -1.448 17919 58197 1 142 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.152 0.268 17919 58198 1 142 . 1 1 44 44 ILE H H 44 9.030 9.030 8.536 0.494 17919 58199 1 142 . 1 1 45 45 PHE N N 45 125.390 125.390 127.599 -2.209 17919 58200 1 142 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.099 -0.054 17919 58201 1 142 . 1 1 45 45 PHE C C 45 174.470 174.470 174.469 0.001 17919 58202 1 142 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.122 0.898 17919 58203 1 142 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.075 0.685 17919 58204 1 142 . 1 1 45 45 PHE H H 45 8.830 8.830 8.418 0.412 17919 58205 1 142 . 1 1 46 46 ALA N N 46 132.200 132.200 129.904 2.296 17919 58206 1 142 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.675 0.015 17919 58207 1 142 . 1 1 46 46 ALA C C 46 177.290 177.290 177.740 -0.450 17919 58208 1 142 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.398 0.143 17919 58209 1 142 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.439 0.131 17919 58210 1 142 . 1 1 46 46 ALA H H 46 8.810 8.810 8.704 0.106 17919 58211 1 142 . 1 1 47 47 GLY N N 47 102.340 102.340 103.387 -1.047 17919 58212 1 142 . 1 1 47 47 GLY C C 47 173.810 173.810 174.325 -0.515 17919 58213 1 142 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.120 0.230 17919 58214 1 142 . 1 1 47 47 GLY H H 47 8.130 8.130 8.433 -0.303 17919 58215 1 142 . 1 1 48 48 LYS N N 48 121.570 121.570 121.475 0.095 17919 58216 1 142 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.572 0.050 17919 58217 1 142 . 1 1 48 48 LYS C C 48 174.700 174.700 175.312 -0.612 17919 58218 1 142 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.767 -0.217 17919 58219 1 142 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.400 0.130 17919 58220 1 142 . 1 1 48 48 LYS H H 48 7.980 7.980 7.895 0.085 17919 58221 1 142 . 1 1 49 49 GLN N N 49 122.410 122.410 125.371 -2.961 17919 58222 1 142 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.493 0.067 17919 58223 1 142 . 1 1 49 49 GLN C C 49 175.670 175.670 175.736 -0.066 17919 58224 1 142 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.203 -0.463 17919 58225 1 142 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.297 -0.297 17919 58226 1 142 . 1 1 49 49 GLN H H 49 8.600 8.600 8.618 -0.018 17919 58227 1 142 . 1 1 50 50 LEU N N 50 125.520 125.520 129.065 -3.545 17919 58228 1 142 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.076 0.014 17919 58229 1 142 . 1 1 50 50 LEU C C 50 176.660 176.660 176.284 0.376 17919 58230 1 142 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.103 0.137 17919 58231 1 142 . 1 1 50 50 LEU CB C 50 41.570 41.570 40.962 0.608 17919 58232 1 142 . 1 1 50 50 LEU H H 50 8.530 8.530 8.234 0.296 17919 58233 1 142 . 1 1 51 51 GLU N N 51 122.940 122.940 124.651 -1.711 17919 58234 1 142 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.502 -0.014 17919 58235 1 142 . 1 1 51 51 GLU C C 51 175.870 175.870 176.650 -0.780 17919 58236 1 142 . 1 1 51 51 GLU CA C 51 55.960 55.960 54.921 1.039 17919 58237 1 142 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.363 0.207 17919 58238 1 142 . 1 1 51 51 GLU H H 51 8.400 8.400 8.274 0.126 17919 58239 1 142 . 1 1 52 52 ASP N N 52 120.030 120.030 122.119 -2.089 17919 58240 1 142 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.523 -0.164 17919 58241 1 142 . 1 1 52 52 ASP C C 52 177.330 177.330 177.735 -0.405 17919 58242 1 142 . 1 1 52 52 ASP CA C 52 56.960 56.960 56.867 0.093 17919 58243 1 142 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.608 0.242 17919 58244 1 142 . 1 1 52 52 ASP H H 52 8.160 8.160 8.837 -0.677 17919 58245 1 142 . 1 1 53 53 GLY N N 53 106.660 106.660 106.790 -0.130 17919 58246 1 142 . 1 1 53 53 GLY C C 53 174.870 174.870 174.353 0.517 17919 58247 1 142 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.511 -0.341 17919 58248 1 142 . 1 1 53 53 GLY H H 53 9.390 9.390 8.698 0.692 17919 58249 1 142 . 1 1 54 54 ARG N N 54 119.050 119.050 119.119 -0.069 17919 58250 1 142 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.718 -0.023 17919 58251 1 142 . 1 1 54 54 ARG C C 54 175.350 175.350 175.062 0.288 17919 58252 1 142 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.284 0.106 17919 58253 1 142 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.714 -1.064 17919 58254 1 142 . 1 1 54 54 ARG H H 54 7.460 7.460 7.257 0.203 17919 58255 1 142 . 1 1 55 55 THR N N 55 108.400 108.400 110.221 -1.821 17919 58256 1 142 . 1 1 55 55 THR HA H 55 5.240 5.240 5.278 -0.038 17919 58257 1 142 . 1 1 55 55 THR C C 55 176.560 176.560 176.009 0.551 17919 58258 1 142 . 1 1 55 55 THR CA C 55 59.690 59.690 59.410 0.279 17919 58259 1 142 . 1 1 55 55 THR CB C 55 72.260 72.260 71.990 0.270 17919 58260 1 142 . 1 1 55 55 THR H H 55 8.730 8.730 8.889 -0.159 17919 58261 1 142 . 1 1 56 56 LEU N N 56 117.920 117.920 120.763 -2.843 17919 58262 1 142 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.012 0.048 17919 58263 1 142 . 1 1 56 56 LEU C C 56 180.810 180.810 178.756 2.054 17919 58264 1 142 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.232 0.478 17919 58265 1 142 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.589 -1.219 17919 58266 1 142 . 1 1 56 56 LEU H H 56 8.140 8.140 8.402 -0.262 17919 58267 1 142 . 1 1 57 57 SER N N 57 113.330 113.330 115.973 -2.643 17919 58268 1 142 . 1 1 57 57 SER HA H 57 4.370 4.370 4.057 0.313 17919 58269 1 142 . 1 1 57 57 SER C C 57 178.310 178.310 176.777 1.533 17919 58270 1 142 . 1 1 57 57 SER CA C 57 61.080 61.080 62.571 -1.491 17919 58271 1 142 . 1 1 57 57 SER CB C 57 62.530 62.530 62.714 -0.184 17919 58272 1 142 . 1 1 57 57 SER H H 57 8.470 8.470 7.866 0.604 17919 58273 1 142 . 1 1 58 58 ASP N N 58 124.190 124.190 121.616 2.574 17919 58274 1 142 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.169 0.127 17919 58275 1 142 . 1 1 58 58 ASP C C 58 177.400 177.400 177.314 0.086 17919 58276 1 142 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.749 0.431 17919 58277 1 142 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.356 -0.256 17919 58278 1 142 . 1 1 58 58 ASP H H 58 7.930 7.930 7.799 0.131 17919 58279 1 142 . 1 1 59 59 TYR N N 59 115.510 115.510 114.701 0.809 17919 58280 1 142 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.623 0.047 17919 58281 1 142 . 1 1 59 59 TYR C C 59 174.700 174.700 175.328 -0.628 17919 58282 1 142 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.787 0.463 17919 58283 1 142 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.882 1.188 17919 58284 1 142 . 1 1 59 59 TYR H H 59 7.250 7.250 7.245 0.005 17919 58285 1 142 . 1 1 60 60 ASN N N 60 115.900 115.900 116.327 -0.427 17919 58286 1 142 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.394 -0.039 17919 58287 1 142 . 1 1 60 60 ASN C C 60 174.340 174.340 174.861 -0.521 17919 58288 1 142 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.403 -0.283 17919 58289 1 142 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.257 0.153 17919 58290 1 142 . 1 1 60 60 ASN H H 60 8.150 8.150 8.281 -0.131 17919 58291 1 142 . 1 1 61 61 ILE N N 61 118.600 118.600 119.385 -0.785 17919 58292 1 142 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.766 -0.373 17919 58293 1 142 . 1 1 61 61 ILE C C 61 174.610 174.610 175.192 -0.582 17919 58294 1 142 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.930 0.490 17919 58295 1 142 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.897 -1.157 17919 58296 1 142 . 1 1 61 61 ILE H H 61 7.250 7.250 7.980 -0.730 17919 58297 1 142 . 1 1 62 62 GLN N N 62 124.740 124.740 122.499 2.241 17919 58298 1 142 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.687 -0.181 17919 58299 1 142 . 1 1 62 62 GLN C C 62 175.970 175.970 175.645 0.325 17919 58300 1 142 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.590 0.070 17919 58301 1 142 . 1 1 62 62 GLN CB C 62 31.650 31.650 32.379 -0.729 17919 58302 1 142 . 1 1 62 62 GLN H H 62 7.610 7.610 7.824 -0.214 17919 58303 1 142 . 1 1 63 63 LYS N N 63 120.300 120.300 122.269 -1.969 17919 58304 1 142 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.824 0.177 17919 58305 1 142 . 1 1 63 63 LYS C C 63 175.810 175.810 176.833 -1.023 17919 58306 1 142 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.182 -0.392 17919 58307 1 142 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.038 0.612 17919 58308 1 142 . 1 1 63 63 LYS H H 63 8.490 8.490 8.655 -0.165 17919 58309 1 142 . 1 1 64 64 GLU N N 64 113.950 113.950 122.103 -8.153 17919 58310 1 142 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.937 -0.472 17919 58311 1 142 . 1 1 64 64 GLU C C 64 175.250 175.250 175.332 -0.082 17919 58312 1 142 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.536 0.354 17919 58313 1 142 . 1 1 64 64 GLU CB C 64 25.900 25.900 29.194 -3.294 17919 58314 1 142 . 1 1 64 64 GLU H H 64 9.280 9.280 8.844 0.436 17919 58315 1 142 . 1 1 65 65 SER N N 65 114.730 114.730 114.336 0.394 17919 58316 1 142 . 1 1 65 65 SER HA H 65 4.640 4.640 4.720 -0.080 17919 58317 1 142 . 1 1 65 65 SER C C 65 172.160 172.160 173.316 -1.156 17919 58318 1 142 . 1 1 65 65 SER CA C 65 60.890 60.890 59.053 1.837 17919 58319 1 142 . 1 1 65 65 SER CB C 65 64.910 64.910 65.133 -0.223 17919 58320 1 142 . 1 1 65 65 SER H H 65 7.670 7.670 7.427 0.243 17919 58321 1 142 . 1 1 66 66 THR N N 66 117.110 117.110 117.143 -0.033 17919 58322 1 142 . 1 1 66 66 THR HA H 66 5.270 5.270 5.323 -0.053 17919 58323 1 142 . 1 1 66 66 THR C C 66 173.950 173.950 173.565 0.385 17919 58324 1 142 . 1 1 66 66 THR CA C 66 62.340 62.340 62.066 0.274 17919 58325 1 142 . 1 1 66 66 THR CB C 66 70.080 70.080 70.727 -0.647 17919 58326 1 142 . 1 1 66 66 THR H H 66 8.730 8.730 8.471 0.259 17919 58327 1 142 . 1 1 67 67 LEU N N 67 127.110 127.110 126.943 0.167 17919 58328 1 142 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.828 0.232 17919 58329 1 142 . 1 1 67 67 LEU C C 67 175.770 175.770 175.793 -0.023 17919 58330 1 142 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.894 0.006 17919 58331 1 142 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.984 0.276 17919 58332 1 142 . 1 1 67 67 LEU H H 67 9.410 9.410 9.098 0.312 17919 58333 1 142 . 1 1 68 68 HIS N N 68 118.380 118.380 122.057 -3.677 17919 58334 1 142 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.113 0.127 17919 58335 1 142 . 1 1 68 68 HIS C C 68 173.150 173.150 174.976 -1.826 17919 58336 1 142 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.984 0.016 17919 58337 1 142 . 1 1 68 68 HIS CB C 68 30.530 30.530 29.163 1.367 17919 58338 1 142 . 1 1 68 68 HIS H H 68 9.230 9.230 9.053 0.177 17919 58339 1 142 . 1 1 69 69 LEU N N 69 124.460 124.460 126.618 -2.158 17919 58340 1 142 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.183 1.007 17919 58341 1 142 . 1 1 69 69 LEU C C 69 175.270 175.270 175.299 -0.029 17919 58342 1 142 . 1 1 69 69 LEU CA C 69 53.890 53.890 56.005 -2.115 17919 58343 1 142 . 1 1 69 69 LEU CB C 69 44.380 44.380 42.260 2.120 17919 58344 1 142 . 1 1 69 69 LEU H H 69 8.340 8.340 8.458 -0.118 17919 58345 1 142 . 1 1 70 70 VAL N N 70 126.940 126.940 122.781 4.159 17919 58346 1 142 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.591 -0.241 17919 58347 1 142 . 1 1 70 70 VAL C C 70 174.000 174.000 174.600 -0.600 17919 58348 1 142 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.327 1.473 17919 58349 1 142 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.397 -0.487 17919 58350 1 142 . 1 1 70 70 VAL H H 70 9.200 9.200 8.993 0.207 17919 58351 1 142 . 1 1 71 71 LEU N N 71 123.130 123.130 120.268 2.862 17919 58352 1 142 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.637 0.423 17919 58353 1 142 . 1 1 71 71 LEU C C 71 177.830 177.830 177.094 0.736 17919 58354 1 142 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.872 0.068 17919 58355 1 142 . 1 1 71 71 LEU CB C 71 42.850 42.850 44.177 -1.327 17919 58356 1 142 . 1 1 71 71 LEU H H 71 8.120 8.120 8.271 -0.151 17919 58357 1 142 . 1 1 72 72 ARG N N 72 123.490 123.490 122.126 1.364 17919 58358 1 142 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.450 -0.149 17919 58359 1 142 . 1 1 72 72 ARG C C 72 175.350 175.350 175.481 -0.131 17919 58360 1 142 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.896 -1.286 17919 58361 1 142 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.890 0.460 17919 58362 1 142 . 1 1 72 72 ARG H H 72 8.580 8.580 8.228 0.352 17919 58363 1 143 . 1 1 2 2 GLN N N 2 123.220 123.220 122.510 0.710 17919 58364 1 143 . 1 1 2 2 GLN HA H 2 5.249 5.249 4.729 0.519 17919 58365 1 143 . 1 1 2 2 GLN C C 2 175.920 175.920 174.866 1.054 17919 58366 1 143 . 1 1 2 2 GLN CA C 2 55.080 55.080 55.638 -0.558 17919 58367 1 143 . 1 1 2 2 GLN CB C 2 30.760 30.760 29.395 1.365 17919 58368 1 143 . 1 1 2 2 GLN H H 2 8.900 8.900 8.578 0.322 17919 58369 1 143 . 1 1 3 3 ILE N N 3 115.340 115.340 119.235 -3.895 17919 58370 1 143 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.207 0.006 17919 58371 1 143 . 1 1 3 3 ILE C C 3 172.450 172.450 173.623 -1.173 17919 58372 1 143 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.440 0.131 17919 58373 1 143 . 1 1 3 3 ILE CB C 3 42.210 42.210 40.714 1.496 17919 58374 1 143 . 1 1 3 3 ILE H H 3 8.320 8.320 7.835 0.485 17919 58375 1 143 . 1 1 4 4 PHE N N 4 118.110 118.110 120.984 -2.874 17919 58376 1 143 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.116 0.514 17919 58377 1 143 . 1 1 4 4 PHE C C 4 175.320 175.320 175.026 0.294 17919 58378 1 143 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.507 -0.297 17919 58379 1 143 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.934 -0.454 17919 58380 1 143 . 1 1 4 4 PHE H H 4 8.610 8.610 7.647 0.963 17919 58381 1 143 . 1 1 5 5 VAL N N 5 121.000 121.000 121.183 -0.183 17919 58382 1 143 . 1 1 5 5 VAL HA H 5 4.725 4.725 5.046 -0.321 17919 58383 1 143 . 1 1 5 5 VAL C C 5 174.870 174.870 175.120 -0.250 17919 58384 1 143 . 1 1 5 5 VAL CA C 5 60.620 60.620 60.916 -0.296 17919 58385 1 143 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.236 0.994 17919 58386 1 143 . 1 1 5 5 VAL H H 5 9.300 9.300 8.868 0.432 17919 58387 1 143 . 1 1 6 6 LYS N N 6 127.520 127.520 127.159 0.361 17919 58388 1 143 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.385 -0.018 17919 58389 1 143 . 1 1 6 6 LYS C C 6 177.140 177.140 176.490 0.650 17919 58390 1 143 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.386 0.134 17919 58391 1 143 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.816 0.234 17919 58392 1 143 . 1 1 6 6 LYS H H 6 8.820 8.820 8.641 0.179 17919 58393 1 143 . 1 1 7 7 THR N N 7 115.400 115.400 112.639 2.761 17919 58394 1 143 . 1 1 7 7 THR HA H 7 4.970 4.970 4.451 0.519 17919 58395 1 143 . 1 1 7 7 THR C C 7 176.910 176.910 176.342 0.568 17919 58396 1 143 . 1 1 7 7 THR CA C 7 60.470 60.470 60.625 -0.155 17919 58397 1 143 . 1 1 7 7 THR CB C 7 70.630 70.630 70.287 0.343 17919 58398 1 143 . 1 1 7 7 THR H H 7 8.730 8.730 8.724 0.006 17919 58399 1 143 . 1 1 8 8 LEU N N 8 121.330 121.330 120.895 0.435 17919 58400 1 143 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.424 -0.114 17919 58401 1 143 . 1 1 8 8 LEU C C 8 178.800 178.800 177.946 0.854 17919 58402 1 143 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.181 0.399 17919 58403 1 143 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.082 -0.112 17919 58404 1 143 . 1 1 8 8 LEU H H 8 9.100 9.100 8.620 0.480 17919 58405 1 143 . 1 1 9 9 THR N N 9 105.590 105.590 110.067 -4.477 17919 58406 1 143 . 1 1 9 9 THR HA H 9 4.428 4.428 4.320 0.108 17919 58407 1 143 . 1 1 9 9 THR C C 9 175.520 175.520 175.678 -0.158 17919 58408 1 143 . 1 1 9 9 THR CA C 9 61.400 61.400 62.164 -0.764 17919 58409 1 143 . 1 1 9 9 THR CB C 9 69.140 69.140 69.477 -0.337 17919 58410 1 143 . 1 1 9 9 THR H H 9 7.630 7.630 7.502 0.128 17919 58411 1 143 . 1 1 10 10 GLY N N 10 108.890 108.890 109.901 -1.011 17919 58412 1 143 . 1 1 10 10 GLY C C 10 174.070 174.070 174.100 -0.030 17919 58413 1 143 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.852 0.608 17919 58414 1 143 . 1 1 10 10 GLY H H 10 7.810 7.810 8.368 -0.558 17919 58415 1 143 . 1 1 11 11 LYS N N 11 121.600 121.600 121.765 -0.165 17919 58416 1 143 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.498 -0.137 17919 58417 1 143 . 1 1 11 11 LYS C C 11 175.940 175.940 176.066 -0.126 17919 58418 1 143 . 1 1 11 11 LYS CA C 11 56.280 56.280 55.856 0.423 17919 58419 1 143 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.031 0.169 17919 58420 1 143 . 1 1 11 11 LYS H H 11 7.280 7.280 7.710 -0.430 17919 58421 1 143 . 1 1 12 12 THR N N 12 120.440 120.440 118.309 2.131 17919 58422 1 143 . 1 1 12 12 THR HA H 12 5.046 5.046 4.705 0.341 17919 58423 1 143 . 1 1 12 12 THR C C 12 174.320 174.320 174.294 0.026 17919 58424 1 143 . 1 1 12 12 THR CA C 12 62.390 62.390 61.679 0.711 17919 58425 1 143 . 1 1 12 12 THR CB C 12 69.910 69.910 69.962 -0.052 17919 58426 1 143 . 1 1 12 12 THR H H 12 8.650 8.650 8.249 0.401 17919 58427 1 143 . 1 1 13 13 ILE N N 13 127.110 127.110 120.095 7.015 17919 58428 1 143 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.827 -0.283 17919 58429 1 143 . 1 1 13 13 ILE C C 13 175.220 175.220 173.801 1.419 17919 58430 1 143 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.432 0.548 17919 58431 1 143 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.595 -0.645 17919 58432 1 143 . 1 1 13 13 ILE H H 13 9.450 9.450 8.755 0.695 17919 58433 1 143 . 1 1 14 14 THR N N 14 121.520 121.520 120.147 1.373 17919 58434 1 143 . 1 1 14 14 THR HA H 14 4.964 4.964 4.842 0.122 17919 58435 1 143 . 1 1 14 14 THR C C 14 173.790 173.790 173.483 0.307 17919 58436 1 143 . 1 1 14 14 THR CA C 14 61.940 61.940 61.889 0.051 17919 58437 1 143 . 1 1 14 14 THR CB C 14 69.650 69.650 69.970 -0.320 17919 58438 1 143 . 1 1 14 14 THR H H 14 8.710 8.710 8.317 0.393 17919 58439 1 143 . 1 1 15 15 LEU N N 15 124.800 124.800 126.086 -1.286 17919 58440 1 143 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.689 0.091 17919 58441 1 143 . 1 1 15 15 LEU C C 15 174.670 174.670 174.818 -0.148 17919 58442 1 143 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.836 -1.006 17919 58443 1 143 . 1 1 15 15 LEU CB C 15 47.070 47.070 46.583 0.487 17919 58444 1 143 . 1 1 15 15 LEU H H 15 8.710 8.710 8.348 0.362 17919 58445 1 143 . 1 1 16 16 GLU N N 16 122.160 122.160 124.413 -2.253 17919 58446 1 143 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.494 0.423 17919 58447 1 143 . 1 1 16 16 GLU C C 16 175.860 175.860 174.934 0.926 17919 58448 1 143 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.211 -0.390 17919 58449 1 143 . 1 1 16 16 GLU CB C 16 29.450 29.450 29.187 0.263 17919 58450 1 143 . 1 1 16 16 GLU H H 16 8.140 8.140 8.740 -0.600 17919 58451 1 143 . 1 1 17 17 VAL N N 17 117.210 117.210 121.150 -3.940 17919 58452 1 143 . 1 1 17 17 VAL HA H 17 4.714 4.714 5.057 -0.343 17919 58453 1 143 . 1 1 17 17 VAL C C 17 174.160 174.160 174.964 -0.804 17919 58454 1 143 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.887 -0.457 17919 58455 1 143 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.193 1.207 17919 58456 1 143 . 1 1 17 17 VAL H H 17 8.900 8.900 7.892 1.008 17919 58457 1 143 . 1 1 18 18 GLU N N 18 118.990 118.990 119.575 -0.585 17919 58458 1 143 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.815 0.264 17919 58459 1 143 . 1 1 18 18 GLU C C 18 176.160 176.160 175.426 0.734 17919 58460 1 143 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.885 -0.165 17919 58461 1 143 . 1 1 18 18 GLU CB C 18 30.310 30.310 29.900 0.410 17919 58462 1 143 . 1 1 18 18 GLU H H 18 8.640 8.640 8.415 0.225 17919 58463 1 143 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.450 -0.309 17919 58464 1 143 . 1 1 19 19 PRO C C 19 175.310 175.310 177.534 -2.224 17919 58465 1 143 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.222 0.248 17919 58466 1 143 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.025 -0.075 17919 58467 1 143 . 1 1 20 20 SER N N 20 103.400 103.400 111.102 -7.702 17919 58468 1 143 . 1 1 20 20 SER HA H 20 4.370 4.370 4.313 0.057 17919 58469 1 143 . 1 1 20 20 SER C C 20 174.660 174.660 174.546 0.114 17919 58470 1 143 . 1 1 20 20 SER CA C 20 57.400 57.400 59.215 -1.815 17919 58471 1 143 . 1 1 20 20 SER CB C 20 63.370 63.370 62.701 0.669 17919 58472 1 143 . 1 1 20 20 SER H H 20 7.040 7.040 8.034 -0.994 17919 58473 1 143 . 1 1 21 21 ASP N N 21 123.480 123.480 125.004 -1.524 17919 58474 1 143 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.623 0.072 17919 58475 1 143 . 1 1 21 21 ASP C C 21 176.360 176.360 175.588 0.772 17919 58476 1 143 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.465 0.235 17919 58477 1 143 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.039 -0.239 17919 58478 1 143 . 1 1 21 21 ASP H H 21 8.030 8.030 7.797 0.233 17919 58479 1 143 . 1 1 22 22 THR N N 22 108.800 108.800 111.970 -3.170 17919 58480 1 143 . 1 1 22 22 THR HA H 22 4.920 4.920 4.663 0.257 17919 58481 1 143 . 1 1 22 22 THR C C 22 176.750 176.750 175.981 0.769 17919 58482 1 143 . 1 1 22 22 THR CA C 22 59.690 59.690 60.390 -0.700 17919 58483 1 143 . 1 1 22 22 THR CB C 22 71.200 71.200 71.080 0.120 17919 58484 1 143 . 1 1 22 22 THR H H 22 7.900 7.900 8.126 -0.226 17919 58485 1 143 . 1 1 23 23 ILE N N 23 121.190 121.190 122.747 -1.557 17919 58486 1 143 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.783 -0.126 17919 58487 1 143 . 1 1 23 23 ILE C C 23 179.040 179.040 177.637 1.403 17919 58488 1 143 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.403 -0.143 17919 58489 1 143 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.182 -1.832 17919 58490 1 143 . 1 1 23 23 ILE H H 23 8.560 8.560 8.421 0.139 17919 58491 1 143 . 1 1 24 24 GLU N N 24 120.830 120.830 120.811 0.019 17919 58492 1 143 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.856 0.061 17919 58493 1 143 . 1 1 24 24 GLU C C 24 178.640 178.640 178.395 0.245 17919 58494 1 143 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.483 -0.262 17919 58495 1 143 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.436 -1.156 17919 58496 1 143 . 1 1 24 24 GLU H H 24 9.760 9.760 8.090 1.670 17919 58497 1 143 . 1 1 25 25 ASN N N 25 120.570 120.570 117.848 2.722 17919 58498 1 143 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.521 0.004 17919 58499 1 143 . 1 1 25 25 ASN C C 25 178.380 178.380 177.818 0.562 17919 58500 1 143 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.752 0.309 17919 58501 1 143 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.251 0.199 17919 58502 1 143 . 1 1 25 25 ASN H H 25 7.920 7.920 7.564 0.356 17919 58503 1 143 . 1 1 26 26 VAL N N 26 121.710 121.710 120.867 0.843 17919 58504 1 143 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.586 -0.189 17919 58505 1 143 . 1 1 26 26 VAL C C 26 177.950 177.950 177.997 -0.047 17919 58506 1 143 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.849 0.811 17919 58507 1 143 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.547 -0.708 17919 58508 1 143 . 1 1 26 26 VAL H H 26 8.070 8.070 8.389 -0.319 17919 58509 1 143 . 1 1 27 27 LYS N N 27 118.860 118.860 119.632 -0.772 17919 58510 1 143 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.197 0.383 17919 58511 1 143 . 1 1 27 27 LYS C C 27 180.550 180.550 178.866 1.684 17919 58512 1 143 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.472 -0.222 17919 58513 1 143 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.386 1.344 17919 58514 1 143 . 1 1 27 27 LYS H H 27 8.560 8.560 8.212 0.348 17919 58515 1 143 . 1 1 28 28 ALA N N 28 123.440 123.440 120.589 2.851 17919 58516 1 143 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.056 0.104 17919 58517 1 143 . 1 1 28 28 ALA C C 28 180.300 180.300 178.939 1.361 17919 58518 1 143 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.062 0.308 17919 58519 1 143 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.471 -0.761 17919 58520 1 143 . 1 1 28 28 ALA H H 28 8.060 8.060 8.332 -0.272 17919 58521 1 143 . 1 1 29 29 LYS N N 29 119.940 119.940 119.273 0.667 17919 58522 1 143 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.106 0.101 17919 58523 1 143 . 1 1 29 29 LYS C C 29 180.320 180.320 179.059 1.261 17919 58524 1 143 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.189 0.461 17919 58525 1 143 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.376 0.914 17919 58526 1 143 . 1 1 29 29 LYS H H 29 7.850 7.850 7.282 0.568 17919 58527 1 143 . 1 1 30 30 ILE N N 30 121.080 121.080 120.737 0.343 17919 58528 1 143 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.626 -0.119 17919 58529 1 143 . 1 1 30 30 ILE C C 30 178.310 178.310 177.600 0.710 17919 58530 1 143 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.428 0.722 17919 58531 1 143 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.065 -0.265 17919 58532 1 143 . 1 1 30 30 ILE H H 30 8.280 8.280 7.879 0.401 17919 58533 1 143 . 1 1 31 31 GLN N N 31 123.490 123.490 119.528 3.962 17919 58534 1 143 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.125 -0.296 17919 58535 1 143 . 1 1 31 31 GLN C C 31 178.890 178.890 178.613 0.277 17919 58536 1 143 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.075 0.925 17919 58537 1 143 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.363 -0.643 17919 58538 1 143 . 1 1 31 31 GLN H H 31 8.580 8.580 8.249 0.331 17919 58539 1 143 . 1 1 32 32 ASP N N 32 119.360 119.360 120.416 -1.056 17919 58540 1 143 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.458 -0.104 17919 58541 1 143 . 1 1 32 32 ASP C C 32 177.250 177.250 178.032 -0.782 17919 58542 1 143 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.609 0.581 17919 58543 1 143 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.881 -0.301 17919 58544 1 143 . 1 1 32 32 ASP H H 32 8.010 8.010 7.737 0.273 17919 58545 1 143 . 1 1 33 33 LYS N N 33 115.130 115.130 117.694 -2.564 17919 58546 1 143 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.317 0.020 17919 58547 1 143 . 1 1 33 33 LYS C C 33 177.870 177.870 177.598 0.272 17919 58548 1 143 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.668 0.382 17919 58549 1 143 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.342 0.828 17919 58550 1 143 . 1 1 33 33 LYS H H 33 7.430 7.430 7.697 -0.267 17919 58551 1 143 . 1 1 34 34 GLU N N 34 113.870 113.870 114.624 -0.754 17919 58552 1 143 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.530 0.095 17919 58553 1 143 . 1 1 34 34 GLU C C 34 177.840 177.840 176.947 0.893 17919 58554 1 143 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.037 -0.867 17919 58555 1 143 . 1 1 34 34 GLU CB C 34 32.660 32.660 32.227 0.433 17919 58556 1 143 . 1 1 34 34 GLU H H 34 8.740 8.740 8.191 0.549 17919 58557 1 143 . 1 1 35 35 GLY N N 35 108.650 108.650 108.937 -0.287 17919 58558 1 143 . 1 1 35 35 GLY C C 35 173.960 173.960 174.733 -0.773 17919 58559 1 143 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.930 0.150 17919 58560 1 143 . 1 1 35 35 GLY H H 35 8.530 8.530 7.852 0.678 17919 58561 1 143 . 1 1 36 36 ILE N N 36 119.880 119.880 118.666 1.214 17919 58562 1 143 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.462 -0.017 17919 58563 1 143 . 1 1 36 36 ILE C C 36 173.590 173.590 174.375 -0.785 17919 58564 1 143 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.806 -0.056 17919 58565 1 143 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.042 2.538 17919 58566 1 143 . 1 1 36 36 ILE H H 36 6.150 6.150 7.630 -1.480 17919 58567 1 143 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.815 -0.181 17919 58568 1 143 . 1 1 37 37 PRO C C 37 176.940 176.940 176.483 0.457 17919 58569 1 143 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.243 0.417 17919 58570 1 143 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.469 0.381 17919 58571 1 143 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.165 -0.048 17919 58572 1 143 . 1 1 38 38 PRO C C 38 178.320 178.320 178.762 -0.442 17919 58573 1 143 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.944 0.316 17919 58574 1 143 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.844 1.046 17919 58575 1 143 . 1 1 39 39 ASP N N 39 113.380 113.380 115.982 -2.602 17919 58576 1 143 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.330 0.100 17919 58577 1 143 . 1 1 39 39 ASP C C 39 177.090 177.090 177.814 -0.724 17919 58578 1 143 . 1 1 39 39 ASP CA C 39 55.640 55.640 57.106 -1.466 17919 58579 1 143 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.532 -0.992 17919 58580 1 143 . 1 1 39 39 ASP H H 39 8.550 8.550 8.608 -0.058 17919 58581 1 143 . 1 1 40 40 GLN N N 40 116.780 116.780 115.496 1.284 17919 58582 1 143 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.458 0.006 17919 58583 1 143 . 1 1 40 40 GLN C C 40 175.380 175.380 175.620 -0.240 17919 58584 1 143 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.096 0.544 17919 58585 1 143 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.333 0.807 17919 58586 1 143 . 1 1 40 40 GLN H H 40 7.820 7.820 7.877 -0.057 17919 58587 1 143 . 1 1 41 41 GLN N N 41 117.720 117.720 119.892 -2.172 17919 58588 1 143 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.452 -0.208 17919 58589 1 143 . 1 1 41 41 GLN C C 41 176.300 176.300 175.234 1.066 17919 58590 1 143 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.402 0.068 17919 58591 1 143 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.908 1.742 17919 58592 1 143 . 1 1 41 41 GLN H H 41 7.480 7.480 7.412 0.068 17919 58593 1 143 . 1 1 42 42 ARG N N 42 122.680 122.680 122.906 -0.226 17919 58594 1 143 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.723 -0.223 17919 58595 1 143 . 1 1 42 42 ARG C C 42 174.050 174.050 174.182 -0.132 17919 58596 1 143 . 1 1 42 42 ARG CA C 42 55.050 55.050 53.848 1.202 17919 58597 1 143 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.627 -1.877 17919 58598 1 143 . 1 1 42 42 ARG H H 42 8.530 8.530 8.255 0.275 17919 58599 1 143 . 1 1 43 43 LEU N N 43 124.040 124.040 126.406 -2.366 17919 58600 1 143 . 1 1 43 43 LEU C C 43 175.290 175.290 176.161 -0.871 17919 58601 1 143 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.901 -0.922 17919 58602 1 143 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.208 2.582 17919 58603 1 143 . 1 1 43 43 LEU H H 43 8.820 8.820 8.764 0.056 17919 58604 1 143 . 1 1 44 44 ILE N N 44 121.920 121.920 123.431 -1.511 17919 58605 1 143 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.985 0.007 17919 58606 1 143 . 1 1 44 44 ILE C C 44 176.060 176.060 175.024 1.036 17919 58607 1 143 . 1 1 44 44 ILE CA C 44 58.980 58.980 58.774 0.206 17919 58608 1 143 . 1 1 44 44 ILE CB C 44 41.420 41.420 39.115 2.305 17919 58609 1 143 . 1 1 44 44 ILE H H 44 9.030 9.030 8.392 0.638 17919 58610 1 143 . 1 1 45 45 PHE N N 45 125.390 125.390 127.652 -2.262 17919 58611 1 143 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.842 0.203 17919 58612 1 143 . 1 1 45 45 PHE C C 45 174.470 174.470 173.923 0.547 17919 58613 1 143 . 1 1 45 45 PHE CA C 45 57.020 57.020 57.551 -0.531 17919 58614 1 143 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.661 1.099 17919 58615 1 143 . 1 1 45 45 PHE H H 45 8.830 8.830 8.914 -0.084 17919 58616 1 143 . 1 1 46 46 ALA N N 46 132.200 132.200 129.654 2.546 17919 58617 1 143 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.633 0.057 17919 58618 1 143 . 1 1 46 46 ALA C C 46 177.290 177.290 177.602 -0.312 17919 58619 1 143 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.624 -0.084 17919 58620 1 143 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.102 0.468 17919 58621 1 143 . 1 1 46 46 ALA H H 46 8.810 8.810 8.979 -0.169 17919 58622 1 143 . 1 1 47 47 GLY N N 47 102.340 102.340 104.010 -1.670 17919 58623 1 143 . 1 1 47 47 GLY C C 47 173.810 173.810 173.813 -0.003 17919 58624 1 143 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.754 0.596 17919 58625 1 143 . 1 1 47 47 GLY H H 47 8.130 8.130 8.477 -0.347 17919 58626 1 143 . 1 1 48 48 LYS N N 48 121.570 121.570 120.883 0.687 17919 58627 1 143 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.589 0.033 17919 58628 1 143 . 1 1 48 48 LYS C C 48 174.700 174.700 174.642 0.058 17919 58629 1 143 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.756 -0.206 17919 58630 1 143 . 1 1 48 48 LYS CB C 48 34.530 34.530 35.171 -0.641 17919 58631 1 143 . 1 1 48 48 LYS H H 48 7.980 7.980 7.670 0.310 17919 58632 1 143 . 1 1 49 49 GLN N N 49 122.410 122.410 125.987 -3.577 17919 58633 1 143 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.527 0.033 17919 58634 1 143 . 1 1 49 49 GLN C C 49 175.670 175.670 175.637 0.033 17919 58635 1 143 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.285 -0.545 17919 58636 1 143 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.207 -0.207 17919 58637 1 143 . 1 1 49 49 GLN H H 49 8.600 8.600 8.619 -0.019 17919 58638 1 143 . 1 1 50 50 LEU N N 50 125.520 125.520 128.626 -3.106 17919 58639 1 143 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.109 -0.019 17919 58640 1 143 . 1 1 50 50 LEU C C 50 176.660 176.660 176.597 0.063 17919 58641 1 143 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.997 0.243 17919 58642 1 143 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.222 0.348 17919 58643 1 143 . 1 1 50 50 LEU H H 50 8.530 8.530 8.037 0.493 17919 58644 1 143 . 1 1 51 51 GLU N N 51 122.940 122.940 124.603 -1.663 17919 58645 1 143 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.413 0.075 17919 58646 1 143 . 1 1 51 51 GLU C C 51 175.870 175.870 176.952 -1.082 17919 58647 1 143 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.747 0.213 17919 58648 1 143 . 1 1 51 51 GLU CB C 51 31.570 31.570 30.616 0.954 17919 58649 1 143 . 1 1 51 51 GLU H H 51 8.400 8.400 8.261 0.139 17919 58650 1 143 . 1 1 52 52 ASP N N 52 120.030 120.030 124.306 -4.276 17919 58651 1 143 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.462 -0.103 17919 58652 1 143 . 1 1 52 52 ASP C C 52 177.330 177.330 177.408 -0.078 17919 58653 1 143 . 1 1 52 52 ASP CA C 52 56.960 56.960 56.803 0.157 17919 58654 1 143 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.892 -0.042 17919 58655 1 143 . 1 1 52 52 ASP H H 52 8.160 8.160 8.742 -0.582 17919 58656 1 143 . 1 1 53 53 GLY N N 53 106.660 106.660 104.095 2.565 17919 58657 1 143 . 1 1 53 53 GLY C C 53 174.870 174.870 174.372 0.498 17919 58658 1 143 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.719 0.451 17919 58659 1 143 . 1 1 53 53 GLY H H 53 9.390 9.390 8.397 0.993 17919 58660 1 143 . 1 1 54 54 ARG N N 54 119.050 119.050 120.193 -1.143 17919 58661 1 143 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.654 0.041 17919 58662 1 143 . 1 1 54 54 ARG C C 54 175.350 175.350 175.380 -0.030 17919 58663 1 143 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.373 0.017 17919 58664 1 143 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.865 -0.215 17919 58665 1 143 . 1 1 54 54 ARG H H 54 7.460 7.460 7.710 -0.250 17919 58666 1 143 . 1 1 55 55 THR N N 55 108.400 108.400 112.557 -4.157 17919 58667 1 143 . 1 1 55 55 THR HA H 55 5.240 5.240 4.845 0.395 17919 58668 1 143 . 1 1 55 55 THR C C 55 176.560 176.560 176.608 -0.048 17919 58669 1 143 . 1 1 55 55 THR CA C 55 59.690 59.690 60.036 -0.346 17919 58670 1 143 . 1 1 55 55 THR CB C 55 72.260 72.260 70.514 1.746 17919 58671 1 143 . 1 1 55 55 THR H H 55 8.730 8.730 8.353 0.377 17919 58672 1 143 . 1 1 56 56 LEU N N 56 117.920 117.920 121.032 -3.112 17919 58673 1 143 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.097 -0.037 17919 58674 1 143 . 1 1 56 56 LEU C C 56 180.810 180.810 178.675 2.135 17919 58675 1 143 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.270 0.440 17919 58676 1 143 . 1 1 56 56 LEU CB C 56 40.370 40.370 40.920 -0.551 17919 58677 1 143 . 1 1 56 56 LEU H H 56 8.140 8.140 8.236 -0.096 17919 58678 1 143 . 1 1 57 57 SER N N 57 113.330 113.330 113.848 -0.518 17919 58679 1 143 . 1 1 57 57 SER HA H 57 4.370 4.370 4.180 0.190 17919 58680 1 143 . 1 1 57 57 SER C C 57 178.310 178.310 176.501 1.809 17919 58681 1 143 . 1 1 57 57 SER CA C 57 61.080 61.080 61.353 -0.273 17919 58682 1 143 . 1 1 57 57 SER CB C 57 62.530 62.530 62.463 0.067 17919 58683 1 143 . 1 1 57 57 SER H H 57 8.470 8.470 7.964 0.506 17919 58684 1 143 . 1 1 58 58 ASP N N 58 124.190 124.190 122.200 1.990 17919 58685 1 143 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.360 -0.064 17919 58686 1 143 . 1 1 58 58 ASP C C 58 177.400 177.400 176.144 1.256 17919 58687 1 143 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.218 0.962 17919 58688 1 143 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.398 -0.298 17919 58689 1 143 . 1 1 58 58 ASP H H 58 7.930 7.930 7.706 0.224 17919 58690 1 143 . 1 1 59 59 TYR N N 59 115.510 115.510 116.271 -0.761 17919 58691 1 143 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.825 -0.155 17919 58692 1 143 . 1 1 59 59 TYR C C 59 174.700 174.700 174.632 0.068 17919 58693 1 143 . 1 1 59 59 TYR CA C 59 58.250 58.250 55.909 2.341 17919 58694 1 143 . 1 1 59 59 TYR CB C 59 40.070 40.070 37.889 2.181 17919 58695 1 143 . 1 1 59 59 TYR H H 59 7.250 7.250 7.297 -0.047 17919 58696 1 143 . 1 1 60 60 ASN N N 60 115.900 115.900 118.620 -2.720 17919 58697 1 143 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.352 0.003 17919 58698 1 143 . 1 1 60 60 ASN C C 60 174.340 174.340 174.596 -0.256 17919 58699 1 143 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.419 -0.299 17919 58700 1 143 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.953 -0.543 17919 58701 1 143 . 1 1 60 60 ASN H H 60 8.150 8.150 7.915 0.235 17919 58702 1 143 . 1 1 61 61 ILE N N 61 118.600 118.600 119.587 -0.987 17919 58703 1 143 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.865 -0.472 17919 58704 1 143 . 1 1 61 61 ILE C C 61 174.610 174.610 174.989 -0.379 17919 58705 1 143 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.815 0.605 17919 58706 1 143 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.019 -0.279 17919 58707 1 143 . 1 1 61 61 ILE H H 61 7.250 7.250 7.776 -0.526 17919 58708 1 143 . 1 1 62 62 GLN N N 62 124.740 124.740 126.941 -2.201 17919 58709 1 143 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.571 -0.065 17919 58710 1 143 . 1 1 62 62 GLN C C 62 175.970 175.970 174.721 1.249 17919 58711 1 143 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.987 -0.327 17919 58712 1 143 . 1 1 62 62 GLN CB C 62 31.650 31.650 33.065 -1.415 17919 58713 1 143 . 1 1 62 62 GLN H H 62 7.610 7.610 8.040 -0.430 17919 58714 1 143 . 1 1 63 63 LYS N N 63 120.300 120.300 121.371 -1.071 17919 58715 1 143 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.894 0.107 17919 58716 1 143 . 1 1 63 63 LYS C C 63 175.810 175.810 177.313 -1.503 17919 58717 1 143 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.694 -0.904 17919 58718 1 143 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.408 0.242 17919 58719 1 143 . 1 1 63 63 LYS H H 63 8.490 8.490 8.569 -0.078 17919 58720 1 143 . 1 1 64 64 GLU N N 64 113.950 113.950 120.940 -6.990 17919 58721 1 143 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.845 -0.380 17919 58722 1 143 . 1 1 64 64 GLU C C 64 175.250 175.250 175.726 -0.476 17919 58723 1 143 . 1 1 64 64 GLU CA C 64 57.890 57.890 58.171 -0.281 17919 58724 1 143 . 1 1 64 64 GLU CB C 64 25.900 25.900 27.787 -1.887 17919 58725 1 143 . 1 1 64 64 GLU H H 64 9.280 9.280 8.581 0.699 17919 58726 1 143 . 1 1 65 65 SER N N 65 114.730 114.730 115.084 -0.354 17919 58727 1 143 . 1 1 65 65 SER HA H 65 4.640 4.640 4.565 0.075 17919 58728 1 143 . 1 1 65 65 SER C C 65 172.160 172.160 173.772 -1.612 17919 58729 1 143 . 1 1 65 65 SER CA C 65 60.890 60.890 59.351 1.539 17919 58730 1 143 . 1 1 65 65 SER CB C 65 64.910 64.910 64.189 0.721 17919 58731 1 143 . 1 1 65 65 SER H H 65 7.670 7.670 7.816 -0.146 17919 58732 1 143 . 1 1 66 66 THR N N 66 117.110 117.110 120.984 -3.874 17919 58733 1 143 . 1 1 66 66 THR HA H 66 5.270 5.270 4.971 0.299 17919 58734 1 143 . 1 1 66 66 THR C C 66 173.950 173.950 173.694 0.256 17919 58735 1 143 . 1 1 66 66 THR CA C 66 62.340 62.340 61.886 0.454 17919 58736 1 143 . 1 1 66 66 THR CB C 66 70.080 70.080 70.174 -0.093 17919 58737 1 143 . 1 1 66 66 THR H H 66 8.730 8.730 8.369 0.361 17919 58738 1 143 . 1 1 67 67 LEU N N 67 127.110 127.110 127.847 -0.737 17919 58739 1 143 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.994 0.066 17919 58740 1 143 . 1 1 67 67 LEU C C 67 175.770 175.770 175.442 0.328 17919 58741 1 143 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.860 0.040 17919 58742 1 143 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.872 0.388 17919 58743 1 143 . 1 1 67 67 LEU H H 67 9.410 9.410 8.735 0.675 17919 58744 1 143 . 1 1 68 68 HIS N N 68 118.380 118.380 119.388 -1.008 17919 58745 1 143 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.740 -0.500 17919 58746 1 143 . 1 1 68 68 HIS C C 68 173.150 173.150 173.542 -0.392 17919 58747 1 143 . 1 1 68 68 HIS CA C 68 55.000 55.000 53.532 1.468 17919 58748 1 143 . 1 1 68 68 HIS CB C 68 30.530 30.530 34.276 -3.746 17919 58749 1 143 . 1 1 68 68 HIS H H 68 9.230 9.230 8.910 0.320 17919 58750 1 143 . 1 1 69 69 LEU N N 69 124.460 124.460 122.892 1.568 17919 58751 1 143 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.868 0.322 17919 58752 1 143 . 1 1 69 69 LEU C C 69 175.270 175.270 174.015 1.255 17919 58753 1 143 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.966 -0.076 17919 58754 1 143 . 1 1 69 69 LEU CB C 69 44.380 44.380 45.464 -1.084 17919 58755 1 143 . 1 1 69 69 LEU H H 69 8.340 8.340 7.305 1.035 17919 58756 1 143 . 1 1 70 70 VAL N N 70 126.940 126.940 126.465 0.475 17919 58757 1 143 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.238 0.112 17919 58758 1 143 . 1 1 70 70 VAL C C 70 174.000 174.000 175.009 -1.009 17919 58759 1 143 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.880 -0.080 17919 58760 1 143 . 1 1 70 70 VAL CB C 70 34.910 34.910 32.962 1.948 17919 58761 1 143 . 1 1 70 70 VAL H H 70 9.200 9.200 8.938 0.262 17919 58762 1 143 . 1 1 71 71 LEU N N 71 123.130 123.130 129.150 -6.020 17919 58763 1 143 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.187 0.873 17919 58764 1 143 . 1 1 71 71 LEU C C 71 177.830 177.830 177.653 0.177 17919 58765 1 143 . 1 1 71 71 LEU CA C 71 53.940 53.940 55.066 -1.126 17919 58766 1 143 . 1 1 71 71 LEU CB C 71 42.850 42.850 41.612 1.238 17919 58767 1 143 . 1 1 71 71 LEU H H 71 8.120 8.120 8.838 -0.718 17919 58768 1 143 . 1 1 72 72 ARG N N 72 123.490 123.490 128.133 -4.643 17919 58769 1 143 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.492 -0.191 17919 58770 1 143 . 1 1 72 72 ARG C C 72 175.350 175.350 175.142 0.208 17919 58771 1 143 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.391 0.219 17919 58772 1 143 . 1 1 72 72 ARG CB C 72 31.350 31.350 28.913 2.437 17919 58773 1 143 . 1 1 72 72 ARG H H 72 8.580 8.580 8.474 0.106 17919 58774 1 144 . 1 1 2 2 GLN N N 2 123.220 123.220 118.890 4.330 17919 58775 1 144 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.249 -0.000 17919 58776 1 144 . 1 1 2 2 GLN C C 2 175.920 175.920 174.805 1.115 17919 58777 1 144 . 1 1 2 2 GLN CA C 2 55.080 55.080 55.032 0.048 17919 58778 1 144 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.709 0.051 17919 58779 1 144 . 1 1 2 2 GLN H H 2 8.900 8.900 8.203 0.697 17919 58780 1 144 . 1 1 3 3 ILE N N 3 115.340 115.340 117.201 -1.861 17919 58781 1 144 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.498 -0.285 17919 58782 1 144 . 1 1 3 3 ILE C C 3 172.450 172.450 173.370 -0.920 17919 58783 1 144 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.515 0.055 17919 58784 1 144 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.666 0.544 17919 58785 1 144 . 1 1 3 3 ILE H H 3 8.320 8.320 7.754 0.566 17919 58786 1 144 . 1 1 4 4 PHE N N 4 118.110 118.110 121.503 -3.393 17919 58787 1 144 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.469 0.161 17919 58788 1 144 . 1 1 4 4 PHE C C 4 175.320 175.320 175.328 -0.008 17919 58789 1 144 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.576 -0.366 17919 58790 1 144 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.202 -0.722 17919 58791 1 144 . 1 1 4 4 PHE H H 4 8.610 8.610 8.387 0.223 17919 58792 1 144 . 1 1 5 5 VAL N N 5 121.000 121.000 119.371 1.629 17919 58793 1 144 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.904 -0.179 17919 58794 1 144 . 1 1 5 5 VAL C C 5 174.870 174.870 174.270 0.600 17919 58795 1 144 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.121 -0.501 17919 58796 1 144 . 1 1 5 5 VAL CB C 5 34.230 34.230 35.082 -0.852 17919 58797 1 144 . 1 1 5 5 VAL H H 5 9.300 9.300 8.570 0.730 17919 58798 1 144 . 1 1 6 6 LYS N N 6 127.520 127.520 128.035 -0.515 17919 58799 1 144 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.388 -0.021 17919 58800 1 144 . 1 1 6 6 LYS C C 6 177.140 177.140 176.353 0.787 17919 58801 1 144 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.384 0.136 17919 58802 1 144 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.971 -0.921 17919 58803 1 144 . 1 1 6 6 LYS H H 6 8.820 8.820 8.386 0.434 17919 58804 1 144 . 1 1 7 7 THR N N 7 115.400 115.400 116.740 -1.340 17919 58805 1 144 . 1 1 7 7 THR HA H 7 4.970 4.970 4.589 0.381 17919 58806 1 144 . 1 1 7 7 THR C C 7 176.910 176.910 175.851 1.059 17919 58807 1 144 . 1 1 7 7 THR CA C 7 60.470 60.470 60.761 -0.291 17919 58808 1 144 . 1 1 7 7 THR CB C 7 70.630 70.630 70.621 0.009 17919 58809 1 144 . 1 1 7 7 THR H H 7 8.730 8.730 8.635 0.095 17919 58810 1 144 . 1 1 8 8 LEU N N 8 121.330 121.330 119.766 1.564 17919 58811 1 144 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.333 -0.023 17919 58812 1 144 . 1 1 8 8 LEU C C 8 178.800 178.800 178.591 0.209 17919 58813 1 144 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.251 0.329 17919 58814 1 144 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.948 0.022 17919 58815 1 144 . 1 1 8 8 LEU H H 8 9.100 9.100 8.875 0.225 17919 58816 1 144 . 1 1 9 9 THR N N 9 105.590 105.590 109.223 -3.633 17919 58817 1 144 . 1 1 9 9 THR HA H 9 4.428 4.428 4.301 0.127 17919 58818 1 144 . 1 1 9 9 THR C C 9 175.520 175.520 174.925 0.595 17919 58819 1 144 . 1 1 9 9 THR CA C 9 61.400 61.400 61.863 -0.463 17919 58820 1 144 . 1 1 9 9 THR CB C 9 69.140 69.140 68.827 0.313 17919 58821 1 144 . 1 1 9 9 THR H H 9 7.630 7.630 8.054 -0.424 17919 58822 1 144 . 1 1 10 10 GLY N N 10 108.890 108.890 111.418 -2.528 17919 58823 1 144 . 1 1 10 10 GLY C C 10 174.070 174.070 174.091 -0.021 17919 58824 1 144 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.367 0.093 17919 58825 1 144 . 1 1 10 10 GLY H H 10 7.810 7.810 7.648 0.162 17919 58826 1 144 . 1 1 11 11 LYS N N 11 121.600 121.600 120.302 1.298 17919 58827 1 144 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.282 0.079 17919 58828 1 144 . 1 1 11 11 LYS C C 11 175.940 175.940 175.605 0.335 17919 58829 1 144 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.615 -0.335 17919 58830 1 144 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.647 -0.447 17919 58831 1 144 . 1 1 11 11 LYS H H 11 7.280 7.280 7.513 -0.233 17919 58832 1 144 . 1 1 12 12 THR N N 12 120.440 120.440 119.567 0.873 17919 58833 1 144 . 1 1 12 12 THR HA H 12 5.046 5.046 5.376 -0.330 17919 58834 1 144 . 1 1 12 12 THR C C 12 174.320 174.320 174.698 -0.378 17919 58835 1 144 . 1 1 12 12 THR CA C 12 62.390 62.390 60.905 1.485 17919 58836 1 144 . 1 1 12 12 THR CB C 12 69.910 69.910 70.248 -0.338 17919 58837 1 144 . 1 1 12 12 THR H H 12 8.650 8.650 8.258 0.392 17919 58838 1 144 . 1 1 13 13 ILE N N 13 127.110 127.110 124.941 2.169 17919 58839 1 144 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.649 -0.105 17919 58840 1 144 . 1 1 13 13 ILE C C 13 175.220 175.220 175.013 0.207 17919 58841 1 144 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.033 -0.053 17919 58842 1 144 . 1 1 13 13 ILE CB C 13 40.950 40.950 39.091 1.859 17919 58843 1 144 . 1 1 13 13 ILE H H 13 9.450 9.450 9.011 0.439 17919 58844 1 144 . 1 1 14 14 THR N N 14 121.520 121.520 119.993 1.527 17919 58845 1 144 . 1 1 14 14 THR HA H 14 4.964 4.964 4.979 -0.015 17919 58846 1 144 . 1 1 14 14 THR C C 14 173.790 173.790 174.173 -0.383 17919 58847 1 144 . 1 1 14 14 THR CA C 14 61.940 61.940 61.868 0.072 17919 58848 1 144 . 1 1 14 14 THR CB C 14 69.650 69.650 69.750 -0.100 17919 58849 1 144 . 1 1 14 14 THR H H 14 8.710 8.710 8.275 0.435 17919 58850 1 144 . 1 1 15 15 LEU N N 15 124.800 124.800 126.246 -1.446 17919 58851 1 144 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.666 0.114 17919 58852 1 144 . 1 1 15 15 LEU C C 15 174.670 174.670 175.885 -1.215 17919 58853 1 144 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.787 -0.957 17919 58854 1 144 . 1 1 15 15 LEU CB C 15 47.070 47.070 43.644 3.426 17919 58855 1 144 . 1 1 15 15 LEU H H 15 8.710 8.710 7.978 0.732 17919 58856 1 144 . 1 1 16 16 GLU N N 16 122.160 122.160 122.421 -0.261 17919 58857 1 144 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.885 0.032 17919 58858 1 144 . 1 1 16 16 GLU C C 16 175.860 175.860 176.539 -0.679 17919 58859 1 144 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.904 -1.084 17919 58860 1 144 . 1 1 16 16 GLU CB C 16 29.450 29.450 29.042 0.408 17919 58861 1 144 . 1 1 16 16 GLU H H 16 8.140 8.140 8.699 -0.559 17919 58862 1 144 . 1 1 17 17 VAL N N 17 117.210 117.210 119.848 -2.638 17919 58863 1 144 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.653 0.061 17919 58864 1 144 . 1 1 17 17 VAL C C 17 174.160 174.160 175.257 -1.097 17919 58865 1 144 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.130 -0.701 17919 58866 1 144 . 1 1 17 17 VAL CB C 17 36.400 36.400 34.460 1.940 17919 58867 1 144 . 1 1 17 17 VAL H H 17 8.900 8.900 7.508 1.392 17919 58868 1 144 . 1 1 18 18 GLU N N 18 118.990 118.990 119.505 -0.515 17919 58869 1 144 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.807 0.272 17919 58870 1 144 . 1 1 18 18 GLU C C 18 176.160 176.160 175.324 0.836 17919 58871 1 144 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.821 -0.101 17919 58872 1 144 . 1 1 18 18 GLU CB C 18 30.310 30.310 32.492 -2.182 17919 58873 1 144 . 1 1 18 18 GLU H H 18 8.640 8.640 8.220 0.420 17919 58874 1 144 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.498 -0.357 17919 58875 1 144 . 1 1 19 19 PRO C C 19 175.310 175.310 176.910 -1.600 17919 58876 1 144 . 1 1 19 19 PRO CA C 19 65.470 65.470 64.658 0.812 17919 58877 1 144 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.331 -0.381 17919 58878 1 144 . 1 1 20 20 SER N N 20 103.400 103.400 109.736 -6.336 17919 58879 1 144 . 1 1 20 20 SER HA H 20 4.370 4.370 4.396 -0.026 17919 58880 1 144 . 1 1 20 20 SER C C 20 174.660 174.660 174.461 0.199 17919 58881 1 144 . 1 1 20 20 SER CA C 20 57.400 57.400 57.669 -0.269 17919 58882 1 144 . 1 1 20 20 SER CB C 20 63.370 63.370 63.126 0.244 17919 58883 1 144 . 1 1 20 20 SER H H 20 7.040 7.040 7.806 -0.766 17919 58884 1 144 . 1 1 21 21 ASP N N 21 123.480 123.480 125.257 -1.777 17919 58885 1 144 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.672 0.023 17919 58886 1 144 . 1 1 21 21 ASP C C 21 176.360 176.360 175.816 0.544 17919 58887 1 144 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.033 0.667 17919 58888 1 144 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.553 -0.753 17919 58889 1 144 . 1 1 21 21 ASP H H 21 8.030 8.030 7.715 0.315 17919 58890 1 144 . 1 1 22 22 THR N N 22 108.800 108.800 113.864 -5.064 17919 58891 1 144 . 1 1 22 22 THR HA H 22 4.920 4.920 4.838 0.082 17919 58892 1 144 . 1 1 22 22 THR C C 22 176.750 176.750 175.877 0.873 17919 58893 1 144 . 1 1 22 22 THR CA C 22 59.690 59.690 60.921 -1.231 17919 58894 1 144 . 1 1 22 22 THR CB C 22 71.200 71.200 70.426 0.774 17919 58895 1 144 . 1 1 22 22 THR H H 22 7.900 7.900 8.343 -0.443 17919 58896 1 144 . 1 1 23 23 ILE N N 23 121.190 121.190 124.467 -3.277 17919 58897 1 144 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.779 -0.122 17919 58898 1 144 . 1 1 23 23 ILE C C 23 179.040 179.040 177.622 1.418 17919 58899 1 144 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.241 0.019 17919 58900 1 144 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.172 -1.822 17919 58901 1 144 . 1 1 23 23 ILE H H 23 8.560 8.560 9.283 -0.723 17919 58902 1 144 . 1 1 24 24 GLU N N 24 120.830 120.830 120.737 0.093 17919 58903 1 144 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.976 -0.059 17919 58904 1 144 . 1 1 24 24 GLU C C 24 178.640 178.640 178.973 -0.333 17919 58905 1 144 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.711 0.509 17919 58906 1 144 . 1 1 24 24 GLU CB C 24 28.280 28.280 28.464 -0.184 17919 58907 1 144 . 1 1 24 24 GLU H H 24 9.760 9.760 7.976 1.784 17919 58908 1 144 . 1 1 25 25 ASN N N 25 120.570 120.570 118.981 1.589 17919 58909 1 144 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.541 -0.016 17919 58910 1 144 . 1 1 25 25 ASN C C 25 178.380 178.380 177.711 0.669 17919 58911 1 144 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.477 0.583 17919 58912 1 144 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.019 0.431 17919 58913 1 144 . 1 1 25 25 ASN H H 25 7.920 7.920 8.195 -0.275 17919 58914 1 144 . 1 1 26 26 VAL N N 26 121.710 121.710 120.030 1.680 17919 58915 1 144 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.710 -0.313 17919 58916 1 144 . 1 1 26 26 VAL C C 26 177.950 177.950 177.595 0.355 17919 58917 1 144 . 1 1 26 26 VAL CA C 26 67.660 67.660 65.740 1.919 17919 58918 1 144 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.762 -0.922 17919 58919 1 144 . 1 1 26 26 VAL H H 26 8.070 8.070 8.200 -0.130 17919 58920 1 144 . 1 1 27 27 LYS N N 27 118.860 118.860 120.550 -1.690 17919 58921 1 144 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.293 0.287 17919 58922 1 144 . 1 1 27 27 LYS C C 27 180.550 180.550 178.689 1.861 17919 58923 1 144 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.507 -0.257 17919 58924 1 144 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.342 1.389 17919 58925 1 144 . 1 1 27 27 LYS H H 27 8.560 8.560 8.472 0.088 17919 58926 1 144 . 1 1 28 28 ALA N N 28 123.440 123.440 122.770 0.670 17919 58927 1 144 . 1 1 28 28 ALA HA H 28 4.160 4.160 3.934 0.226 17919 58928 1 144 . 1 1 28 28 ALA C C 28 180.300 180.300 179.091 1.209 17919 58929 1 144 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.456 -0.086 17919 58930 1 144 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.198 -0.488 17919 58931 1 144 . 1 1 28 28 ALA H H 28 8.060 8.060 8.018 0.042 17919 58932 1 144 . 1 1 29 29 LYS N N 29 119.940 119.940 119.546 0.394 17919 58933 1 144 . 1 1 29 29 LYS HA H 29 4.207 4.207 3.960 0.247 17919 58934 1 144 . 1 1 29 29 LYS C C 29 180.320 180.320 179.134 1.186 17919 58935 1 144 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.584 0.066 17919 58936 1 144 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.175 1.115 17919 58937 1 144 . 1 1 29 29 LYS H H 29 7.850 7.850 7.464 0.386 17919 58938 1 144 . 1 1 30 30 ILE N N 30 121.080 121.080 119.597 1.483 17919 58939 1 144 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.588 -0.081 17919 58940 1 144 . 1 1 30 30 ILE C C 30 178.310 178.310 177.886 0.424 17919 58941 1 144 . 1 1 30 30 ILE CA C 30 66.150 66.150 64.858 1.292 17919 58942 1 144 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.164 -0.364 17919 58943 1 144 . 1 1 30 30 ILE H H 30 8.280 8.280 7.741 0.539 17919 58944 1 144 . 1 1 31 31 GLN N N 31 123.490 123.490 120.001 3.489 17919 58945 1 144 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.888 -0.059 17919 58946 1 144 . 1 1 31 31 GLN C C 31 178.890 178.890 178.536 0.354 17919 58947 1 144 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.394 0.606 17919 58948 1 144 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.448 -0.728 17919 58949 1 144 . 1 1 31 31 GLN H H 31 8.580 8.580 7.867 0.713 17919 58950 1 144 . 1 1 32 32 ASP N N 32 119.360 119.360 120.831 -1.471 17919 58951 1 144 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.368 -0.014 17919 58952 1 144 . 1 1 32 32 ASP C C 32 177.250 177.250 178.385 -1.135 17919 58953 1 144 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.909 0.281 17919 58954 1 144 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.560 0.020 17919 58955 1 144 . 1 1 32 32 ASP H H 32 8.010 8.010 8.462 -0.452 17919 58956 1 144 . 1 1 33 33 LYS N N 33 115.130 115.130 118.090 -2.960 17919 58957 1 144 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.237 0.100 17919 58958 1 144 . 1 1 33 33 LYS C C 33 177.870 177.870 178.078 -0.208 17919 58959 1 144 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.178 -0.128 17919 58960 1 144 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.001 1.169 17919 58961 1 144 . 1 1 33 33 LYS H H 33 7.430 7.430 8.095 -0.665 17919 58962 1 144 . 1 1 34 34 GLU N N 34 113.870 113.870 113.908 -0.038 17919 58963 1 144 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.477 0.148 17919 58964 1 144 . 1 1 34 34 GLU C C 34 177.840 177.840 177.297 0.543 17919 58965 1 144 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.738 -0.568 17919 58966 1 144 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.631 1.029 17919 58967 1 144 . 1 1 34 34 GLU H H 34 8.740 8.740 8.021 0.719 17919 58968 1 144 . 1 1 35 35 GLY N N 35 108.650 108.650 109.327 -0.677 17919 58969 1 144 . 1 1 35 35 GLY C C 35 173.960 173.960 174.261 -0.301 17919 58970 1 144 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.641 0.439 17919 58971 1 144 . 1 1 35 35 GLY H H 35 8.530 8.530 8.295 0.235 17919 58972 1 144 . 1 1 36 36 ILE N N 36 119.880 119.880 121.718 -1.838 17919 58973 1 144 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.350 0.095 17919 58974 1 144 . 1 1 36 36 ILE C C 36 173.590 173.590 173.890 -0.300 17919 58975 1 144 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.666 0.084 17919 58976 1 144 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.726 1.854 17919 58977 1 144 . 1 1 36 36 ILE H H 36 6.150 6.150 7.438 -1.288 17919 58978 1 144 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.737 -0.103 17919 58979 1 144 . 1 1 37 37 PRO C C 37 176.940 176.940 176.144 0.796 17919 58980 1 144 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.305 0.355 17919 58981 1 144 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.377 0.473 17919 58982 1 144 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.124 -0.007 17919 58983 1 144 . 1 1 38 38 PRO C C 38 178.320 178.320 178.517 -0.197 17919 58984 1 144 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.766 0.494 17919 58985 1 144 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.779 1.111 17919 58986 1 144 . 1 1 39 39 ASP N N 39 113.380 113.380 114.569 -1.189 17919 58987 1 144 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.414 0.016 17919 58988 1 144 . 1 1 39 39 ASP C C 39 177.090 177.090 176.752 0.338 17919 58989 1 144 . 1 1 39 39 ASP CA C 39 55.640 55.640 55.641 -0.001 17919 58990 1 144 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.369 -0.829 17919 58991 1 144 . 1 1 39 39 ASP H H 39 8.550 8.550 8.509 0.041 17919 58992 1 144 . 1 1 40 40 GLN N N 40 116.780 116.780 115.803 0.977 17919 58993 1 144 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.253 0.211 17919 58994 1 144 . 1 1 40 40 GLN C C 40 175.380 175.380 175.879 -0.499 17919 58995 1 144 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.311 -0.671 17919 58996 1 144 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.470 0.670 17919 58997 1 144 . 1 1 40 40 GLN H H 40 7.820 7.820 8.021 -0.201 17919 58998 1 144 . 1 1 41 41 GLN N N 41 117.720 117.720 119.113 -1.393 17919 58999 1 144 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.429 -0.185 17919 59000 1 144 . 1 1 41 41 GLN C C 41 176.300 176.300 175.239 1.061 17919 59001 1 144 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.888 0.582 17919 59002 1 144 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.967 1.683 17919 59003 1 144 . 1 1 41 41 GLN H H 41 7.480 7.480 7.308 0.172 17919 59004 1 144 . 1 1 42 42 ARG N N 42 122.680 122.680 124.203 -1.523 17919 59005 1 144 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.630 -0.130 17919 59006 1 144 . 1 1 42 42 ARG C C 42 174.050 174.050 174.363 -0.313 17919 59007 1 144 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.819 0.231 17919 59008 1 144 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.049 -0.299 17919 59009 1 144 . 1 1 42 42 ARG H H 42 8.530 8.530 7.981 0.549 17919 59010 1 144 . 1 1 43 43 LEU N N 43 124.040 124.040 127.847 -3.807 17919 59011 1 144 . 1 1 43 43 LEU C C 43 175.290 175.290 176.281 -0.991 17919 59012 1 144 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.164 -1.185 17919 59013 1 144 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.249 2.541 17919 59014 1 144 . 1 1 43 43 LEU H H 43 8.820 8.820 8.751 0.069 17919 59015 1 144 . 1 1 44 44 ILE N N 44 121.920 121.920 121.803 0.117 17919 59016 1 144 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.985 0.007 17919 59017 1 144 . 1 1 44 44 ILE C C 44 176.060 176.060 174.667 1.393 17919 59018 1 144 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.204 -1.224 17919 59019 1 144 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.125 0.295 17919 59020 1 144 . 1 1 44 44 ILE H H 44 9.030 9.030 8.674 0.356 17919 59021 1 144 . 1 1 45 45 PHE N N 45 125.390 125.390 126.864 -1.474 17919 59022 1 144 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.066 -0.021 17919 59023 1 144 . 1 1 45 45 PHE C C 45 174.470 174.470 174.736 -0.266 17919 59024 1 144 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.058 0.962 17919 59025 1 144 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.476 0.284 17919 59026 1 144 . 1 1 45 45 PHE H H 45 8.830 8.830 8.904 -0.074 17919 59027 1 144 . 1 1 46 46 ALA N N 46 132.200 132.200 126.644 5.556 17919 59028 1 144 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.539 0.151 17919 59029 1 144 . 1 1 46 46 ALA C C 46 177.290 177.290 177.553 -0.263 17919 59030 1 144 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.692 -0.152 17919 59031 1 144 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.258 0.312 17919 59032 1 144 . 1 1 46 46 ALA H H 46 8.810 8.810 8.589 0.221 17919 59033 1 144 . 1 1 47 47 GLY N N 47 102.340 102.340 103.098 -0.758 17919 59034 1 144 . 1 1 47 47 GLY C C 47 173.810 173.810 174.033 -0.223 17919 59035 1 144 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.881 0.469 17919 59036 1 144 . 1 1 47 47 GLY H H 47 8.130 8.130 8.382 -0.252 17919 59037 1 144 . 1 1 48 48 LYS N N 48 121.570 121.570 121.495 0.075 17919 59038 1 144 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.665 -0.043 17919 59039 1 144 . 1 1 48 48 LYS C C 48 174.700 174.700 175.049 -0.349 17919 59040 1 144 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.670 -0.120 17919 59041 1 144 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.830 -0.300 17919 59042 1 144 . 1 1 48 48 LYS H H 48 7.980 7.980 7.907 0.073 17919 59043 1 144 . 1 1 49 49 GLN N N 49 122.410 122.410 124.018 -1.608 17919 59044 1 144 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.694 -0.134 17919 59045 1 144 . 1 1 49 49 GLN C C 49 175.670 175.670 175.713 -0.043 17919 59046 1 144 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.312 0.428 17919 59047 1 144 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.975 -0.975 17919 59048 1 144 . 1 1 49 49 GLN H H 49 8.600 8.600 8.621 -0.021 17919 59049 1 144 . 1 1 50 50 LEU N N 50 125.520 125.520 125.958 -0.438 17919 59050 1 144 . 1 1 50 50 LEU HA H 50 4.090 4.090 3.929 0.161 17919 59051 1 144 . 1 1 50 50 LEU C C 50 176.660 176.660 176.280 0.380 17919 59052 1 144 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.426 -0.186 17919 59053 1 144 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.164 0.406 17919 59054 1 144 . 1 1 50 50 LEU H H 50 8.530 8.530 8.315 0.215 17919 59055 1 144 . 1 1 51 51 GLU N N 51 122.940 122.940 125.489 -2.549 17919 59056 1 144 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.383 0.105 17919 59057 1 144 . 1 1 51 51 GLU C C 51 175.870 175.870 177.015 -1.145 17919 59058 1 144 . 1 1 51 51 GLU CA C 51 55.960 55.960 56.383 -0.423 17919 59059 1 144 . 1 1 51 51 GLU CB C 51 31.570 31.570 30.600 0.970 17919 59060 1 144 . 1 1 51 51 GLU H H 51 8.400 8.400 8.087 0.313 17919 59061 1 144 . 1 1 52 52 ASP N N 52 120.030 120.030 125.498 -5.468 17919 59062 1 144 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.467 -0.108 17919 59063 1 144 . 1 1 52 52 ASP C C 52 177.330 177.330 178.060 -0.730 17919 59064 1 144 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.466 -0.506 17919 59065 1 144 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.828 0.022 17919 59066 1 144 . 1 1 52 52 ASP H H 52 8.160 8.160 8.870 -0.710 17919 59067 1 144 . 1 1 53 53 GLY N N 53 106.660 106.660 107.730 -1.070 17919 59068 1 144 . 1 1 53 53 GLY C C 53 174.870 174.870 174.045 0.825 17919 59069 1 144 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.218 -0.048 17919 59070 1 144 . 1 1 53 53 GLY H H 53 9.390 9.390 8.473 0.917 17919 59071 1 144 . 1 1 54 54 ARG N N 54 119.050 119.050 119.735 -0.685 17919 59072 1 144 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.559 0.136 17919 59073 1 144 . 1 1 54 54 ARG C C 54 175.350 175.350 175.154 0.196 17919 59074 1 144 . 1 1 54 54 ARG CA C 54 54.390 54.390 53.934 0.456 17919 59075 1 144 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.931 -0.281 17919 59076 1 144 . 1 1 54 54 ARG H H 54 7.460 7.460 7.288 0.172 17919 59077 1 144 . 1 1 55 55 THR N N 55 108.400 108.400 112.364 -3.964 17919 59078 1 144 . 1 1 55 55 THR HA H 55 5.240 5.240 4.796 0.444 17919 59079 1 144 . 1 1 55 55 THR C C 55 176.560 176.560 176.097 0.463 17919 59080 1 144 . 1 1 55 55 THR CA C 55 59.690 59.690 60.640 -0.950 17919 59081 1 144 . 1 1 55 55 THR CB C 55 72.260 72.260 70.342 1.918 17919 59082 1 144 . 1 1 55 55 THR H H 55 8.730 8.730 8.763 -0.033 17919 59083 1 144 . 1 1 56 56 LEU N N 56 117.920 117.920 120.875 -2.955 17919 59084 1 144 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.151 -0.091 17919 59085 1 144 . 1 1 56 56 LEU C C 56 180.810 180.810 178.923 1.887 17919 59086 1 144 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.393 0.317 17919 59087 1 144 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.498 -1.128 17919 59088 1 144 . 1 1 56 56 LEU H H 56 8.140 8.140 8.355 -0.215 17919 59089 1 144 . 1 1 57 57 SER N N 57 113.330 113.330 113.780 -0.450 17919 59090 1 144 . 1 1 57 57 SER HA H 57 4.370 4.370 4.110 0.260 17919 59091 1 144 . 1 1 57 57 SER C C 57 178.310 178.310 176.695 1.615 17919 59092 1 144 . 1 1 57 57 SER CA C 57 61.080 61.080 61.494 -0.414 17919 59093 1 144 . 1 1 57 57 SER CB C 57 62.530 62.530 62.552 -0.022 17919 59094 1 144 . 1 1 57 57 SER H H 57 8.470 8.470 8.134 0.336 17919 59095 1 144 . 1 1 58 58 ASP N N 58 124.190 124.190 122.650 1.540 17919 59096 1 144 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.287 0.009 17919 59097 1 144 . 1 1 58 58 ASP C C 58 177.400 177.400 177.088 0.312 17919 59098 1 144 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.695 0.485 17919 59099 1 144 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.390 -0.290 17919 59100 1 144 . 1 1 58 58 ASP H H 58 7.930 7.930 7.821 0.109 17919 59101 1 144 . 1 1 59 59 TYR N N 59 115.510 115.510 115.091 0.419 17919 59102 1 144 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.705 -0.035 17919 59103 1 144 . 1 1 59 59 TYR C C 59 174.700 174.700 174.686 0.014 17919 59104 1 144 . 1 1 59 59 TYR CA C 59 58.250 58.250 56.455 1.795 17919 59105 1 144 . 1 1 59 59 TYR CB C 59 40.070 40.070 37.786 2.284 17919 59106 1 144 . 1 1 59 59 TYR H H 59 7.250 7.250 7.066 0.184 17919 59107 1 144 . 1 1 60 60 ASN N N 60 115.900 115.900 116.272 -0.372 17919 59108 1 144 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.315 0.040 17919 59109 1 144 . 1 1 60 60 ASN C C 60 174.340 174.340 174.279 0.061 17919 59110 1 144 . 1 1 60 60 ASN CA C 60 54.120 54.120 53.980 0.140 17919 59111 1 144 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.069 0.341 17919 59112 1 144 . 1 1 60 60 ASN H H 60 8.150 8.150 7.924 0.226 17919 59113 1 144 . 1 1 61 61 ILE N N 61 118.600 118.600 119.939 -1.339 17919 59114 1 144 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.743 -0.350 17919 59115 1 144 . 1 1 61 61 ILE C C 61 174.610 174.610 175.640 -1.030 17919 59116 1 144 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.496 0.924 17919 59117 1 144 . 1 1 61 61 ILE CB C 61 36.740 36.740 36.280 0.460 17919 59118 1 144 . 1 1 61 61 ILE H H 61 7.250 7.250 7.697 -0.447 17919 59119 1 144 . 1 1 62 62 GLN N N 62 124.740 124.740 125.980 -1.240 17919 59120 1 144 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.333 0.173 17919 59121 1 144 . 1 1 62 62 GLN C C 62 175.970 175.970 175.860 0.110 17919 59122 1 144 . 1 1 62 62 GLN CA C 62 53.660 53.660 54.933 -1.273 17919 59123 1 144 . 1 1 62 62 GLN CB C 62 31.650 31.650 29.968 1.682 17919 59124 1 144 . 1 1 62 62 GLN H H 62 7.610 7.610 7.720 -0.110 17919 59125 1 144 . 1 1 63 63 LYS N N 63 120.300 120.300 119.237 1.063 17919 59126 1 144 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.047 -0.046 17919 59127 1 144 . 1 1 63 63 LYS C C 63 175.810 175.810 177.210 -1.400 17919 59128 1 144 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.397 0.393 17919 59129 1 144 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.228 0.422 17919 59130 1 144 . 1 1 63 63 LYS H H 63 8.490 8.490 8.390 0.100 17919 59131 1 144 . 1 1 64 64 GLU N N 64 113.950 113.950 117.986 -4.036 17919 59132 1 144 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.946 -0.481 17919 59133 1 144 . 1 1 64 64 GLU C C 64 175.250 175.250 175.732 -0.482 17919 59134 1 144 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.658 0.232 17919 59135 1 144 . 1 1 64 64 GLU CB C 64 25.900 25.900 27.840 -1.940 17919 59136 1 144 . 1 1 64 64 GLU H H 64 9.280 9.280 8.795 0.485 17919 59137 1 144 . 1 1 65 65 SER N N 65 114.730 114.730 114.544 0.186 17919 59138 1 144 . 1 1 65 65 SER HA H 65 4.640 4.640 4.675 -0.035 17919 59139 1 144 . 1 1 65 65 SER C C 65 172.160 172.160 174.159 -1.999 17919 59140 1 144 . 1 1 65 65 SER CA C 65 60.890 60.890 59.082 1.808 17919 59141 1 144 . 1 1 65 65 SER CB C 65 64.910 64.910 64.444 0.466 17919 59142 1 144 . 1 1 65 65 SER H H 65 7.670 7.670 7.546 0.124 17919 59143 1 144 . 1 1 66 66 THR N N 66 117.110 117.110 117.916 -0.806 17919 59144 1 144 . 1 1 66 66 THR HA H 66 5.270 5.270 5.207 0.063 17919 59145 1 144 . 1 1 66 66 THR C C 66 173.950 173.950 173.975 -0.025 17919 59146 1 144 . 1 1 66 66 THR CA C 66 62.340 62.340 62.091 0.249 17919 59147 1 144 . 1 1 66 66 THR CB C 66 70.080 70.080 70.519 -0.439 17919 59148 1 144 . 1 1 66 66 THR H H 66 8.730 8.730 8.461 0.269 17919 59149 1 144 . 1 1 67 67 LEU N N 67 127.110 127.110 126.584 0.526 17919 59150 1 144 . 1 1 67 67 LEU HA H 67 5.060 5.060 5.132 -0.072 17919 59151 1 144 . 1 1 67 67 LEU C C 67 175.770 175.770 175.711 0.059 17919 59152 1 144 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.219 0.681 17919 59153 1 144 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.658 0.602 17919 59154 1 144 . 1 1 67 67 LEU H H 67 9.410 9.410 8.669 0.741 17919 59155 1 144 . 1 1 68 68 HIS N N 68 118.380 118.380 120.276 -1.896 17919 59156 1 144 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.291 -0.051 17919 59157 1 144 . 1 1 68 68 HIS C C 68 173.150 173.150 174.068 -0.918 17919 59158 1 144 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.422 0.578 17919 59159 1 144 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.814 -2.284 17919 59160 1 144 . 1 1 68 68 HIS H H 68 9.230 9.230 8.897 0.333 17919 59161 1 144 . 1 1 69 69 LEU N N 69 124.460 124.460 127.196 -2.736 17919 59162 1 144 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.004 0.186 17919 59163 1 144 . 1 1 69 69 LEU C C 69 175.270 175.270 174.009 1.261 17919 59164 1 144 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.662 0.228 17919 59165 1 144 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.120 0.260 17919 59166 1 144 . 1 1 69 69 LEU H H 69 8.340 8.340 7.581 0.759 17919 59167 1 144 . 1 1 70 70 VAL N N 70 126.940 126.940 124.892 2.048 17919 59168 1 144 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.265 0.085 17919 59169 1 144 . 1 1 70 70 VAL C C 70 174.000 174.000 174.624 -0.624 17919 59170 1 144 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.140 0.660 17919 59171 1 144 . 1 1 70 70 VAL CB C 70 34.910 34.910 34.651 0.259 17919 59172 1 144 . 1 1 70 70 VAL H H 70 9.200 9.200 8.138 1.062 17919 59173 1 144 . 1 1 71 71 LEU N N 71 123.130 123.130 121.706 1.424 17919 59174 1 144 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.139 -0.079 17919 59175 1 144 . 1 1 71 71 LEU C C 71 177.830 177.830 177.719 0.111 17919 59176 1 144 . 1 1 71 71 LEU CA C 71 53.940 53.940 52.675 1.265 17919 59177 1 144 . 1 1 71 71 LEU CB C 71 42.850 42.850 41.495 1.355 17919 59178 1 144 . 1 1 71 71 LEU H H 71 8.120 8.120 8.327 -0.207 17919 59179 1 144 . 1 1 72 72 ARG N N 72 123.490 123.490 125.117 -1.627 17919 59180 1 144 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.442 -0.141 17919 59181 1 144 . 1 1 72 72 ARG C C 72 175.350 175.350 176.763 -1.413 17919 59182 1 144 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.760 -1.150 17919 59183 1 144 . 1 1 72 72 ARG CB C 72 31.350 31.350 28.158 3.192 17919 59184 1 144 . 1 1 72 72 ARG H H 72 8.580 8.580 8.771 -0.191 17919 59185 1 145 . 1 1 2 2 GLN N N 2 123.220 123.220 120.264 2.956 17919 59186 1 145 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.231 0.018 17919 59187 1 145 . 1 1 2 2 GLN C C 2 175.920 175.920 175.076 0.844 17919 59188 1 145 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.180 0.900 17919 59189 1 145 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.620 0.140 17919 59190 1 145 . 1 1 2 2 GLN H H 2 8.900 8.900 8.567 0.333 17919 59191 1 145 . 1 1 3 3 ILE N N 3 115.340 115.340 117.818 -2.478 17919 59192 1 145 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.022 0.191 17919 59193 1 145 . 1 1 3 3 ILE C C 3 172.450 172.450 173.750 -1.300 17919 59194 1 145 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.588 -0.018 17919 59195 1 145 . 1 1 3 3 ILE CB C 3 42.210 42.210 40.025 2.185 17919 59196 1 145 . 1 1 3 3 ILE H H 3 8.320 8.320 7.557 0.763 17919 59197 1 145 . 1 1 4 4 PHE N N 4 118.110 118.110 120.274 -2.164 17919 59198 1 145 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.147 0.483 17919 59199 1 145 . 1 1 4 4 PHE C C 4 175.320 175.320 175.548 -0.228 17919 59200 1 145 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.818 -0.608 17919 59201 1 145 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.299 0.181 17919 59202 1 145 . 1 1 4 4 PHE H H 4 8.610 8.610 7.666 0.944 17919 59203 1 145 . 1 1 5 5 VAL N N 5 121.000 121.000 120.298 0.702 17919 59204 1 145 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.586 0.139 17919 59205 1 145 . 1 1 5 5 VAL C C 5 174.870 174.870 174.901 -0.031 17919 59206 1 145 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.706 -1.086 17919 59207 1 145 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.434 0.796 17919 59208 1 145 . 1 1 5 5 VAL H H 5 9.300 9.300 9.028 0.272 17919 59209 1 145 . 1 1 6 6 LYS N N 6 127.520 127.520 130.120 -2.600 17919 59210 1 145 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.227 0.140 17919 59211 1 145 . 1 1 6 6 LYS C C 6 177.140 177.140 176.612 0.528 17919 59212 1 145 . 1 1 6 6 LYS CA C 6 54.520 54.520 53.260 1.260 17919 59213 1 145 . 1 1 6 6 LYS CB C 6 35.050 35.050 33.350 1.700 17919 59214 1 145 . 1 1 6 6 LYS H H 6 8.820 8.820 9.231 -0.411 17919 59215 1 145 . 1 1 7 7 THR N N 7 115.400 115.400 119.862 -4.462 17919 59216 1 145 . 1 1 7 7 THR HA H 7 4.970 4.970 4.043 0.927 17919 59217 1 145 . 1 1 7 7 THR C C 7 176.910 176.910 175.992 0.918 17919 59218 1 145 . 1 1 7 7 THR CA C 7 60.470 60.470 61.805 -1.335 17919 59219 1 145 . 1 1 7 7 THR CB C 7 70.630 70.630 69.196 1.434 17919 59220 1 145 . 1 1 7 7 THR H H 7 8.730 8.730 8.705 0.025 17919 59221 1 145 . 1 1 8 8 LEU N N 8 121.330 121.330 123.519 -2.189 17919 59222 1 145 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.077 0.233 17919 59223 1 145 . 1 1 8 8 LEU C C 8 178.800 178.800 178.000 0.800 17919 59224 1 145 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.951 -0.371 17919 59225 1 145 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.199 -0.229 17919 59226 1 145 . 1 1 8 8 LEU H H 8 9.100 9.100 7.838 1.262 17919 59227 1 145 . 1 1 9 9 THR N N 9 105.590 105.590 107.026 -1.436 17919 59228 1 145 . 1 1 9 9 THR HA H 9 4.428 4.428 4.243 0.185 17919 59229 1 145 . 1 1 9 9 THR C C 9 175.520 175.520 175.441 0.079 17919 59230 1 145 . 1 1 9 9 THR CA C 9 61.400 61.400 62.226 -0.826 17919 59231 1 145 . 1 1 9 9 THR CB C 9 69.140 69.140 68.540 0.600 17919 59232 1 145 . 1 1 9 9 THR H H 9 7.630 7.630 7.943 -0.313 17919 59233 1 145 . 1 1 10 10 GLY N N 10 108.890 108.890 110.245 -1.355 17919 59234 1 145 . 1 1 10 10 GLY C C 10 174.070 174.070 173.736 0.334 17919 59235 1 145 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.642 0.818 17919 59236 1 145 . 1 1 10 10 GLY H H 10 7.810 7.810 7.752 0.058 17919 59237 1 145 . 1 1 11 11 LYS N N 11 121.600 121.600 121.889 -0.289 17919 59238 1 145 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.600 -0.239 17919 59239 1 145 . 1 1 11 11 LYS C C 11 175.940 175.940 175.962 -0.022 17919 59240 1 145 . 1 1 11 11 LYS CA C 11 56.280 56.280 54.453 1.827 17919 59241 1 145 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.796 -0.596 17919 59242 1 145 . 1 1 11 11 LYS H H 11 7.280 7.280 7.991 -0.711 17919 59243 1 145 . 1 1 12 12 THR N N 12 120.440 120.440 120.477 -0.037 17919 59244 1 145 . 1 1 12 12 THR HA H 12 5.046 5.046 4.361 0.685 17919 59245 1 145 . 1 1 12 12 THR C C 12 174.320 174.320 174.208 0.112 17919 59246 1 145 . 1 1 12 12 THR CA C 12 62.390 62.390 63.313 -0.923 17919 59247 1 145 . 1 1 12 12 THR CB C 12 69.910 69.910 69.274 0.636 17919 59248 1 145 . 1 1 12 12 THR H H 12 8.650 8.650 8.512 0.138 17919 59249 1 145 . 1 1 13 13 ILE N N 13 127.110 127.110 129.077 -1.967 17919 59250 1 145 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.604 -0.060 17919 59251 1 145 . 1 1 13 13 ILE C C 13 175.220 175.220 174.920 0.300 17919 59252 1 145 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.461 -0.481 17919 59253 1 145 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.585 0.365 17919 59254 1 145 . 1 1 13 13 ILE H H 13 9.450 9.450 8.600 0.850 17919 59255 1 145 . 1 1 14 14 THR N N 14 121.520 121.520 124.071 -2.551 17919 59256 1 145 . 1 1 14 14 THR HA H 14 4.964 4.964 4.681 0.282 17919 59257 1 145 . 1 1 14 14 THR C C 14 173.790 173.790 174.137 -0.347 17919 59258 1 145 . 1 1 14 14 THR CA C 14 61.940 61.940 62.177 -0.237 17919 59259 1 145 . 1 1 14 14 THR CB C 14 69.650 69.650 69.535 0.115 17919 59260 1 145 . 1 1 14 14 THR H H 14 8.710 8.710 8.302 0.408 17919 59261 1 145 . 1 1 15 15 LEU N N 15 124.800 124.800 127.718 -2.918 17919 59262 1 145 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.662 0.118 17919 59263 1 145 . 1 1 15 15 LEU C C 15 174.670 174.670 175.650 -0.980 17919 59264 1 145 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.825 -0.995 17919 59265 1 145 . 1 1 15 15 LEU CB C 15 47.070 47.070 43.455 3.615 17919 59266 1 145 . 1 1 15 15 LEU H H 15 8.710 8.710 8.274 0.436 17919 59267 1 145 . 1 1 16 16 GLU N N 16 122.160 122.160 123.636 -1.476 17919 59268 1 145 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.979 -0.062 17919 59269 1 145 . 1 1 16 16 GLU C C 16 175.860 175.860 176.197 -0.337 17919 59270 1 145 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.638 -0.818 17919 59271 1 145 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.811 -1.361 17919 59272 1 145 . 1 1 16 16 GLU H H 16 8.140 8.140 8.516 -0.376 17919 59273 1 145 . 1 1 17 17 VAL N N 17 117.210 117.210 120.358 -3.148 17919 59274 1 145 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.776 -0.062 17919 59275 1 145 . 1 1 17 17 VAL C C 17 174.160 174.160 174.556 -0.396 17919 59276 1 145 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.444 -1.014 17919 59277 1 145 . 1 1 17 17 VAL CB C 17 36.400 36.400 34.532 1.867 17919 59278 1 145 . 1 1 17 17 VAL H H 17 8.900 8.900 8.948 -0.048 17919 59279 1 145 . 1 1 18 18 GLU N N 18 118.990 118.990 118.230 0.760 17919 59280 1 145 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.809 0.270 17919 59281 1 145 . 1 1 18 18 GLU C C 18 176.160 176.160 175.144 1.016 17919 59282 1 145 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.297 -0.577 17919 59283 1 145 . 1 1 18 18 GLU CB C 18 30.310 30.310 32.020 -1.710 17919 59284 1 145 . 1 1 18 18 GLU H H 18 8.640 8.640 8.389 0.251 17919 59285 1 145 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.164 -0.023 17919 59286 1 145 . 1 1 19 19 PRO C C 19 175.310 175.310 177.519 -2.209 17919 59287 1 145 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.906 -0.436 17919 59288 1 145 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.886 0.064 17919 59289 1 145 . 1 1 20 20 SER N N 20 103.400 103.400 110.017 -6.617 17919 59290 1 145 . 1 1 20 20 SER HA H 20 4.370 4.370 4.473 -0.103 17919 59291 1 145 . 1 1 20 20 SER C C 20 174.660 174.660 173.884 0.776 17919 59292 1 145 . 1 1 20 20 SER CA C 20 57.400 57.400 58.668 -1.268 17919 59293 1 145 . 1 1 20 20 SER CB C 20 63.370 63.370 62.726 0.644 17919 59294 1 145 . 1 1 20 20 SER H H 20 7.040 7.040 8.366 -1.326 17919 59295 1 145 . 1 1 21 21 ASP N N 21 123.480 123.480 123.706 -0.226 17919 59296 1 145 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.628 0.067 17919 59297 1 145 . 1 1 21 21 ASP C C 21 176.360 176.360 176.059 0.301 17919 59298 1 145 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.197 0.503 17919 59299 1 145 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.352 -0.552 17919 59300 1 145 . 1 1 21 21 ASP H H 21 8.030 8.030 7.718 0.312 17919 59301 1 145 . 1 1 22 22 THR N N 22 108.800 108.800 113.251 -4.451 17919 59302 1 145 . 1 1 22 22 THR HA H 22 4.920 4.920 4.451 0.469 17919 59303 1 145 . 1 1 22 22 THR C C 22 176.750 176.750 175.706 1.044 17919 59304 1 145 . 1 1 22 22 THR CA C 22 59.690 59.690 62.353 -2.663 17919 59305 1 145 . 1 1 22 22 THR CB C 22 71.200 71.200 70.289 0.911 17919 59306 1 145 . 1 1 22 22 THR H H 22 7.900 7.900 8.372 -0.472 17919 59307 1 145 . 1 1 23 23 ILE N N 23 121.190 121.190 122.691 -1.501 17919 59308 1 145 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.856 -0.199 17919 59309 1 145 . 1 1 23 23 ILE C C 23 179.040 179.040 177.730 1.310 17919 59310 1 145 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.098 0.162 17919 59311 1 145 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.637 -2.287 17919 59312 1 145 . 1 1 23 23 ILE H H 23 8.560 8.560 9.012 -0.452 17919 59313 1 145 . 1 1 24 24 GLU N N 24 120.830 120.830 120.495 0.335 17919 59314 1 145 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.815 0.102 17919 59315 1 145 . 1 1 24 24 GLU C C 24 178.640 178.640 178.692 -0.052 17919 59316 1 145 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.013 0.207 17919 59317 1 145 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.400 -1.120 17919 59318 1 145 . 1 1 24 24 GLU H H 24 9.760 9.760 8.325 1.435 17919 59319 1 145 . 1 1 25 25 ASN N N 25 120.570 120.570 117.824 2.746 17919 59320 1 145 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.503 0.022 17919 59321 1 145 . 1 1 25 25 ASN C C 25 178.380 178.380 178.088 0.292 17919 59322 1 145 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.904 0.156 17919 59323 1 145 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.348 0.102 17919 59324 1 145 . 1 1 25 25 ASN H H 25 7.920 7.920 7.639 0.281 17919 59325 1 145 . 1 1 26 26 VAL N N 26 121.710 121.710 120.980 0.730 17919 59326 1 145 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.721 -0.324 17919 59327 1 145 . 1 1 26 26 VAL C C 26 177.950 177.950 177.971 -0.021 17919 59328 1 145 . 1 1 26 26 VAL CA C 26 67.660 67.660 65.848 1.812 17919 59329 1 145 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.630 -0.789 17919 59330 1 145 . 1 1 26 26 VAL H H 26 8.070 8.070 7.592 0.478 17919 59331 1 145 . 1 1 27 27 LYS N N 27 118.860 118.860 120.184 -1.324 17919 59332 1 145 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.128 0.452 17919 59333 1 145 . 1 1 27 27 LYS C C 27 180.550 180.550 178.982 1.568 17919 59334 1 145 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.903 -0.653 17919 59335 1 145 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.253 1.477 17919 59336 1 145 . 1 1 27 27 LYS H H 27 8.560 8.560 8.253 0.307 17919 59337 1 145 . 1 1 28 28 ALA N N 28 123.440 123.440 121.410 2.030 17919 59338 1 145 . 1 1 28 28 ALA HA H 28 4.160 4.160 3.931 0.229 17919 59339 1 145 . 1 1 28 28 ALA C C 28 180.300 180.300 179.339 0.961 17919 59340 1 145 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.765 -0.395 17919 59341 1 145 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.354 -0.644 17919 59342 1 145 . 1 1 28 28 ALA H H 28 8.060 8.060 8.115 -0.055 17919 59343 1 145 . 1 1 29 29 LYS N N 29 119.940 119.940 118.586 1.354 17919 59344 1 145 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.019 0.188 17919 59345 1 145 . 1 1 29 29 LYS C C 29 180.320 180.320 179.048 1.272 17919 59346 1 145 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.312 0.338 17919 59347 1 145 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.116 1.174 17919 59348 1 145 . 1 1 29 29 LYS H H 29 7.850 7.850 7.437 0.413 17919 59349 1 145 . 1 1 30 30 ILE N N 30 121.080 121.080 120.441 0.639 17919 59350 1 145 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.616 -0.109 17919 59351 1 145 . 1 1 30 30 ILE C C 30 178.310 178.310 177.526 0.784 17919 59352 1 145 . 1 1 30 30 ILE CA C 30 66.150 66.150 64.837 1.313 17919 59353 1 145 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.384 -0.584 17919 59354 1 145 . 1 1 30 30 ILE H H 30 8.280 8.280 7.876 0.404 17919 59355 1 145 . 1 1 31 31 GLN N N 31 123.490 123.490 119.968 3.522 17919 59356 1 145 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.866 -0.037 17919 59357 1 145 . 1 1 31 31 GLN C C 31 178.890 178.890 178.631 0.259 17919 59358 1 145 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.208 0.792 17919 59359 1 145 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.355 -0.635 17919 59360 1 145 . 1 1 31 31 GLN H H 31 8.580 8.580 8.545 0.035 17919 59361 1 145 . 1 1 32 32 ASP N N 32 119.360 119.360 119.436 -0.076 17919 59362 1 145 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.353 0.001 17919 59363 1 145 . 1 1 32 32 ASP C C 32 177.250 177.250 177.900 -0.650 17919 59364 1 145 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.979 0.211 17919 59365 1 145 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.820 -0.240 17919 59366 1 145 . 1 1 32 32 ASP H H 32 8.010 8.010 8.121 -0.111 17919 59367 1 145 . 1 1 33 33 LYS N N 33 115.130 115.130 118.458 -3.328 17919 59368 1 145 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.247 0.090 17919 59369 1 145 . 1 1 33 33 LYS C C 33 177.870 177.870 178.644 -0.774 17919 59370 1 145 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.895 0.155 17919 59371 1 145 . 1 1 33 33 LYS CB C 33 34.170 34.170 32.895 1.275 17919 59372 1 145 . 1 1 33 33 LYS H H 33 7.430 7.430 7.658 -0.228 17919 59373 1 145 . 1 1 34 34 GLU N N 34 113.870 113.870 115.145 -1.275 17919 59374 1 145 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.498 0.127 17919 59375 1 145 . 1 1 34 34 GLU C C 34 177.840 177.840 177.389 0.451 17919 59376 1 145 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.050 -0.880 17919 59377 1 145 . 1 1 34 34 GLU CB C 34 32.660 32.660 30.564 2.096 17919 59378 1 145 . 1 1 34 34 GLU H H 34 8.740 8.740 8.159 0.581 17919 59379 1 145 . 1 1 35 35 GLY N N 35 108.650 108.650 109.424 -0.774 17919 59380 1 145 . 1 1 35 35 GLY C C 35 173.960 173.960 174.543 -0.583 17919 59381 1 145 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.938 0.142 17919 59382 1 145 . 1 1 35 35 GLY H H 35 8.530 8.530 7.757 0.773 17919 59383 1 145 . 1 1 36 36 ILE N N 36 119.880 119.880 120.303 -0.423 17919 59384 1 145 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.259 0.186 17919 59385 1 145 . 1 1 36 36 ILE C C 36 173.590 173.590 174.340 -0.750 17919 59386 1 145 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.412 0.338 17919 59387 1 145 . 1 1 36 36 ILE CB C 36 40.580 40.580 36.945 3.635 17919 59388 1 145 . 1 1 36 36 ILE H H 36 6.150 6.150 7.867 -1.717 17919 59389 1 145 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.719 -0.085 17919 59390 1 145 . 1 1 37 37 PRO C C 37 176.940 176.940 175.874 1.066 17919 59391 1 145 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.677 -0.017 17919 59392 1 145 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.414 0.436 17919 59393 1 145 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.234 -0.117 17919 59394 1 145 . 1 1 38 38 PRO C C 38 178.320 178.320 178.172 0.148 17919 59395 1 145 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.642 0.618 17919 59396 1 145 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.807 1.083 17919 59397 1 145 . 1 1 39 39 ASP N N 39 113.380 113.380 116.572 -3.192 17919 59398 1 145 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.296 0.134 17919 59399 1 145 . 1 1 39 39 ASP C C 39 177.090 177.090 177.178 -0.088 17919 59400 1 145 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.823 -1.183 17919 59401 1 145 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.101 -0.561 17919 59402 1 145 . 1 1 39 39 ASP H H 39 8.550 8.550 8.769 -0.219 17919 59403 1 145 . 1 1 40 40 GLN N N 40 116.780 116.780 118.099 -1.319 17919 59404 1 145 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.203 0.261 17919 59405 1 145 . 1 1 40 40 GLN C C 40 175.380 175.380 175.969 -0.589 17919 59406 1 145 . 1 1 40 40 GLN CA C 40 55.640 55.640 57.292 -1.652 17919 59407 1 145 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.781 0.359 17919 59408 1 145 . 1 1 40 40 GLN H H 40 7.820 7.820 7.421 0.399 17919 59409 1 145 . 1 1 41 41 GLN N N 41 117.720 117.720 119.952 -2.232 17919 59410 1 145 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.412 -0.168 17919 59411 1 145 . 1 1 41 41 GLN C C 41 176.300 176.300 174.575 1.725 17919 59412 1 145 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.609 0.861 17919 59413 1 145 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.732 1.918 17919 59414 1 145 . 1 1 41 41 GLN H H 41 7.480 7.480 7.452 0.028 17919 59415 1 145 . 1 1 42 42 ARG N N 42 122.680 122.680 126.970 -4.290 17919 59416 1 145 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.539 -0.039 17919 59417 1 145 . 1 1 42 42 ARG C C 42 174.050 174.050 174.486 -0.436 17919 59418 1 145 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.790 0.260 17919 59419 1 145 . 1 1 42 42 ARG CB C 42 31.750 31.750 30.635 1.115 17919 59420 1 145 . 1 1 42 42 ARG H H 42 8.530 8.530 8.256 0.274 17919 59421 1 145 . 1 1 43 43 LEU N N 43 124.040 124.040 127.733 -3.693 17919 59422 1 145 . 1 1 43 43 LEU C C 43 175.290 175.290 175.784 -0.494 17919 59423 1 145 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.786 -1.806 17919 59424 1 145 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.167 2.623 17919 59425 1 145 . 1 1 43 43 LEU H H 43 8.820 8.820 8.511 0.309 17919 59426 1 145 . 1 1 44 44 ILE N N 44 121.920 121.920 123.612 -1.692 17919 59427 1 145 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.930 0.062 17919 59428 1 145 . 1 1 44 44 ILE C C 44 176.060 176.060 174.869 1.191 17919 59429 1 145 . 1 1 44 44 ILE CA C 44 58.980 58.980 58.172 0.808 17919 59430 1 145 . 1 1 44 44 ILE CB C 44 41.420 41.420 39.771 1.649 17919 59431 1 145 . 1 1 44 44 ILE H H 44 9.030 9.030 9.066 -0.036 17919 59432 1 145 . 1 1 45 45 PHE N N 45 125.390 125.390 127.716 -2.326 17919 59433 1 145 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.898 0.147 17919 59434 1 145 . 1 1 45 45 PHE C C 45 174.470 174.470 173.995 0.475 17919 59435 1 145 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.658 0.362 17919 59436 1 145 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.673 1.087 17919 59437 1 145 . 1 1 45 45 PHE H H 45 8.830 8.830 8.199 0.631 17919 59438 1 145 . 1 1 46 46 ALA N N 46 132.200 132.200 129.938 2.262 17919 59439 1 145 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.687 0.003 17919 59440 1 145 . 1 1 46 46 ALA C C 46 177.290 177.290 177.114 0.176 17919 59441 1 145 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.694 -0.154 17919 59442 1 145 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.494 0.076 17919 59443 1 145 . 1 1 46 46 ALA H H 46 8.810 8.810 8.594 0.216 17919 59444 1 145 . 1 1 47 47 GLY N N 47 102.340 102.340 104.762 -2.422 17919 59445 1 145 . 1 1 47 47 GLY C C 47 173.810 173.810 174.302 -0.492 17919 59446 1 145 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.212 0.138 17919 59447 1 145 . 1 1 47 47 GLY H H 47 8.130 8.130 8.396 -0.266 17919 59448 1 145 . 1 1 48 48 LYS N N 48 121.570 121.570 121.671 -0.101 17919 59449 1 145 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.562 0.060 17919 59450 1 145 . 1 1 48 48 LYS C C 48 174.700 174.700 175.658 -0.958 17919 59451 1 145 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.015 -0.465 17919 59452 1 145 . 1 1 48 48 LYS CB C 48 34.530 34.530 33.977 0.553 17919 59453 1 145 . 1 1 48 48 LYS H H 48 7.980 7.980 7.922 0.058 17919 59454 1 145 . 1 1 49 49 GLN N N 49 122.410 122.410 123.292 -0.882 17919 59455 1 145 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.283 0.277 17919 59456 1 145 . 1 1 49 49 GLN C C 49 175.670 175.670 175.578 0.092 17919 59457 1 145 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.853 -0.113 17919 59458 1 145 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.604 -0.604 17919 59459 1 145 . 1 1 49 49 GLN H H 49 8.600 8.600 8.618 -0.018 17919 59460 1 145 . 1 1 50 50 LEU N N 50 125.520 125.520 125.647 -0.127 17919 59461 1 145 . 1 1 50 50 LEU HA H 50 4.090 4.090 3.899 0.191 17919 59462 1 145 . 1 1 50 50 LEU C C 50 176.660 176.660 175.293 1.367 17919 59463 1 145 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.895 0.345 17919 59464 1 145 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.818 -0.248 17919 59465 1 145 . 1 1 50 50 LEU H H 50 8.530 8.530 8.492 0.038 17919 59466 1 145 . 1 1 51 51 GLU N N 51 122.940 122.940 124.231 -1.291 17919 59467 1 145 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.584 -0.096 17919 59468 1 145 . 1 1 51 51 GLU C C 51 175.870 175.870 176.001 -0.131 17919 59469 1 145 . 1 1 51 51 GLU CA C 51 55.960 55.960 54.681 1.279 17919 59470 1 145 . 1 1 51 51 GLU CB C 51 31.570 31.570 33.274 -1.704 17919 59471 1 145 . 1 1 51 51 GLU H H 51 8.400 8.400 8.851 -0.451 17919 59472 1 145 . 1 1 52 52 ASP N N 52 120.030 120.030 123.980 -3.950 17919 59473 1 145 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.661 -0.302 17919 59474 1 145 . 1 1 52 52 ASP C C 52 177.330 177.330 177.851 -0.521 17919 59475 1 145 . 1 1 52 52 ASP CA C 52 56.960 56.960 56.546 0.414 17919 59476 1 145 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.952 -0.102 17919 59477 1 145 . 1 1 52 52 ASP H H 52 8.160 8.160 8.851 -0.691 17919 59478 1 145 . 1 1 53 53 GLY N N 53 106.660 106.660 107.005 -0.345 17919 59479 1 145 . 1 1 53 53 GLY C C 53 174.870 174.870 174.380 0.490 17919 59480 1 145 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.101 0.069 17919 59481 1 145 . 1 1 53 53 GLY H H 53 9.390 9.390 8.522 0.868 17919 59482 1 145 . 1 1 54 54 ARG N N 54 119.050 119.050 120.058 -1.008 17919 59483 1 145 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.640 0.055 17919 59484 1 145 . 1 1 54 54 ARG C C 54 175.350 175.350 174.928 0.422 17919 59485 1 145 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.276 0.114 17919 59486 1 145 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.310 -0.660 17919 59487 1 145 . 1 1 54 54 ARG H H 54 7.460 7.460 7.671 -0.211 17919 59488 1 145 . 1 1 55 55 THR N N 55 108.400 108.400 111.846 -3.446 17919 59489 1 145 . 1 1 55 55 THR HA H 55 5.240 5.240 4.920 0.320 17919 59490 1 145 . 1 1 55 55 THR C C 55 176.560 176.560 176.258 0.302 17919 59491 1 145 . 1 1 55 55 THR CA C 55 59.690 59.690 60.249 -0.559 17919 59492 1 145 . 1 1 55 55 THR CB C 55 72.260 72.260 70.974 1.286 17919 59493 1 145 . 1 1 55 55 THR H H 55 8.730 8.730 8.747 -0.017 17919 59494 1 145 . 1 1 56 56 LEU N N 56 117.920 117.920 121.921 -4.001 17919 59495 1 145 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.956 0.104 17919 59496 1 145 . 1 1 56 56 LEU C C 56 180.810 180.810 178.839 1.971 17919 59497 1 145 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.750 -0.040 17919 59498 1 145 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.178 -0.808 17919 59499 1 145 . 1 1 56 56 LEU H H 56 8.140 8.140 8.660 -0.520 17919 59500 1 145 . 1 1 57 57 SER N N 57 113.330 113.330 115.060 -1.730 17919 59501 1 145 . 1 1 57 57 SER HA H 57 4.370 4.370 4.085 0.285 17919 59502 1 145 . 1 1 57 57 SER C C 57 178.310 178.310 176.892 1.418 17919 59503 1 145 . 1 1 57 57 SER CA C 57 61.080 61.080 61.828 -0.748 17919 59504 1 145 . 1 1 57 57 SER CB C 57 62.530 62.530 62.515 0.015 17919 59505 1 145 . 1 1 57 57 SER H H 57 8.470 8.470 7.951 0.519 17919 59506 1 145 . 1 1 58 58 ASP N N 58 124.190 124.190 121.954 2.236 17919 59507 1 145 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.258 0.038 17919 59508 1 145 . 1 1 58 58 ASP C C 58 177.400 177.400 177.277 0.123 17919 59509 1 145 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.787 0.393 17919 59510 1 145 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.227 -0.127 17919 59511 1 145 . 1 1 58 58 ASP H H 58 7.930 7.930 7.808 0.122 17919 59512 1 145 . 1 1 59 59 TYR N N 59 115.510 115.510 114.992 0.518 17919 59513 1 145 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.595 0.075 17919 59514 1 145 . 1 1 59 59 TYR C C 59 174.700 174.700 175.294 -0.594 17919 59515 1 145 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.071 1.179 17919 59516 1 145 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.233 1.837 17919 59517 1 145 . 1 1 59 59 TYR H H 59 7.250 7.250 7.251 -0.001 17919 59518 1 145 . 1 1 60 60 ASN N N 60 115.900 115.900 117.756 -1.856 17919 59519 1 145 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.353 0.002 17919 59520 1 145 . 1 1 60 60 ASN C C 60 174.340 174.340 174.156 0.184 17919 59521 1 145 . 1 1 60 60 ASN CA C 60 54.120 54.120 53.907 0.213 17919 59522 1 145 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.599 -0.189 17919 59523 1 145 . 1 1 60 60 ASN H H 60 8.150 8.150 7.691 0.459 17919 59524 1 145 . 1 1 61 61 ILE N N 61 118.600 118.600 119.846 -1.246 17919 59525 1 145 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.752 -0.359 17919 59526 1 145 . 1 1 61 61 ILE C C 61 174.610 174.610 174.716 -0.106 17919 59527 1 145 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.168 1.252 17919 59528 1 145 . 1 1 61 61 ILE CB C 61 36.740 36.740 38.526 -1.786 17919 59529 1 145 . 1 1 61 61 ILE H H 61 7.250 7.250 7.700 -0.451 17919 59530 1 145 . 1 1 62 62 GLN N N 62 124.740 124.740 124.095 0.645 17919 59531 1 145 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.657 -0.151 17919 59532 1 145 . 1 1 62 62 GLN C C 62 175.970 175.970 175.453 0.517 17919 59533 1 145 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.368 0.292 17919 59534 1 145 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.270 0.380 17919 59535 1 145 . 1 1 62 62 GLN H H 62 7.610 7.610 8.073 -0.463 17919 59536 1 145 . 1 1 63 63 LYS N N 63 120.300 120.300 122.636 -2.336 17919 59537 1 145 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.806 0.195 17919 59538 1 145 . 1 1 63 63 LYS C C 63 175.810 175.810 176.767 -0.957 17919 59539 1 145 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.747 -0.957 17919 59540 1 145 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.024 0.626 17919 59541 1 145 . 1 1 63 63 LYS H H 63 8.490 8.490 8.618 -0.128 17919 59542 1 145 . 1 1 64 64 GLU N N 64 113.950 113.950 121.084 -7.134 17919 59543 1 145 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.741 -0.276 17919 59544 1 145 . 1 1 64 64 GLU C C 64 175.250 175.250 175.872 -0.622 17919 59545 1 145 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.961 -0.071 17919 59546 1 145 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.380 -2.480 17919 59547 1 145 . 1 1 64 64 GLU H H 64 9.280 9.280 8.282 0.998 17919 59548 1 145 . 1 1 65 65 SER N N 65 114.730 114.730 116.099 -1.369 17919 59549 1 145 . 1 1 65 65 SER HA H 65 4.640 4.640 4.396 0.244 17919 59550 1 145 . 1 1 65 65 SER C C 65 172.160 172.160 174.446 -2.286 17919 59551 1 145 . 1 1 65 65 SER CA C 65 60.890 60.890 59.700 1.190 17919 59552 1 145 . 1 1 65 65 SER CB C 65 64.910 64.910 63.521 1.389 17919 59553 1 145 . 1 1 65 65 SER H H 65 7.670 7.670 7.367 0.302 17919 59554 1 145 . 1 1 66 66 THR N N 66 117.110 117.110 122.726 -5.616 17919 59555 1 145 . 1 1 66 66 THR HA H 66 5.270 5.270 4.610 0.660 17919 59556 1 145 . 1 1 66 66 THR C C 66 173.950 173.950 174.727 -0.777 17919 59557 1 145 . 1 1 66 66 THR CA C 66 62.340 62.340 63.684 -1.344 17919 59558 1 145 . 1 1 66 66 THR CB C 66 70.080 70.080 69.426 0.654 17919 59559 1 145 . 1 1 66 66 THR H H 66 8.730 8.730 8.480 0.250 17919 59560 1 145 . 1 1 67 67 LEU N N 67 127.110 127.110 127.290 -0.180 17919 59561 1 145 . 1 1 67 67 LEU HA H 67 5.060 5.060 5.002 0.058 17919 59562 1 145 . 1 1 67 67 LEU C C 67 175.770 175.770 175.643 0.127 17919 59563 1 145 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.679 0.221 17919 59564 1 145 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.416 -0.156 17919 59565 1 145 . 1 1 67 67 LEU H H 67 9.410 9.410 8.957 0.453 17919 59566 1 145 . 1 1 68 68 HIS N N 68 118.380 118.380 119.086 -0.706 17919 59567 1 145 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.648 -0.408 17919 59568 1 145 . 1 1 68 68 HIS C C 68 173.150 173.150 173.385 -0.235 17919 59569 1 145 . 1 1 68 68 HIS CA C 68 55.000 55.000 53.832 1.168 17919 59570 1 145 . 1 1 68 68 HIS CB C 68 30.530 30.530 34.324 -3.794 17919 59571 1 145 . 1 1 68 68 HIS H H 68 9.230 9.230 9.058 0.172 17919 59572 1 145 . 1 1 69 69 LEU N N 69 124.460 124.460 123.665 0.795 17919 59573 1 145 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.930 0.260 17919 59574 1 145 . 1 1 69 69 LEU C C 69 175.270 175.270 174.179 1.091 17919 59575 1 145 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.312 -0.422 17919 59576 1 145 . 1 1 69 69 LEU CB C 69 44.380 44.380 45.295 -0.915 17919 59577 1 145 . 1 1 69 69 LEU H H 69 8.340 8.340 7.390 0.950 17919 59578 1 145 . 1 1 70 70 VAL N N 70 126.940 126.940 123.963 2.977 17919 59579 1 145 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.655 -0.305 17919 59580 1 145 . 1 1 70 70 VAL C C 70 174.000 174.000 173.603 0.397 17919 59581 1 145 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.790 1.010 17919 59582 1 145 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.547 -0.637 17919 59583 1 145 . 1 1 70 70 VAL H H 70 9.200 9.200 8.343 0.857 17919 59584 1 145 . 1 1 71 71 LEU N N 71 123.130 123.130 124.158 -1.028 17919 59585 1 145 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.085 -0.025 17919 59586 1 145 . 1 1 71 71 LEU C C 71 177.830 177.830 176.558 1.272 17919 59587 1 145 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.103 0.837 17919 59588 1 145 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.201 -0.351 17919 59589 1 145 . 1 1 71 71 LEU H H 71 8.120 8.120 8.217 -0.097 17919 59590 1 145 . 1 1 72 72 ARG N N 72 123.490 123.490 123.718 -0.228 17919 59591 1 145 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.493 -0.192 17919 59592 1 145 . 1 1 72 72 ARG C C 72 175.350 175.350 175.481 -0.131 17919 59593 1 145 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.028 -0.418 17919 59594 1 145 . 1 1 72 72 ARG CB C 72 31.350 31.350 31.316 0.035 17919 59595 1 145 . 1 1 72 72 ARG H H 72 8.580 8.580 8.491 0.089 17919 59596 1 146 . 1 1 2 2 GLN N N 2 123.220 123.220 120.871 2.349 17919 59597 1 146 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.190 0.059 17919 59598 1 146 . 1 1 2 2 GLN C C 2 175.920 175.920 175.644 0.276 17919 59599 1 146 . 1 1 2 2 GLN CA C 2 55.080 55.080 53.880 1.200 17919 59600 1 146 . 1 1 2 2 GLN CB C 2 30.760 30.760 29.693 1.067 17919 59601 1 146 . 1 1 2 2 GLN H H 2 8.900 8.900 8.458 0.442 17919 59602 1 146 . 1 1 3 3 ILE N N 3 115.340 115.340 115.715 -0.375 17919 59603 1 146 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.542 -0.329 17919 59604 1 146 . 1 1 3 3 ILE C C 3 172.450 172.450 173.445 -0.995 17919 59605 1 146 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.938 -0.368 17919 59606 1 146 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.937 0.273 17919 59607 1 146 . 1 1 3 3 ILE H H 3 8.320 8.320 7.581 0.739 17919 59608 1 146 . 1 1 4 4 PHE N N 4 118.110 118.110 118.991 -0.881 17919 59609 1 146 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.762 -0.132 17919 59610 1 146 . 1 1 4 4 PHE C C 4 175.320 175.320 175.382 -0.062 17919 59611 1 146 . 1 1 4 4 PHE CA C 4 55.210 55.210 54.999 0.211 17919 59612 1 146 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.447 -0.967 17919 59613 1 146 . 1 1 4 4 PHE H H 4 8.610 8.610 8.872 -0.262 17919 59614 1 146 . 1 1 5 5 VAL N N 5 121.000 121.000 118.938 2.062 17919 59615 1 146 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.855 -0.130 17919 59616 1 146 . 1 1 5 5 VAL C C 5 174.870 174.870 174.912 -0.042 17919 59617 1 146 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.289 -0.669 17919 59618 1 146 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.460 0.770 17919 59619 1 146 . 1 1 5 5 VAL H H 5 9.300 9.300 8.423 0.877 17919 59620 1 146 . 1 1 6 6 LYS N N 6 127.520 127.520 129.240 -1.720 17919 59621 1 146 . 1 1 6 6 LYS HA H 6 5.367 5.367 4.929 0.438 17919 59622 1 146 . 1 1 6 6 LYS C C 6 177.140 177.140 176.727 0.413 17919 59623 1 146 . 1 1 6 6 LYS CA C 6 54.520 54.520 55.429 -0.909 17919 59624 1 146 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.708 0.342 17919 59625 1 146 . 1 1 6 6 LYS H H 6 8.820 8.820 8.490 0.330 17919 59626 1 146 . 1 1 7 7 THR N N 7 115.400 115.400 117.761 -2.361 17919 59627 1 146 . 1 1 7 7 THR HA H 7 4.970 4.970 4.579 0.391 17919 59628 1 146 . 1 1 7 7 THR C C 7 176.910 176.910 175.687 1.223 17919 59629 1 146 . 1 1 7 7 THR CA C 7 60.470 60.470 61.089 -0.619 17919 59630 1 146 . 1 1 7 7 THR CB C 7 70.630 70.630 70.208 0.422 17919 59631 1 146 . 1 1 7 7 THR H H 7 8.730 8.730 8.492 0.238 17919 59632 1 146 . 1 1 8 8 LEU N N 8 121.330 121.330 120.971 0.359 17919 59633 1 146 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.353 -0.043 17919 59634 1 146 . 1 1 8 8 LEU C C 8 178.800 178.800 178.225 0.575 17919 59635 1 146 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.143 0.437 17919 59636 1 146 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.244 -0.274 17919 59637 1 146 . 1 1 8 8 LEU H H 8 9.100 9.100 8.852 0.248 17919 59638 1 146 . 1 1 9 9 THR N N 9 105.590 105.590 107.769 -2.179 17919 59639 1 146 . 1 1 9 9 THR HA H 9 4.428 4.428 4.244 0.184 17919 59640 1 146 . 1 1 9 9 THR C C 9 175.520 175.520 175.597 -0.077 17919 59641 1 146 . 1 1 9 9 THR CA C 9 61.400 61.400 62.750 -1.350 17919 59642 1 146 . 1 1 9 9 THR CB C 9 69.140 69.140 68.938 0.202 17919 59643 1 146 . 1 1 9 9 THR H H 9 7.630 7.630 7.916 -0.286 17919 59644 1 146 . 1 1 10 10 GLY N N 10 108.890 108.890 110.970 -2.080 17919 59645 1 146 . 1 1 10 10 GLY C C 10 174.070 174.070 173.630 0.440 17919 59646 1 146 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.568 0.892 17919 59647 1 146 . 1 1 10 10 GLY H H 10 7.810 7.810 7.821 -0.011 17919 59648 1 146 . 1 1 11 11 LYS N N 11 121.600 121.600 122.311 -0.711 17919 59649 1 146 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.573 -0.212 17919 59650 1 146 . 1 1 11 11 LYS C C 11 175.940 175.940 175.507 0.433 17919 59651 1 146 . 1 1 11 11 LYS CA C 11 56.280 56.280 55.752 0.528 17919 59652 1 146 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.880 -0.680 17919 59653 1 146 . 1 1 11 11 LYS H H 11 7.280 7.280 8.278 -0.998 17919 59654 1 146 . 1 1 12 12 THR N N 12 120.440 120.440 119.108 1.332 17919 59655 1 146 . 1 1 12 12 THR HA H 12 5.046 5.046 4.743 0.303 17919 59656 1 146 . 1 1 12 12 THR C C 12 174.320 174.320 174.342 -0.022 17919 59657 1 146 . 1 1 12 12 THR CA C 12 62.390 62.390 61.870 0.520 17919 59658 1 146 . 1 1 12 12 THR CB C 12 69.910 69.910 69.978 -0.068 17919 59659 1 146 . 1 1 12 12 THR H H 12 8.650 8.650 8.372 0.278 17919 59660 1 146 . 1 1 13 13 ILE N N 13 127.110 127.110 125.416 1.694 17919 59661 1 146 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.436 0.108 17919 59662 1 146 . 1 1 13 13 ILE C C 13 175.220 175.220 174.299 0.921 17919 59663 1 146 . 1 1 13 13 ILE CA C 13 59.980 59.980 61.115 -1.135 17919 59664 1 146 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.868 0.082 17919 59665 1 146 . 1 1 13 13 ILE H H 13 9.450 9.450 8.121 1.329 17919 59666 1 146 . 1 1 14 14 THR N N 14 121.520 121.520 122.977 -1.457 17919 59667 1 146 . 1 1 14 14 THR HA H 14 4.964 4.964 4.786 0.178 17919 59668 1 146 . 1 1 14 14 THR C C 14 173.790 173.790 173.676 0.114 17919 59669 1 146 . 1 1 14 14 THR CA C 14 61.940 61.940 61.700 0.240 17919 59670 1 146 . 1 1 14 14 THR CB C 14 69.650 69.650 70.159 -0.509 17919 59671 1 146 . 1 1 14 14 THR H H 14 8.710 8.710 8.472 0.238 17919 59672 1 146 . 1 1 15 15 LEU N N 15 124.800 124.800 125.768 -0.968 17919 59673 1 146 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.720 0.060 17919 59674 1 146 . 1 1 15 15 LEU C C 15 174.670 174.670 174.467 0.203 17919 59675 1 146 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.792 -0.962 17919 59676 1 146 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.663 1.407 17919 59677 1 146 . 1 1 15 15 LEU H H 15 8.710 8.710 8.123 0.587 17919 59678 1 146 . 1 1 16 16 GLU N N 16 122.160 122.160 122.628 -0.468 17919 59679 1 146 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.756 0.161 17919 59680 1 146 . 1 1 16 16 GLU C C 16 175.860 175.860 176.267 -0.407 17919 59681 1 146 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.454 -0.634 17919 59682 1 146 . 1 1 16 16 GLU CB C 16 29.450 29.450 29.577 -0.127 17919 59683 1 146 . 1 1 16 16 GLU H H 16 8.140 8.140 8.618 -0.478 17919 59684 1 146 . 1 1 17 17 VAL N N 17 117.210 117.210 121.407 -4.197 17919 59685 1 146 . 1 1 17 17 VAL HA H 17 4.714 4.714 5.029 -0.315 17919 59686 1 146 . 1 1 17 17 VAL C C 17 174.160 174.160 175.126 -0.966 17919 59687 1 146 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.986 -0.556 17919 59688 1 146 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.609 0.791 17919 59689 1 146 . 1 1 17 17 VAL H H 17 8.900 8.900 8.251 0.649 17919 59690 1 146 . 1 1 18 18 GLU N N 18 118.990 118.990 116.267 2.723 17919 59691 1 146 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.775 0.304 17919 59692 1 146 . 1 1 18 18 GLU C C 18 176.160 176.160 174.403 1.757 17919 59693 1 146 . 1 1 18 18 GLU CA C 18 52.720 52.720 54.275 -1.554 17919 59694 1 146 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.321 -0.011 17919 59695 1 146 . 1 1 18 18 GLU H H 18 8.640 8.640 8.624 0.016 17919 59696 1 146 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.329 -0.188 17919 59697 1 146 . 1 1 19 19 PRO C C 19 175.310 175.310 178.044 -2.734 17919 59698 1 146 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.312 0.158 17919 59699 1 146 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.836 0.114 17919 59700 1 146 . 1 1 20 20 SER N N 20 103.400 103.400 109.976 -6.576 17919 59701 1 146 . 1 1 20 20 SER HA H 20 4.370 4.370 4.278 0.092 17919 59702 1 146 . 1 1 20 20 SER C C 20 174.660 174.660 174.537 0.123 17919 59703 1 146 . 1 1 20 20 SER CA C 20 57.400 57.400 59.166 -1.766 17919 59704 1 146 . 1 1 20 20 SER CB C 20 63.370 63.370 62.587 0.784 17919 59705 1 146 . 1 1 20 20 SER H H 20 7.040 7.040 7.977 -0.937 17919 59706 1 146 . 1 1 21 21 ASP N N 21 123.480 123.480 124.470 -0.990 17919 59707 1 146 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.724 -0.029 17919 59708 1 146 . 1 1 21 21 ASP C C 21 176.360 176.360 175.949 0.411 17919 59709 1 146 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.143 0.557 17919 59710 1 146 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.580 -0.780 17919 59711 1 146 . 1 1 21 21 ASP H H 21 8.030 8.030 8.066 -0.036 17919 59712 1 146 . 1 1 22 22 THR N N 22 108.800 108.800 112.624 -3.824 17919 59713 1 146 . 1 1 22 22 THR HA H 22 4.920 4.920 4.291 0.629 17919 59714 1 146 . 1 1 22 22 THR C C 22 176.750 176.750 175.819 0.931 17919 59715 1 146 . 1 1 22 22 THR CA C 22 59.690 59.690 62.052 -2.362 17919 59716 1 146 . 1 1 22 22 THR CB C 22 71.200 71.200 69.712 1.488 17919 59717 1 146 . 1 1 22 22 THR H H 22 7.900 7.900 8.207 -0.307 17919 59718 1 146 . 1 1 23 23 ILE N N 23 121.190 121.190 123.688 -2.498 17919 59719 1 146 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.687 -0.030 17919 59720 1 146 . 1 1 23 23 ILE C C 23 179.040 179.040 177.482 1.558 17919 59721 1 146 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.897 -1.637 17919 59722 1 146 . 1 1 23 23 ILE CB C 23 34.350 34.350 37.395 -3.045 17919 59723 1 146 . 1 1 23 23 ILE H H 23 8.560 8.560 8.704 -0.144 17919 59724 1 146 . 1 1 24 24 GLU N N 24 120.830 120.830 118.456 2.374 17919 59725 1 146 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.902 0.015 17919 59726 1 146 . 1 1 24 24 GLU C C 24 178.640 178.640 178.290 0.350 17919 59727 1 146 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.540 0.680 17919 59728 1 146 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.524 -1.244 17919 59729 1 146 . 1 1 24 24 GLU H H 24 9.760 9.760 8.261 1.499 17919 59730 1 146 . 1 1 25 25 ASN N N 25 120.570 120.570 118.320 2.250 17919 59731 1 146 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.523 0.002 17919 59732 1 146 . 1 1 25 25 ASN C C 25 178.380 178.380 177.728 0.652 17919 59733 1 146 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.702 0.358 17919 59734 1 146 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.169 0.282 17919 59735 1 146 . 1 1 25 25 ASN H H 25 7.920 7.920 7.586 0.334 17919 59736 1 146 . 1 1 26 26 VAL N N 26 121.710 121.710 118.879 2.831 17919 59737 1 146 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.571 -0.174 17919 59738 1 146 . 1 1 26 26 VAL C C 26 177.950 177.950 177.827 0.123 17919 59739 1 146 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.048 1.612 17919 59740 1 146 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.142 -0.301 17919 59741 1 146 . 1 1 26 26 VAL H H 26 8.070 8.070 7.656 0.414 17919 59742 1 146 . 1 1 27 27 LYS N N 27 118.860 118.860 120.996 -2.136 17919 59743 1 146 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.213 0.367 17919 59744 1 146 . 1 1 27 27 LYS C C 27 180.550 180.550 178.978 1.572 17919 59745 1 146 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.606 -0.356 17919 59746 1 146 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.394 1.336 17919 59747 1 146 . 1 1 27 27 LYS H H 27 8.560 8.560 7.627 0.933 17919 59748 1 146 . 1 1 28 28 ALA N N 28 123.440 123.440 119.691 3.749 17919 59749 1 146 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.110 0.050 17919 59750 1 146 . 1 1 28 28 ALA C C 28 180.300 180.300 178.993 1.307 17919 59751 1 146 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.922 0.448 17919 59752 1 146 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.444 -0.734 17919 59753 1 146 . 1 1 28 28 ALA H H 28 8.060 8.060 8.157 -0.097 17919 59754 1 146 . 1 1 29 29 LYS N N 29 119.940 119.940 120.085 -0.145 17919 59755 1 146 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.051 0.156 17919 59756 1 146 . 1 1 29 29 LYS C C 29 180.320 180.320 178.989 1.331 17919 59757 1 146 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.345 0.305 17919 59758 1 146 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.346 0.944 17919 59759 1 146 . 1 1 29 29 LYS H H 29 7.850 7.850 7.530 0.320 17919 59760 1 146 . 1 1 30 30 ILE N N 30 121.080 121.080 120.073 1.007 17919 59761 1 146 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.608 -0.101 17919 59762 1 146 . 1 1 30 30 ILE C C 30 178.310 178.310 177.434 0.876 17919 59763 1 146 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.460 0.690 17919 59764 1 146 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.584 -0.784 17919 59765 1 146 . 1 1 30 30 ILE H H 30 8.280 8.280 8.232 0.048 17919 59766 1 146 . 1 1 31 31 GLN N N 31 123.490 123.490 119.965 3.525 17919 59767 1 146 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.019 -0.190 17919 59768 1 146 . 1 1 31 31 GLN C C 31 178.890 178.890 177.980 0.910 17919 59769 1 146 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.218 0.782 17919 59770 1 146 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.655 -0.935 17919 59771 1 146 . 1 1 31 31 GLN H H 31 8.580 8.580 8.081 0.499 17919 59772 1 146 . 1 1 32 32 ASP N N 32 119.360 119.360 119.046 0.314 17919 59773 1 146 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.410 -0.056 17919 59774 1 146 . 1 1 32 32 ASP C C 32 177.250 177.250 178.303 -1.053 17919 59775 1 146 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.696 0.494 17919 59776 1 146 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.873 -0.293 17919 59777 1 146 . 1 1 32 32 ASP H H 32 8.010 8.010 8.188 -0.178 17919 59778 1 146 . 1 1 33 33 LYS N N 33 115.130 115.130 116.664 -1.534 17919 59779 1 146 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.424 -0.087 17919 59780 1 146 . 1 1 33 33 LYS C C 33 177.870 177.870 177.773 0.097 17919 59781 1 146 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.822 0.228 17919 59782 1 146 . 1 1 33 33 LYS CB C 33 34.170 34.170 34.284 -0.114 17919 59783 1 146 . 1 1 33 33 LYS H H 33 7.430 7.430 7.520 -0.090 17919 59784 1 146 . 1 1 34 34 GLU N N 34 113.870 113.870 115.224 -1.354 17919 59785 1 146 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.504 0.121 17919 59786 1 146 . 1 1 34 34 GLU C C 34 177.840 177.840 176.809 1.031 17919 59787 1 146 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.755 -0.585 17919 59788 1 146 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.519 1.141 17919 59789 1 146 . 1 1 34 34 GLU H H 34 8.740 8.740 8.013 0.727 17919 59790 1 146 . 1 1 35 35 GLY N N 35 108.650 108.650 108.480 0.170 17919 59791 1 146 . 1 1 35 35 GLY C C 35 173.960 173.960 174.633 -0.673 17919 59792 1 146 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.487 0.593 17919 59793 1 146 . 1 1 35 35 GLY H H 35 8.530 8.530 7.990 0.540 17919 59794 1 146 . 1 1 36 36 ILE N N 36 119.880 119.880 122.373 -2.493 17919 59795 1 146 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.355 0.090 17919 59796 1 146 . 1 1 36 36 ILE C C 36 173.590 173.590 174.284 -0.694 17919 59797 1 146 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.167 -0.417 17919 59798 1 146 . 1 1 36 36 ILE CB C 36 40.580 40.580 37.931 2.649 17919 59799 1 146 . 1 1 36 36 ILE H H 36 6.150 6.150 7.584 -1.434 17919 59800 1 146 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.900 -0.266 17919 59801 1 146 . 1 1 37 37 PRO C C 37 176.940 176.940 175.888 1.052 17919 59802 1 146 . 1 1 37 37 PRO CA C 37 61.660 61.660 60.947 0.713 17919 59803 1 146 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.364 0.486 17919 59804 1 146 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.232 -0.115 17919 59805 1 146 . 1 1 38 38 PRO C C 38 178.320 178.320 178.570 -0.250 17919 59806 1 146 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.609 0.651 17919 59807 1 146 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.820 1.070 17919 59808 1 146 . 1 1 39 39 ASP N N 39 113.380 113.380 117.274 -3.894 17919 59809 1 146 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.393 0.037 17919 59810 1 146 . 1 1 39 39 ASP C C 39 177.090 177.090 177.618 -0.528 17919 59811 1 146 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.526 -0.886 17919 59812 1 146 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.471 -0.931 17919 59813 1 146 . 1 1 39 39 ASP H H 39 8.550 8.550 8.492 0.058 17919 59814 1 146 . 1 1 40 40 GLN N N 40 116.780 116.780 116.556 0.224 17919 59815 1 146 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.234 0.230 17919 59816 1 146 . 1 1 40 40 GLN C C 40 175.380 175.380 176.139 -0.759 17919 59817 1 146 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.491 0.149 17919 59818 1 146 . 1 1 40 40 GLN CB C 40 30.140 30.140 27.809 2.331 17919 59819 1 146 . 1 1 40 40 GLN H H 40 7.820 7.820 8.013 -0.193 17919 59820 1 146 . 1 1 41 41 GLN N N 41 117.720 117.720 118.563 -0.843 17919 59821 1 146 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.502 -0.258 17919 59822 1 146 . 1 1 41 41 GLN C C 41 176.300 176.300 174.917 1.383 17919 59823 1 146 . 1 1 41 41 GLN CA C 41 56.470 56.470 54.582 1.888 17919 59824 1 146 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.215 2.435 17919 59825 1 146 . 1 1 41 41 GLN H H 41 7.480 7.480 7.372 0.108 17919 59826 1 146 . 1 1 42 42 ARG N N 42 122.680 122.680 126.459 -3.779 17919 59827 1 146 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.258 0.242 17919 59828 1 146 . 1 1 42 42 ARG C C 42 174.050 174.050 174.053 -0.003 17919 59829 1 146 . 1 1 42 42 ARG CA C 42 55.050 55.050 56.566 -1.516 17919 59830 1 146 . 1 1 42 42 ARG CB C 42 31.750 31.750 31.372 0.378 17919 59831 1 146 . 1 1 42 42 ARG H H 42 8.530 8.530 7.766 0.764 17919 59832 1 146 . 1 1 43 43 LEU N N 43 124.040 124.040 126.845 -2.805 17919 59833 1 146 . 1 1 43 43 LEU C C 43 175.290 175.290 175.086 0.204 17919 59834 1 146 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.733 -0.753 17919 59835 1 146 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.904 0.886 17919 59836 1 146 . 1 1 43 43 LEU H H 43 8.820 8.820 8.461 0.359 17919 59837 1 146 . 1 1 44 44 ILE N N 44 121.920 121.920 123.200 -1.280 17919 59838 1 146 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.784 0.208 17919 59839 1 146 . 1 1 44 44 ILE C C 44 176.060 176.060 174.238 1.822 17919 59840 1 146 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.220 -1.240 17919 59841 1 146 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.428 -0.008 17919 59842 1 146 . 1 1 44 44 ILE H H 44 9.030 9.030 8.113 0.917 17919 59843 1 146 . 1 1 45 45 PHE N N 45 125.390 125.390 127.407 -2.017 17919 59844 1 146 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.020 0.025 17919 59845 1 146 . 1 1 45 45 PHE C C 45 174.470 174.470 174.344 0.126 17919 59846 1 146 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.438 0.582 17919 59847 1 146 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.743 1.017 17919 59848 1 146 . 1 1 45 45 PHE H H 45 8.830 8.830 8.948 -0.118 17919 59849 1 146 . 1 1 46 46 ALA N N 46 132.200 132.200 130.361 1.839 17919 59850 1 146 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.607 0.083 17919 59851 1 146 . 1 1 46 46 ALA C C 46 177.290 177.290 177.544 -0.254 17919 59852 1 146 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.358 0.182 17919 59853 1 146 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.008 0.562 17919 59854 1 146 . 1 1 46 46 ALA H H 46 8.810 8.810 8.879 -0.069 17919 59855 1 146 . 1 1 47 47 GLY N N 47 102.340 102.340 104.474 -2.134 17919 59856 1 146 . 1 1 47 47 GLY C C 47 173.810 173.810 174.102 -0.292 17919 59857 1 146 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.961 0.389 17919 59858 1 146 . 1 1 47 47 GLY H H 47 8.130 8.130 8.473 -0.343 17919 59859 1 146 . 1 1 48 48 LYS N N 48 121.570 121.570 122.166 -0.596 17919 59860 1 146 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.535 0.087 17919 59861 1 146 . 1 1 48 48 LYS C C 48 174.700 174.700 175.298 -0.598 17919 59862 1 146 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.598 -0.048 17919 59863 1 146 . 1 1 48 48 LYS CB C 48 34.530 34.530 33.641 0.889 17919 59864 1 146 . 1 1 48 48 LYS H H 48 7.980 7.980 7.753 0.227 17919 59865 1 146 . 1 1 49 49 GLN N N 49 122.410 122.410 126.439 -4.029 17919 59866 1 146 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.349 0.211 17919 59867 1 146 . 1 1 49 49 GLN C C 49 175.670 175.670 175.889 -0.219 17919 59868 1 146 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.655 -0.915 17919 59869 1 146 . 1 1 49 49 GLN CB C 49 29.000 29.000 28.885 0.115 17919 59870 1 146 . 1 1 49 49 GLN H H 49 8.600 8.600 8.707 -0.107 17919 59871 1 146 . 1 1 50 50 LEU N N 50 125.520 125.520 125.650 -0.130 17919 59872 1 146 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.122 -0.032 17919 59873 1 146 . 1 1 50 50 LEU C C 50 176.660 176.660 176.713 -0.053 17919 59874 1 146 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.141 0.099 17919 59875 1 146 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.735 -0.165 17919 59876 1 146 . 1 1 50 50 LEU H H 50 8.530 8.530 8.130 0.400 17919 59877 1 146 . 1 1 51 51 GLU N N 51 122.940 122.940 122.001 0.939 17919 59878 1 146 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.377 0.111 17919 59879 1 146 . 1 1 51 51 GLU C C 51 175.870 175.870 176.810 -0.940 17919 59880 1 146 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.659 0.301 17919 59881 1 146 . 1 1 51 51 GLU CB C 51 31.570 31.570 30.773 0.797 17919 59882 1 146 . 1 1 51 51 GLU H H 51 8.400 8.400 8.190 0.210 17919 59883 1 146 . 1 1 52 52 ASP N N 52 120.030 120.030 127.028 -6.998 17919 59884 1 146 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.408 -0.049 17919 59885 1 146 . 1 1 52 52 ASP C C 52 177.330 177.330 177.246 0.084 17919 59886 1 146 . 1 1 52 52 ASP CA C 52 56.960 56.960 56.814 0.146 17919 59887 1 146 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.981 -0.131 17919 59888 1 146 . 1 1 52 52 ASP H H 52 8.160 8.160 8.748 -0.588 17919 59889 1 146 . 1 1 53 53 GLY N N 53 106.660 106.660 103.860 2.800 17919 59890 1 146 . 1 1 53 53 GLY C C 53 174.870 174.870 174.231 0.639 17919 59891 1 146 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.753 0.417 17919 59892 1 146 . 1 1 53 53 GLY H H 53 9.390 9.390 8.495 0.895 17919 59893 1 146 . 1 1 54 54 ARG N N 54 119.050 119.050 119.341 -0.291 17919 59894 1 146 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.643 0.052 17919 59895 1 146 . 1 1 54 54 ARG C C 54 175.350 175.350 175.160 0.190 17919 59896 1 146 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.428 -0.038 17919 59897 1 146 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.715 -1.065 17919 59898 1 146 . 1 1 54 54 ARG H H 54 7.460 7.460 7.495 -0.035 17919 59899 1 146 . 1 1 55 55 THR N N 55 108.400 108.400 112.423 -4.023 17919 59900 1 146 . 1 1 55 55 THR HA H 55 5.240 5.240 4.976 0.264 17919 59901 1 146 . 1 1 55 55 THR C C 55 176.560 176.560 176.100 0.460 17919 59902 1 146 . 1 1 55 55 THR CA C 55 59.690 59.690 59.917 -0.227 17919 59903 1 146 . 1 1 55 55 THR CB C 55 72.260 72.260 70.937 1.323 17919 59904 1 146 . 1 1 55 55 THR H H 55 8.730 8.730 9.383 -0.653 17919 59905 1 146 . 1 1 56 56 LEU N N 56 117.920 117.920 119.862 -1.942 17919 59906 1 146 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.004 0.056 17919 59907 1 146 . 1 1 56 56 LEU C C 56 180.810 180.810 178.578 2.232 17919 59908 1 146 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.460 0.250 17919 59909 1 146 . 1 1 56 56 LEU CB C 56 40.370 40.370 40.744 -0.374 17919 59910 1 146 . 1 1 56 56 LEU H H 56 8.140 8.140 8.258 -0.118 17919 59911 1 146 . 1 1 57 57 SER N N 57 113.330 113.330 111.447 1.883 17919 59912 1 146 . 1 1 57 57 SER HA H 57 4.370 4.370 4.385 -0.015 17919 59913 1 146 . 1 1 57 57 SER C C 57 178.310 178.310 175.172 3.138 17919 59914 1 146 . 1 1 57 57 SER CA C 57 61.080 61.080 60.553 0.527 17919 59915 1 146 . 1 1 57 57 SER CB C 57 62.530 62.530 63.024 -0.494 17919 59916 1 146 . 1 1 57 57 SER H H 57 8.470 8.470 7.585 0.885 17919 59917 1 146 . 1 1 58 58 ASP N N 58 124.190 124.190 120.770 3.420 17919 59918 1 146 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.221 0.075 17919 59919 1 146 . 1 1 58 58 ASP C C 58 177.400 177.400 176.781 0.619 17919 59920 1 146 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.470 0.710 17919 59921 1 146 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.587 -0.487 17919 59922 1 146 . 1 1 58 58 ASP H H 58 7.930 7.930 7.600 0.330 17919 59923 1 146 . 1 1 59 59 TYR N N 59 115.510 115.510 115.229 0.281 17919 59924 1 146 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.768 -0.098 17919 59925 1 146 . 1 1 59 59 TYR C C 59 174.700 174.700 174.759 -0.059 17919 59926 1 146 . 1 1 59 59 TYR CA C 59 58.250 58.250 56.391 1.859 17919 59927 1 146 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.761 1.309 17919 59928 1 146 . 1 1 59 59 TYR H H 59 7.250 7.250 7.312 -0.062 17919 59929 1 146 . 1 1 60 60 ASN N N 60 115.900 115.900 117.373 -1.473 17919 59930 1 146 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.403 -0.048 17919 59931 1 146 . 1 1 60 60 ASN C C 60 174.340 174.340 174.723 -0.383 17919 59932 1 146 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.061 0.059 17919 59933 1 146 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.560 -0.150 17919 59934 1 146 . 1 1 60 60 ASN H H 60 8.150 8.150 8.003 0.147 17919 59935 1 146 . 1 1 61 61 ILE N N 61 118.600 118.600 119.872 -1.272 17919 59936 1 146 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.837 -0.444 17919 59937 1 146 . 1 1 61 61 ILE C C 61 174.610 174.610 175.410 -0.800 17919 59938 1 146 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.126 0.294 17919 59939 1 146 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.089 -0.349 17919 59940 1 146 . 1 1 61 61 ILE H H 61 7.250 7.250 8.377 -1.127 17919 59941 1 146 . 1 1 62 62 GLN N N 62 124.740 124.740 125.751 -1.011 17919 59942 1 146 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.635 -0.129 17919 59943 1 146 . 1 1 62 62 GLN C C 62 175.970 175.970 175.684 0.286 17919 59944 1 146 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.656 0.004 17919 59945 1 146 . 1 1 62 62 GLN CB C 62 31.650 31.650 32.779 -1.129 17919 59946 1 146 . 1 1 62 62 GLN H H 62 7.610 7.610 7.957 -0.347 17919 59947 1 146 . 1 1 63 63 LYS N N 63 120.300 120.300 123.356 -3.056 17919 59948 1 146 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.806 0.195 17919 59949 1 146 . 1 1 63 63 LYS C C 63 175.810 175.810 176.637 -0.827 17919 59950 1 146 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.909 -0.119 17919 59951 1 146 . 1 1 63 63 LYS CB C 63 32.650 32.650 30.854 1.796 17919 59952 1 146 . 1 1 63 63 LYS H H 63 8.490 8.490 8.853 -0.363 17919 59953 1 146 . 1 1 64 64 GLU N N 64 113.950 113.950 119.125 -5.175 17919 59954 1 146 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.852 -0.387 17919 59955 1 146 . 1 1 64 64 GLU C C 64 175.250 175.250 175.204 0.046 17919 59956 1 146 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.542 0.348 17919 59957 1 146 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.367 -2.467 17919 59958 1 146 . 1 1 64 64 GLU H H 64 9.280 9.280 8.844 0.436 17919 59959 1 146 . 1 1 65 65 SER N N 65 114.730 114.730 114.779 -0.049 17919 59960 1 146 . 1 1 65 65 SER HA H 65 4.640 4.640 4.637 0.003 17919 59961 1 146 . 1 1 65 65 SER C C 65 172.160 172.160 173.685 -1.525 17919 59962 1 146 . 1 1 65 65 SER CA C 65 60.890 60.890 60.027 0.863 17919 59963 1 146 . 1 1 65 65 SER CB C 65 64.910 64.910 64.385 0.525 17919 59964 1 146 . 1 1 65 65 SER H H 65 7.670 7.670 7.715 -0.045 17919 59965 1 146 . 1 1 66 66 THR N N 66 117.110 117.110 116.158 0.952 17919 59966 1 146 . 1 1 66 66 THR HA H 66 5.270 5.270 5.032 0.238 17919 59967 1 146 . 1 1 66 66 THR C C 66 173.950 173.950 173.944 0.006 17919 59968 1 146 . 1 1 66 66 THR CA C 66 62.340 62.340 62.172 0.168 17919 59969 1 146 . 1 1 66 66 THR CB C 66 70.080 70.080 71.170 -1.090 17919 59970 1 146 . 1 1 66 66 THR H H 66 8.730 8.730 8.467 0.263 17919 59971 1 146 . 1 1 67 67 LEU N N 67 127.110 127.110 125.239 1.871 17919 59972 1 146 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.983 0.077 17919 59973 1 146 . 1 1 67 67 LEU C C 67 175.770 175.770 175.558 0.212 17919 59974 1 146 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.373 -0.473 17919 59975 1 146 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.978 0.282 17919 59976 1 146 . 1 1 67 67 LEU H H 67 9.410 9.410 8.721 0.689 17919 59977 1 146 . 1 1 68 68 HIS N N 68 118.380 118.380 120.260 -1.880 17919 59978 1 146 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.177 0.063 17919 59979 1 146 . 1 1 68 68 HIS C C 68 173.150 173.150 174.418 -1.268 17919 59980 1 146 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.224 0.776 17919 59981 1 146 . 1 1 68 68 HIS CB C 68 30.530 30.530 31.629 -1.099 17919 59982 1 146 . 1 1 68 68 HIS H H 68 9.230 9.230 8.884 0.346 17919 59983 1 146 . 1 1 69 69 LEU N N 69 124.460 124.460 127.320 -2.860 17919 59984 1 146 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.767 0.423 17919 59985 1 146 . 1 1 69 69 LEU C C 69 175.270 175.270 174.644 0.626 17919 59986 1 146 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.318 -0.428 17919 59987 1 146 . 1 1 69 69 LEU CB C 69 44.380 44.380 43.130 1.250 17919 59988 1 146 . 1 1 69 69 LEU H H 69 8.340 8.340 8.219 0.121 17919 59989 1 146 . 1 1 70 70 VAL N N 70 126.940 126.940 122.215 4.725 17919 59990 1 146 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.410 -0.060 17919 59991 1 146 . 1 1 70 70 VAL C C 70 174.000 174.000 174.153 -0.153 17919 59992 1 146 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.544 1.256 17919 59993 1 146 . 1 1 70 70 VAL CB C 70 34.910 34.910 34.617 0.293 17919 59994 1 146 . 1 1 70 70 VAL H H 70 9.200 9.200 7.999 1.201 17919 59995 1 146 . 1 1 71 71 LEU N N 71 123.130 123.130 128.332 -5.202 17919 59996 1 146 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.346 0.714 17919 59997 1 146 . 1 1 71 71 LEU C C 71 177.830 177.830 177.090 0.740 17919 59998 1 146 . 1 1 71 71 LEU CA C 71 53.940 53.940 55.635 -1.695 17919 59999 1 146 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.210 0.640 17919 60000 1 146 . 1 1 71 71 LEU H H 71 8.120 8.120 8.530 -0.410 17919 60001 1 146 . 1 1 72 72 ARG N N 72 123.490 123.490 126.860 -3.370 17919 60002 1 146 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.509 -0.208 17919 60003 1 146 . 1 1 72 72 ARG C C 72 175.350 175.350 175.434 -0.084 17919 60004 1 146 . 1 1 72 72 ARG CA C 72 55.610 55.610 54.594 1.016 17919 60005 1 146 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.189 1.161 17919 60006 1 146 . 1 1 72 72 ARG H H 72 8.580 8.580 7.954 0.626 17919 60007 1 147 . 1 1 2 2 GLN N N 2 123.220 123.220 122.594 0.626 17919 60008 1 147 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.473 -0.224 17919 60009 1 147 . 1 1 2 2 GLN C C 2 175.920 175.920 175.466 0.454 17919 60010 1 147 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.193 0.887 17919 60011 1 147 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.353 0.407 17919 60012 1 147 . 1 1 2 2 GLN H H 2 8.900 8.900 8.645 0.255 17919 60013 1 147 . 1 1 3 3 ILE N N 3 115.340 115.340 116.126 -0.786 17919 60014 1 147 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.171 0.042 17919 60015 1 147 . 1 1 3 3 ILE C C 3 172.450 172.450 173.597 -1.147 17919 60016 1 147 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.611 -0.042 17919 60017 1 147 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.872 0.338 17919 60018 1 147 . 1 1 3 3 ILE H H 3 8.320 8.320 8.637 -0.317 17919 60019 1 147 . 1 1 4 4 PHE N N 4 118.110 118.110 118.603 -0.493 17919 60020 1 147 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.506 0.124 17919 60021 1 147 . 1 1 4 4 PHE C C 4 175.320 175.320 174.938 0.382 17919 60022 1 147 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.679 -0.469 17919 60023 1 147 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.910 -0.430 17919 60024 1 147 . 1 1 4 4 PHE H H 4 8.610 8.610 7.937 0.673 17919 60025 1 147 . 1 1 5 5 VAL N N 5 121.000 121.000 123.515 -2.515 17919 60026 1 147 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.688 0.037 17919 60027 1 147 . 1 1 5 5 VAL C C 5 174.870 174.870 174.787 0.083 17919 60028 1 147 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.242 -0.622 17919 60029 1 147 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.006 1.224 17919 60030 1 147 . 1 1 5 5 VAL H H 5 9.300 9.300 9.258 0.042 17919 60031 1 147 . 1 1 6 6 LYS N N 6 127.520 127.520 129.719 -2.199 17919 60032 1 147 . 1 1 6 6 LYS HA H 6 5.367 5.367 4.886 0.481 17919 60033 1 147 . 1 1 6 6 LYS C C 6 177.140 177.140 176.061 1.079 17919 60034 1 147 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.608 -0.088 17919 60035 1 147 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.820 0.230 17919 60036 1 147 . 1 1 6 6 LYS H H 6 8.820 8.820 8.875 -0.055 17919 60037 1 147 . 1 1 7 7 THR N N 7 115.400 115.400 117.653 -2.253 17919 60038 1 147 . 1 1 7 7 THR HA H 7 4.970 4.970 4.417 0.553 17919 60039 1 147 . 1 1 7 7 THR C C 7 176.910 176.910 176.279 0.631 17919 60040 1 147 . 1 1 7 7 THR CA C 7 60.470 60.470 60.302 0.168 17919 60041 1 147 . 1 1 7 7 THR CB C 7 70.630 70.630 70.217 0.413 17919 60042 1 147 . 1 1 7 7 THR H H 7 8.730 8.730 8.348 0.382 17919 60043 1 147 . 1 1 8 8 LEU N N 8 121.330 121.330 121.197 0.133 17919 60044 1 147 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.181 0.129 17919 60045 1 147 . 1 1 8 8 LEU C C 8 178.800 178.800 177.901 0.899 17919 60046 1 147 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.745 -0.165 17919 60047 1 147 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.968 0.002 17919 60048 1 147 . 1 1 8 8 LEU H H 8 9.100 9.100 8.804 0.296 17919 60049 1 147 . 1 1 9 9 THR N N 9 105.590 105.590 106.915 -1.325 17919 60050 1 147 . 1 1 9 9 THR HA H 9 4.428 4.428 4.311 0.117 17919 60051 1 147 . 1 1 9 9 THR C C 9 175.520 175.520 175.445 0.075 17919 60052 1 147 . 1 1 9 9 THR CA C 9 61.400 61.400 61.843 -0.443 17919 60053 1 147 . 1 1 9 9 THR CB C 9 69.140 69.140 69.443 -0.303 17919 60054 1 147 . 1 1 9 9 THR H H 9 7.630 7.630 7.685 -0.055 17919 60055 1 147 . 1 1 10 10 GLY N N 10 108.890 108.890 111.120 -2.230 17919 60056 1 147 . 1 1 10 10 GLY C C 10 174.070 174.070 174.105 -0.035 17919 60057 1 147 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.705 0.755 17919 60058 1 147 . 1 1 10 10 GLY H H 10 7.810 7.810 7.653 0.157 17919 60059 1 147 . 1 1 11 11 LYS N N 11 121.600 121.600 121.242 0.358 17919 60060 1 147 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.401 -0.040 17919 60061 1 147 . 1 1 11 11 LYS C C 11 175.940 175.940 175.538 0.402 17919 60062 1 147 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.580 -0.300 17919 60063 1 147 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.488 -0.288 17919 60064 1 147 . 1 1 11 11 LYS H H 11 7.280 7.280 7.754 -0.474 17919 60065 1 147 . 1 1 12 12 THR N N 12 120.440 120.440 116.751 3.689 17919 60066 1 147 . 1 1 12 12 THR HA H 12 5.046 5.046 5.316 -0.270 17919 60067 1 147 . 1 1 12 12 THR C C 12 174.320 174.320 173.510 0.810 17919 60068 1 147 . 1 1 12 12 THR CA C 12 62.390 62.390 61.316 1.074 17919 60069 1 147 . 1 1 12 12 THR CB C 12 69.910 69.910 71.805 -1.895 17919 60070 1 147 . 1 1 12 12 THR H H 12 8.650 8.650 8.219 0.431 17919 60071 1 147 . 1 1 13 13 ILE N N 13 127.110 127.110 125.439 1.671 17919 60072 1 147 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.414 0.130 17919 60073 1 147 . 1 1 13 13 ILE C C 13 175.220 175.220 174.392 0.828 17919 60074 1 147 . 1 1 13 13 ILE CA C 13 59.980 59.980 61.088 -1.108 17919 60075 1 147 . 1 1 13 13 ILE CB C 13 40.950 40.950 42.498 -1.548 17919 60076 1 147 . 1 1 13 13 ILE H H 13 9.450 9.450 8.790 0.660 17919 60077 1 147 . 1 1 14 14 THR N N 14 121.520 121.520 122.935 -1.415 17919 60078 1 147 . 1 1 14 14 THR HA H 14 4.964 4.964 5.158 -0.194 17919 60079 1 147 . 1 1 14 14 THR C C 14 173.790 173.790 174.014 -0.224 17919 60080 1 147 . 1 1 14 14 THR CA C 14 61.940 61.940 62.249 -0.309 17919 60081 1 147 . 1 1 14 14 THR CB C 14 69.650 69.650 69.498 0.153 17919 60082 1 147 . 1 1 14 14 THR H H 14 8.710 8.710 8.501 0.209 17919 60083 1 147 . 1 1 15 15 LEU N N 15 124.800 124.800 127.182 -2.382 17919 60084 1 147 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.757 0.023 17919 60085 1 147 . 1 1 15 15 LEU C C 15 174.670 174.670 175.178 -0.508 17919 60086 1 147 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.625 -0.795 17919 60087 1 147 . 1 1 15 15 LEU CB C 15 47.070 47.070 44.905 2.165 17919 60088 1 147 . 1 1 15 15 LEU H H 15 8.710 8.710 8.889 -0.179 17919 60089 1 147 . 1 1 16 16 GLU N N 16 122.160 122.160 123.075 -0.915 17919 60090 1 147 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.990 -0.073 17919 60091 1 147 . 1 1 16 16 GLU C C 16 175.860 175.860 176.269 -0.409 17919 60092 1 147 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.401 -0.582 17919 60093 1 147 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.105 -0.655 17919 60094 1 147 . 1 1 16 16 GLU H H 16 8.140 8.140 8.582 -0.442 17919 60095 1 147 . 1 1 17 17 VAL N N 17 117.210 117.210 120.707 -3.497 17919 60096 1 147 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.596 0.118 17919 60097 1 147 . 1 1 17 17 VAL C C 17 174.160 174.160 174.062 0.098 17919 60098 1 147 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.441 -1.011 17919 60099 1 147 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.205 1.195 17919 60100 1 147 . 1 1 17 17 VAL H H 17 8.900 8.900 8.871 0.029 17919 60101 1 147 . 1 1 18 18 GLU N N 18 118.990 118.990 118.962 0.028 17919 60102 1 147 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.783 0.296 17919 60103 1 147 . 1 1 18 18 GLU C C 18 176.160 176.160 175.236 0.924 17919 60104 1 147 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.772 -0.052 17919 60105 1 147 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.611 -0.301 17919 60106 1 147 . 1 1 18 18 GLU H H 18 8.640 8.640 8.392 0.248 17919 60107 1 147 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.251 -0.110 17919 60108 1 147 . 1 1 19 19 PRO C C 19 175.310 175.310 177.594 -2.284 17919 60109 1 147 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.466 0.004 17919 60110 1 147 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.925 0.025 17919 60111 1 147 . 1 1 20 20 SER N N 20 103.400 103.400 108.469 -5.069 17919 60112 1 147 . 1 1 20 20 SER HA H 20 4.370 4.370 4.324 0.046 17919 60113 1 147 . 1 1 20 20 SER C C 20 174.660 174.660 174.606 0.054 17919 60114 1 147 . 1 1 20 20 SER CA C 20 57.400 57.400 59.027 -1.627 17919 60115 1 147 . 1 1 20 20 SER CB C 20 63.370 63.370 62.903 0.467 17919 60116 1 147 . 1 1 20 20 SER H H 20 7.040 7.040 7.966 -0.926 17919 60117 1 147 . 1 1 21 21 ASP N N 21 123.480 123.480 124.219 -0.739 17919 60118 1 147 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.730 -0.035 17919 60119 1 147 . 1 1 21 21 ASP C C 21 176.360 176.360 176.082 0.278 17919 60120 1 147 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.868 0.832 17919 60121 1 147 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.737 -0.937 17919 60122 1 147 . 1 1 21 21 ASP H H 21 8.030 8.030 8.084 -0.054 17919 60123 1 147 . 1 1 22 22 THR N N 22 108.800 108.800 112.808 -4.008 17919 60124 1 147 . 1 1 22 22 THR HA H 22 4.920 4.920 4.818 0.102 17919 60125 1 147 . 1 1 22 22 THR C C 22 176.750 176.750 175.998 0.752 17919 60126 1 147 . 1 1 22 22 THR CA C 22 59.690 59.690 61.300 -1.610 17919 60127 1 147 . 1 1 22 22 THR CB C 22 71.200 71.200 70.548 0.652 17919 60128 1 147 . 1 1 22 22 THR H H 22 7.900 7.900 8.286 -0.386 17919 60129 1 147 . 1 1 23 23 ILE N N 23 121.190 121.190 123.130 -1.940 17919 60130 1 147 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.753 -0.096 17919 60131 1 147 . 1 1 23 23 ILE C C 23 179.040 179.040 177.614 1.426 17919 60132 1 147 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.409 -0.149 17919 60133 1 147 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.375 -2.025 17919 60134 1 147 . 1 1 23 23 ILE H H 23 8.560 8.560 9.144 -0.584 17919 60135 1 147 . 1 1 24 24 GLU N N 24 120.830 120.830 120.946 -0.116 17919 60136 1 147 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.867 0.050 17919 60137 1 147 . 1 1 24 24 GLU C C 24 178.640 178.640 178.783 -0.143 17919 60138 1 147 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.137 0.083 17919 60139 1 147 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.461 -1.181 17919 60140 1 147 . 1 1 24 24 GLU H H 24 9.760 9.760 8.261 1.499 17919 60141 1 147 . 1 1 25 25 ASN N N 25 120.570 120.570 116.885 3.685 17919 60142 1 147 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.544 -0.019 17919 60143 1 147 . 1 1 25 25 ASN C C 25 178.380 178.380 178.145 0.235 17919 60144 1 147 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.723 0.337 17919 60145 1 147 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.469 -0.019 17919 60146 1 147 . 1 1 25 25 ASN H H 25 7.920 7.920 7.485 0.435 17919 60147 1 147 . 1 1 26 26 VAL N N 26 121.710 121.710 121.039 0.671 17919 60148 1 147 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.609 -0.212 17919 60149 1 147 . 1 1 26 26 VAL C C 26 177.950 177.950 177.978 -0.028 17919 60150 1 147 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.709 0.951 17919 60151 1 147 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.693 -0.853 17919 60152 1 147 . 1 1 26 26 VAL H H 26 8.070 8.070 8.137 -0.067 17919 60153 1 147 . 1 1 27 27 LYS N N 27 118.860 118.860 119.712 -0.852 17919 60154 1 147 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.320 0.260 17919 60155 1 147 . 1 1 27 27 LYS C C 27 180.550 180.550 178.917 1.633 17919 60156 1 147 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.239 0.012 17919 60157 1 147 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.343 1.387 17919 60158 1 147 . 1 1 27 27 LYS H H 27 8.560 8.560 8.239 0.321 17919 60159 1 147 . 1 1 28 28 ALA N N 28 123.440 123.440 122.321 1.119 17919 60160 1 147 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.156 0.004 17919 60161 1 147 . 1 1 28 28 ALA C C 28 180.300 180.300 179.129 1.171 17919 60162 1 147 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.846 0.524 17919 60163 1 147 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.196 -0.486 17919 60164 1 147 . 1 1 28 28 ALA H H 28 8.060 8.060 8.327 -0.267 17919 60165 1 147 . 1 1 29 29 LYS N N 29 119.940 119.940 119.737 0.203 17919 60166 1 147 . 1 1 29 29 LYS HA H 29 4.207 4.207 3.974 0.233 17919 60167 1 147 . 1 1 29 29 LYS C C 29 180.320 180.320 178.742 1.578 17919 60168 1 147 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.355 0.295 17919 60169 1 147 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.264 1.026 17919 60170 1 147 . 1 1 29 29 LYS H H 29 7.850 7.850 7.376 0.474 17919 60171 1 147 . 1 1 30 30 ILE N N 30 121.080 121.080 119.531 1.549 17919 60172 1 147 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.565 -0.058 17919 60173 1 147 . 1 1 30 30 ILE C C 30 178.310 178.310 177.523 0.787 17919 60174 1 147 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.187 0.963 17919 60175 1 147 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.684 -0.884 17919 60176 1 147 . 1 1 30 30 ILE H H 30 8.280 8.280 7.757 0.523 17919 60177 1 147 . 1 1 31 31 GLN N N 31 123.490 123.490 120.699 2.791 17919 60178 1 147 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.051 -0.222 17919 60179 1 147 . 1 1 31 31 GLN C C 31 178.890 178.890 178.279 0.611 17919 60180 1 147 . 1 1 31 31 GLN CA C 31 60.000 60.000 58.989 1.010 17919 60181 1 147 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.526 -0.806 17919 60182 1 147 . 1 1 31 31 GLN H H 31 8.580 8.580 8.431 0.149 17919 60183 1 147 . 1 1 32 32 ASP N N 32 119.360 119.360 118.328 1.032 17919 60184 1 147 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.393 -0.039 17919 60185 1 147 . 1 1 32 32 ASP C C 32 177.250 177.250 177.850 -0.600 17919 60186 1 147 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.556 0.634 17919 60187 1 147 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.817 -0.237 17919 60188 1 147 . 1 1 32 32 ASP H H 32 8.010 8.010 7.880 0.130 17919 60189 1 147 . 1 1 33 33 LYS N N 33 115.130 115.130 117.943 -2.813 17919 60190 1 147 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.356 -0.019 17919 60191 1 147 . 1 1 33 33 LYS C C 33 177.870 177.870 177.555 0.315 17919 60192 1 147 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.517 0.532 17919 60193 1 147 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.956 0.214 17919 60194 1 147 . 1 1 33 33 LYS H H 33 7.430 7.430 7.420 0.010 17919 60195 1 147 . 1 1 34 34 GLU N N 34 113.870 113.870 117.036 -3.166 17919 60196 1 147 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.535 0.090 17919 60197 1 147 . 1 1 34 34 GLU C C 34 177.840 177.840 176.737 1.103 17919 60198 1 147 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.794 -0.624 17919 60199 1 147 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.192 1.468 17919 60200 1 147 . 1 1 34 34 GLU H H 34 8.740 8.740 7.869 0.871 17919 60201 1 147 . 1 1 35 35 GLY N N 35 108.650 108.650 109.714 -1.064 17919 60202 1 147 . 1 1 35 35 GLY C C 35 173.960 173.960 174.847 -0.887 17919 60203 1 147 . 1 1 35 35 GLY CA C 35 46.080 46.080 46.261 -0.181 17919 60204 1 147 . 1 1 35 35 GLY H H 35 8.530 8.530 8.156 0.374 17919 60205 1 147 . 1 1 36 36 ILE N N 36 119.880 119.880 119.127 0.753 17919 60206 1 147 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.382 0.063 17919 60207 1 147 . 1 1 36 36 ILE C C 36 173.590 173.590 174.350 -0.760 17919 60208 1 147 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.404 0.346 17919 60209 1 147 . 1 1 36 36 ILE CB C 36 40.580 40.580 37.290 3.290 17919 60210 1 147 . 1 1 36 36 ILE H H 36 6.150 6.150 7.757 -1.607 17919 60211 1 147 . 1 1 37 37 PRO HA H 37 4.634 4.634 5.030 -0.396 17919 60212 1 147 . 1 1 37 37 PRO C C 37 176.940 176.940 176.978 -0.038 17919 60213 1 147 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.162 0.498 17919 60214 1 147 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.427 0.423 17919 60215 1 147 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.207 -0.090 17919 60216 1 147 . 1 1 38 38 PRO C C 38 178.320 178.320 178.225 0.095 17919 60217 1 147 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.219 1.041 17919 60218 1 147 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.730 1.160 17919 60219 1 147 . 1 1 39 39 ASP N N 39 113.380 113.380 117.990 -4.610 17919 60220 1 147 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.268 0.162 17919 60221 1 147 . 1 1 39 39 ASP C C 39 177.090 177.090 178.515 -1.425 17919 60222 1 147 . 1 1 39 39 ASP CA C 39 55.640 55.640 57.865 -2.225 17919 60223 1 147 . 1 1 39 39 ASP CB C 39 39.540 39.540 39.782 -0.242 17919 60224 1 147 . 1 1 39 39 ASP H H 39 8.550 8.550 8.620 -0.070 17919 60225 1 147 . 1 1 40 40 GLN N N 40 116.780 116.780 115.515 1.265 17919 60226 1 147 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.340 0.124 17919 60227 1 147 . 1 1 40 40 GLN C C 40 175.380 175.380 176.444 -1.064 17919 60228 1 147 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.920 -0.280 17919 60229 1 147 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.302 0.838 17919 60230 1 147 . 1 1 40 40 GLN H H 40 7.820 7.820 8.087 -0.267 17919 60231 1 147 . 1 1 41 41 GLN N N 41 117.720 117.720 119.512 -1.792 17919 60232 1 147 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.294 -0.050 17919 60233 1 147 . 1 1 41 41 GLN C C 41 176.300 176.300 175.808 0.492 17919 60234 1 147 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.680 -0.210 17919 60235 1 147 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.378 2.272 17919 60236 1 147 . 1 1 41 41 GLN H H 41 7.480 7.480 7.368 0.112 17919 60237 1 147 . 1 1 42 42 ARG N N 42 122.680 122.680 123.069 -0.389 17919 60238 1 147 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.658 -0.158 17919 60239 1 147 . 1 1 42 42 ARG C C 42 174.050 174.050 174.601 -0.551 17919 60240 1 147 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.032 0.017 17919 60241 1 147 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.076 -1.326 17919 60242 1 147 . 1 1 42 42 ARG H H 42 8.530 8.530 8.854 -0.324 17919 60243 1 147 . 1 1 43 43 LEU N N 43 124.040 124.040 125.983 -1.943 17919 60244 1 147 . 1 1 43 43 LEU C C 43 175.290 175.290 175.671 -0.381 17919 60245 1 147 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.343 -1.363 17919 60246 1 147 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.085 1.705 17919 60247 1 147 . 1 1 43 43 LEU H H 43 8.820 8.820 8.862 -0.042 17919 60248 1 147 . 1 1 44 44 ILE N N 44 121.920 121.920 122.435 -0.515 17919 60249 1 147 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.925 0.067 17919 60250 1 147 . 1 1 44 44 ILE C C 44 176.060 176.060 174.381 1.679 17919 60251 1 147 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.498 -1.518 17919 60252 1 147 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.056 0.363 17919 60253 1 147 . 1 1 44 44 ILE H H 44 9.030 9.030 9.176 -0.146 17919 60254 1 147 . 1 1 45 45 PHE N N 45 125.390 125.390 128.507 -3.117 17919 60255 1 147 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.049 -0.004 17919 60256 1 147 . 1 1 45 45 PHE C C 45 174.470 174.470 174.803 -0.333 17919 60257 1 147 . 1 1 45 45 PHE CA C 45 57.020 57.020 55.585 1.435 17919 60258 1 147 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.374 1.386 17919 60259 1 147 . 1 1 45 45 PHE H H 45 8.830 8.830 8.840 -0.010 17919 60260 1 147 . 1 1 46 46 ALA N N 46 132.200 132.200 129.804 2.396 17919 60261 1 147 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.632 0.058 17919 60262 1 147 . 1 1 46 46 ALA C C 46 177.290 177.290 178.152 -0.862 17919 60263 1 147 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.196 0.344 17919 60264 1 147 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.499 0.071 17919 60265 1 147 . 1 1 46 46 ALA H H 46 8.810 8.810 8.986 -0.176 17919 60266 1 147 . 1 1 47 47 GLY N N 47 102.340 102.340 102.250 0.090 17919 60267 1 147 . 1 1 47 47 GLY C C 47 173.810 173.810 174.332 -0.522 17919 60268 1 147 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.157 0.193 17919 60269 1 147 . 1 1 47 47 GLY H H 47 8.130 8.130 8.509 -0.379 17919 60270 1 147 . 1 1 48 48 LYS N N 48 121.570 121.570 120.407 1.163 17919 60271 1 147 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.652 -0.030 17919 60272 1 147 . 1 1 48 48 LYS C C 48 174.700 174.700 175.754 -1.054 17919 60273 1 147 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.667 -0.117 17919 60274 1 147 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.485 0.045 17919 60275 1 147 . 1 1 48 48 LYS H H 48 7.980 7.980 7.859 0.121 17919 60276 1 147 . 1 1 49 49 GLN N N 49 122.410 122.410 121.067 1.343 17919 60277 1 147 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.466 0.094 17919 60278 1 147 . 1 1 49 49 GLN C C 49 175.670 175.670 175.993 -0.323 17919 60279 1 147 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.008 -0.267 17919 60280 1 147 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.385 -0.385 17919 60281 1 147 . 1 1 49 49 GLN H H 49 8.600 8.600 8.514 0.086 17919 60282 1 147 . 1 1 50 50 LEU N N 50 125.520 125.520 125.524 -0.004 17919 60283 1 147 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.233 -0.143 17919 60284 1 147 . 1 1 50 50 LEU C C 50 176.660 176.660 175.644 1.016 17919 60285 1 147 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.895 0.345 17919 60286 1 147 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.463 -0.893 17919 60287 1 147 . 1 1 50 50 LEU H H 50 8.530 8.530 8.780 -0.250 17919 60288 1 147 . 1 1 51 51 GLU N N 51 122.940 122.940 123.216 -0.276 17919 60289 1 147 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.572 -0.084 17919 60290 1 147 . 1 1 51 51 GLU C C 51 175.870 175.870 176.478 -0.608 17919 60291 1 147 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.279 0.681 17919 60292 1 147 . 1 1 51 51 GLU CB C 51 31.570 31.570 33.050 -1.480 17919 60293 1 147 . 1 1 51 51 GLU H H 51 8.400 8.400 8.294 0.106 17919 60294 1 147 . 1 1 52 52 ASP N N 52 120.030 120.030 123.539 -3.509 17919 60295 1 147 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.633 -0.274 17919 60296 1 147 . 1 1 52 52 ASP C C 52 177.330 177.330 177.939 -0.609 17919 60297 1 147 . 1 1 52 52 ASP CA C 52 56.960 56.960 56.260 0.700 17919 60298 1 147 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.993 -0.143 17919 60299 1 147 . 1 1 52 52 ASP H H 52 8.160 8.160 8.802 -0.642 17919 60300 1 147 . 1 1 53 53 GLY N N 53 106.660 106.660 106.105 0.555 17919 60301 1 147 . 1 1 53 53 GLY C C 53 174.870 174.870 174.976 -0.106 17919 60302 1 147 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.193 -0.023 17919 60303 1 147 . 1 1 53 53 GLY H H 53 9.390 9.390 8.285 1.105 17919 60304 1 147 . 1 1 54 54 ARG N N 54 119.050 119.050 120.149 -1.099 17919 60305 1 147 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.438 0.257 17919 60306 1 147 . 1 1 54 54 ARG C C 54 175.350 175.350 176.039 -0.689 17919 60307 1 147 . 1 1 54 54 ARG CA C 54 54.390 54.390 55.456 -1.066 17919 60308 1 147 . 1 1 54 54 ARG CB C 54 32.650 32.650 31.357 1.293 17919 60309 1 147 . 1 1 54 54 ARG H H 54 7.460 7.460 7.352 0.108 17919 60310 1 147 . 1 1 55 55 THR N N 55 108.400 108.400 112.286 -3.886 17919 60311 1 147 . 1 1 55 55 THR HA H 55 5.240 5.240 4.790 0.450 17919 60312 1 147 . 1 1 55 55 THR C C 55 176.560 176.560 175.703 0.857 17919 60313 1 147 . 1 1 55 55 THR CA C 55 59.690 59.690 61.018 -1.328 17919 60314 1 147 . 1 1 55 55 THR CB C 55 72.260 72.260 71.162 1.098 17919 60315 1 147 . 1 1 55 55 THR H H 55 8.730 8.730 8.603 0.127 17919 60316 1 147 . 1 1 56 56 LEU N N 56 117.920 117.920 122.177 -4.257 17919 60317 1 147 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.057 0.003 17919 60318 1 147 . 1 1 56 56 LEU C C 56 180.810 180.810 178.549 2.261 17919 60319 1 147 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.041 0.669 17919 60320 1 147 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.923 -1.554 17919 60321 1 147 . 1 1 56 56 LEU H H 56 8.140 8.140 8.691 -0.551 17919 60322 1 147 . 1 1 57 57 SER N N 57 113.330 113.330 114.195 -0.865 17919 60323 1 147 . 1 1 57 57 SER HA H 57 4.370 4.370 4.049 0.321 17919 60324 1 147 . 1 1 57 57 SER C C 57 178.310 178.310 176.846 1.464 17919 60325 1 147 . 1 1 57 57 SER CA C 57 61.080 61.080 61.411 -0.331 17919 60326 1 147 . 1 1 57 57 SER CB C 57 62.530 62.530 62.697 -0.167 17919 60327 1 147 . 1 1 57 57 SER H H 57 8.470 8.470 7.820 0.650 17919 60328 1 147 . 1 1 58 58 ASP N N 58 124.190 124.190 121.153 3.037 17919 60329 1 147 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.309 -0.013 17919 60330 1 147 . 1 1 58 58 ASP C C 58 177.400 177.400 177.066 0.334 17919 60331 1 147 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.841 0.339 17919 60332 1 147 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.432 -0.332 17919 60333 1 147 . 1 1 58 58 ASP H H 58 7.930 7.930 7.843 0.087 17919 60334 1 147 . 1 1 59 59 TYR N N 59 115.510 115.510 115.391 0.119 17919 60335 1 147 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.620 0.050 17919 60336 1 147 . 1 1 59 59 TYR C C 59 174.700 174.700 175.016 -0.316 17919 60337 1 147 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.746 0.504 17919 60338 1 147 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.098 1.972 17919 60339 1 147 . 1 1 59 59 TYR H H 59 7.250 7.250 7.278 -0.028 17919 60340 1 147 . 1 1 60 60 ASN N N 60 115.900 115.900 114.481 1.419 17919 60341 1 147 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.334 0.021 17919 60342 1 147 . 1 1 60 60 ASN C C 60 174.340 174.340 174.619 -0.279 17919 60343 1 147 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.028 0.092 17919 60344 1 147 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.056 0.354 17919 60345 1 147 . 1 1 60 60 ASN H H 60 8.150 8.150 7.799 0.351 17919 60346 1 147 . 1 1 61 61 ILE N N 61 118.600 118.600 119.501 -0.901 17919 60347 1 147 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.760 -0.367 17919 60348 1 147 . 1 1 61 61 ILE C C 61 174.610 174.610 176.110 -1.500 17919 60349 1 147 . 1 1 61 61 ILE CA C 61 62.420 62.420 60.420 2.000 17919 60350 1 147 . 1 1 61 61 ILE CB C 61 36.740 36.740 36.149 0.591 17919 60351 1 147 . 1 1 61 61 ILE H H 61 7.250 7.250 7.413 -0.163 17919 60352 1 147 . 1 1 62 62 GLN N N 62 124.740 124.740 125.995 -1.255 17919 60353 1 147 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.665 -0.159 17919 60354 1 147 . 1 1 62 62 GLN C C 62 175.970 175.970 175.974 -0.004 17919 60355 1 147 . 1 1 62 62 GLN CA C 62 53.660 53.660 54.174 -0.514 17919 60356 1 147 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.420 0.230 17919 60357 1 147 . 1 1 62 62 GLN H H 62 7.610 7.610 7.974 -0.364 17919 60358 1 147 . 1 1 63 63 LYS N N 63 120.300 120.300 121.581 -1.281 17919 60359 1 147 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.862 0.139 17919 60360 1 147 . 1 1 63 63 LYS C C 63 175.810 175.810 176.981 -1.171 17919 60361 1 147 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.882 -0.091 17919 60362 1 147 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.927 0.723 17919 60363 1 147 . 1 1 63 63 LYS H H 63 8.490 8.490 8.797 -0.307 17919 60364 1 147 . 1 1 64 64 GLU N N 64 113.950 113.950 119.383 -5.433 17919 60365 1 147 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.521 -0.056 17919 60366 1 147 . 1 1 64 64 GLU C C 64 175.250 175.250 176.107 -0.857 17919 60367 1 147 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.861 0.029 17919 60368 1 147 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.468 -2.568 17919 60369 1 147 . 1 1 64 64 GLU H H 64 9.280 9.280 8.427 0.853 17919 60370 1 147 . 1 1 65 65 SER N N 65 114.730 114.730 114.192 0.538 17919 60371 1 147 . 1 1 65 65 SER HA H 65 4.640 4.640 4.558 0.082 17919 60372 1 147 . 1 1 65 65 SER C C 65 172.160 172.160 174.298 -2.138 17919 60373 1 147 . 1 1 65 65 SER CA C 65 60.890 60.890 60.113 0.777 17919 60374 1 147 . 1 1 65 65 SER CB C 65 64.910 64.910 64.370 0.540 17919 60375 1 147 . 1 1 65 65 SER H H 65 7.670 7.670 7.657 0.013 17919 60376 1 147 . 1 1 66 66 THR N N 66 117.110 117.110 119.812 -2.702 17919 60377 1 147 . 1 1 66 66 THR HA H 66 5.270 5.270 5.048 0.222 17919 60378 1 147 . 1 1 66 66 THR C C 66 173.950 173.950 174.184 -0.234 17919 60379 1 147 . 1 1 66 66 THR CA C 66 62.340 62.340 61.998 0.342 17919 60380 1 147 . 1 1 66 66 THR CB C 66 70.080 70.080 70.075 0.005 17919 60381 1 147 . 1 1 66 66 THR H H 66 8.730 8.730 8.487 0.243 17919 60382 1 147 . 1 1 67 67 LEU N N 67 127.110 127.110 128.731 -1.621 17919 60383 1 147 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.734 0.326 17919 60384 1 147 . 1 1 67 67 LEU C C 67 175.770 175.770 175.547 0.223 17919 60385 1 147 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.927 -0.027 17919 60386 1 147 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.851 0.409 17919 60387 1 147 . 1 1 67 67 LEU H H 67 9.410 9.410 9.047 0.363 17919 60388 1 147 . 1 1 68 68 HIS N N 68 118.380 118.380 122.489 -4.109 17919 60389 1 147 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.380 -0.140 17919 60390 1 147 . 1 1 68 68 HIS C C 68 173.150 173.150 173.761 -0.611 17919 60391 1 147 . 1 1 68 68 HIS CA C 68 55.000 55.000 55.073 -0.073 17919 60392 1 147 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.745 -2.215 17919 60393 1 147 . 1 1 68 68 HIS H H 68 9.230 9.230 9.002 0.228 17919 60394 1 147 . 1 1 69 69 LEU N N 69 124.460 124.460 127.168 -2.708 17919 60395 1 147 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.336 -0.146 17919 60396 1 147 . 1 1 69 69 LEU C C 69 175.270 175.270 175.034 0.236 17919 60397 1 147 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.925 -0.035 17919 60398 1 147 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.965 -0.585 17919 60399 1 147 . 1 1 69 69 LEU H H 69 8.340 8.340 7.637 0.703 17919 60400 1 147 . 1 1 70 70 VAL N N 70 126.940 126.940 126.118 0.822 17919 60401 1 147 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.468 -0.118 17919 60402 1 147 . 1 1 70 70 VAL C C 70 174.000 174.000 174.399 -0.399 17919 60403 1 147 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.229 0.571 17919 60404 1 147 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.285 -0.375 17919 60405 1 147 . 1 1 70 70 VAL H H 70 9.200 9.200 9.284 -0.084 17919 60406 1 147 . 1 1 71 71 LEU N N 71 123.130 123.130 123.678 -0.548 17919 60407 1 147 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.108 -0.048 17919 60408 1 147 . 1 1 71 71 LEU C C 71 177.830 177.830 176.827 1.003 17919 60409 1 147 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.206 0.734 17919 60410 1 147 . 1 1 71 71 LEU CB C 71 42.850 42.850 45.044 -2.194 17919 60411 1 147 . 1 1 71 71 LEU H H 71 8.120 8.120 8.525 -0.405 17919 60412 1 147 . 1 1 72 72 ARG N N 72 123.490 123.490 123.177 0.313 17919 60413 1 147 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.879 -0.578 17919 60414 1 147 . 1 1 72 72 ARG C C 72 175.350 175.350 174.401 0.949 17919 60415 1 147 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.098 0.512 17919 60416 1 147 . 1 1 72 72 ARG CB C 72 31.350 31.350 33.209 -1.859 17919 60417 1 147 . 1 1 72 72 ARG H H 72 8.580 8.580 8.420 0.160 17919 60418 1 148 . 1 1 2 2 GLN N N 2 123.220 123.220 126.092 -2.872 17919 60419 1 148 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.026 0.223 17919 60420 1 148 . 1 1 2 2 GLN C C 2 175.920 175.920 174.896 1.024 17919 60421 1 148 . 1 1 2 2 GLN CA C 2 55.080 55.080 55.897 -0.817 17919 60422 1 148 . 1 1 2 2 GLN CB C 2 30.760 30.760 29.969 0.791 17919 60423 1 148 . 1 1 2 2 GLN H H 2 8.900 8.900 8.535 0.365 17919 60424 1 148 . 1 1 3 3 ILE N N 3 115.340 115.340 117.733 -2.393 17919 60425 1 148 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.169 0.044 17919 60426 1 148 . 1 1 3 3 ILE C C 3 172.450 172.450 173.348 -0.898 17919 60427 1 148 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.471 0.099 17919 60428 1 148 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.608 0.602 17919 60429 1 148 . 1 1 3 3 ILE H H 3 8.320 8.320 8.250 0.070 17919 60430 1 148 . 1 1 4 4 PHE N N 4 118.110 118.110 120.559 -2.449 17919 60431 1 148 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.411 0.219 17919 60432 1 148 . 1 1 4 4 PHE C C 4 175.320 175.320 175.062 0.258 17919 60433 1 148 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.454 -0.244 17919 60434 1 148 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.899 -0.419 17919 60435 1 148 . 1 1 4 4 PHE H H 4 8.610 8.610 8.655 -0.045 17919 60436 1 148 . 1 1 5 5 VAL N N 5 121.000 121.000 122.520 -1.520 17919 60437 1 148 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.799 -0.074 17919 60438 1 148 . 1 1 5 5 VAL C C 5 174.870 174.870 174.548 0.322 17919 60439 1 148 . 1 1 5 5 VAL CA C 5 60.620 60.620 60.914 -0.294 17919 60440 1 148 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.855 -0.625 17919 60441 1 148 . 1 1 5 5 VAL H H 5 9.300 9.300 8.594 0.706 17919 60442 1 148 . 1 1 6 6 LYS N N 6 127.520 127.520 129.519 -1.999 17919 60443 1 148 . 1 1 6 6 LYS HA H 6 5.367 5.367 4.837 0.530 17919 60444 1 148 . 1 1 6 6 LYS C C 6 177.140 177.140 176.365 0.775 17919 60445 1 148 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.551 -0.031 17919 60446 1 148 . 1 1 6 6 LYS CB C 6 35.050 35.050 33.920 1.130 17919 60447 1 148 . 1 1 6 6 LYS H H 6 8.820 8.820 8.939 -0.119 17919 60448 1 148 . 1 1 7 7 THR N N 7 115.400 115.400 117.763 -2.363 17919 60449 1 148 . 1 1 7 7 THR HA H 7 4.970 4.970 4.500 0.470 17919 60450 1 148 . 1 1 7 7 THR C C 7 176.910 176.910 174.584 2.326 17919 60451 1 148 . 1 1 7 7 THR CA C 7 60.470 60.470 60.098 0.372 17919 60452 1 148 . 1 1 7 7 THR CB C 7 70.630 70.630 70.555 0.075 17919 60453 1 148 . 1 1 7 7 THR H H 7 8.730 8.730 8.159 0.571 17919 60454 1 148 . 1 1 8 8 LEU N N 8 121.330 121.330 119.978 1.352 17919 60455 1 148 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.310 0.000 17919 60456 1 148 . 1 1 8 8 LEU C C 8 178.800 178.800 178.468 0.332 17919 60457 1 148 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.823 -0.243 17919 60458 1 148 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.195 -0.225 17919 60459 1 148 . 1 1 8 8 LEU H H 8 9.100 9.100 8.478 0.622 17919 60460 1 148 . 1 1 9 9 THR N N 9 105.590 105.590 107.099 -1.509 17919 60461 1 148 . 1 1 9 9 THR HA H 9 4.428 4.428 4.200 0.228 17919 60462 1 148 . 1 1 9 9 THR C C 9 175.520 175.520 175.304 0.216 17919 60463 1 148 . 1 1 9 9 THR CA C 9 61.400 61.400 62.950 -1.550 17919 60464 1 148 . 1 1 9 9 THR CB C 9 69.140 69.140 69.079 0.062 17919 60465 1 148 . 1 1 9 9 THR H H 9 7.630 7.630 7.982 -0.352 17919 60466 1 148 . 1 1 10 10 GLY N N 10 108.890 108.890 110.987 -2.097 17919 60467 1 148 . 1 1 10 10 GLY C C 10 174.070 174.070 174.278 -0.208 17919 60468 1 148 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.846 0.614 17919 60469 1 148 . 1 1 10 10 GLY H H 10 7.810 7.810 7.429 0.381 17919 60470 1 148 . 1 1 11 11 LYS N N 11 121.600 121.600 122.994 -1.394 17919 60471 1 148 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.167 0.194 17919 60472 1 148 . 1 1 11 11 LYS C C 11 175.940 175.940 175.722 0.218 17919 60473 1 148 . 1 1 11 11 LYS CA C 11 56.280 56.280 57.131 -0.851 17919 60474 1 148 . 1 1 11 11 LYS CB C 11 33.200 33.200 32.766 0.435 17919 60475 1 148 . 1 1 11 11 LYS H H 11 7.280 7.280 8.006 -0.726 17919 60476 1 148 . 1 1 12 12 THR N N 12 120.440 120.440 117.588 2.852 17919 60477 1 148 . 1 1 12 12 THR HA H 12 5.046 5.046 4.824 0.222 17919 60478 1 148 . 1 1 12 12 THR C C 12 174.320 174.320 174.506 -0.186 17919 60479 1 148 . 1 1 12 12 THR CA C 12 62.390 62.390 62.612 -0.222 17919 60480 1 148 . 1 1 12 12 THR CB C 12 69.910 69.910 69.232 0.678 17919 60481 1 148 . 1 1 12 12 THR H H 12 8.650 8.650 8.346 0.304 17919 60482 1 148 . 1 1 13 13 ILE N N 13 127.110 127.110 128.984 -1.874 17919 60483 1 148 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.322 0.222 17919 60484 1 148 . 1 1 13 13 ILE C C 13 175.220 175.220 175.595 -0.375 17919 60485 1 148 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.820 -0.840 17919 60486 1 148 . 1 1 13 13 ILE CB C 13 40.950 40.950 39.002 1.948 17919 60487 1 148 . 1 1 13 13 ILE H H 13 9.450 9.450 8.855 0.595 17919 60488 1 148 . 1 1 14 14 THR N N 14 121.520 121.520 125.066 -3.546 17919 60489 1 148 . 1 1 14 14 THR HA H 14 4.964 4.964 4.619 0.345 17919 60490 1 148 . 1 1 14 14 THR C C 14 173.790 173.790 174.184 -0.394 17919 60491 1 148 . 1 1 14 14 THR CA C 14 61.940 61.940 62.919 -0.979 17919 60492 1 148 . 1 1 14 14 THR CB C 14 69.650 69.650 68.791 0.859 17919 60493 1 148 . 1 1 14 14 THR H H 14 8.710 8.710 8.810 -0.100 17919 60494 1 148 . 1 1 15 15 LEU N N 15 124.800 124.800 128.066 -3.266 17919 60495 1 148 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.553 0.227 17919 60496 1 148 . 1 1 15 15 LEU C C 15 174.670 174.670 175.627 -0.957 17919 60497 1 148 . 1 1 15 15 LEU CA C 15 52.830 52.830 54.257 -1.427 17919 60498 1 148 . 1 1 15 15 LEU CB C 15 47.070 47.070 43.045 4.025 17919 60499 1 148 . 1 1 15 15 LEU H H 15 8.710 8.710 8.362 0.348 17919 60500 1 148 . 1 1 16 16 GLU N N 16 122.160 122.160 123.490 -1.330 17919 60501 1 148 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.068 -0.151 17919 60502 1 148 . 1 1 16 16 GLU C C 16 175.860 175.860 176.032 -0.172 17919 60503 1 148 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.177 -0.357 17919 60504 1 148 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.116 -0.666 17919 60505 1 148 . 1 1 16 16 GLU H H 16 8.140 8.140 8.702 -0.562 17919 60506 1 148 . 1 1 17 17 VAL N N 17 117.210 117.210 118.380 -1.170 17919 60507 1 148 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.681 0.033 17919 60508 1 148 . 1 1 17 17 VAL C C 17 174.160 174.160 174.305 -0.145 17919 60509 1 148 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.420 -0.990 17919 60510 1 148 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.772 0.628 17919 60511 1 148 . 1 1 17 17 VAL H H 17 8.900 8.900 8.770 0.130 17919 60512 1 148 . 1 1 18 18 GLU N N 18 118.990 118.990 121.733 -2.743 17919 60513 1 148 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.936 0.143 17919 60514 1 148 . 1 1 18 18 GLU C C 18 176.160 176.160 175.687 0.473 17919 60515 1 148 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.037 0.683 17919 60516 1 148 . 1 1 18 18 GLU CB C 18 30.310 30.310 32.518 -2.208 17919 60517 1 148 . 1 1 18 18 GLU H H 18 8.640 8.640 9.103 -0.463 17919 60518 1 148 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.141 -0.000 17919 60519 1 148 . 1 1 19 19 PRO C C 19 175.310 175.310 178.006 -2.696 17919 60520 1 148 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.782 -0.312 17919 60521 1 148 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.905 0.045 17919 60522 1 148 . 1 1 20 20 SER N N 20 103.400 103.400 111.259 -7.859 17919 60523 1 148 . 1 1 20 20 SER HA H 20 4.370 4.370 4.185 0.185 17919 60524 1 148 . 1 1 20 20 SER C C 20 174.660 174.660 174.489 0.171 17919 60525 1 148 . 1 1 20 20 SER CA C 20 57.400 57.400 59.825 -2.425 17919 60526 1 148 . 1 1 20 20 SER CB C 20 63.370 63.370 62.831 0.539 17919 60527 1 148 . 1 1 20 20 SER H H 20 7.040 7.040 8.322 -1.282 17919 60528 1 148 . 1 1 21 21 ASP N N 21 123.480 123.480 122.370 1.110 17919 60529 1 148 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.740 -0.045 17919 60530 1 148 . 1 1 21 21 ASP C C 21 176.360 176.360 176.005 0.355 17919 60531 1 148 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.008 0.692 17919 60532 1 148 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.749 -0.949 17919 60533 1 148 . 1 1 21 21 ASP H H 21 8.030 8.030 7.900 0.130 17919 60534 1 148 . 1 1 22 22 THR N N 22 108.800 108.800 113.372 -4.572 17919 60535 1 148 . 1 1 22 22 THR HA H 22 4.920 4.920 4.595 0.325 17919 60536 1 148 . 1 1 22 22 THR C C 22 176.750 176.750 175.975 0.775 17919 60537 1 148 . 1 1 22 22 THR CA C 22 59.690 59.690 61.132 -1.442 17919 60538 1 148 . 1 1 22 22 THR CB C 22 71.200 71.200 70.462 0.738 17919 60539 1 148 . 1 1 22 22 THR H H 22 7.900 7.900 8.295 -0.395 17919 60540 1 148 . 1 1 23 23 ILE N N 23 121.190 121.190 120.986 0.204 17919 60541 1 148 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.838 -0.181 17919 60542 1 148 . 1 1 23 23 ILE C C 23 179.040 179.040 177.891 1.149 17919 60543 1 148 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.547 -0.287 17919 60544 1 148 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.002 -1.652 17919 60545 1 148 . 1 1 23 23 ILE H H 23 8.560 8.560 8.292 0.268 17919 60546 1 148 . 1 1 24 24 GLU N N 24 120.830 120.830 119.404 1.426 17919 60547 1 148 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.895 0.022 17919 60548 1 148 . 1 1 24 24 GLU C C 24 178.640 178.640 178.568 0.072 17919 60549 1 148 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.624 0.596 17919 60550 1 148 . 1 1 24 24 GLU CB C 24 28.280 28.280 28.276 0.004 17919 60551 1 148 . 1 1 24 24 GLU H H 24 9.760 9.760 8.033 1.727 17919 60552 1 148 . 1 1 25 25 ASN N N 25 120.570 120.570 118.856 1.714 17919 60553 1 148 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.555 -0.030 17919 60554 1 148 . 1 1 25 25 ASN C C 25 178.380 178.380 177.786 0.594 17919 60555 1 148 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.848 0.212 17919 60556 1 148 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.602 -0.152 17919 60557 1 148 . 1 1 25 25 ASN H H 25 7.920 7.920 7.484 0.436 17919 60558 1 148 . 1 1 26 26 VAL N N 26 121.710 121.710 120.792 0.918 17919 60559 1 148 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.577 -0.180 17919 60560 1 148 . 1 1 26 26 VAL C C 26 177.950 177.950 177.897 0.053 17919 60561 1 148 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.605 1.055 17919 60562 1 148 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.360 -0.520 17919 60563 1 148 . 1 1 26 26 VAL H H 26 8.070 8.070 7.710 0.360 17919 60564 1 148 . 1 1 27 27 LYS N N 27 118.860 118.860 118.862 -0.002 17919 60565 1 148 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.224 0.356 17919 60566 1 148 . 1 1 27 27 LYS C C 27 180.550 180.550 179.170 1.380 17919 60567 1 148 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.441 -0.191 17919 60568 1 148 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.174 1.556 17919 60569 1 148 . 1 1 27 27 LYS H H 27 8.560 8.560 8.187 0.373 17919 60570 1 148 . 1 1 28 28 ALA N N 28 123.440 123.440 121.902 1.538 17919 60571 1 148 . 1 1 28 28 ALA HA H 28 4.160 4.160 3.995 0.165 17919 60572 1 148 . 1 1 28 28 ALA C C 28 180.300 180.300 179.154 1.146 17919 60573 1 148 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.190 0.180 17919 60574 1 148 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.341 -0.631 17919 60575 1 148 . 1 1 28 28 ALA H H 28 8.060 8.060 7.840 0.220 17919 60576 1 148 . 1 1 29 29 LYS N N 29 119.940 119.940 118.287 1.653 17919 60577 1 148 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.094 0.113 17919 60578 1 148 . 1 1 29 29 LYS C C 29 180.320 180.320 179.228 1.092 17919 60579 1 148 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.020 0.630 17919 60580 1 148 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.259 1.031 17919 60581 1 148 . 1 1 29 29 LYS H H 29 7.850 7.850 7.406 0.444 17919 60582 1 148 . 1 1 30 30 ILE N N 30 121.080 121.080 120.757 0.323 17919 60583 1 148 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.620 -0.113 17919 60584 1 148 . 1 1 30 30 ILE C C 30 178.310 178.310 177.290 1.020 17919 60585 1 148 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.335 0.814 17919 60586 1 148 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.306 -0.506 17919 60587 1 148 . 1 1 30 30 ILE H H 30 8.280 8.280 7.521 0.759 17919 60588 1 148 . 1 1 31 31 GLN N N 31 123.490 123.490 119.687 3.803 17919 60589 1 148 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.006 -0.177 17919 60590 1 148 . 1 1 31 31 GLN C C 31 178.890 178.890 178.247 0.643 17919 60591 1 148 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.102 0.898 17919 60592 1 148 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.468 -0.748 17919 60593 1 148 . 1 1 31 31 GLN H H 31 8.580 8.580 7.789 0.791 17919 60594 1 148 . 1 1 32 32 ASP N N 32 119.360 119.360 118.751 0.609 17919 60595 1 148 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.390 -0.036 17919 60596 1 148 . 1 1 32 32 ASP C C 32 177.250 177.250 177.662 -0.412 17919 60597 1 148 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.773 0.417 17919 60598 1 148 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.866 -0.286 17919 60599 1 148 . 1 1 32 32 ASP H H 32 8.010 8.010 8.154 -0.144 17919 60600 1 148 . 1 1 33 33 LYS N N 33 115.130 115.130 117.652 -2.522 17919 60601 1 148 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.376 -0.039 17919 60602 1 148 . 1 1 33 33 LYS C C 33 177.870 177.870 178.239 -0.369 17919 60603 1 148 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.507 0.543 17919 60604 1 148 . 1 1 33 33 LYS CB C 33 34.170 34.170 34.410 -0.240 17919 60605 1 148 . 1 1 33 33 LYS H H 33 7.430 7.430 7.486 -0.056 17919 60606 1 148 . 1 1 34 34 GLU N N 34 113.870 113.870 116.777 -2.907 17919 60607 1 148 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.413 0.212 17919 60608 1 148 . 1 1 34 34 GLU C C 34 177.840 177.840 177.073 0.767 17919 60609 1 148 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.854 -1.684 17919 60610 1 148 . 1 1 34 34 GLU CB C 34 32.660 32.660 30.699 1.961 17919 60611 1 148 . 1 1 34 34 GLU H H 34 8.740 8.740 8.226 0.514 17919 60612 1 148 . 1 1 35 35 GLY N N 35 108.650 108.650 108.090 0.560 17919 60613 1 148 . 1 1 35 35 GLY C C 35 173.960 173.960 174.388 -0.428 17919 60614 1 148 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.295 0.785 17919 60615 1 148 . 1 1 35 35 GLY H H 35 8.530 8.530 7.771 0.759 17919 60616 1 148 . 1 1 36 36 ILE N N 36 119.880 119.880 122.504 -2.624 17919 60617 1 148 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.329 0.116 17919 60618 1 148 . 1 1 36 36 ILE C C 36 173.590 173.590 174.486 -0.896 17919 60619 1 148 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.096 -0.346 17919 60620 1 148 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.183 2.397 17919 60621 1 148 . 1 1 36 36 ILE H H 36 6.150 6.150 7.619 -1.469 17919 60622 1 148 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.758 -0.124 17919 60623 1 148 . 1 1 37 37 PRO C C 37 176.940 176.940 176.717 0.223 17919 60624 1 148 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.687 -0.027 17919 60625 1 148 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.309 0.541 17919 60626 1 148 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.163 -0.046 17919 60627 1 148 . 1 1 38 38 PRO C C 38 178.320 178.320 178.418 -0.098 17919 60628 1 148 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.562 0.698 17919 60629 1 148 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.521 1.369 17919 60630 1 148 . 1 1 39 39 ASP N N 39 113.380 113.380 116.693 -3.313 17919 60631 1 148 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.316 0.115 17919 60632 1 148 . 1 1 39 39 ASP C C 39 177.090 177.090 177.411 -0.321 17919 60633 1 148 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.805 -1.165 17919 60634 1 148 . 1 1 39 39 ASP CB C 39 39.540 39.540 39.943 -0.403 17919 60635 1 148 . 1 1 39 39 ASP H H 39 8.550 8.550 8.644 -0.094 17919 60636 1 148 . 1 1 40 40 GLN N N 40 116.780 116.780 117.222 -0.442 17919 60637 1 148 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.237 0.227 17919 60638 1 148 . 1 1 40 40 GLN C C 40 175.380 175.380 176.685 -1.305 17919 60639 1 148 . 1 1 40 40 GLN CA C 40 55.640 55.640 57.179 -1.539 17919 60640 1 148 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.164 0.976 17919 60641 1 148 . 1 1 40 40 GLN H H 40 7.820 7.820 7.727 0.093 17919 60642 1 148 . 1 1 41 41 GLN N N 41 117.720 117.720 119.768 -2.048 17919 60643 1 148 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.173 0.071 17919 60644 1 148 . 1 1 41 41 GLN C C 41 176.300 176.300 175.330 0.970 17919 60645 1 148 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.664 -0.194 17919 60646 1 148 . 1 1 41 41 GLN CB C 41 31.650 31.650 28.783 2.867 17919 60647 1 148 . 1 1 41 41 GLN H H 41 7.480 7.480 7.451 0.029 17919 60648 1 148 . 1 1 42 42 ARG N N 42 122.680 122.680 123.560 -0.880 17919 60649 1 148 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.616 -0.116 17919 60650 1 148 . 1 1 42 42 ARG C C 42 174.050 174.050 174.841 -0.791 17919 60651 1 148 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.004 0.046 17919 60652 1 148 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.794 -1.044 17919 60653 1 148 . 1 1 42 42 ARG H H 42 8.530 8.530 8.043 0.487 17919 60654 1 148 . 1 1 43 43 LEU N N 43 124.040 124.040 122.667 1.373 17919 60655 1 148 . 1 1 43 43 LEU C C 43 175.290 175.290 176.117 -0.827 17919 60656 1 148 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.651 -0.671 17919 60657 1 148 . 1 1 43 43 LEU CB C 43 45.790 45.790 45.029 0.761 17919 60658 1 148 . 1 1 43 43 LEU H H 43 8.820 8.820 8.544 0.276 17919 60659 1 148 . 1 1 44 44 ILE N N 44 121.920 121.920 121.103 0.817 17919 60660 1 148 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.091 -0.099 17919 60661 1 148 . 1 1 44 44 ILE C C 44 176.060 176.060 174.358 1.702 17919 60662 1 148 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.931 -0.951 17919 60663 1 148 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.851 -0.431 17919 60664 1 148 . 1 1 44 44 ILE H H 44 9.030 9.030 8.585 0.445 17919 60665 1 148 . 1 1 45 45 PHE N N 45 125.390 125.390 126.949 -1.559 17919 60666 1 148 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.000 0.045 17919 60667 1 148 . 1 1 45 45 PHE C C 45 174.470 174.470 174.440 0.030 17919 60668 1 148 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.561 0.459 17919 60669 1 148 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.864 0.896 17919 60670 1 148 . 1 1 45 45 PHE H H 45 8.830 8.830 9.104 -0.274 17919 60671 1 148 . 1 1 46 46 ALA N N 46 132.200 132.200 129.290 2.910 17919 60672 1 148 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.638 0.052 17919 60673 1 148 . 1 1 46 46 ALA C C 46 177.290 177.290 177.790 -0.500 17919 60674 1 148 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.589 -0.049 17919 60675 1 148 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.628 -0.058 17919 60676 1 148 . 1 1 46 46 ALA H H 46 8.810 8.810 8.974 -0.164 17919 60677 1 148 . 1 1 47 47 GLY N N 47 102.340 102.340 103.274 -0.934 17919 60678 1 148 . 1 1 47 47 GLY C C 47 173.810 173.810 174.119 -0.309 17919 60679 1 148 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.100 0.250 17919 60680 1 148 . 1 1 47 47 GLY H H 47 8.130 8.130 8.225 -0.095 17919 60681 1 148 . 1 1 48 48 LYS N N 48 121.570 121.570 120.255 1.315 17919 60682 1 148 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.758 -0.136 17919 60683 1 148 . 1 1 48 48 LYS C C 48 174.700 174.700 174.766 -0.066 17919 60684 1 148 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.549 0.001 17919 60685 1 148 . 1 1 48 48 LYS CB C 48 34.530 34.530 35.628 -1.098 17919 60686 1 148 . 1 1 48 48 LYS H H 48 7.980 7.980 7.754 0.226 17919 60687 1 148 . 1 1 49 49 GLN N N 49 122.410 122.410 125.530 -3.120 17919 60688 1 148 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.682 -0.122 17919 60689 1 148 . 1 1 49 49 GLN C C 49 175.670 175.670 175.800 -0.130 17919 60690 1 148 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.036 -0.296 17919 60691 1 148 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.527 -0.527 17919 60692 1 148 . 1 1 49 49 GLN H H 49 8.600 8.600 8.617 -0.017 17919 60693 1 148 . 1 1 50 50 LEU N N 50 125.520 125.520 128.258 -2.738 17919 60694 1 148 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.090 0.000 17919 60695 1 148 . 1 1 50 50 LEU C C 50 176.660 176.660 176.436 0.224 17919 60696 1 148 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.275 -0.035 17919 60697 1 148 . 1 1 50 50 LEU CB C 50 41.570 41.570 40.823 0.747 17919 60698 1 148 . 1 1 50 50 LEU H H 50 8.530 8.530 8.257 0.273 17919 60699 1 148 . 1 1 51 51 GLU N N 51 122.940 122.940 125.574 -2.634 17919 60700 1 148 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.091 0.397 17919 60701 1 148 . 1 1 51 51 GLU C C 51 175.870 175.870 177.293 -1.423 17919 60702 1 148 . 1 1 51 51 GLU CA C 51 55.960 55.960 57.751 -1.790 17919 60703 1 148 . 1 1 51 51 GLU CB C 51 31.570 31.570 30.334 1.236 17919 60704 1 148 . 1 1 51 51 GLU H H 51 8.400 8.400 8.234 0.166 17919 60705 1 148 . 1 1 52 52 ASP N N 52 120.030 120.030 122.055 -2.025 17919 60706 1 148 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.509 -0.150 17919 60707 1 148 . 1 1 52 52 ASP C C 52 177.330 177.330 176.895 0.435 17919 60708 1 148 . 1 1 52 52 ASP CA C 52 56.960 56.960 56.280 0.680 17919 60709 1 148 . 1 1 52 52 ASP CB C 52 40.850 40.850 41.011 -0.161 17919 60710 1 148 . 1 1 52 52 ASP H H 52 8.160 8.160 8.724 -0.564 17919 60711 1 148 . 1 1 53 53 GLY N N 53 106.660 106.660 104.699 1.961 17919 60712 1 148 . 1 1 53 53 GLY C C 53 174.870 174.870 174.082 0.788 17919 60713 1 148 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.428 0.742 17919 60714 1 148 . 1 1 53 53 GLY H H 53 9.390 9.390 8.295 1.095 17919 60715 1 148 . 1 1 54 54 ARG N N 54 119.050 119.050 120.502 -1.452 17919 60716 1 148 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.704 -0.009 17919 60717 1 148 . 1 1 54 54 ARG C C 54 175.350 175.350 175.699 -0.349 17919 60718 1 148 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.986 -0.597 17919 60719 1 148 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.835 -0.185 17919 60720 1 148 . 1 1 54 54 ARG H H 54 7.460 7.460 7.403 0.057 17919 60721 1 148 . 1 1 55 55 THR N N 55 108.400 108.400 112.265 -3.865 17919 60722 1 148 . 1 1 55 55 THR HA H 55 5.240 5.240 4.883 0.357 17919 60723 1 148 . 1 1 55 55 THR C C 55 176.560 176.560 176.286 0.274 17919 60724 1 148 . 1 1 55 55 THR CA C 55 59.690 59.690 60.417 -0.727 17919 60725 1 148 . 1 1 55 55 THR CB C 55 72.260 72.260 70.473 1.787 17919 60726 1 148 . 1 1 55 55 THR H H 55 8.730 8.730 8.896 -0.166 17919 60727 1 148 . 1 1 56 56 LEU N N 56 117.920 117.920 119.329 -1.409 17919 60728 1 148 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.271 -0.211 17919 60729 1 148 . 1 1 56 56 LEU C C 56 180.810 180.810 178.837 1.973 17919 60730 1 148 . 1 1 56 56 LEU CA C 56 58.710 58.710 57.730 0.980 17919 60731 1 148 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.542 -1.172 17919 60732 1 148 . 1 1 56 56 LEU H H 56 8.140 8.140 8.255 -0.115 17919 60733 1 148 . 1 1 57 57 SER N N 57 113.330 113.330 115.436 -2.106 17919 60734 1 148 . 1 1 57 57 SER HA H 57 4.370 4.370 4.240 0.130 17919 60735 1 148 . 1 1 57 57 SER C C 57 178.310 178.310 176.705 1.605 17919 60736 1 148 . 1 1 57 57 SER CA C 57 61.080 61.080 61.456 -0.376 17919 60737 1 148 . 1 1 57 57 SER CB C 57 62.530 62.530 62.569 -0.039 17919 60738 1 148 . 1 1 57 57 SER H H 57 8.470 8.470 7.981 0.489 17919 60739 1 148 . 1 1 58 58 ASP N N 58 124.190 124.190 121.801 2.389 17919 60740 1 148 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.275 0.021 17919 60741 1 148 . 1 1 58 58 ASP C C 58 177.400 177.400 177.140 0.260 17919 60742 1 148 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.881 0.299 17919 60743 1 148 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.414 -0.314 17919 60744 1 148 . 1 1 58 58 ASP H H 58 7.930 7.930 7.951 -0.021 17919 60745 1 148 . 1 1 59 59 TYR N N 59 115.510 115.510 115.353 0.157 17919 60746 1 148 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.673 -0.003 17919 60747 1 148 . 1 1 59 59 TYR C C 59 174.700 174.700 174.694 0.006 17919 60748 1 148 . 1 1 59 59 TYR CA C 59 58.250 58.250 56.233 2.017 17919 60749 1 148 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.510 1.560 17919 60750 1 148 . 1 1 59 59 TYR H H 59 7.250 7.250 7.250 -0.000 17919 60751 1 148 . 1 1 60 60 ASN N N 60 115.900 115.900 117.728 -1.828 17919 60752 1 148 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.310 0.045 17919 60753 1 148 . 1 1 60 60 ASN C C 60 174.340 174.340 174.499 -0.159 17919 60754 1 148 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.160 -0.040 17919 60755 1 148 . 1 1 60 60 ASN CB C 60 37.410 37.410 38.010 -0.600 17919 60756 1 148 . 1 1 60 60 ASN H H 60 8.150 8.150 8.171 -0.021 17919 60757 1 148 . 1 1 61 61 ILE N N 61 118.600 118.600 119.868 -1.268 17919 60758 1 148 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.934 -0.541 17919 60759 1 148 . 1 1 61 61 ILE C C 61 174.610 174.610 175.631 -1.021 17919 60760 1 148 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.071 0.349 17919 60761 1 148 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.306 -0.566 17919 60762 1 148 . 1 1 61 61 ILE H H 61 7.250 7.250 8.328 -1.078 17919 60763 1 148 . 1 1 62 62 GLN N N 62 124.740 124.740 128.095 -3.355 17919 60764 1 148 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.568 -0.062 17919 60765 1 148 . 1 1 62 62 GLN C C 62 175.970 175.970 175.653 0.317 17919 60766 1 148 . 1 1 62 62 GLN CA C 62 53.660 53.660 54.169 -0.509 17919 60767 1 148 . 1 1 62 62 GLN CB C 62 31.650 31.650 29.998 1.652 17919 60768 1 148 . 1 1 62 62 GLN H H 62 7.610 7.610 7.955 -0.345 17919 60769 1 148 . 1 1 63 63 LYS N N 63 120.300 120.300 119.567 0.733 17919 60770 1 148 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.127 -0.126 17919 60771 1 148 . 1 1 63 63 LYS C C 63 175.810 175.810 177.222 -1.412 17919 60772 1 148 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.512 0.278 17919 60773 1 148 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.196 0.454 17919 60774 1 148 . 1 1 63 63 LYS H H 63 8.490 8.490 8.559 -0.069 17919 60775 1 148 . 1 1 64 64 GLU N N 64 113.950 113.950 117.338 -3.388 17919 60776 1 148 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.628 -0.163 17919 60777 1 148 . 1 1 64 64 GLU C C 64 175.250 175.250 175.632 -0.382 17919 60778 1 148 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.675 0.215 17919 60779 1 148 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.514 -2.614 17919 60780 1 148 . 1 1 64 64 GLU H H 64 9.280 9.280 8.523 0.757 17919 60781 1 148 . 1 1 65 65 SER N N 65 114.730 114.730 114.279 0.451 17919 60782 1 148 . 1 1 65 65 SER HA H 65 4.640 4.640 4.468 0.172 17919 60783 1 148 . 1 1 65 65 SER C C 65 172.160 172.160 174.159 -1.999 17919 60784 1 148 . 1 1 65 65 SER CA C 65 60.890 60.890 60.027 0.863 17919 60785 1 148 . 1 1 65 65 SER CB C 65 64.910 64.910 64.222 0.688 17919 60786 1 148 . 1 1 65 65 SER H H 65 7.670 7.670 7.528 0.142 17919 60787 1 148 . 1 1 66 66 THR N N 66 117.110 117.110 118.535 -1.425 17919 60788 1 148 . 1 1 66 66 THR HA H 66 5.270 5.270 5.432 -0.162 17919 60789 1 148 . 1 1 66 66 THR C C 66 173.950 173.950 174.085 -0.135 17919 60790 1 148 . 1 1 66 66 THR CA C 66 62.340 62.340 61.868 0.472 17919 60791 1 148 . 1 1 66 66 THR CB C 66 70.080 70.080 70.875 -0.795 17919 60792 1 148 . 1 1 66 66 THR H H 66 8.730 8.730 8.409 0.321 17919 60793 1 148 . 1 1 67 67 LEU N N 67 127.110 127.110 126.164 0.946 17919 60794 1 148 . 1 1 67 67 LEU HA H 67 5.060 5.060 5.147 -0.087 17919 60795 1 148 . 1 1 67 67 LEU C C 67 175.770 175.770 175.392 0.378 17919 60796 1 148 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.673 0.227 17919 60797 1 148 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.069 0.191 17919 60798 1 148 . 1 1 67 67 LEU H H 67 9.410 9.410 8.283 1.127 17919 60799 1 148 . 1 1 68 68 HIS N N 68 118.380 118.380 122.207 -3.827 17919 60800 1 148 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.231 0.009 17919 60801 1 148 . 1 1 68 68 HIS C C 68 173.150 173.150 174.117 -0.967 17919 60802 1 148 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.158 0.842 17919 60803 1 148 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.065 -1.535 17919 60804 1 148 . 1 1 68 68 HIS H H 68 9.230 9.230 9.064 0.166 17919 60805 1 148 . 1 1 69 69 LEU N N 69 124.460 124.460 129.944 -5.484 17919 60806 1 148 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.908 0.282 17919 60807 1 148 . 1 1 69 69 LEU C C 69 175.270 175.270 174.925 0.345 17919 60808 1 148 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.637 0.253 17919 60809 1 148 . 1 1 69 69 LEU CB C 69 44.380 44.380 43.266 1.114 17919 60810 1 148 . 1 1 69 69 LEU H H 69 8.340 8.340 8.160 0.180 17919 60811 1 148 . 1 1 70 70 VAL N N 70 126.940 126.940 126.922 0.018 17919 60812 1 148 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.316 0.034 17919 60813 1 148 . 1 1 70 70 VAL C C 70 174.000 174.000 173.878 0.122 17919 60814 1 148 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.167 0.633 17919 60815 1 148 . 1 1 70 70 VAL CB C 70 34.910 34.910 33.894 1.016 17919 60816 1 148 . 1 1 70 70 VAL H H 70 9.200 9.200 8.102 1.098 17919 60817 1 148 . 1 1 71 71 LEU N N 71 123.130 123.130 127.480 -4.350 17919 60818 1 148 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.933 0.127 17919 60819 1 148 . 1 1 71 71 LEU C C 71 177.830 177.830 177.140 0.690 17919 60820 1 148 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.284 0.656 17919 60821 1 148 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.142 -0.292 17919 60822 1 148 . 1 1 71 71 LEU H H 71 8.120 8.120 8.372 -0.252 17919 60823 1 148 . 1 1 72 72 ARG N N 72 123.490 123.490 124.594 -1.104 17919 60824 1 148 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.258 0.043 17919 60825 1 148 . 1 1 72 72 ARG C C 72 175.350 175.350 175.773 -0.423 17919 60826 1 148 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.492 -0.881 17919 60827 1 148 . 1 1 72 72 ARG CB C 72 31.350 31.350 31.077 0.273 17919 60828 1 148 . 1 1 72 72 ARG H H 72 8.580 8.580 8.211 0.369 17919 60829 1 149 . 1 1 2 2 GLN N N 2 123.220 123.220 124.775 -1.555 17919 60830 1 149 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.048 0.201 17919 60831 1 149 . 1 1 2 2 GLN C C 2 175.920 175.920 175.050 0.870 17919 60832 1 149 . 1 1 2 2 GLN CA C 2 55.080 55.080 55.466 -0.386 17919 60833 1 149 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.247 0.513 17919 60834 1 149 . 1 1 2 2 GLN H H 2 8.900 8.900 8.541 0.359 17919 60835 1 149 . 1 1 3 3 ILE N N 3 115.340 115.340 118.709 -3.369 17919 60836 1 149 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.305 -0.092 17919 60837 1 149 . 1 1 3 3 ILE C C 3 172.450 172.450 173.482 -1.032 17919 60838 1 149 . 1 1 3 3 ILE CA C 3 59.570 59.570 58.886 0.684 17919 60839 1 149 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.392 0.817 17919 60840 1 149 . 1 1 3 3 ILE H H 3 8.320 8.320 8.793 -0.473 17919 60841 1 149 . 1 1 4 4 PHE N N 4 118.110 118.110 118.471 -0.361 17919 60842 1 149 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.053 0.577 17919 60843 1 149 . 1 1 4 4 PHE C C 4 175.320 175.320 175.018 0.302 17919 60844 1 149 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.719 -0.509 17919 60845 1 149 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.861 -0.381 17919 60846 1 149 . 1 1 4 4 PHE H H 4 8.610 8.610 8.365 0.245 17919 60847 1 149 . 1 1 5 5 VAL N N 5 121.000 121.000 120.902 0.098 17919 60848 1 149 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.975 -0.250 17919 60849 1 149 . 1 1 5 5 VAL C C 5 174.870 174.870 175.375 -0.505 17919 60850 1 149 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.113 -0.493 17919 60851 1 149 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.701 0.529 17919 60852 1 149 . 1 1 5 5 VAL H H 5 9.300 9.300 8.667 0.633 17919 60853 1 149 . 1 1 6 6 LYS N N 6 127.520 127.520 127.831 -0.311 17919 60854 1 149 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.190 0.177 17919 60855 1 149 . 1 1 6 6 LYS C C 6 177.140 177.140 176.812 0.328 17919 60856 1 149 . 1 1 6 6 LYS CA C 6 54.520 54.520 55.197 -0.676 17919 60857 1 149 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.374 0.676 17919 60858 1 149 . 1 1 6 6 LYS H H 6 8.820 8.820 8.598 0.222 17919 60859 1 149 . 1 1 7 7 THR N N 7 115.400 115.400 113.118 2.282 17919 60860 1 149 . 1 1 7 7 THR HA H 7 4.970 4.970 4.366 0.604 17919 60861 1 149 . 1 1 7 7 THR C C 7 176.910 176.910 176.270 0.640 17919 60862 1 149 . 1 1 7 7 THR CA C 7 60.470 60.470 60.462 0.008 17919 60863 1 149 . 1 1 7 7 THR CB C 7 70.630 70.630 70.379 0.251 17919 60864 1 149 . 1 1 7 7 THR H H 7 8.730 8.730 8.593 0.137 17919 60865 1 149 . 1 1 8 8 LEU N N 8 121.330 121.330 122.655 -1.325 17919 60866 1 149 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.229 0.081 17919 60867 1 149 . 1 1 8 8 LEU C C 8 178.800 178.800 178.034 0.766 17919 60868 1 149 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.948 -0.368 17919 60869 1 149 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.816 0.154 17919 60870 1 149 . 1 1 8 8 LEU H H 8 9.100 9.100 8.452 0.648 17919 60871 1 149 . 1 1 9 9 THR N N 9 105.590 105.590 108.064 -2.474 17919 60872 1 149 . 1 1 9 9 THR HA H 9 4.428 4.428 4.317 0.111 17919 60873 1 149 . 1 1 9 9 THR C C 9 175.520 175.520 175.306 0.214 17919 60874 1 149 . 1 1 9 9 THR CA C 9 61.400 61.400 62.269 -0.869 17919 60875 1 149 . 1 1 9 9 THR CB C 9 69.140 69.140 69.084 0.056 17919 60876 1 149 . 1 1 9 9 THR H H 9 7.630 7.630 7.991 -0.361 17919 60877 1 149 . 1 1 10 10 GLY N N 10 108.890 108.890 111.825 -2.935 17919 60878 1 149 . 1 1 10 10 GLY C C 10 174.070 174.070 173.841 0.229 17919 60879 1 149 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.990 0.470 17919 60880 1 149 . 1 1 10 10 GLY H H 10 7.810 7.810 8.001 -0.191 17919 60881 1 149 . 1 1 11 11 LYS N N 11 121.600 121.600 122.205 -0.605 17919 60882 1 149 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.187 0.174 17919 60883 1 149 . 1 1 11 11 LYS C C 11 175.940 175.940 175.800 0.140 17919 60884 1 149 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.640 -0.360 17919 60885 1 149 . 1 1 11 11 LYS CB C 11 33.200 33.200 32.948 0.252 17919 60886 1 149 . 1 1 11 11 LYS H H 11 7.280 7.280 7.711 -0.431 17919 60887 1 149 . 1 1 12 12 THR N N 12 120.440 120.440 122.106 -1.666 17919 60888 1 149 . 1 1 12 12 THR HA H 12 5.046 5.046 4.776 0.270 17919 60889 1 149 . 1 1 12 12 THR C C 12 174.320 174.320 174.539 -0.219 17919 60890 1 149 . 1 1 12 12 THR CA C 12 62.390 62.390 63.021 -0.631 17919 60891 1 149 . 1 1 12 12 THR CB C 12 69.910 69.910 68.934 0.976 17919 60892 1 149 . 1 1 12 12 THR H H 12 8.650 8.650 8.381 0.269 17919 60893 1 149 . 1 1 13 13 ILE N N 13 127.110 127.110 127.368 -0.258 17919 60894 1 149 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.668 -0.124 17919 60895 1 149 . 1 1 13 13 ILE C C 13 175.220 175.220 174.486 0.734 17919 60896 1 149 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.722 0.258 17919 60897 1 149 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.179 0.771 17919 60898 1 149 . 1 1 13 13 ILE H H 13 9.450 9.450 9.269 0.181 17919 60899 1 149 . 1 1 14 14 THR N N 14 121.520 121.520 124.864 -3.344 17919 60900 1 149 . 1 1 14 14 THR HA H 14 4.964 4.964 4.574 0.390 17919 60901 1 149 . 1 1 14 14 THR C C 14 173.790 173.790 174.277 -0.487 17919 60902 1 149 . 1 1 14 14 THR CA C 14 61.940 61.940 63.604 -1.664 17919 60903 1 149 . 1 1 14 14 THR CB C 14 69.650 69.650 69.275 0.375 17919 60904 1 149 . 1 1 14 14 THR H H 14 8.710 8.710 8.576 0.134 17919 60905 1 149 . 1 1 15 15 LEU N N 15 124.800 124.800 127.955 -3.155 17919 60906 1 149 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.705 0.075 17919 60907 1 149 . 1 1 15 15 LEU C C 15 174.670 174.670 174.856 -0.186 17919 60908 1 149 . 1 1 15 15 LEU CA C 15 52.830 52.830 54.013 -1.183 17919 60909 1 149 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.236 1.834 17919 60910 1 149 . 1 1 15 15 LEU H H 15 8.710 8.710 8.675 0.035 17919 60911 1 149 . 1 1 16 16 GLU N N 16 122.160 122.160 123.718 -1.558 17919 60912 1 149 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.928 -0.011 17919 60913 1 149 . 1 1 16 16 GLU C C 16 175.860 175.860 175.726 0.134 17919 60914 1 149 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.531 -0.710 17919 60915 1 149 . 1 1 16 16 GLU CB C 16 29.450 29.450 31.302 -1.852 17919 60916 1 149 . 1 1 16 16 GLU H H 16 8.140 8.140 8.670 -0.530 17919 60917 1 149 . 1 1 17 17 VAL N N 17 117.210 117.210 120.495 -3.285 17919 60918 1 149 . 1 1 17 17 VAL HA H 17 4.714 4.714 5.204 -0.490 17919 60919 1 149 . 1 1 17 17 VAL C C 17 174.160 174.160 174.921 -0.761 17919 60920 1 149 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.613 -0.183 17919 60921 1 149 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.981 0.419 17919 60922 1 149 . 1 1 17 17 VAL H H 17 8.900 8.900 8.743 0.157 17919 60923 1 149 . 1 1 18 18 GLU N N 18 118.990 118.990 119.615 -0.625 17919 60924 1 149 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.870 0.209 17919 60925 1 149 . 1 1 18 18 GLU C C 18 176.160 176.160 175.011 1.149 17919 60926 1 149 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.802 -0.082 17919 60927 1 149 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.198 0.112 17919 60928 1 149 . 1 1 18 18 GLU H H 18 8.640 8.640 8.181 0.459 17919 60929 1 149 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.193 -0.052 17919 60930 1 149 . 1 1 19 19 PRO C C 19 175.310 175.310 178.147 -2.837 17919 60931 1 149 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.700 -0.230 17919 60932 1 149 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.926 0.024 17919 60933 1 149 . 1 1 20 20 SER N N 20 103.400 103.400 110.183 -6.783 17919 60934 1 149 . 1 1 20 20 SER HA H 20 4.370 4.370 4.218 0.152 17919 60935 1 149 . 1 1 20 20 SER C C 20 174.660 174.660 174.403 0.257 17919 60936 1 149 . 1 1 20 20 SER CA C 20 57.400 57.400 59.280 -1.880 17919 60937 1 149 . 1 1 20 20 SER CB C 20 63.370 63.370 62.912 0.458 17919 60938 1 149 . 1 1 20 20 SER H H 20 7.040 7.040 7.936 -0.896 17919 60939 1 149 . 1 1 21 21 ASP N N 21 123.480 123.480 122.755 0.725 17919 60940 1 149 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.527 0.168 17919 60941 1 149 . 1 1 21 21 ASP C C 21 176.360 176.360 176.286 0.074 17919 60942 1 149 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.817 -0.117 17919 60943 1 149 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.807 -1.007 17919 60944 1 149 . 1 1 21 21 ASP H H 21 8.030 8.030 7.708 0.322 17919 60945 1 149 . 1 1 22 22 THR N N 22 108.800 108.800 113.411 -4.611 17919 60946 1 149 . 1 1 22 22 THR HA H 22 4.920 4.920 4.539 0.381 17919 60947 1 149 . 1 1 22 22 THR C C 22 176.750 176.750 176.651 0.099 17919 60948 1 149 . 1 1 22 22 THR CA C 22 59.690 59.690 61.349 -1.659 17919 60949 1 149 . 1 1 22 22 THR CB C 22 71.200 71.200 70.510 0.690 17919 60950 1 149 . 1 1 22 22 THR H H 22 7.900 7.900 8.409 -0.509 17919 60951 1 149 . 1 1 23 23 ILE N N 23 121.190 121.190 121.957 -0.767 17919 60952 1 149 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.688 -0.031 17919 60953 1 149 . 1 1 23 23 ILE C C 23 179.040 179.040 177.858 1.182 17919 60954 1 149 . 1 1 23 23 ILE CA C 23 62.260 62.260 64.120 -1.860 17919 60955 1 149 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.546 -2.196 17919 60956 1 149 . 1 1 23 23 ILE H H 23 8.560 8.560 8.965 -0.405 17919 60957 1 149 . 1 1 24 24 GLU N N 24 120.830 120.830 120.253 0.577 17919 60958 1 149 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.985 -0.068 17919 60959 1 149 . 1 1 24 24 GLU C C 24 178.640 178.640 178.883 -0.243 17919 60960 1 149 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.661 0.559 17919 60961 1 149 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.470 -1.190 17919 60962 1 149 . 1 1 24 24 GLU H H 24 9.760 9.760 8.573 1.187 17919 60963 1 149 . 1 1 25 25 ASN N N 25 120.570 120.570 118.847 1.723 17919 60964 1 149 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.479 0.046 17919 60965 1 149 . 1 1 25 25 ASN C C 25 178.380 178.380 177.775 0.605 17919 60966 1 149 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.339 -0.279 17919 60967 1 149 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.545 -0.095 17919 60968 1 149 . 1 1 25 25 ASN H H 25 7.920 7.920 7.988 -0.068 17919 60969 1 149 . 1 1 26 26 VAL N N 26 121.710 121.710 121.206 0.504 17919 60970 1 149 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.609 -0.212 17919 60971 1 149 . 1 1 26 26 VAL C C 26 177.950 177.950 177.445 0.505 17919 60972 1 149 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.942 0.718 17919 60973 1 149 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.623 -0.783 17919 60974 1 149 . 1 1 26 26 VAL H H 26 8.070 8.070 7.723 0.347 17919 60975 1 149 . 1 1 27 27 LYS N N 27 118.860 118.860 119.434 -0.574 17919 60976 1 149 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.142 0.438 17919 60977 1 149 . 1 1 27 27 LYS C C 27 180.550 180.550 178.641 1.909 17919 60978 1 149 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.139 0.111 17919 60979 1 149 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.551 1.179 17919 60980 1 149 . 1 1 27 27 LYS H H 27 8.560 8.560 8.357 0.203 17919 60981 1 149 . 1 1 28 28 ALA N N 28 123.440 123.440 123.690 -0.250 17919 60982 1 149 . 1 1 28 28 ALA HA H 28 4.160 4.160 3.959 0.201 17919 60983 1 149 . 1 1 28 28 ALA C C 28 180.300 180.300 179.157 1.143 17919 60984 1 149 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.333 0.037 17919 60985 1 149 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.322 -0.612 17919 60986 1 149 . 1 1 28 28 ALA H H 28 8.060 8.060 8.370 -0.310 17919 60987 1 149 . 1 1 29 29 LYS N N 29 119.940 119.940 118.881 1.059 17919 60988 1 149 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.175 0.032 17919 60989 1 149 . 1 1 29 29 LYS C C 29 180.320 180.320 179.350 0.970 17919 60990 1 149 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.440 0.211 17919 60991 1 149 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.178 1.112 17919 60992 1 149 . 1 1 29 29 LYS H H 29 7.850 7.850 7.763 0.087 17919 60993 1 149 . 1 1 30 30 ILE N N 30 121.080 121.080 119.123 1.957 17919 60994 1 149 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.666 -0.159 17919 60995 1 149 . 1 1 30 30 ILE C C 30 178.310 178.310 177.402 0.908 17919 60996 1 149 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.185 0.965 17919 60997 1 149 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.386 -0.586 17919 60998 1 149 . 1 1 30 30 ILE H H 30 8.280 8.280 7.523 0.757 17919 60999 1 149 . 1 1 31 31 GLN N N 31 123.490 123.490 120.385 3.105 17919 61000 1 149 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.969 -0.140 17919 61001 1 149 . 1 1 31 31 GLN C C 31 178.890 178.890 178.266 0.624 17919 61002 1 149 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.077 0.923 17919 61003 1 149 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.639 -0.919 17919 61004 1 149 . 1 1 31 31 GLN H H 31 8.580 8.580 7.973 0.607 17919 61005 1 149 . 1 1 32 32 ASP N N 32 119.360 119.360 117.836 1.524 17919 61006 1 149 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.511 -0.157 17919 61007 1 149 . 1 1 32 32 ASP C C 32 177.250 177.250 177.455 -0.205 17919 61008 1 149 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.251 0.939 17919 61009 1 149 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.458 0.122 17919 61010 1 149 . 1 1 32 32 ASP H H 32 8.010 8.010 8.032 -0.022 17919 61011 1 149 . 1 1 33 33 LYS N N 33 115.130 115.130 118.040 -2.910 17919 61012 1 149 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.430 -0.093 17919 61013 1 149 . 1 1 33 33 LYS C C 33 177.870 177.870 177.885 -0.015 17919 61014 1 149 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.632 0.418 17919 61015 1 149 . 1 1 33 33 LYS CB C 33 34.170 34.170 34.455 -0.285 17919 61016 1 149 . 1 1 33 33 LYS H H 33 7.430 7.430 7.404 0.026 17919 61017 1 149 . 1 1 34 34 GLU N N 34 113.870 113.870 115.802 -1.932 17919 61018 1 149 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.472 0.153 17919 61019 1 149 . 1 1 34 34 GLU C C 34 177.840 177.840 177.456 0.384 17919 61020 1 149 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.085 -0.915 17919 61021 1 149 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.332 1.328 17919 61022 1 149 . 1 1 34 34 GLU H H 34 8.740 8.740 8.220 0.520 17919 61023 1 149 . 1 1 35 35 GLY N N 35 108.650 108.650 109.004 -0.354 17919 61024 1 149 . 1 1 35 35 GLY C C 35 173.960 173.960 174.744 -0.784 17919 61025 1 149 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.682 0.398 17919 61026 1 149 . 1 1 35 35 GLY H H 35 8.530 8.530 7.789 0.741 17919 61027 1 149 . 1 1 36 36 ILE N N 36 119.880 119.880 122.150 -2.270 17919 61028 1 149 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.233 0.212 17919 61029 1 149 . 1 1 36 36 ILE C C 36 173.590 173.590 174.509 -0.919 17919 61030 1 149 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.325 -0.575 17919 61031 1 149 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.028 2.552 17919 61032 1 149 . 1 1 36 36 ILE H H 36 6.150 6.150 7.760 -1.610 17919 61033 1 149 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.574 0.060 17919 61034 1 149 . 1 1 37 37 PRO C C 37 176.940 176.940 176.801 0.139 17919 61035 1 149 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.839 -0.179 17919 61036 1 149 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.568 0.282 17919 61037 1 149 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.212 -0.095 17919 61038 1 149 . 1 1 38 38 PRO C C 38 178.320 178.320 178.314 0.006 17919 61039 1 149 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.498 0.762 17919 61040 1 149 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.937 0.953 17919 61041 1 149 . 1 1 39 39 ASP N N 39 113.380 113.380 117.190 -3.810 17919 61042 1 149 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.321 0.109 17919 61043 1 149 . 1 1 39 39 ASP C C 39 177.090 177.090 177.871 -0.781 17919 61044 1 149 . 1 1 39 39 ASP CA C 39 55.640 55.640 57.062 -1.423 17919 61045 1 149 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.431 -0.891 17919 61046 1 149 . 1 1 39 39 ASP H H 39 8.550 8.550 8.587 -0.037 17919 61047 1 149 . 1 1 40 40 GLN N N 40 116.780 116.780 116.192 0.588 17919 61048 1 149 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.171 0.293 17919 61049 1 149 . 1 1 40 40 GLN C C 40 175.380 175.380 176.669 -1.289 17919 61050 1 149 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.134 -0.494 17919 61051 1 149 . 1 1 40 40 GLN CB C 40 30.140 30.140 28.718 1.423 17919 61052 1 149 . 1 1 40 40 GLN H H 40 7.820 7.820 7.839 -0.019 17919 61053 1 149 . 1 1 41 41 GLN N N 41 117.720 117.720 119.112 -1.392 17919 61054 1 149 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.264 -0.020 17919 61055 1 149 . 1 1 41 41 GLN C C 41 176.300 176.300 175.764 0.536 17919 61056 1 149 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.571 -0.101 17919 61057 1 149 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.342 2.308 17919 61058 1 149 . 1 1 41 41 GLN H H 41 7.480 7.480 7.293 0.187 17919 61059 1 149 . 1 1 42 42 ARG N N 42 122.680 122.680 123.576 -0.896 17919 61060 1 149 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.646 -0.146 17919 61061 1 149 . 1 1 42 42 ARG C C 42 174.050 174.050 174.852 -0.802 17919 61062 1 149 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.695 0.355 17919 61063 1 149 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.077 -0.327 17919 61064 1 149 . 1 1 42 42 ARG H H 42 8.530 8.530 8.179 0.351 17919 61065 1 149 . 1 1 43 43 LEU N N 43 124.040 124.040 126.532 -2.492 17919 61066 1 149 . 1 1 43 43 LEU C C 43 175.290 175.290 176.318 -1.028 17919 61067 1 149 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.938 -0.958 17919 61068 1 149 . 1 1 43 43 LEU CB C 43 45.790 45.790 42.549 3.241 17919 61069 1 149 . 1 1 43 43 LEU H H 43 8.820 8.820 8.703 0.117 17919 61070 1 149 . 1 1 44 44 ILE N N 44 121.920 121.920 124.253 -2.333 17919 61071 1 149 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.249 -0.257 17919 61072 1 149 . 1 1 44 44 ILE C C 44 176.060 176.060 175.019 1.041 17919 61073 1 149 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.874 -0.894 17919 61074 1 149 . 1 1 44 44 ILE CB C 44 41.420 41.420 40.660 0.760 17919 61075 1 149 . 1 1 44 44 ILE H H 44 9.030 9.030 8.617 0.413 17919 61076 1 149 . 1 1 45 45 PHE N N 45 125.390 125.390 127.130 -1.740 17919 61077 1 149 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.924 0.121 17919 61078 1 149 . 1 1 45 45 PHE C C 45 174.470 174.470 174.389 0.081 17919 61079 1 149 . 1 1 45 45 PHE CA C 45 57.020 57.020 57.202 -0.182 17919 61080 1 149 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.918 0.842 17919 61081 1 149 . 1 1 45 45 PHE H H 45 8.830 8.830 9.013 -0.183 17919 61082 1 149 . 1 1 46 46 ALA N N 46 132.200 132.200 129.163 3.037 17919 61083 1 149 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.687 0.003 17919 61084 1 149 . 1 1 46 46 ALA C C 46 177.290 177.290 177.814 -0.524 17919 61085 1 149 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.920 -0.380 17919 61086 1 149 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.763 -0.193 17919 61087 1 149 . 1 1 46 46 ALA H H 46 8.810 8.810 8.796 0.014 17919 61088 1 149 . 1 1 47 47 GLY N N 47 102.340 102.340 103.642 -1.302 17919 61089 1 149 . 1 1 47 47 GLY C C 47 173.810 173.810 174.267 -0.457 17919 61090 1 149 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.814 0.536 17919 61091 1 149 . 1 1 47 47 GLY H H 47 8.130 8.130 8.317 -0.187 17919 61092 1 149 . 1 1 48 48 LYS N N 48 121.570 121.570 121.674 -0.104 17919 61093 1 149 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.557 0.065 17919 61094 1 149 . 1 1 48 48 LYS C C 48 174.700 174.700 175.080 -0.380 17919 61095 1 149 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.105 -0.555 17919 61096 1 149 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.536 -0.007 17919 61097 1 149 . 1 1 48 48 LYS H H 48 7.980 7.980 7.959 0.021 17919 61098 1 149 . 1 1 49 49 GLN N N 49 122.410 122.410 126.209 -3.799 17919 61099 1 149 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.699 -0.139 17919 61100 1 149 . 1 1 49 49 GLN C C 49 175.670 175.670 175.313 0.357 17919 61101 1 149 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.709 0.031 17919 61102 1 149 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.619 -0.619 17919 61103 1 149 . 1 1 49 49 GLN H H 49 8.600 8.600 8.633 -0.033 17919 61104 1 149 . 1 1 50 50 LEU N N 50 125.520 125.520 128.113 -2.593 17919 61105 1 149 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.375 -0.285 17919 61106 1 149 . 1 1 50 50 LEU C C 50 176.660 176.660 176.789 -0.129 17919 61107 1 149 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.245 -0.005 17919 61108 1 149 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.676 -1.106 17919 61109 1 149 . 1 1 50 50 LEU H H 50 8.530 8.530 8.581 -0.051 17919 61110 1 149 . 1 1 51 51 GLU N N 51 122.940 122.940 123.713 -0.773 17919 61111 1 149 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.457 0.031 17919 61112 1 149 . 1 1 51 51 GLU C C 51 175.870 175.870 177.044 -1.174 17919 61113 1 149 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.733 0.226 17919 61114 1 149 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.024 0.546 17919 61115 1 149 . 1 1 51 51 GLU H H 51 8.400 8.400 8.330 0.070 17919 61116 1 149 . 1 1 52 52 ASP N N 52 120.030 120.030 126.204 -6.174 17919 61117 1 149 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.365 -0.006 17919 61118 1 149 . 1 1 52 52 ASP C C 52 177.330 177.330 177.994 -0.664 17919 61119 1 149 . 1 1 52 52 ASP CA C 52 56.960 56.960 58.267 -1.306 17919 61120 1 149 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.670 0.180 17919 61121 1 149 . 1 1 52 52 ASP H H 52 8.160 8.160 8.864 -0.704 17919 61122 1 149 . 1 1 53 53 GLY N N 53 106.660 106.660 103.903 2.757 17919 61123 1 149 . 1 1 53 53 GLY C C 53 174.870 174.870 174.454 0.416 17919 61124 1 149 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.803 0.367 17919 61125 1 149 . 1 1 53 53 GLY H H 53 9.390 9.390 8.185 1.205 17919 61126 1 149 . 1 1 54 54 ARG N N 54 119.050 119.050 121.445 -2.395 17919 61127 1 149 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.377 0.318 17919 61128 1 149 . 1 1 54 54 ARG C C 54 175.350 175.350 175.414 -0.064 17919 61129 1 149 . 1 1 54 54 ARG CA C 54 54.390 54.390 55.459 -1.069 17919 61130 1 149 . 1 1 54 54 ARG CB C 54 32.650 32.650 31.193 1.457 17919 61131 1 149 . 1 1 54 54 ARG H H 54 7.460 7.460 7.558 -0.098 17919 61132 1 149 . 1 1 55 55 THR N N 55 108.400 108.400 116.373 -7.973 17919 61133 1 149 . 1 1 55 55 THR HA H 55 5.240 5.240 4.798 0.442 17919 61134 1 149 . 1 1 55 55 THR C C 55 176.560 176.560 175.839 0.721 17919 61135 1 149 . 1 1 55 55 THR CA C 55 59.690 59.690 60.413 -0.723 17919 61136 1 149 . 1 1 55 55 THR CB C 55 72.260 72.260 70.169 2.091 17919 61137 1 149 . 1 1 55 55 THR H H 55 8.730 8.730 8.033 0.697 17919 61138 1 149 . 1 1 56 56 LEU N N 56 117.920 117.920 123.532 -5.612 17919 61139 1 149 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.036 0.024 17919 61140 1 149 . 1 1 56 56 LEU C C 56 180.810 180.810 178.883 1.927 17919 61141 1 149 . 1 1 56 56 LEU CA C 56 58.710 58.710 57.741 0.969 17919 61142 1 149 . 1 1 56 56 LEU CB C 56 40.370 40.370 40.067 0.303 17919 61143 1 149 . 1 1 56 56 LEU H H 56 8.140 8.140 8.089 0.051 17919 61144 1 149 . 1 1 57 57 SER N N 57 113.330 113.330 113.721 -0.391 17919 61145 1 149 . 1 1 57 57 SER HA H 57 4.370 4.370 3.988 0.382 17919 61146 1 149 . 1 1 57 57 SER C C 57 178.310 178.310 176.863 1.447 17919 61147 1 149 . 1 1 57 57 SER CA C 57 61.080 61.080 60.875 0.205 17919 61148 1 149 . 1 1 57 57 SER CB C 57 62.530 62.530 62.681 -0.151 17919 61149 1 149 . 1 1 57 57 SER H H 57 8.470 8.470 7.919 0.551 17919 61150 1 149 . 1 1 58 58 ASP N N 58 124.190 124.190 121.928 2.262 17919 61151 1 149 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.403 -0.107 17919 61152 1 149 . 1 1 58 58 ASP C C 58 177.400 177.400 177.406 -0.006 17919 61153 1 149 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.173 1.007 17919 61154 1 149 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.714 -0.614 17919 61155 1 149 . 1 1 58 58 ASP H H 58 7.930 7.930 7.787 0.143 17919 61156 1 149 . 1 1 59 59 TYR N N 59 115.510 115.510 115.933 -0.423 17919 61157 1 149 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.639 0.031 17919 61158 1 149 . 1 1 59 59 TYR C C 59 174.700 174.700 175.296 -0.596 17919 61159 1 149 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.958 0.292 17919 61160 1 149 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.538 1.532 17919 61161 1 149 . 1 1 59 59 TYR H H 59 7.250 7.250 7.403 -0.153 17919 61162 1 149 . 1 1 60 60 ASN N N 60 115.900 115.900 117.241 -1.341 17919 61163 1 149 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.436 -0.081 17919 61164 1 149 . 1 1 60 60 ASN C C 60 174.340 174.340 174.305 0.035 17919 61165 1 149 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.074 0.046 17919 61166 1 149 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.478 -0.068 17919 61167 1 149 . 1 1 60 60 ASN H H 60 8.150 8.150 7.746 0.404 17919 61168 1 149 . 1 1 61 61 ILE N N 61 118.600 118.600 120.572 -1.972 17919 61169 1 149 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.867 -0.474 17919 61170 1 149 . 1 1 61 61 ILE C C 61 174.610 174.610 175.105 -0.495 17919 61171 1 149 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.158 0.262 17919 61172 1 149 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.616 -0.876 17919 61173 1 149 . 1 1 61 61 ILE H H 61 7.250 7.250 7.588 -0.338 17919 61174 1 149 . 1 1 62 62 GLN N N 62 124.740 124.740 126.498 -1.758 17919 61175 1 149 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.656 -0.150 17919 61176 1 149 . 1 1 62 62 GLN C C 62 175.970 175.970 176.030 -0.060 17919 61177 1 149 . 1 1 62 62 GLN CA C 62 53.660 53.660 54.301 -0.641 17919 61178 1 149 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.648 0.002 17919 61179 1 149 . 1 1 62 62 GLN H H 62 7.610 7.610 7.961 -0.351 17919 61180 1 149 . 1 1 63 63 LYS N N 63 120.300 120.300 119.593 0.707 17919 61181 1 149 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.904 0.097 17919 61182 1 149 . 1 1 63 63 LYS C C 63 175.810 175.810 177.383 -1.573 17919 61183 1 149 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.990 -0.200 17919 61184 1 149 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.259 0.391 17919 61185 1 149 . 1 1 63 63 LYS H H 63 8.490 8.490 8.667 -0.177 17919 61186 1 149 . 1 1 64 64 GLU N N 64 113.950 113.950 117.838 -3.888 17919 61187 1 149 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.704 -0.239 17919 61188 1 149 . 1 1 64 64 GLU C C 64 175.250 175.250 176.070 -0.820 17919 61189 1 149 . 1 1 64 64 GLU CA C 64 57.890 57.890 58.013 -0.123 17919 61190 1 149 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.825 -2.925 17919 61191 1 149 . 1 1 64 64 GLU H H 64 9.280 9.280 8.678 0.602 17919 61192 1 149 . 1 1 65 65 SER N N 65 114.730 114.730 115.061 -0.331 17919 61193 1 149 . 1 1 65 65 SER HA H 65 4.640 4.640 4.549 0.091 17919 61194 1 149 . 1 1 65 65 SER C C 65 172.160 172.160 174.245 -2.085 17919 61195 1 149 . 1 1 65 65 SER CA C 65 60.890 60.890 59.985 0.905 17919 61196 1 149 . 1 1 65 65 SER CB C 65 64.910 64.910 64.240 0.670 17919 61197 1 149 . 1 1 65 65 SER H H 65 7.670 7.670 7.397 0.273 17919 61198 1 149 . 1 1 66 66 THR N N 66 117.110 117.110 118.104 -0.994 17919 61199 1 149 . 1 1 66 66 THR HA H 66 5.270 5.270 5.346 -0.076 17919 61200 1 149 . 1 1 66 66 THR C C 66 173.950 173.950 174.130 -0.180 17919 61201 1 149 . 1 1 66 66 THR CA C 66 62.340 62.340 62.042 0.298 17919 61202 1 149 . 1 1 66 66 THR CB C 66 70.080 70.080 70.573 -0.493 17919 61203 1 149 . 1 1 66 66 THR H H 66 8.730 8.730 8.464 0.266 17919 61204 1 149 . 1 1 67 67 LEU N N 67 127.110 127.110 127.631 -0.521 17919 61205 1 149 . 1 1 67 67 LEU HA H 67 5.060 5.060 5.221 -0.161 17919 61206 1 149 . 1 1 67 67 LEU C C 67 175.770 175.770 175.641 0.129 17919 61207 1 149 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.883 0.017 17919 61208 1 149 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.605 0.655 17919 61209 1 149 . 1 1 67 67 LEU H H 67 9.410 9.410 8.981 0.429 17919 61210 1 149 . 1 1 68 68 HIS N N 68 118.380 118.380 119.497 -1.117 17919 61211 1 149 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.736 -0.496 17919 61212 1 149 . 1 1 68 68 HIS C C 68 173.150 173.150 173.938 -0.788 17919 61213 1 149 . 1 1 68 68 HIS CA C 68 55.000 55.000 53.688 1.312 17919 61214 1 149 . 1 1 68 68 HIS CB C 68 30.530 30.530 34.333 -3.803 17919 61215 1 149 . 1 1 68 68 HIS H H 68 9.230 9.230 9.091 0.139 17919 61216 1 149 . 1 1 69 69 LEU N N 69 124.460 124.460 122.183 2.277 17919 61217 1 149 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.042 0.148 17919 61218 1 149 . 1 1 69 69 LEU C C 69 175.270 175.270 173.973 1.297 17919 61219 1 149 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.549 -0.659 17919 61220 1 149 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.720 -0.340 17919 61221 1 149 . 1 1 69 69 LEU H H 69 8.340 8.340 6.978 1.362 17919 61222 1 149 . 1 1 70 70 VAL N N 70 126.940 126.940 126.982 -0.042 17919 61223 1 149 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.524 -0.174 17919 61224 1 149 . 1 1 70 70 VAL C C 70 174.000 174.000 174.399 -0.399 17919 61225 1 149 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.564 0.236 17919 61226 1 149 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.183 -0.273 17919 61227 1 149 . 1 1 70 70 VAL H H 70 9.200 9.200 8.186 1.014 17919 61228 1 149 . 1 1 71 71 LEU N N 71 123.130 123.130 123.384 -0.254 17919 61229 1 149 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.162 -0.102 17919 61230 1 149 . 1 1 71 71 LEU C C 71 177.830 177.830 177.196 0.634 17919 61231 1 149 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.196 0.744 17919 61232 1 149 . 1 1 71 71 LEU CB C 71 42.850 42.850 44.428 -1.577 17919 61233 1 149 . 1 1 71 71 LEU H H 71 8.120 8.120 8.318 -0.198 17919 61234 1 149 . 1 1 72 72 ARG N N 72 123.490 123.490 123.511 -0.021 17919 61235 1 149 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.501 -0.200 17919 61236 1 149 . 1 1 72 72 ARG C C 72 175.350 175.350 174.951 0.399 17919 61237 1 149 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.270 -0.660 17919 61238 1 149 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.807 0.543 17919 61239 1 149 . 1 1 72 72 ARG H H 72 8.580 8.580 8.416 0.164 17919 61240 1 150 . 1 1 2 2 GLN N N 2 123.220 123.220 122.900 0.320 17919 61241 1 150 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.252 -0.003 17919 61242 1 150 . 1 1 2 2 GLN C C 2 175.920 175.920 175.616 0.304 17919 61243 1 150 . 1 1 2 2 GLN CA C 2 55.080 55.080 55.382 -0.302 17919 61244 1 150 . 1 1 2 2 GLN CB C 2 30.760 30.760 29.907 0.853 17919 61245 1 150 . 1 1 2 2 GLN H H 2 8.900 8.900 8.669 0.231 17919 61246 1 150 . 1 1 3 3 ILE N N 3 115.340 115.340 116.644 -1.304 17919 61247 1 150 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.258 -0.045 17919 61248 1 150 . 1 1 3 3 ILE C C 3 172.450 172.450 173.540 -1.090 17919 61249 1 150 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.053 0.517 17919 61250 1 150 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.563 0.647 17919 61251 1 150 . 1 1 3 3 ILE H H 3 8.320 8.320 8.538 -0.218 17919 61252 1 150 . 1 1 4 4 PHE N N 4 118.110 118.110 119.754 -1.644 17919 61253 1 150 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.399 0.231 17919 61254 1 150 . 1 1 4 4 PHE C C 4 175.320 175.320 175.062 0.258 17919 61255 1 150 . 1 1 4 4 PHE CA C 4 55.210 55.210 54.984 0.225 17919 61256 1 150 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.264 -0.784 17919 61257 1 150 . 1 1 4 4 PHE H H 4 8.610 8.610 8.662 -0.052 17919 61258 1 150 . 1 1 5 5 VAL N N 5 121.000 121.000 121.180 -0.180 17919 61259 1 150 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.994 -0.269 17919 61260 1 150 . 1 1 5 5 VAL C C 5 174.870 174.870 174.370 0.500 17919 61261 1 150 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.069 -0.449 17919 61262 1 150 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.683 -0.453 17919 61263 1 150 . 1 1 5 5 VAL H H 5 9.300 9.300 9.198 0.102 17919 61264 1 150 . 1 1 6 6 LYS N N 6 127.520 127.520 128.628 -1.108 17919 61265 1 150 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.435 -0.068 17919 61266 1 150 . 1 1 6 6 LYS C C 6 177.140 177.140 176.019 1.121 17919 61267 1 150 . 1 1 6 6 LYS CA C 6 54.520 54.520 53.829 0.691 17919 61268 1 150 . 1 1 6 6 LYS CB C 6 35.050 35.050 36.710 -1.660 17919 61269 1 150 . 1 1 6 6 LYS H H 6 8.820 8.820 8.475 0.345 17919 61270 1 150 . 1 1 7 7 THR N N 7 115.400 115.400 116.489 -1.089 17919 61271 1 150 . 1 1 7 7 THR HA H 7 4.970 4.970 4.835 0.135 17919 61272 1 150 . 1 1 7 7 THR C C 7 176.910 176.910 176.349 0.561 17919 61273 1 150 . 1 1 7 7 THR CA C 7 60.470 60.470 60.376 0.094 17919 61274 1 150 . 1 1 7 7 THR CB C 7 70.630 70.630 70.897 -0.267 17919 61275 1 150 . 1 1 7 7 THR H H 7 8.730 8.730 8.410 0.320 17919 61276 1 150 . 1 1 8 8 LEU N N 8 121.330 121.330 122.699 -1.369 17919 61277 1 150 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.304 0.006 17919 61278 1 150 . 1 1 8 8 LEU C C 8 178.800 178.800 177.140 1.660 17919 61279 1 150 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.076 0.504 17919 61280 1 150 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.044 -0.074 17919 61281 1 150 . 1 1 8 8 LEU H H 8 9.100 9.100 8.172 0.928 17919 61282 1 150 . 1 1 9 9 THR N N 9 105.590 105.590 106.954 -1.364 17919 61283 1 150 . 1 1 9 9 THR HA H 9 4.428 4.428 4.337 0.091 17919 61284 1 150 . 1 1 9 9 THR C C 9 175.520 175.520 175.371 0.149 17919 61285 1 150 . 1 1 9 9 THR CA C 9 61.400 61.400 61.960 -0.560 17919 61286 1 150 . 1 1 9 9 THR CB C 9 69.140 69.140 68.485 0.655 17919 61287 1 150 . 1 1 9 9 THR H H 9 7.630 7.630 7.726 -0.096 17919 61288 1 150 . 1 1 10 10 GLY N N 10 108.890 108.890 109.816 -0.926 17919 61289 1 150 . 1 1 10 10 GLY C C 10 174.070 174.070 173.997 0.073 17919 61290 1 150 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.990 0.470 17919 61291 1 150 . 1 1 10 10 GLY H H 10 7.810 7.810 7.647 0.163 17919 61292 1 150 . 1 1 11 11 LYS N N 11 121.600 121.600 121.522 0.078 17919 61293 1 150 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.473 -0.112 17919 61294 1 150 . 1 1 11 11 LYS C C 11 175.940 175.940 175.284 0.656 17919 61295 1 150 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.035 0.245 17919 61296 1 150 . 1 1 11 11 LYS CB C 11 33.200 33.200 34.056 -0.856 17919 61297 1 150 . 1 1 11 11 LYS H H 11 7.280 7.280 7.884 -0.604 17919 61298 1 150 . 1 1 12 12 THR N N 12 120.440 120.440 114.901 5.539 17919 61299 1 150 . 1 1 12 12 THR HA H 12 5.046 5.046 5.290 -0.244 17919 61300 1 150 . 1 1 12 12 THR C C 12 174.320 174.320 173.768 0.552 17919 61301 1 150 . 1 1 12 12 THR CA C 12 62.390 62.390 61.038 1.352 17919 61302 1 150 . 1 1 12 12 THR CB C 12 69.910 69.910 71.697 -1.787 17919 61303 1 150 . 1 1 12 12 THR H H 12 8.650 8.650 8.270 0.380 17919 61304 1 150 . 1 1 13 13 ILE N N 13 127.110 127.110 127.329 -0.219 17919 61305 1 150 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.474 0.070 17919 61306 1 150 . 1 1 13 13 ILE C C 13 175.220 175.220 174.984 0.236 17919 61307 1 150 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.172 -0.192 17919 61308 1 150 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.488 0.462 17919 61309 1 150 . 1 1 13 13 ILE H H 13 9.450 9.450 9.302 0.148 17919 61310 1 150 . 1 1 14 14 THR N N 14 121.520 121.520 124.163 -2.643 17919 61311 1 150 . 1 1 14 14 THR HA H 14 4.964 4.964 4.775 0.189 17919 61312 1 150 . 1 1 14 14 THR C C 14 173.790 173.790 174.055 -0.265 17919 61313 1 150 . 1 1 14 14 THR CA C 14 61.940 61.940 62.965 -1.026 17919 61314 1 150 . 1 1 14 14 THR CB C 14 69.650 69.650 69.118 0.532 17919 61315 1 150 . 1 1 14 14 THR H H 14 8.710 8.710 8.596 0.114 17919 61316 1 150 . 1 1 15 15 LEU N N 15 124.800 124.800 128.870 -4.070 17919 61317 1 150 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.664 0.116 17919 61318 1 150 . 1 1 15 15 LEU C C 15 174.670 174.670 175.754 -1.084 17919 61319 1 150 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.664 -0.834 17919 61320 1 150 . 1 1 15 15 LEU CB C 15 47.070 47.070 44.527 2.543 17919 61321 1 150 . 1 1 15 15 LEU H H 15 8.710 8.710 8.892 -0.182 17919 61322 1 150 . 1 1 16 16 GLU N N 16 122.160 122.160 122.957 -0.797 17919 61323 1 150 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.506 0.411 17919 61324 1 150 . 1 1 16 16 GLU C C 16 175.860 175.860 175.692 0.168 17919 61325 1 150 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.562 -0.742 17919 61326 1 150 . 1 1 16 16 GLU CB C 16 29.450 29.450 29.513 -0.063 17919 61327 1 150 . 1 1 16 16 GLU H H 16 8.140 8.140 8.688 -0.548 17919 61328 1 150 . 1 1 17 17 VAL N N 17 117.210 117.210 119.202 -1.992 17919 61329 1 150 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.995 -0.281 17919 61330 1 150 . 1 1 17 17 VAL C C 17 174.160 174.160 175.400 -1.240 17919 61331 1 150 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.905 -0.475 17919 61332 1 150 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.273 1.127 17919 61333 1 150 . 1 1 17 17 VAL H H 17 8.900 8.900 8.787 0.113 17919 61334 1 150 . 1 1 18 18 GLU N N 18 118.990 118.990 120.550 -1.560 17919 61335 1 150 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.844 0.235 17919 61336 1 150 . 1 1 18 18 GLU C C 18 176.160 176.160 175.292 0.868 17919 61337 1 150 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.685 0.035 17919 61338 1 150 . 1 1 18 18 GLU CB C 18 30.310 30.310 29.961 0.349 17919 61339 1 150 . 1 1 18 18 GLU H H 18 8.640 8.640 9.094 -0.454 17919 61340 1 150 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.197 -0.056 17919 61341 1 150 . 1 1 19 19 PRO C C 19 175.310 175.310 177.698 -2.388 17919 61342 1 150 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.824 -0.354 17919 61343 1 150 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.901 0.049 17919 61344 1 150 . 1 1 20 20 SER N N 20 103.400 103.400 109.042 -5.642 17919 61345 1 150 . 1 1 20 20 SER HA H 20 4.370 4.370 4.370 -0.000 17919 61346 1 150 . 1 1 20 20 SER C C 20 174.660 174.660 174.110 0.550 17919 61347 1 150 . 1 1 20 20 SER CA C 20 57.400 57.400 59.395 -1.996 17919 61348 1 150 . 1 1 20 20 SER CB C 20 63.370 63.370 62.762 0.608 17919 61349 1 150 . 1 1 20 20 SER H H 20 7.040 7.040 8.076 -1.036 17919 61350 1 150 . 1 1 21 21 ASP N N 21 123.480 123.480 123.543 -0.063 17919 61351 1 150 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.632 0.063 17919 61352 1 150 . 1 1 21 21 ASP C C 21 176.360 176.360 175.607 0.753 17919 61353 1 150 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.555 0.145 17919 61354 1 150 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.470 -0.670 17919 61355 1 150 . 1 1 21 21 ASP H H 21 8.030 8.030 7.678 0.352 17919 61356 1 150 . 1 1 22 22 THR N N 22 108.800 108.800 112.269 -3.469 17919 61357 1 150 . 1 1 22 22 THR HA H 22 4.920 4.920 4.627 0.293 17919 61358 1 150 . 1 1 22 22 THR C C 22 176.750 176.750 175.859 0.891 17919 61359 1 150 . 1 1 22 22 THR CA C 22 59.690 59.690 61.146 -1.456 17919 61360 1 150 . 1 1 22 22 THR CB C 22 71.200 71.200 70.158 1.042 17919 61361 1 150 . 1 1 22 22 THR H H 22 7.900 7.900 8.264 -0.364 17919 61362 1 150 . 1 1 23 23 ILE N N 23 121.190 121.190 123.189 -1.999 17919 61363 1 150 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.772 -0.115 17919 61364 1 150 . 1 1 23 23 ILE C C 23 179.040 179.040 177.201 1.839 17919 61365 1 150 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.228 0.032 17919 61366 1 150 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.689 -2.339 17919 61367 1 150 . 1 1 23 23 ILE H H 23 8.560 8.560 8.857 -0.297 17919 61368 1 150 . 1 1 24 24 GLU N N 24 120.830 120.830 119.795 1.035 17919 61369 1 150 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.980 -0.063 17919 61370 1 150 . 1 1 24 24 GLU C C 24 178.640 178.640 178.222 0.418 17919 61371 1 150 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.374 0.846 17919 61372 1 150 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.454 -1.174 17919 61373 1 150 . 1 1 24 24 GLU H H 24 9.760 9.760 7.800 1.960 17919 61374 1 150 . 1 1 25 25 ASN N N 25 120.570 120.570 118.605 1.965 17919 61375 1 150 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.543 -0.018 17919 61376 1 150 . 1 1 25 25 ASN C C 25 178.380 178.380 177.781 0.599 17919 61377 1 150 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.532 0.527 17919 61378 1 150 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.410 0.040 17919 61379 1 150 . 1 1 25 25 ASN H H 25 7.920 7.920 7.590 0.330 17919 61380 1 150 . 1 1 26 26 VAL N N 26 121.710 121.710 120.533 1.177 17919 61381 1 150 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.548 -0.151 17919 61382 1 150 . 1 1 26 26 VAL C C 26 177.950 177.950 177.527 0.423 17919 61383 1 150 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.996 0.664 17919 61384 1 150 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.555 -0.715 17919 61385 1 150 . 1 1 26 26 VAL H H 26 8.070 8.070 8.271 -0.201 17919 61386 1 150 . 1 1 27 27 LYS N N 27 118.860 118.860 120.063 -1.203 17919 61387 1 150 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.242 0.338 17919 61388 1 150 . 1 1 27 27 LYS C C 27 180.550 180.550 178.954 1.596 17919 61389 1 150 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.662 -0.412 17919 61390 1 150 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.231 1.498 17919 61391 1 150 . 1 1 27 27 LYS H H 27 8.560 8.560 7.615 0.945 17919 61392 1 150 . 1 1 28 28 ALA N N 28 123.440 123.440 121.991 1.449 17919 61393 1 150 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.030 0.130 17919 61394 1 150 . 1 1 28 28 ALA C C 28 180.300 180.300 179.213 1.087 17919 61395 1 150 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.137 0.233 17919 61396 1 150 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.313 -0.603 17919 61397 1 150 . 1 1 28 28 ALA H H 28 8.060 8.060 8.227 -0.167 17919 61398 1 150 . 1 1 29 29 LYS N N 29 119.940 119.940 119.906 0.034 17919 61399 1 150 . 1 1 29 29 LYS HA H 29 4.207 4.207 3.978 0.229 17919 61400 1 150 . 1 1 29 29 LYS C C 29 180.320 180.320 179.036 1.284 17919 61401 1 150 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.515 0.135 17919 61402 1 150 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.381 0.909 17919 61403 1 150 . 1 1 29 29 LYS H H 29 7.850 7.850 7.729 0.121 17919 61404 1 150 . 1 1 30 30 ILE N N 30 121.080 121.080 120.127 0.953 17919 61405 1 150 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.606 -0.099 17919 61406 1 150 . 1 1 30 30 ILE C C 30 178.310 178.310 177.492 0.818 17919 61407 1 150 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.560 0.590 17919 61408 1 150 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.846 -1.046 17919 61409 1 150 . 1 1 30 30 ILE H H 30 8.280 8.280 8.538 -0.258 17919 61410 1 150 . 1 1 31 31 GLN N N 31 123.490 123.490 119.188 4.302 17919 61411 1 150 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.055 -0.226 17919 61412 1 150 . 1 1 31 31 GLN C C 31 178.890 178.890 178.432 0.458 17919 61413 1 150 . 1 1 31 31 GLN CA C 31 60.000 60.000 58.916 1.084 17919 61414 1 150 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.580 -0.860 17919 61415 1 150 . 1 1 31 31 GLN H H 31 8.580 8.580 8.390 0.190 17919 61416 1 150 . 1 1 32 32 ASP N N 32 119.360 119.360 121.147 -1.787 17919 61417 1 150 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.392 -0.038 17919 61418 1 150 . 1 1 32 32 ASP C C 32 177.250 177.250 178.038 -0.788 17919 61419 1 150 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.979 0.211 17919 61420 1 150 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.823 -0.243 17919 61421 1 150 . 1 1 32 32 ASP H H 32 8.010 8.010 8.190 -0.180 17919 61422 1 150 . 1 1 33 33 LYS N N 33 115.130 115.130 118.049 -2.919 17919 61423 1 150 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.263 0.074 17919 61424 1 150 . 1 1 33 33 LYS C C 33 177.870 177.870 178.393 -0.523 17919 61425 1 150 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.063 -0.013 17919 61426 1 150 . 1 1 33 33 LYS CB C 33 34.170 34.170 32.958 1.212 17919 61427 1 150 . 1 1 33 33 LYS H H 33 7.430 7.430 7.567 -0.137 17919 61428 1 150 . 1 1 34 34 GLU N N 34 113.870 113.870 114.305 -0.435 17919 61429 1 150 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.489 0.136 17919 61430 1 150 . 1 1 34 34 GLU C C 34 177.840 177.840 177.349 0.491 17919 61431 1 150 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.948 -0.778 17919 61432 1 150 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.413 1.247 17919 61433 1 150 . 1 1 34 34 GLU H H 34 8.740 8.740 8.108 0.632 17919 61434 1 150 . 1 1 35 35 GLY N N 35 108.650 108.650 109.024 -0.374 17919 61435 1 150 . 1 1 35 35 GLY C C 35 173.960 173.960 174.685 -0.725 17919 61436 1 150 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.763 0.317 17919 61437 1 150 . 1 1 35 35 GLY H H 35 8.530 8.530 7.874 0.656 17919 61438 1 150 . 1 1 36 36 ILE N N 36 119.880 119.880 122.698 -2.818 17919 61439 1 150 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.256 0.189 17919 61440 1 150 . 1 1 36 36 ILE C C 36 173.590 173.590 174.526 -0.936 17919 61441 1 150 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.228 -0.478 17919 61442 1 150 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.362 2.218 17919 61443 1 150 . 1 1 36 36 ILE H H 36 6.150 6.150 7.787 -1.637 17919 61444 1 150 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.776 -0.142 17919 61445 1 150 . 1 1 37 37 PRO C C 37 176.940 176.940 176.511 0.429 17919 61446 1 150 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.552 0.108 17919 61447 1 150 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.316 0.534 17919 61448 1 150 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.201 -0.084 17919 61449 1 150 . 1 1 38 38 PRO C C 38 178.320 178.320 178.657 -0.337 17919 61450 1 150 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.322 0.938 17919 61451 1 150 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.836 1.054 17919 61452 1 150 . 1 1 39 39 ASP N N 39 113.380 113.380 117.763 -4.383 17919 61453 1 150 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.244 0.186 17919 61454 1 150 . 1 1 39 39 ASP C C 39 177.090 177.090 178.092 -1.002 17919 61455 1 150 . 1 1 39 39 ASP CA C 39 55.640 55.640 57.212 -1.572 17919 61456 1 150 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.232 -0.692 17919 61457 1 150 . 1 1 39 39 ASP H H 39 8.550 8.550 8.691 -0.141 17919 61458 1 150 . 1 1 40 40 GLN N N 40 116.780 116.780 116.463 0.317 17919 61459 1 150 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.104 0.360 17919 61460 1 150 . 1 1 40 40 GLN C C 40 175.380 175.380 176.207 -0.827 17919 61461 1 150 . 1 1 40 40 GLN CA C 40 55.640 55.640 57.222 -1.582 17919 61462 1 150 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.133 1.007 17919 61463 1 150 . 1 1 40 40 GLN H H 40 7.820 7.820 7.808 0.012 17919 61464 1 150 . 1 1 41 41 GLN N N 41 117.720 117.720 118.303 -0.583 17919 61465 1 150 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.513 -0.269 17919 61466 1 150 . 1 1 41 41 GLN C C 41 176.300 176.300 174.880 1.420 17919 61467 1 150 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.355 1.115 17919 61468 1 150 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.849 1.801 17919 61469 1 150 . 1 1 41 41 GLN H H 41 7.480 7.480 7.592 -0.112 17919 61470 1 150 . 1 1 42 42 ARG N N 42 122.680 122.680 124.800 -2.120 17919 61471 1 150 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.558 -0.058 17919 61472 1 150 . 1 1 42 42 ARG C C 42 174.050 174.050 174.003 0.047 17919 61473 1 150 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.121 -0.071 17919 61474 1 150 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.508 -0.758 17919 61475 1 150 . 1 1 42 42 ARG H H 42 8.530 8.530 7.877 0.653 17919 61476 1 150 . 1 1 43 43 LEU N N 43 124.040 124.040 128.068 -4.028 17919 61477 1 150 . 1 1 43 43 LEU C C 43 175.290 175.290 175.516 -0.226 17919 61478 1 150 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.740 -0.760 17919 61479 1 150 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.829 1.961 17919 61480 1 150 . 1 1 43 43 LEU H H 43 8.820 8.820 8.723 0.097 17919 61481 1 150 . 1 1 44 44 ILE N N 44 121.920 121.920 122.739 -0.819 17919 61482 1 150 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.068 -0.076 17919 61483 1 150 . 1 1 44 44 ILE C C 44 176.060 176.060 174.676 1.384 17919 61484 1 150 . 1 1 44 44 ILE CA C 44 58.980 58.980 58.375 0.605 17919 61485 1 150 . 1 1 44 44 ILE CB C 44 41.420 41.420 39.685 1.735 17919 61486 1 150 . 1 1 44 44 ILE H H 44 9.030 9.030 9.033 -0.003 17919 61487 1 150 . 1 1 45 45 PHE N N 45 125.390 125.390 128.135 -2.745 17919 61488 1 150 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.931 0.114 17919 61489 1 150 . 1 1 45 45 PHE C C 45 174.470 174.470 174.204 0.266 17919 61490 1 150 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.723 0.297 17919 61491 1 150 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.513 1.247 17919 61492 1 150 . 1 1 45 45 PHE H H 45 8.830 8.830 8.785 0.045 17919 61493 1 150 . 1 1 46 46 ALA N N 46 132.200 132.200 129.800 2.400 17919 61494 1 150 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.628 0.062 17919 61495 1 150 . 1 1 46 46 ALA C C 46 177.290 177.290 177.317 -0.027 17919 61496 1 150 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.897 -0.357 17919 61497 1 150 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.857 -0.287 17919 61498 1 150 . 1 1 46 46 ALA H H 46 8.810 8.810 8.628 0.182 17919 61499 1 150 . 1 1 47 47 GLY N N 47 102.340 102.340 104.101 -1.761 17919 61500 1 150 . 1 1 47 47 GLY C C 47 173.810 173.810 174.838 -1.028 17919 61501 1 150 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.565 -0.215 17919 61502 1 150 . 1 1 47 47 GLY H H 47 8.130 8.130 8.354 -0.224 17919 61503 1 150 . 1 1 48 48 LYS N N 48 121.570 121.570 121.974 -0.404 17919 61504 1 150 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.532 0.090 17919 61505 1 150 . 1 1 48 48 LYS C C 48 174.700 174.700 176.081 -1.381 17919 61506 1 150 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.182 -0.632 17919 61507 1 150 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.074 0.456 17919 61508 1 150 . 1 1 48 48 LYS H H 48 7.980 7.980 7.966 0.014 17919 61509 1 150 . 1 1 49 49 GLN N N 49 122.410 122.410 124.846 -2.436 17919 61510 1 150 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.402 0.158 17919 61511 1 150 . 1 1 49 49 GLN C C 49 175.670 175.670 175.060 0.610 17919 61512 1 150 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.553 -0.813 17919 61513 1 150 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.373 -0.373 17919 61514 1 150 . 1 1 49 49 GLN H H 49 8.600 8.600 8.627 -0.027 17919 61515 1 150 . 1 1 50 50 LEU N N 50 125.520 125.520 128.956 -3.436 17919 61516 1 150 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.034 0.056 17919 61517 1 150 . 1 1 50 50 LEU C C 50 176.660 176.660 175.166 1.494 17919 61518 1 150 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.914 0.326 17919 61519 1 150 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.899 -1.329 17919 61520 1 150 . 1 1 50 50 LEU H H 50 8.530 8.530 8.504 0.026 17919 61521 1 150 . 1 1 51 51 GLU N N 51 122.940 122.940 122.489 0.451 17919 61522 1 150 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.637 -0.149 17919 61523 1 150 . 1 1 51 51 GLU C C 51 175.870 175.870 175.935 -0.065 17919 61524 1 150 . 1 1 51 51 GLU CA C 51 55.960 55.960 54.896 1.064 17919 61525 1 150 . 1 1 51 51 GLU CB C 51 31.570 31.570 33.393 -1.823 17919 61526 1 150 . 1 1 51 51 GLU H H 51 8.400 8.400 7.937 0.463 17919 61527 1 150 . 1 1 52 52 ASP N N 52 120.030 120.030 121.603 -1.573 17919 61528 1 150 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.574 -0.215 17919 61529 1 150 . 1 1 52 52 ASP C C 52 177.330 177.330 178.284 -0.954 17919 61530 1 150 . 1 1 52 52 ASP CA C 52 56.960 56.960 56.802 0.158 17919 61531 1 150 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.900 -0.050 17919 61532 1 150 . 1 1 52 52 ASP H H 52 8.160 8.160 8.760 -0.600 17919 61533 1 150 . 1 1 53 53 GLY N N 53 106.660 106.660 106.893 -0.233 17919 61534 1 150 . 1 1 53 53 GLY C C 53 174.870 174.870 174.666 0.204 17919 61535 1 150 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.319 -0.149 17919 61536 1 150 . 1 1 53 53 GLY H H 53 9.390 9.390 8.354 1.036 17919 61537 1 150 . 1 1 54 54 ARG N N 54 119.050 119.050 119.607 -0.557 17919 61538 1 150 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.652 0.043 17919 61539 1 150 . 1 1 54 54 ARG C C 54 175.350 175.350 175.785 -0.435 17919 61540 1 150 . 1 1 54 54 ARG CA C 54 54.390 54.390 53.693 0.697 17919 61541 1 150 . 1 1 54 54 ARG CB C 54 32.650 32.650 31.903 0.747 17919 61542 1 150 . 1 1 54 54 ARG H H 54 7.460 7.460 7.446 0.014 17919 61543 1 150 . 1 1 55 55 THR N N 55 108.400 108.400 112.312 -3.912 17919 61544 1 150 . 1 1 55 55 THR HA H 55 5.240 5.240 4.977 0.263 17919 61545 1 150 . 1 1 55 55 THR C C 55 176.560 176.560 175.990 0.570 17919 61546 1 150 . 1 1 55 55 THR CA C 55 59.690 59.690 60.334 -0.644 17919 61547 1 150 . 1 1 55 55 THR CB C 55 72.260 72.260 71.362 0.898 17919 61548 1 150 . 1 1 55 55 THR H H 55 8.730 8.730 8.850 -0.120 17919 61549 1 150 . 1 1 56 56 LEU N N 56 117.920 117.920 121.211 -3.291 17919 61550 1 150 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.008 0.052 17919 61551 1 150 . 1 1 56 56 LEU C C 56 180.810 180.810 179.085 1.725 17919 61552 1 150 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.544 0.166 17919 61553 1 150 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.511 -1.141 17919 61554 1 150 . 1 1 56 56 LEU H H 56 8.140 8.140 8.217 -0.077 17919 61555 1 150 . 1 1 57 57 SER N N 57 113.330 113.330 114.272 -0.942 17919 61556 1 150 . 1 1 57 57 SER HA H 57 4.370 4.370 4.107 0.263 17919 61557 1 150 . 1 1 57 57 SER C C 57 178.310 178.310 177.075 1.235 17919 61558 1 150 . 1 1 57 57 SER CA C 57 61.080 61.080 61.718 -0.638 17919 61559 1 150 . 1 1 57 57 SER CB C 57 62.530 62.530 62.623 -0.093 17919 61560 1 150 . 1 1 57 57 SER H H 57 8.470 8.470 7.888 0.582 17919 61561 1 150 . 1 1 58 58 ASP N N 58 124.190 124.190 123.158 1.032 17919 61562 1 150 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.279 0.017 17919 61563 1 150 . 1 1 58 58 ASP C C 58 177.400 177.400 177.835 -0.435 17919 61564 1 150 . 1 1 58 58 ASP CA C 58 57.180 57.180 57.078 0.102 17919 61565 1 150 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.443 -0.343 17919 61566 1 150 . 1 1 58 58 ASP H H 58 7.930 7.930 7.623 0.307 17919 61567 1 150 . 1 1 59 59 TYR N N 59 115.510 115.510 115.369 0.141 17919 61568 1 150 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.652 0.018 17919 61569 1 150 . 1 1 59 59 TYR C C 59 174.700 174.700 175.137 -0.437 17919 61570 1 150 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.449 0.801 17919 61571 1 150 . 1 1 59 59 TYR CB C 59 40.070 40.070 37.486 2.584 17919 61572 1 150 . 1 1 59 59 TYR H H 59 7.250 7.250 7.379 -0.129 17919 61573 1 150 . 1 1 60 60 ASN N N 60 115.900 115.900 117.113 -1.213 17919 61574 1 150 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.391 -0.036 17919 61575 1 150 . 1 1 60 60 ASN C C 60 174.340 174.340 174.573 -0.233 17919 61576 1 150 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.362 -0.242 17919 61577 1 150 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.584 -0.174 17919 61578 1 150 . 1 1 60 60 ASN H H 60 8.150 8.150 7.663 0.487 17919 61579 1 150 . 1 1 61 61 ILE N N 61 118.600 118.600 119.987 -1.387 17919 61580 1 150 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.760 -0.367 17919 61581 1 150 . 1 1 61 61 ILE C C 61 174.610 174.610 175.370 -0.760 17919 61582 1 150 . 1 1 61 61 ILE CA C 61 62.420 62.420 60.680 1.740 17919 61583 1 150 . 1 1 61 61 ILE CB C 61 36.740 36.740 36.694 0.046 17919 61584 1 150 . 1 1 61 61 ILE H H 61 7.250 7.250 7.984 -0.734 17919 61585 1 150 . 1 1 62 62 GLN N N 62 124.740 124.740 124.985 -0.245 17919 61586 1 150 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.673 -0.167 17919 61587 1 150 . 1 1 62 62 GLN C C 62 175.970 175.970 175.321 0.649 17919 61588 1 150 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.802 -0.142 17919 61589 1 150 . 1 1 62 62 GLN CB C 62 31.650 31.650 32.277 -0.627 17919 61590 1 150 . 1 1 62 62 GLN H H 62 7.610 7.610 7.892 -0.282 17919 61591 1 150 . 1 1 63 63 LYS N N 63 120.300 120.300 125.132 -4.832 17919 61592 1 150 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.787 0.214 17919 61593 1 150 . 1 1 63 63 LYS C C 63 175.810 175.810 176.619 -0.809 17919 61594 1 150 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.088 -0.298 17919 61595 1 150 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.740 0.910 17919 61596 1 150 . 1 1 63 63 LYS H H 63 8.490 8.490 8.737 -0.247 17919 61597 1 150 . 1 1 64 64 GLU N N 64 113.950 113.950 120.228 -6.278 17919 61598 1 150 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.296 0.169 17919 61599 1 150 . 1 1 64 64 GLU C C 64 175.250 175.250 175.181 0.069 17919 61600 1 150 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.954 -0.064 17919 61601 1 150 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.716 -2.816 17919 61602 1 150 . 1 1 64 64 GLU H H 64 9.280 9.280 8.896 0.384 17919 61603 1 150 . 1 1 65 65 SER N N 65 114.730 114.730 115.402 -0.672 17919 61604 1 150 . 1 1 65 65 SER HA H 65 4.640 4.640 4.382 0.258 17919 61605 1 150 . 1 1 65 65 SER C C 65 172.160 172.160 173.998 -1.838 17919 61606 1 150 . 1 1 65 65 SER CA C 65 60.890 60.890 60.618 0.272 17919 61607 1 150 . 1 1 65 65 SER CB C 65 64.910 64.910 63.915 0.995 17919 61608 1 150 . 1 1 65 65 SER H H 65 7.670 7.670 8.053 -0.383 17919 61609 1 150 . 1 1 66 66 THR N N 66 117.110 117.110 117.579 -0.469 17919 61610 1 150 . 1 1 66 66 THR HA H 66 5.270 5.270 5.159 0.111 17919 61611 1 150 . 1 1 66 66 THR C C 66 173.950 173.950 173.983 -0.033 17919 61612 1 150 . 1 1 66 66 THR CA C 66 62.340 62.340 62.079 0.261 17919 61613 1 150 . 1 1 66 66 THR CB C 66 70.080 70.080 69.880 0.200 17919 61614 1 150 . 1 1 66 66 THR H H 66 8.730 8.730 8.484 0.246 17919 61615 1 150 . 1 1 67 67 LEU N N 67 127.110 127.110 128.687 -1.577 17919 61616 1 150 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.728 0.332 17919 61617 1 150 . 1 1 67 67 LEU C C 67 175.770 175.770 175.729 0.041 17919 61618 1 150 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.044 -0.144 17919 61619 1 150 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.516 0.744 17919 61620 1 150 . 1 1 67 67 LEU H H 67 9.410 9.410 9.157 0.253 17919 61621 1 150 . 1 1 68 68 HIS N N 68 118.380 118.380 125.591 -7.211 17919 61622 1 150 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.273 -0.033 17919 61623 1 150 . 1 1 68 68 HIS C C 68 173.150 173.150 173.445 -0.295 17919 61624 1 150 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.381 0.619 17919 61625 1 150 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.789 -2.259 17919 61626 1 150 . 1 1 68 68 HIS H H 68 9.230 9.230 9.306 -0.076 17919 61627 1 150 . 1 1 69 69 LEU N N 69 124.460 124.460 127.146 -2.686 17919 61628 1 150 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.819 0.371 17919 61629 1 150 . 1 1 69 69 LEU C C 69 175.270 175.270 174.000 1.270 17919 61630 1 150 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.454 0.436 17919 61631 1 150 . 1 1 69 69 LEU CB C 69 44.380 44.380 45.422 -1.042 17919 61632 1 150 . 1 1 69 69 LEU H H 69 8.340 8.340 8.543 -0.203 17919 61633 1 150 . 1 1 70 70 VAL N N 70 126.940 126.940 125.908 1.032 17919 61634 1 150 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.228 0.122 17919 61635 1 150 . 1 1 70 70 VAL C C 70 174.000 174.000 174.383 -0.383 17919 61636 1 150 . 1 1 70 70 VAL CA C 70 60.800 60.800 61.293 -0.493 17919 61637 1 150 . 1 1 70 70 VAL CB C 70 34.910 34.910 32.963 1.947 17919 61638 1 150 . 1 1 70 70 VAL H H 70 9.200 9.200 8.502 0.698 17919 61639 1 150 . 1 1 71 71 LEU N N 71 123.130 123.130 126.984 -3.854 17919 61640 1 150 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.474 0.586 17919 61641 1 150 . 1 1 71 71 LEU C C 71 177.830 177.830 177.498 0.332 17919 61642 1 150 . 1 1 71 71 LEU CA C 71 53.940 53.940 54.560 -0.620 17919 61643 1 150 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.612 0.238 17919 61644 1 150 . 1 1 71 71 LEU H H 71 8.120 8.120 8.542 -0.422 17919 61645 1 150 . 1 1 72 72 ARG N N 72 123.490 123.490 122.805 0.685 17919 61646 1 150 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.348 -0.047 17919 61647 1 150 . 1 1 72 72 ARG C C 72 175.350 175.350 175.452 -0.102 17919 61648 1 150 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.436 0.174 17919 61649 1 150 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.599 0.751 17919 61650 1 150 . 1 1 72 72 ARG H H 72 8.580 8.580 8.005 0.576 17919 61651 1 151 . 1 1 2 2 GLN N N 2 123.220 123.220 125.386 -2.166 17919 61652 1 151 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.312 -0.063 17919 61653 1 151 . 1 1 2 2 GLN C C 2 175.920 175.920 174.147 1.773 17919 61654 1 151 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.315 0.765 17919 61655 1 151 . 1 1 2 2 GLN CB C 2 30.760 30.760 31.282 -0.522 17919 61656 1 151 . 1 1 2 2 GLN H H 2 8.900 8.900 8.467 0.433 17919 61657 1 151 . 1 1 3 3 ILE N N 3 115.340 115.340 119.326 -3.986 17919 61658 1 151 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.056 0.157 17919 61659 1 151 . 1 1 3 3 ILE C C 3 172.450 172.450 173.174 -0.724 17919 61660 1 151 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.776 -0.206 17919 61661 1 151 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.505 0.705 17919 61662 1 151 . 1 1 3 3 ILE H H 3 8.320 8.320 8.082 0.238 17919 61663 1 151 . 1 1 4 4 PHE N N 4 118.110 118.110 121.026 -2.916 17919 61664 1 151 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.283 0.347 17919 61665 1 151 . 1 1 4 4 PHE C C 4 175.320 175.320 175.480 -0.160 17919 61666 1 151 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.243 -0.033 17919 61667 1 151 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.480 -0.000 17919 61668 1 151 . 1 1 4 4 PHE H H 4 8.610 8.610 7.749 0.861 17919 61669 1 151 . 1 1 5 5 VAL N N 5 121.000 121.000 121.402 -0.402 17919 61670 1 151 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.505 0.220 17919 61671 1 151 . 1 1 5 5 VAL C C 5 174.870 174.870 174.650 0.220 17919 61672 1 151 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.390 -0.770 17919 61673 1 151 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.029 0.201 17919 61674 1 151 . 1 1 5 5 VAL H H 5 9.300 9.300 9.220 0.080 17919 61675 1 151 . 1 1 6 6 LYS N N 6 127.520 127.520 129.774 -2.254 17919 61676 1 151 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.196 0.171 17919 61677 1 151 . 1 1 6 6 LYS C C 6 177.140 177.140 176.762 0.378 17919 61678 1 151 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.734 -0.214 17919 61679 1 151 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.416 0.634 17919 61680 1 151 . 1 1 6 6 LYS H H 6 8.820 8.820 9.095 -0.275 17919 61681 1 151 . 1 1 7 7 THR N N 7 115.400 115.400 119.514 -4.114 17919 61682 1 151 . 1 1 7 7 THR HA H 7 4.970 4.970 4.922 0.048 17919 61683 1 151 . 1 1 7 7 THR C C 7 176.910 176.910 176.425 0.485 17919 61684 1 151 . 1 1 7 7 THR CA C 7 60.470 60.470 61.743 -1.273 17919 61685 1 151 . 1 1 7 7 THR CB C 7 70.630 70.630 70.264 0.366 17919 61686 1 151 . 1 1 7 7 THR H H 7 8.730 8.730 8.530 0.200 17919 61687 1 151 . 1 1 8 8 LEU N N 8 121.330 121.330 123.039 -1.709 17919 61688 1 151 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.336 -0.026 17919 61689 1 151 . 1 1 8 8 LEU C C 8 178.800 178.800 177.874 0.926 17919 61690 1 151 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.486 0.095 17919 61691 1 151 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.886 0.084 17919 61692 1 151 . 1 1 8 8 LEU H H 8 9.100 9.100 8.951 0.149 17919 61693 1 151 . 1 1 9 9 THR N N 9 105.590 105.590 109.546 -3.956 17919 61694 1 151 . 1 1 9 9 THR HA H 9 4.428 4.428 4.356 0.072 17919 61695 1 151 . 1 1 9 9 THR C C 9 175.520 175.520 175.421 0.099 17919 61696 1 151 . 1 1 9 9 THR CA C 9 61.400 61.400 61.690 -0.290 17919 61697 1 151 . 1 1 9 9 THR CB C 9 69.140 69.140 69.448 -0.308 17919 61698 1 151 . 1 1 9 9 THR H H 9 7.630 7.630 7.569 0.061 17919 61699 1 151 . 1 1 10 10 GLY N N 10 108.890 108.890 110.914 -2.024 17919 61700 1 151 . 1 1 10 10 GLY C C 10 174.070 174.070 174.170 -0.100 17919 61701 1 151 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.904 0.556 17919 61702 1 151 . 1 1 10 10 GLY H H 10 7.810 7.810 7.847 -0.037 17919 61703 1 151 . 1 1 11 11 LYS N N 11 121.600 121.600 121.423 0.177 17919 61704 1 151 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.263 0.098 17919 61705 1 151 . 1 1 11 11 LYS C C 11 175.940 175.940 175.681 0.259 17919 61706 1 151 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.471 -0.191 17919 61707 1 151 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.381 -0.181 17919 61708 1 151 . 1 1 11 11 LYS H H 11 7.280 7.280 7.550 -0.270 17919 61709 1 151 . 1 1 12 12 THR N N 12 120.440 120.440 118.607 1.833 17919 61710 1 151 . 1 1 12 12 THR HA H 12 5.046 5.046 4.905 0.141 17919 61711 1 151 . 1 1 12 12 THR C C 12 174.320 174.320 174.105 0.215 17919 61712 1 151 . 1 1 12 12 THR CA C 12 62.390 62.390 61.540 0.850 17919 61713 1 151 . 1 1 12 12 THR CB C 12 69.910 69.910 69.914 -0.004 17919 61714 1 151 . 1 1 12 12 THR H H 12 8.650 8.650 8.326 0.324 17919 61715 1 151 . 1 1 13 13 ILE N N 13 127.110 127.110 129.094 -1.984 17919 61716 1 151 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.397 0.147 17919 61717 1 151 . 1 1 13 13 ILE C C 13 175.220 175.220 174.955 0.265 17919 61718 1 151 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.364 -0.384 17919 61719 1 151 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.543 0.407 17919 61720 1 151 . 1 1 13 13 ILE H H 13 9.450 9.450 9.337 0.113 17919 61721 1 151 . 1 1 14 14 THR N N 14 121.520 121.520 124.242 -2.722 17919 61722 1 151 . 1 1 14 14 THR HA H 14 4.964 4.964 4.603 0.361 17919 61723 1 151 . 1 1 14 14 THR C C 14 173.790 173.790 173.608 0.182 17919 61724 1 151 . 1 1 14 14 THR CA C 14 61.940 61.940 63.454 -1.514 17919 61725 1 151 . 1 1 14 14 THR CB C 14 69.650 69.650 69.378 0.272 17919 61726 1 151 . 1 1 14 14 THR H H 14 8.710 8.710 8.684 0.026 17919 61727 1 151 . 1 1 15 15 LEU N N 15 124.800 124.800 129.866 -5.066 17919 61728 1 151 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.652 0.128 17919 61729 1 151 . 1 1 15 15 LEU C C 15 174.670 174.670 175.361 -0.691 17919 61730 1 151 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.740 -0.910 17919 61731 1 151 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.323 1.747 17919 61732 1 151 . 1 1 15 15 LEU H H 15 8.710 8.710 8.425 0.285 17919 61733 1 151 . 1 1 16 16 GLU N N 16 122.160 122.160 124.827 -2.667 17919 61734 1 151 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.890 0.027 17919 61735 1 151 . 1 1 16 16 GLU C C 16 175.860 175.860 176.341 -0.481 17919 61736 1 151 . 1 1 16 16 GLU CA C 16 54.820 54.820 54.989 -0.169 17919 61737 1 151 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.303 -0.853 17919 61738 1 151 . 1 1 16 16 GLU H H 16 8.140 8.140 8.447 -0.307 17919 61739 1 151 . 1 1 17 17 VAL N N 17 117.210 117.210 120.543 -3.333 17919 61740 1 151 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.584 0.130 17919 61741 1 151 . 1 1 17 17 VAL C C 17 174.160 174.160 174.533 -0.373 17919 61742 1 151 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.432 -1.002 17919 61743 1 151 . 1 1 17 17 VAL CB C 17 36.400 36.400 34.768 1.632 17919 61744 1 151 . 1 1 17 17 VAL H H 17 8.900 8.900 8.797 0.103 17919 61745 1 151 . 1 1 18 18 GLU N N 18 118.990 118.990 119.639 -0.649 17919 61746 1 151 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.809 0.270 17919 61747 1 151 . 1 1 18 18 GLU C C 18 176.160 176.160 175.213 0.947 17919 61748 1 151 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.146 -0.426 17919 61749 1 151 . 1 1 18 18 GLU CB C 18 30.310 30.310 32.641 -2.331 17919 61750 1 151 . 1 1 18 18 GLU H H 18 8.640 8.640 8.617 0.023 17919 61751 1 151 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.208 -0.067 17919 61752 1 151 . 1 1 19 19 PRO C C 19 175.310 175.310 178.034 -2.724 17919 61753 1 151 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.883 -0.413 17919 61754 1 151 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.083 -0.133 17919 61755 1 151 . 1 1 20 20 SER N N 20 103.400 103.400 108.520 -5.120 17919 61756 1 151 . 1 1 20 20 SER HA H 20 4.370 4.370 4.326 0.044 17919 61757 1 151 . 1 1 20 20 SER C C 20 174.660 174.660 174.481 0.179 17919 61758 1 151 . 1 1 20 20 SER CA C 20 57.400 57.400 58.848 -1.448 17919 61759 1 151 . 1 1 20 20 SER CB C 20 63.370 63.370 62.776 0.594 17919 61760 1 151 . 1 1 20 20 SER H H 20 7.040 7.040 7.865 -0.825 17919 61761 1 151 . 1 1 21 21 ASP N N 21 123.480 123.480 125.518 -2.038 17919 61762 1 151 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.597 0.098 17919 61763 1 151 . 1 1 21 21 ASP C C 21 176.360 176.360 176.301 0.059 17919 61764 1 151 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.582 0.118 17919 61765 1 151 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.228 -0.428 17919 61766 1 151 . 1 1 21 21 ASP H H 21 8.030 8.030 8.038 -0.008 17919 61767 1 151 . 1 1 22 22 THR N N 22 108.800 108.800 114.764 -5.964 17919 61768 1 151 . 1 1 22 22 THR HA H 22 4.920 4.920 4.503 0.417 17919 61769 1 151 . 1 1 22 22 THR C C 22 176.750 176.750 175.952 0.798 17919 61770 1 151 . 1 1 22 22 THR CA C 22 59.690 59.690 62.393 -2.703 17919 61771 1 151 . 1 1 22 22 THR CB C 22 71.200 71.200 70.055 1.145 17919 61772 1 151 . 1 1 22 22 THR H H 22 7.900 7.900 8.139 -0.239 17919 61773 1 151 . 1 1 23 23 ILE N N 23 121.190 121.190 122.072 -0.882 17919 61774 1 151 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.842 -0.185 17919 61775 1 151 . 1 1 23 23 ILE C C 23 179.040 179.040 177.847 1.193 17919 61776 1 151 . 1 1 23 23 ILE CA C 23 62.260 62.260 61.289 0.971 17919 61777 1 151 . 1 1 23 23 ILE CB C 23 34.350 34.350 35.984 -1.635 17919 61778 1 151 . 1 1 23 23 ILE H H 23 8.560 8.560 9.061 -0.501 17919 61779 1 151 . 1 1 24 24 GLU N N 24 120.830 120.830 120.495 0.335 17919 61780 1 151 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.895 0.022 17919 61781 1 151 . 1 1 24 24 GLU C C 24 178.640 178.640 178.709 -0.069 17919 61782 1 151 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.896 0.324 17919 61783 1 151 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.487 -1.207 17919 61784 1 151 . 1 1 24 24 GLU H H 24 9.760 9.760 7.867 1.893 17919 61785 1 151 . 1 1 25 25 ASN N N 25 120.570 120.570 117.849 2.721 17919 61786 1 151 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.540 -0.015 17919 61787 1 151 . 1 1 25 25 ASN C C 25 178.380 178.380 177.780 0.600 17919 61788 1 151 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.005 0.055 17919 61789 1 151 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.489 -0.039 17919 61790 1 151 . 1 1 25 25 ASN H H 25 7.920 7.920 7.513 0.407 17919 61791 1 151 . 1 1 26 26 VAL N N 26 121.710 121.710 120.167 1.543 17919 61792 1 151 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.533 -0.136 17919 61793 1 151 . 1 1 26 26 VAL C C 26 177.950 177.950 178.152 -0.202 17919 61794 1 151 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.457 1.203 17919 61795 1 151 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.032 -0.192 17919 61796 1 151 . 1 1 26 26 VAL H H 26 8.070 8.070 7.848 0.222 17919 61797 1 151 . 1 1 27 27 LYS N N 27 118.860 118.860 119.840 -0.980 17919 61798 1 151 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.120 0.460 17919 61799 1 151 . 1 1 27 27 LYS C C 27 180.550 180.550 179.189 1.361 17919 61800 1 151 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.541 -0.291 17919 61801 1 151 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.102 1.628 17919 61802 1 151 . 1 1 27 27 LYS H H 27 8.560 8.560 7.981 0.579 17919 61803 1 151 . 1 1 28 28 ALA N N 28 123.440 123.440 122.769 0.671 17919 61804 1 151 . 1 1 28 28 ALA HA H 28 4.160 4.160 3.945 0.215 17919 61805 1 151 . 1 1 28 28 ALA C C 28 180.300 180.300 179.140 1.160 17919 61806 1 151 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.337 0.033 17919 61807 1 151 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.242 -0.532 17919 61808 1 151 . 1 1 28 28 ALA H H 28 8.060 8.060 8.084 -0.024 17919 61809 1 151 . 1 1 29 29 LYS N N 29 119.940 119.940 119.241 0.699 17919 61810 1 151 . 1 1 29 29 LYS HA H 29 4.207 4.207 3.932 0.275 17919 61811 1 151 . 1 1 29 29 LYS C C 29 180.320 180.320 179.363 0.957 17919 61812 1 151 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.515 0.135 17919 61813 1 151 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.326 0.964 17919 61814 1 151 . 1 1 29 29 LYS H H 29 7.850 7.850 7.819 0.031 17919 61815 1 151 . 1 1 30 30 ILE N N 30 121.080 121.080 119.543 1.537 17919 61816 1 151 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.697 -0.190 17919 61817 1 151 . 1 1 30 30 ILE C C 30 178.310 178.310 177.281 1.029 17919 61818 1 151 . 1 1 30 30 ILE CA C 30 66.150 66.150 64.993 1.157 17919 61819 1 151 . 1 1 30 30 ILE CB C 30 36.800 36.800 38.019 -1.219 17919 61820 1 151 . 1 1 30 30 ILE H H 30 8.280 8.280 8.101 0.179 17919 61821 1 151 . 1 1 31 31 GLN N N 31 123.490 123.490 121.787 1.703 17919 61822 1 151 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.957 -0.128 17919 61823 1 151 . 1 1 31 31 GLN C C 31 178.890 178.890 178.242 0.648 17919 61824 1 151 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.131 0.869 17919 61825 1 151 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.441 -0.721 17919 61826 1 151 . 1 1 31 31 GLN H H 31 8.580 8.580 8.272 0.308 17919 61827 1 151 . 1 1 32 32 ASP N N 32 119.360 119.360 117.250 2.110 17919 61828 1 151 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.408 -0.054 17919 61829 1 151 . 1 1 32 32 ASP C C 32 177.250 177.250 177.093 0.157 17919 61830 1 151 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.455 0.736 17919 61831 1 151 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.728 -0.148 17919 61832 1 151 . 1 1 32 32 ASP H H 32 8.010 8.010 8.146 -0.136 17919 61833 1 151 . 1 1 33 33 LYS N N 33 115.130 115.130 118.522 -3.392 17919 61834 1 151 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.333 0.004 17919 61835 1 151 . 1 1 33 33 LYS C C 33 177.870 177.870 178.328 -0.458 17919 61836 1 151 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.232 0.818 17919 61837 1 151 . 1 1 33 33 LYS CB C 33 34.170 34.170 34.474 -0.304 17919 61838 1 151 . 1 1 33 33 LYS H H 33 7.430 7.430 7.418 0.012 17919 61839 1 151 . 1 1 34 34 GLU N N 34 113.870 113.870 117.355 -3.485 17919 61840 1 151 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.378 0.247 17919 61841 1 151 . 1 1 34 34 GLU C C 34 177.840 177.840 177.601 0.239 17919 61842 1 151 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.335 -1.165 17919 61843 1 151 . 1 1 34 34 GLU CB C 34 32.660 32.660 30.207 2.453 17919 61844 1 151 . 1 1 34 34 GLU H H 34 8.740 8.740 8.058 0.682 17919 61845 1 151 . 1 1 35 35 GLY N N 35 108.650 108.650 109.437 -0.787 17919 61846 1 151 . 1 1 35 35 GLY C C 35 173.960 173.960 174.139 -0.179 17919 61847 1 151 . 1 1 35 35 GLY CA C 35 46.080 46.080 46.107 -0.027 17919 61848 1 151 . 1 1 35 35 GLY H H 35 8.530 8.530 7.996 0.534 17919 61849 1 151 . 1 1 36 36 ILE N N 36 119.880 119.880 121.802 -1.922 17919 61850 1 151 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.378 0.067 17919 61851 1 151 . 1 1 36 36 ILE C C 36 173.590 173.590 174.580 -0.990 17919 61852 1 151 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.655 0.095 17919 61853 1 151 . 1 1 36 36 ILE CB C 36 40.580 40.580 39.423 1.157 17919 61854 1 151 . 1 1 36 36 ILE H H 36 6.150 6.150 7.679 -1.529 17919 61855 1 151 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.885 -0.251 17919 61856 1 151 . 1 1 37 37 PRO C C 37 176.940 176.940 175.891 1.049 17919 61857 1 151 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.228 0.432 17919 61858 1 151 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.400 0.450 17919 61859 1 151 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.246 -0.129 17919 61860 1 151 . 1 1 38 38 PRO C C 38 178.320 178.320 177.743 0.577 17919 61861 1 151 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.111 1.149 17919 61862 1 151 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.869 1.021 17919 61863 1 151 . 1 1 39 39 ASP N N 39 113.380 113.380 118.001 -4.621 17919 61864 1 151 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.271 0.159 17919 61865 1 151 . 1 1 39 39 ASP C C 39 177.090 177.090 178.286 -1.196 17919 61866 1 151 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.964 -1.323 17919 61867 1 151 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.497 -0.957 17919 61868 1 151 . 1 1 39 39 ASP H H 39 8.550 8.550 8.504 0.046 17919 61869 1 151 . 1 1 40 40 GLN N N 40 116.780 116.780 116.205 0.575 17919 61870 1 151 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.350 0.114 17919 61871 1 151 . 1 1 40 40 GLN C C 40 175.380 175.380 175.684 -0.304 17919 61872 1 151 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.478 -0.838 17919 61873 1 151 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.864 0.276 17919 61874 1 151 . 1 1 40 40 GLN H H 40 7.820 7.820 8.018 -0.198 17919 61875 1 151 . 1 1 41 41 GLN N N 41 117.720 117.720 118.831 -1.111 17919 61876 1 151 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.371 -0.127 17919 61877 1 151 . 1 1 41 41 GLN C C 41 176.300 176.300 175.096 1.204 17919 61878 1 151 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.278 0.192 17919 61879 1 151 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.445 2.205 17919 61880 1 151 . 1 1 41 41 GLN H H 41 7.480 7.480 7.521 -0.041 17919 61881 1 151 . 1 1 42 42 ARG N N 42 122.680 122.680 125.266 -2.586 17919 61882 1 151 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.586 -0.086 17919 61883 1 151 . 1 1 42 42 ARG C C 42 174.050 174.050 173.679 0.371 17919 61884 1 151 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.947 0.103 17919 61885 1 151 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.998 -1.248 17919 61886 1 151 . 1 1 42 42 ARG H H 42 8.530 8.530 8.031 0.499 17919 61887 1 151 . 1 1 43 43 LEU N N 43 124.040 124.040 127.331 -3.291 17919 61888 1 151 . 1 1 43 43 LEU C C 43 175.290 175.290 175.451 -0.161 17919 61889 1 151 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.327 -0.347 17919 61890 1 151 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.847 0.943 17919 61891 1 151 . 1 1 43 43 LEU H H 43 8.820 8.820 8.605 0.215 17919 61892 1 151 . 1 1 44 44 ILE N N 44 121.920 121.920 120.665 1.255 17919 61893 1 151 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.740 0.252 17919 61894 1 151 . 1 1 44 44 ILE C C 44 176.060 176.060 174.383 1.677 17919 61895 1 151 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.452 -0.472 17919 61896 1 151 . 1 1 44 44 ILE CB C 44 41.420 41.420 39.620 1.800 17919 61897 1 151 . 1 1 44 44 ILE H H 44 9.030 9.030 8.594 0.436 17919 61898 1 151 . 1 1 45 45 PHE N N 45 125.390 125.390 128.424 -3.034 17919 61899 1 151 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.957 0.088 17919 61900 1 151 . 1 1 45 45 PHE C C 45 174.470 174.470 174.537 -0.067 17919 61901 1 151 . 1 1 45 45 PHE CA C 45 57.020 57.020 57.031 -0.010 17919 61902 1 151 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.424 1.336 17919 61903 1 151 . 1 1 45 45 PHE H H 45 8.830 8.830 8.061 0.769 17919 61904 1 151 . 1 1 46 46 ALA N N 46 132.200 132.200 129.874 2.326 17919 61905 1 151 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.619 0.071 17919 61906 1 151 . 1 1 46 46 ALA C C 46 177.290 177.290 177.352 -0.062 17919 61907 1 151 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.913 -0.373 17919 61908 1 151 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.736 -0.166 17919 61909 1 151 . 1 1 46 46 ALA H H 46 8.810 8.810 8.679 0.131 17919 61910 1 151 . 1 1 47 47 GLY N N 47 102.340 102.340 104.214 -1.874 17919 61911 1 151 . 1 1 47 47 GLY C C 47 173.810 173.810 174.831 -1.021 17919 61912 1 151 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.385 -0.035 17919 61913 1 151 . 1 1 47 47 GLY H H 47 8.130 8.130 8.390 -0.260 17919 61914 1 151 . 1 1 48 48 LYS N N 48 121.570 121.570 123.294 -1.724 17919 61915 1 151 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.376 0.246 17919 61916 1 151 . 1 1 48 48 LYS C C 48 174.700 174.700 175.986 -1.286 17919 61917 1 151 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.573 -1.023 17919 61918 1 151 . 1 1 48 48 LYS CB C 48 34.530 34.530 33.071 1.459 17919 61919 1 151 . 1 1 48 48 LYS H H 48 7.980 7.980 7.614 0.366 17919 61920 1 151 . 1 1 49 49 GLN N N 49 122.410 122.410 125.874 -3.464 17919 61921 1 151 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.343 0.217 17919 61922 1 151 . 1 1 49 49 GLN C C 49 175.670 175.670 175.787 -0.117 17919 61923 1 151 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.249 -0.509 17919 61924 1 151 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.444 -0.444 17919 61925 1 151 . 1 1 49 49 GLN H H 49 8.600 8.600 8.599 0.001 17919 61926 1 151 . 1 1 50 50 LEU N N 50 125.520 125.520 128.161 -2.641 17919 61927 1 151 . 1 1 50 50 LEU HA H 50 4.090 4.090 3.894 0.196 17919 61928 1 151 . 1 1 50 50 LEU C C 50 176.660 176.660 176.180 0.480 17919 61929 1 151 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.853 -0.613 17919 61930 1 151 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.253 0.317 17919 61931 1 151 . 1 1 50 50 LEU H H 50 8.530 8.530 8.253 0.277 17919 61932 1 151 . 1 1 51 51 GLU N N 51 122.940 122.940 124.333 -1.393 17919 61933 1 151 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.586 -0.098 17919 61934 1 151 . 1 1 51 51 GLU C C 51 175.870 175.870 176.520 -0.650 17919 61935 1 151 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.424 0.536 17919 61936 1 151 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.798 -0.228 17919 61937 1 151 . 1 1 51 51 GLU H H 51 8.400 8.400 8.221 0.179 17919 61938 1 151 . 1 1 52 52 ASP N N 52 120.030 120.030 124.450 -4.420 17919 61939 1 151 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.542 -0.183 17919 61940 1 151 . 1 1 52 52 ASP C C 52 177.330 177.330 177.733 -0.403 17919 61941 1 151 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.083 -0.123 17919 61942 1 151 . 1 1 52 52 ASP CB C 52 40.850 40.850 41.216 -0.366 17919 61943 1 151 . 1 1 52 52 ASP H H 52 8.160 8.160 8.861 -0.701 17919 61944 1 151 . 1 1 53 53 GLY N N 53 106.660 106.660 106.020 0.640 17919 61945 1 151 . 1 1 53 53 GLY C C 53 174.870 174.870 174.212 0.658 17919 61946 1 151 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.781 0.389 17919 61947 1 151 . 1 1 53 53 GLY H H 53 9.390 9.390 8.375 1.015 17919 61948 1 151 . 1 1 54 54 ARG N N 54 119.050 119.050 120.672 -1.622 17919 61949 1 151 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.720 -0.025 17919 61950 1 151 . 1 1 54 54 ARG C C 54 175.350 175.350 175.157 0.193 17919 61951 1 151 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.238 0.152 17919 61952 1 151 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.279 -0.629 17919 61953 1 151 . 1 1 54 54 ARG H H 54 7.460 7.460 7.459 0.001 17919 61954 1 151 . 1 1 55 55 THR N N 55 108.400 108.400 111.700 -3.300 17919 61955 1 151 . 1 1 55 55 THR HA H 55 5.240 5.240 5.189 0.051 17919 61956 1 151 . 1 1 55 55 THR C C 55 176.560 176.560 176.316 0.244 17919 61957 1 151 . 1 1 55 55 THR CA C 55 59.690 59.690 59.766 -0.076 17919 61958 1 151 . 1 1 55 55 THR CB C 55 72.260 72.260 71.596 0.664 17919 61959 1 151 . 1 1 55 55 THR H H 55 8.730 8.730 9.231 -0.501 17919 61960 1 151 . 1 1 56 56 LEU N N 56 117.920 117.920 121.989 -4.069 17919 61961 1 151 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.061 -0.001 17919 61962 1 151 . 1 1 56 56 LEU C C 56 180.810 180.810 178.948 1.862 17919 61963 1 151 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.243 0.467 17919 61964 1 151 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.450 -1.080 17919 61965 1 151 . 1 1 56 56 LEU H H 56 8.140 8.140 8.502 -0.362 17919 61966 1 151 . 1 1 57 57 SER N N 57 113.330 113.330 115.154 -1.824 17919 61967 1 151 . 1 1 57 57 SER HA H 57 4.370 4.370 4.143 0.227 17919 61968 1 151 . 1 1 57 57 SER C C 57 178.310 178.310 176.949 1.361 17919 61969 1 151 . 1 1 57 57 SER CA C 57 61.080 61.080 61.757 -0.677 17919 61970 1 151 . 1 1 57 57 SER CB C 57 62.530 62.530 62.431 0.099 17919 61971 1 151 . 1 1 57 57 SER H H 57 8.470 8.470 7.826 0.644 17919 61972 1 151 . 1 1 58 58 ASP N N 58 124.190 124.190 124.174 0.016 17919 61973 1 151 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.237 0.059 17919 61974 1 151 . 1 1 58 58 ASP C C 58 177.400 177.400 177.632 -0.232 17919 61975 1 151 . 1 1 58 58 ASP CA C 58 57.180 57.180 57.068 0.112 17919 61976 1 151 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.408 -0.308 17919 61977 1 151 . 1 1 58 58 ASP H H 58 7.930 7.930 7.833 0.097 17919 61978 1 151 . 1 1 59 59 TYR N N 59 115.510 115.510 115.682 -0.172 17919 61979 1 151 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.497 0.173 17919 61980 1 151 . 1 1 59 59 TYR C C 59 174.700 174.700 174.993 -0.293 17919 61981 1 151 . 1 1 59 59 TYR CA C 59 58.250 58.250 58.180 0.070 17919 61982 1 151 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.025 2.046 17919 61983 1 151 . 1 1 59 59 TYR H H 59 7.250 7.250 7.275 -0.025 17919 61984 1 151 . 1 1 60 60 ASN N N 60 115.900 115.900 114.122 1.778 17919 61985 1 151 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.379 -0.024 17919 61986 1 151 . 1 1 60 60 ASN C C 60 174.340 174.340 174.367 -0.027 17919 61987 1 151 . 1 1 60 60 ASN CA C 60 54.120 54.120 53.971 0.149 17919 61988 1 151 . 1 1 60 60 ASN CB C 60 37.410 37.410 36.634 0.776 17919 61989 1 151 . 1 1 60 60 ASN H H 60 8.150 8.150 8.067 0.083 17919 61990 1 151 . 1 1 61 61 ILE N N 61 118.600 118.600 120.235 -1.635 17919 61991 1 151 . 1 1 61 61 ILE HA H 61 3.393 3.393 4.077 -0.684 17919 61992 1 151 . 1 1 61 61 ILE C C 61 174.610 174.610 175.374 -0.764 17919 61993 1 151 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.594 0.826 17919 61994 1 151 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.117 -0.377 17919 61995 1 151 . 1 1 61 61 ILE H H 61 7.250 7.250 8.152 -0.902 17919 61996 1 151 . 1 1 62 62 GLN N N 62 124.740 124.740 126.841 -2.101 17919 61997 1 151 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.697 -0.191 17919 61998 1 151 . 1 1 62 62 GLN C C 62 175.970 175.970 175.783 0.187 17919 61999 1 151 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.399 0.261 17919 62000 1 151 . 1 1 62 62 GLN CB C 62 31.650 31.650 30.729 0.921 17919 62001 1 151 . 1 1 62 62 GLN H H 62 7.610 7.610 8.172 -0.562 17919 62002 1 151 . 1 1 63 63 LYS N N 63 120.300 120.300 121.641 -1.341 17919 62003 1 151 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.920 0.081 17919 62004 1 151 . 1 1 63 63 LYS C C 63 175.810 175.810 176.697 -0.887 17919 62005 1 151 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.934 -0.144 17919 62006 1 151 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.551 1.099 17919 62007 1 151 . 1 1 63 63 LYS H H 63 8.490 8.490 8.648 -0.158 17919 62008 1 151 . 1 1 64 64 GLU N N 64 113.950 113.950 118.949 -4.999 17919 62009 1 151 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.325 0.140 17919 62010 1 151 . 1 1 64 64 GLU C C 64 175.250 175.250 175.449 -0.199 17919 62011 1 151 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.714 0.176 17919 62012 1 151 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.508 -2.607 17919 62013 1 151 . 1 1 64 64 GLU H H 64 9.280 9.280 8.745 0.535 17919 62014 1 151 . 1 1 65 65 SER N N 65 114.730 114.730 114.880 -0.150 17919 62015 1 151 . 1 1 65 65 SER HA H 65 4.640 4.640 4.398 0.242 17919 62016 1 151 . 1 1 65 65 SER C C 65 172.160 172.160 174.605 -2.445 17919 62017 1 151 . 1 1 65 65 SER CA C 65 60.890 60.890 59.447 1.443 17919 62018 1 151 . 1 1 65 65 SER CB C 65 64.910 64.910 63.735 1.175 17919 62019 1 151 . 1 1 65 65 SER H H 65 7.670 7.670 7.271 0.399 17919 62020 1 151 . 1 1 66 66 THR N N 66 117.110 117.110 122.248 -5.138 17919 62021 1 151 . 1 1 66 66 THR HA H 66 5.270 5.270 4.571 0.699 17919 62022 1 151 . 1 1 66 66 THR C C 66 173.950 173.950 174.118 -0.168 17919 62023 1 151 . 1 1 66 66 THR CA C 66 62.340 62.340 62.887 -0.547 17919 62024 1 151 . 1 1 66 66 THR CB C 66 70.080 70.080 69.033 1.047 17919 62025 1 151 . 1 1 66 66 THR H H 66 8.730 8.730 8.382 0.348 17919 62026 1 151 . 1 1 67 67 LEU N N 67 127.110 127.110 129.113 -2.003 17919 62027 1 151 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.427 0.633 17919 62028 1 151 . 1 1 67 67 LEU C C 67 175.770 175.770 175.816 -0.046 17919 62029 1 151 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.840 0.060 17919 62030 1 151 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.762 0.498 17919 62031 1 151 . 1 1 67 67 LEU H H 67 9.410 9.410 8.911 0.499 17919 62032 1 151 . 1 1 68 68 HIS N N 68 118.380 118.380 121.726 -3.346 17919 62033 1 151 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.128 0.112 17919 62034 1 151 . 1 1 68 68 HIS C C 68 173.150 173.150 174.655 -1.505 17919 62035 1 151 . 1 1 68 68 HIS CA C 68 55.000 55.000 55.288 -0.288 17919 62036 1 151 . 1 1 68 68 HIS CB C 68 30.530 30.530 30.017 0.513 17919 62037 1 151 . 1 1 68 68 HIS H H 68 9.230 9.230 8.640 0.590 17919 62038 1 151 . 1 1 69 69 LEU N N 69 124.460 124.460 130.285 -5.825 17919 62039 1 151 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.386 -0.196 17919 62040 1 151 . 1 1 69 69 LEU C C 69 175.270 175.270 175.154 0.116 17919 62041 1 151 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.211 -0.321 17919 62042 1 151 . 1 1 69 69 LEU CB C 69 44.380 44.380 43.116 1.264 17919 62043 1 151 . 1 1 69 69 LEU H H 69 8.340 8.340 8.778 -0.438 17919 62044 1 151 . 1 1 70 70 VAL N N 70 126.940 126.940 123.861 3.079 17919 62045 1 151 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.671 -0.321 17919 62046 1 151 . 1 1 70 70 VAL C C 70 174.000 174.000 174.200 -0.200 17919 62047 1 151 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.356 1.444 17919 62048 1 151 . 1 1 70 70 VAL CB C 70 34.910 34.910 34.778 0.132 17919 62049 1 151 . 1 1 70 70 VAL H H 70 9.200 9.200 8.943 0.257 17919 62050 1 151 . 1 1 71 71 LEU N N 71 123.130 123.130 119.843 3.287 17919 62051 1 151 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.274 -0.214 17919 62052 1 151 . 1 1 71 71 LEU C C 71 177.830 177.830 177.709 0.121 17919 62053 1 151 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.227 0.713 17919 62054 1 151 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.225 -0.375 17919 62055 1 151 . 1 1 71 71 LEU H H 71 8.120 8.120 8.144 -0.024 17919 62056 1 151 . 1 1 72 72 ARG N N 72 123.490 123.490 120.475 3.015 17919 62057 1 151 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.497 -0.196 17919 62058 1 151 . 1 1 72 72 ARG C C 72 175.350 175.350 175.953 -0.603 17919 62059 1 151 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.886 -0.276 17919 62060 1 151 . 1 1 72 72 ARG CB C 72 31.350 31.350 31.343 0.007 17919 62061 1 151 . 1 1 72 72 ARG H H 72 8.580 8.580 8.251 0.329 17919 62062 1 152 . 1 1 2 2 GLN N N 2 123.220 123.220 119.582 3.638 17919 62063 1 152 . 1 1 2 2 GLN HA H 2 5.249 5.249 4.731 0.518 17919 62064 1 152 . 1 1 2 2 GLN C C 2 175.920 175.920 175.419 0.501 17919 62065 1 152 . 1 1 2 2 GLN CA C 2 55.080 55.080 55.062 0.018 17919 62066 1 152 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.206 0.554 17919 62067 1 152 . 1 1 2 2 GLN H H 2 8.900 8.900 8.351 0.549 17919 62068 1 152 . 1 1 3 3 ILE N N 3 115.340 115.340 116.088 -0.748 17919 62069 1 152 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.436 -0.223 17919 62070 1 152 . 1 1 3 3 ILE C C 3 172.450 172.450 173.436 -0.986 17919 62071 1 152 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.311 0.259 17919 62072 1 152 . 1 1 3 3 ILE CB C 3 42.210 42.210 42.142 0.068 17919 62073 1 152 . 1 1 3 3 ILE H H 3 8.320 8.320 8.547 -0.227 17919 62074 1 152 . 1 1 4 4 PHE N N 4 118.110 118.110 119.268 -1.158 17919 62075 1 152 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.174 0.456 17919 62076 1 152 . 1 1 4 4 PHE C C 4 175.320 175.320 174.760 0.560 17919 62077 1 152 . 1 1 4 4 PHE CA C 4 55.210 55.210 56.167 -0.957 17919 62078 1 152 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.495 -0.015 17919 62079 1 152 . 1 1 4 4 PHE H H 4 8.610 8.610 8.365 0.245 17919 62080 1 152 . 1 1 5 5 VAL N N 5 121.000 121.000 123.310 -2.310 17919 62081 1 152 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.770 -0.045 17919 62082 1 152 . 1 1 5 5 VAL C C 5 174.870 174.870 174.825 0.045 17919 62083 1 152 . 1 1 5 5 VAL CA C 5 60.620 60.620 60.977 -0.357 17919 62084 1 152 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.234 0.996 17919 62085 1 152 . 1 1 5 5 VAL H H 5 9.300 9.300 9.370 -0.070 17919 62086 1 152 . 1 1 6 6 LYS N N 6 127.520 127.520 128.690 -1.170 17919 62087 1 152 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.370 -0.003 17919 62088 1 152 . 1 1 6 6 LYS C C 6 177.140 177.140 176.789 0.351 17919 62089 1 152 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.305 0.215 17919 62090 1 152 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.192 -0.142 17919 62091 1 152 . 1 1 6 6 LYS H H 6 8.820 8.820 9.240 -0.420 17919 62092 1 152 . 1 1 7 7 THR N N 7 115.400 115.400 118.751 -3.351 17919 62093 1 152 . 1 1 7 7 THR HA H 7 4.970 4.970 4.509 0.461 17919 62094 1 152 . 1 1 7 7 THR C C 7 176.910 176.910 176.510 0.400 17919 62095 1 152 . 1 1 7 7 THR CA C 7 60.470 60.470 62.143 -1.673 17919 62096 1 152 . 1 1 7 7 THR CB C 7 70.630 70.630 70.029 0.601 17919 62097 1 152 . 1 1 7 7 THR H H 7 8.730 8.730 8.863 -0.133 17919 62098 1 152 . 1 1 8 8 LEU N N 8 121.330 121.330 123.283 -1.953 17919 62099 1 152 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.172 0.138 17919 62100 1 152 . 1 1 8 8 LEU C C 8 178.800 178.800 177.402 1.398 17919 62101 1 152 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.962 -0.382 17919 62102 1 152 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.042 -0.072 17919 62103 1 152 . 1 1 8 8 LEU H H 8 9.100 9.100 8.578 0.522 17919 62104 1 152 . 1 1 9 9 THR N N 9 105.590 105.590 112.087 -6.497 17919 62105 1 152 . 1 1 9 9 THR HA H 9 4.428 4.428 4.401 0.027 17919 62106 1 152 . 1 1 9 9 THR C C 9 175.520 175.520 174.931 0.589 17919 62107 1 152 . 1 1 9 9 THR CA C 9 61.400 61.400 62.307 -0.907 17919 62108 1 152 . 1 1 9 9 THR CB C 9 69.140 69.140 68.687 0.453 17919 62109 1 152 . 1 1 9 9 THR H H 9 7.630 7.630 7.743 -0.113 17919 62110 1 152 . 1 1 10 10 GLY N N 10 108.890 108.890 110.922 -2.032 17919 62111 1 152 . 1 1 10 10 GLY C C 10 174.070 174.070 173.764 0.306 17919 62112 1 152 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.955 0.505 17919 62113 1 152 . 1 1 10 10 GLY H H 10 7.810 7.810 8.004 -0.194 17919 62114 1 152 . 1 1 11 11 LYS N N 11 121.600 121.600 122.275 -0.675 17919 62115 1 152 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.379 -0.018 17919 62116 1 152 . 1 1 11 11 LYS C C 11 175.940 175.940 175.464 0.476 17919 62117 1 152 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.575 -0.295 17919 62118 1 152 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.403 -0.203 17919 62119 1 152 . 1 1 11 11 LYS H H 11 7.280 7.280 8.032 -0.752 17919 62120 1 152 . 1 1 12 12 THR N N 12 120.440 120.440 122.385 -1.945 17919 62121 1 152 . 1 1 12 12 THR HA H 12 5.046 5.046 5.391 -0.345 17919 62122 1 152 . 1 1 12 12 THR C C 12 174.320 174.320 174.515 -0.195 17919 62123 1 152 . 1 1 12 12 THR CA C 12 62.390 62.390 61.434 0.956 17919 62124 1 152 . 1 1 12 12 THR CB C 12 69.910 69.910 69.735 0.175 17919 62125 1 152 . 1 1 12 12 THR H H 12 8.650 8.650 8.455 0.195 17919 62126 1 152 . 1 1 13 13 ILE N N 13 127.110 127.110 123.931 3.179 17919 62127 1 152 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.835 -0.291 17919 62128 1 152 . 1 1 13 13 ILE C C 13 175.220 175.220 174.037 1.183 17919 62129 1 152 . 1 1 13 13 ILE CA C 13 59.980 59.980 58.950 1.030 17919 62130 1 152 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.908 0.042 17919 62131 1 152 . 1 1 13 13 ILE H H 13 9.450 9.450 9.084 0.366 17919 62132 1 152 . 1 1 14 14 THR N N 14 121.520 121.520 120.429 1.091 17919 62133 1 152 . 1 1 14 14 THR HA H 14 4.964 4.964 4.939 0.025 17919 62134 1 152 . 1 1 14 14 THR C C 14 173.790 173.790 173.975 -0.185 17919 62135 1 152 . 1 1 14 14 THR CA C 14 61.940 61.940 61.078 0.862 17919 62136 1 152 . 1 1 14 14 THR CB C 14 69.650 69.650 69.536 0.114 17919 62137 1 152 . 1 1 14 14 THR H H 14 8.710 8.710 8.355 0.355 17919 62138 1 152 . 1 1 15 15 LEU N N 15 124.800 124.800 127.780 -2.980 17919 62139 1 152 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.637 0.143 17919 62140 1 152 . 1 1 15 15 LEU C C 15 174.670 174.670 175.285 -0.615 17919 62141 1 152 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.521 -0.691 17919 62142 1 152 . 1 1 15 15 LEU CB C 15 47.070 47.070 46.521 0.549 17919 62143 1 152 . 1 1 15 15 LEU H H 15 8.710 8.710 8.531 0.179 17919 62144 1 152 . 1 1 16 16 GLU N N 16 122.160 122.160 123.534 -1.374 17919 62145 1 152 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.967 -0.050 17919 62146 1 152 . 1 1 16 16 GLU C C 16 175.860 175.860 175.429 0.431 17919 62147 1 152 . 1 1 16 16 GLU CA C 16 54.820 54.820 54.271 0.549 17919 62148 1 152 . 1 1 16 16 GLU CB C 16 29.450 29.450 29.696 -0.246 17919 62149 1 152 . 1 1 16 16 GLU H H 16 8.140 8.140 8.586 -0.446 17919 62150 1 152 . 1 1 17 17 VAL N N 17 117.210 117.210 119.127 -1.917 17919 62151 1 152 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.571 0.143 17919 62152 1 152 . 1 1 17 17 VAL C C 17 174.160 174.160 174.818 -0.658 17919 62153 1 152 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.920 -1.490 17919 62154 1 152 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.728 0.672 17919 62155 1 152 . 1 1 17 17 VAL H H 17 8.900 8.900 8.470 0.430 17919 62156 1 152 . 1 1 18 18 GLU N N 18 118.990 118.990 120.759 -1.769 17919 62157 1 152 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.809 0.270 17919 62158 1 152 . 1 1 18 18 GLU C C 18 176.160 176.160 176.176 -0.016 17919 62159 1 152 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.744 -0.024 17919 62160 1 152 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.199 0.111 17919 62161 1 152 . 1 1 18 18 GLU H H 18 8.640 8.640 8.324 0.316 17919 62162 1 152 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.287 -0.146 17919 62163 1 152 . 1 1 19 19 PRO C C 19 175.310 175.310 176.964 -1.654 17919 62164 1 152 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.232 0.238 17919 62165 1 152 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.233 -0.282 17919 62166 1 152 . 1 1 20 20 SER N N 20 103.400 103.400 109.375 -5.975 17919 62167 1 152 . 1 1 20 20 SER HA H 20 4.370 4.370 4.345 0.025 17919 62168 1 152 . 1 1 20 20 SER C C 20 174.660 174.660 174.069 0.591 17919 62169 1 152 . 1 1 20 20 SER CA C 20 57.400 57.400 58.596 -1.196 17919 62170 1 152 . 1 1 20 20 SER CB C 20 63.370 63.370 62.540 0.830 17919 62171 1 152 . 1 1 20 20 SER H H 20 7.040 7.040 8.331 -1.291 17919 62172 1 152 . 1 1 21 21 ASP N N 21 123.480 123.480 124.331 -0.851 17919 62173 1 152 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.840 -0.145 17919 62174 1 152 . 1 1 21 21 ASP C C 21 176.360 176.360 175.444 0.916 17919 62175 1 152 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.273 1.427 17919 62176 1 152 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.758 -0.958 17919 62177 1 152 . 1 1 21 21 ASP H H 21 8.030 8.030 7.599 0.431 17919 62178 1 152 . 1 1 22 22 THR N N 22 108.800 108.800 113.178 -4.378 17919 62179 1 152 . 1 1 22 22 THR HA H 22 4.920 4.920 4.725 0.195 17919 62180 1 152 . 1 1 22 22 THR C C 22 176.750 176.750 176.167 0.583 17919 62181 1 152 . 1 1 22 22 THR CA C 22 59.690 59.690 61.891 -2.201 17919 62182 1 152 . 1 1 22 22 THR CB C 22 71.200 71.200 70.129 1.071 17919 62183 1 152 . 1 1 22 22 THR H H 22 7.900 7.900 8.310 -0.410 17919 62184 1 152 . 1 1 23 23 ILE N N 23 121.190 121.190 122.118 -0.928 17919 62185 1 152 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.842 -0.185 17919 62186 1 152 . 1 1 23 23 ILE C C 23 179.040 179.040 177.429 1.611 17919 62187 1 152 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.404 -0.144 17919 62188 1 152 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.539 -2.189 17919 62189 1 152 . 1 1 23 23 ILE H H 23 8.560 8.560 8.314 0.246 17919 62190 1 152 . 1 1 24 24 GLU N N 24 120.830 120.830 121.790 -0.960 17919 62191 1 152 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.865 0.052 17919 62192 1 152 . 1 1 24 24 GLU C C 24 178.640 178.640 178.631 0.009 17919 62193 1 152 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.160 0.060 17919 62194 1 152 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.444 -1.164 17919 62195 1 152 . 1 1 24 24 GLU H H 24 9.760 9.760 7.861 1.899 17919 62196 1 152 . 1 1 25 25 ASN N N 25 120.570 120.570 117.250 3.320 17919 62197 1 152 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.555 -0.030 17919 62198 1 152 . 1 1 25 25 ASN C C 25 178.380 178.380 177.950 0.430 17919 62199 1 152 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.693 0.367 17919 62200 1 152 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.266 0.184 17919 62201 1 152 . 1 1 25 25 ASN H H 25 7.920 7.920 7.654 0.266 17919 62202 1 152 . 1 1 26 26 VAL N N 26 121.710 121.710 120.613 1.097 17919 62203 1 152 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.623 -0.226 17919 62204 1 152 . 1 1 26 26 VAL C C 26 177.950 177.950 177.875 0.075 17919 62205 1 152 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.416 1.244 17919 62206 1 152 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.235 -0.395 17919 62207 1 152 . 1 1 26 26 VAL H H 26 8.070 8.070 7.616 0.454 17919 62208 1 152 . 1 1 27 27 LYS N N 27 118.860 118.860 120.198 -1.338 17919 62209 1 152 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.240 0.340 17919 62210 1 152 . 1 1 27 27 LYS C C 27 180.550 180.550 179.203 1.347 17919 62211 1 152 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.673 -0.423 17919 62212 1 152 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.104 1.626 17919 62213 1 152 . 1 1 27 27 LYS H H 27 8.560 8.560 8.426 0.134 17919 62214 1 152 . 1 1 28 28 ALA N N 28 123.440 123.440 122.104 1.336 17919 62215 1 152 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.091 0.069 17919 62216 1 152 . 1 1 28 28 ALA C C 28 180.300 180.300 179.131 1.169 17919 62217 1 152 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.076 0.294 17919 62218 1 152 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.303 -0.593 17919 62219 1 152 . 1 1 28 28 ALA H H 28 8.060 8.060 8.136 -0.076 17919 62220 1 152 . 1 1 29 29 LYS N N 29 119.940 119.940 119.162 0.778 17919 62221 1 152 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.005 0.202 17919 62222 1 152 . 1 1 29 29 LYS C C 29 180.320 180.320 179.092 1.228 17919 62223 1 152 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.596 0.055 17919 62224 1 152 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.343 0.947 17919 62225 1 152 . 1 1 29 29 LYS H H 29 7.850 7.850 7.667 0.183 17919 62226 1 152 . 1 1 30 30 ILE N N 30 121.080 121.080 120.488 0.592 17919 62227 1 152 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.603 -0.096 17919 62228 1 152 . 1 1 30 30 ILE C C 30 178.310 178.310 177.355 0.955 17919 62229 1 152 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.199 0.951 17919 62230 1 152 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.725 -0.925 17919 62231 1 152 . 1 1 30 30 ILE H H 30 8.280 8.280 8.321 -0.041 17919 62232 1 152 . 1 1 31 31 GLN N N 31 123.490 123.490 119.929 3.561 17919 62233 1 152 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.058 -0.229 17919 62234 1 152 . 1 1 31 31 GLN C C 31 178.890 178.890 178.322 0.568 17919 62235 1 152 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.615 0.385 17919 62236 1 152 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.503 -0.783 17919 62237 1 152 . 1 1 31 31 GLN H H 31 8.580 8.580 8.021 0.559 17919 62238 1 152 . 1 1 32 32 ASP N N 32 119.360 119.360 119.453 -0.093 17919 62239 1 152 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.410 -0.056 17919 62240 1 152 . 1 1 32 32 ASP C C 32 177.250 177.250 178.264 -1.014 17919 62241 1 152 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.761 0.429 17919 62242 1 152 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.831 -0.251 17919 62243 1 152 . 1 1 32 32 ASP H H 32 8.010 8.010 8.086 -0.076 17919 62244 1 152 . 1 1 33 33 LYS N N 33 115.130 115.130 118.668 -3.538 17919 62245 1 152 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.193 0.144 17919 62246 1 152 . 1 1 33 33 LYS C C 33 177.870 177.870 178.280 -0.410 17919 62247 1 152 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.407 -0.357 17919 62248 1 152 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.075 1.095 17919 62249 1 152 . 1 1 33 33 LYS H H 33 7.430 7.430 7.842 -0.412 17919 62250 1 152 . 1 1 34 34 GLU N N 34 113.870 113.870 113.831 0.039 17919 62251 1 152 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.522 0.103 17919 62252 1 152 . 1 1 34 34 GLU C C 34 177.840 177.840 176.632 1.208 17919 62253 1 152 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.632 -0.462 17919 62254 1 152 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.674 0.986 17919 62255 1 152 . 1 1 34 34 GLU H H 34 8.740 8.740 8.270 0.470 17919 62256 1 152 . 1 1 35 35 GLY N N 35 108.650 108.650 108.756 -0.106 17919 62257 1 152 . 1 1 35 35 GLY C C 35 173.960 173.960 174.573 -0.613 17919 62258 1 152 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.819 0.261 17919 62259 1 152 . 1 1 35 35 GLY H H 35 8.530 8.530 8.271 0.259 17919 62260 1 152 . 1 1 36 36 ILE N N 36 119.880 119.880 121.938 -2.058 17919 62261 1 152 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.228 0.217 17919 62262 1 152 . 1 1 36 36 ILE C C 36 173.590 173.590 173.847 -0.257 17919 62263 1 152 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.404 -0.654 17919 62264 1 152 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.205 2.375 17919 62265 1 152 . 1 1 36 36 ILE H H 36 6.150 6.150 7.518 -1.368 17919 62266 1 152 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.669 -0.035 17919 62267 1 152 . 1 1 37 37 PRO C C 37 176.940 176.940 176.094 0.846 17919 62268 1 152 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.950 -0.291 17919 62269 1 152 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.414 0.436 17919 62270 1 152 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.191 -0.074 17919 62271 1 152 . 1 1 38 38 PRO C C 38 178.320 178.320 177.381 0.939 17919 62272 1 152 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.363 0.897 17919 62273 1 152 . 1 1 38 38 PRO CB C 38 32.890 32.890 32.087 0.803 17919 62274 1 152 . 1 1 39 39 ASP N N 39 113.380 113.380 114.586 -1.206 17919 62275 1 152 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.409 0.021 17919 62276 1 152 . 1 1 39 39 ASP C C 39 177.090 177.090 177.784 -0.694 17919 62277 1 152 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.734 -1.094 17919 62278 1 152 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.806 -1.266 17919 62279 1 152 . 1 1 39 39 ASP H H 39 8.550 8.550 8.306 0.244 17919 62280 1 152 . 1 1 40 40 GLN N N 40 116.780 116.780 117.437 -0.657 17919 62281 1 152 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.242 0.222 17919 62282 1 152 . 1 1 40 40 GLN C C 40 175.380 175.380 176.563 -1.183 17919 62283 1 152 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.022 -0.382 17919 62284 1 152 . 1 1 40 40 GLN CB C 40 30.140 30.140 28.904 1.236 17919 62285 1 152 . 1 1 40 40 GLN H H 40 7.820 7.820 7.792 0.028 17919 62286 1 152 . 1 1 41 41 GLN N N 41 117.720 117.720 119.029 -1.309 17919 62287 1 152 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.433 -0.189 17919 62288 1 152 . 1 1 41 41 GLN C C 41 176.300 176.300 175.655 0.645 17919 62289 1 152 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.059 0.412 17919 62290 1 152 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.461 2.189 17919 62291 1 152 . 1 1 41 41 GLN H H 41 7.480 7.480 7.267 0.213 17919 62292 1 152 . 1 1 42 42 ARG N N 42 122.680 122.680 126.715 -4.035 17919 62293 1 152 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.600 -0.100 17919 62294 1 152 . 1 1 42 42 ARG C C 42 174.050 174.050 174.322 -0.272 17919 62295 1 152 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.668 0.382 17919 62296 1 152 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.050 -0.300 17919 62297 1 152 . 1 1 42 42 ARG H H 42 8.530 8.530 8.802 -0.272 17919 62298 1 152 . 1 1 43 43 LEU N N 43 124.040 124.040 127.347 -3.307 17919 62299 1 152 . 1 1 43 43 LEU C C 43 175.290 175.290 175.806 -0.516 17919 62300 1 152 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.894 -0.914 17919 62301 1 152 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.523 2.267 17919 62302 1 152 . 1 1 43 43 LEU H H 43 8.820 8.820 8.808 0.012 17919 62303 1 152 . 1 1 44 44 ILE N N 44 121.920 121.920 122.916 -0.996 17919 62304 1 152 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.033 -0.041 17919 62305 1 152 . 1 1 44 44 ILE C C 44 176.060 176.060 174.229 1.831 17919 62306 1 152 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.304 -1.324 17919 62307 1 152 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.724 -0.304 17919 62308 1 152 . 1 1 44 44 ILE H H 44 9.030 9.030 9.178 -0.148 17919 62309 1 152 . 1 1 45 45 PHE N N 45 125.390 125.390 127.379 -1.989 17919 62310 1 152 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.031 0.014 17919 62311 1 152 . 1 1 45 45 PHE C C 45 174.470 174.470 174.523 -0.053 17919 62312 1 152 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.093 0.928 17919 62313 1 152 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.273 0.487 17919 62314 1 152 . 1 1 45 45 PHE H H 45 8.830 8.830 9.003 -0.173 17919 62315 1 152 . 1 1 46 46 ALA N N 46 132.200 132.200 128.718 3.482 17919 62316 1 152 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.652 0.038 17919 62317 1 152 . 1 1 46 46 ALA C C 46 177.290 177.290 177.810 -0.520 17919 62318 1 152 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.407 0.133 17919 62319 1 152 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.464 0.106 17919 62320 1 152 . 1 1 46 46 ALA H H 46 8.810 8.810 8.572 0.238 17919 62321 1 152 . 1 1 47 47 GLY N N 47 102.340 102.340 104.500 -2.160 17919 62322 1 152 . 1 1 47 47 GLY C C 47 173.810 173.810 174.042 -0.232 17919 62323 1 152 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.872 0.478 17919 62324 1 152 . 1 1 47 47 GLY H H 47 8.130 8.130 8.508 -0.378 17919 62325 1 152 . 1 1 48 48 LYS N N 48 121.570 121.570 120.927 0.643 17919 62326 1 152 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.644 -0.022 17919 62327 1 152 . 1 1 48 48 LYS C C 48 174.700 174.700 175.750 -1.050 17919 62328 1 152 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.559 -0.009 17919 62329 1 152 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.329 0.201 17919 62330 1 152 . 1 1 48 48 LYS H H 48 7.980 7.980 7.952 0.028 17919 62331 1 152 . 1 1 49 49 GLN N N 49 122.410 122.410 122.411 -0.001 17919 62332 1 152 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.443 0.117 17919 62333 1 152 . 1 1 49 49 GLN C C 49 175.670 175.670 175.938 -0.268 17919 62334 1 152 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.374 -0.634 17919 62335 1 152 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.124 -0.124 17919 62336 1 152 . 1 1 49 49 GLN H H 49 8.600 8.600 8.599 0.001 17919 62337 1 152 . 1 1 50 50 LEU N N 50 125.520 125.520 127.619 -2.099 17919 62338 1 152 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.328 -0.238 17919 62339 1 152 . 1 1 50 50 LEU C C 50 176.660 176.660 176.224 0.436 17919 62340 1 152 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.389 -0.149 17919 62341 1 152 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.544 0.026 17919 62342 1 152 . 1 1 50 50 LEU H H 50 8.530 8.530 8.726 -0.196 17919 62343 1 152 . 1 1 51 51 GLU N N 51 122.940 122.940 123.403 -0.463 17919 62344 1 152 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.614 -0.126 17919 62345 1 152 . 1 1 51 51 GLU C C 51 175.870 175.870 176.652 -0.782 17919 62346 1 152 . 1 1 51 51 GLU CA C 51 55.960 55.960 54.858 1.103 17919 62347 1 152 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.754 -0.184 17919 62348 1 152 . 1 1 51 51 GLU H H 51 8.400 8.400 8.833 -0.433 17919 62349 1 152 . 1 1 52 52 ASP N N 52 120.030 120.030 121.855 -1.825 17919 62350 1 152 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.485 -0.126 17919 62351 1 152 . 1 1 52 52 ASP C C 52 177.330 177.330 177.716 -0.386 17919 62352 1 152 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.691 -0.731 17919 62353 1 152 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.956 -0.106 17919 62354 1 152 . 1 1 52 52 ASP H H 52 8.160 8.160 8.825 -0.665 17919 62355 1 152 . 1 1 53 53 GLY N N 53 106.660 106.660 105.738 0.922 17919 62356 1 152 . 1 1 53 53 GLY C C 53 174.870 174.870 174.338 0.532 17919 62357 1 152 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.705 0.466 17919 62358 1 152 . 1 1 53 53 GLY H H 53 9.390 9.390 8.260 1.130 17919 62359 1 152 . 1 1 54 54 ARG N N 54 119.050 119.050 121.381 -2.331 17919 62360 1 152 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.509 0.186 17919 62361 1 152 . 1 1 54 54 ARG C C 54 175.350 175.350 175.892 -0.542 17919 62362 1 152 . 1 1 54 54 ARG CA C 54 54.390 54.390 55.261 -0.871 17919 62363 1 152 . 1 1 54 54 ARG CB C 54 32.650 32.650 31.591 1.058 17919 62364 1 152 . 1 1 54 54 ARG H H 54 7.460 7.460 7.373 0.087 17919 62365 1 152 . 1 1 55 55 THR N N 55 108.400 108.400 112.974 -4.574 17919 62366 1 152 . 1 1 55 55 THR HA H 55 5.240 5.240 4.890 0.350 17919 62367 1 152 . 1 1 55 55 THR C C 55 176.560 176.560 176.282 0.278 17919 62368 1 152 . 1 1 55 55 THR CA C 55 59.690 59.690 60.808 -1.118 17919 62369 1 152 . 1 1 55 55 THR CB C 55 72.260 72.260 70.351 1.909 17919 62370 1 152 . 1 1 55 55 THR H H 55 8.730 8.730 8.854 -0.124 17919 62371 1 152 . 1 1 56 56 LEU N N 56 117.920 117.920 121.835 -3.915 17919 62372 1 152 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.111 -0.051 17919 62373 1 152 . 1 1 56 56 LEU C C 56 180.810 180.810 178.864 1.946 17919 62374 1 152 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.556 0.154 17919 62375 1 152 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.382 -1.012 17919 62376 1 152 . 1 1 56 56 LEU H H 56 8.140 8.140 8.760 -0.620 17919 62377 1 152 . 1 1 57 57 SER N N 57 113.330 113.330 115.204 -1.874 17919 62378 1 152 . 1 1 57 57 SER HA H 57 4.370 4.370 4.184 0.186 17919 62379 1 152 . 1 1 57 57 SER C C 57 178.310 178.310 176.808 1.502 17919 62380 1 152 . 1 1 57 57 SER CA C 57 61.080 61.080 61.684 -0.603 17919 62381 1 152 . 1 1 57 57 SER CB C 57 62.530 62.530 62.982 -0.452 17919 62382 1 152 . 1 1 57 57 SER H H 57 8.470 8.470 8.472 -0.002 17919 62383 1 152 . 1 1 58 58 ASP N N 58 124.190 124.190 122.290 1.900 17919 62384 1 152 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.328 -0.032 17919 62385 1 152 . 1 1 58 58 ASP C C 58 177.400 177.400 177.081 0.319 17919 62386 1 152 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.772 0.408 17919 62387 1 152 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.454 -0.354 17919 62388 1 152 . 1 1 58 58 ASP H H 58 7.930 7.930 7.858 0.072 17919 62389 1 152 . 1 1 59 59 TYR N N 59 115.510 115.510 114.951 0.559 17919 62390 1 152 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.607 0.063 17919 62391 1 152 . 1 1 59 59 TYR C C 59 174.700 174.700 175.160 -0.460 17919 62392 1 152 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.104 1.146 17919 62393 1 152 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.337 1.733 17919 62394 1 152 . 1 1 59 59 TYR H H 59 7.250 7.250 7.162 0.088 17919 62395 1 152 . 1 1 60 60 ASN N N 60 115.900 115.900 118.959 -3.059 17919 62396 1 152 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.415 -0.060 17919 62397 1 152 . 1 1 60 60 ASN C C 60 174.340 174.340 174.908 -0.568 17919 62398 1 152 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.154 -0.035 17919 62399 1 152 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.319 0.091 17919 62400 1 152 . 1 1 60 60 ASN H H 60 8.150 8.150 7.910 0.240 17919 62401 1 152 . 1 1 61 61 ILE N N 61 118.600 118.600 120.683 -2.083 17919 62402 1 152 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.846 -0.453 17919 62403 1 152 . 1 1 61 61 ILE C C 61 174.610 174.610 174.683 -0.073 17919 62404 1 152 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.728 0.692 17919 62405 1 152 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.901 -1.161 17919 62406 1 152 . 1 1 61 61 ILE H H 61 7.250 7.250 8.469 -1.219 17919 62407 1 152 . 1 1 62 62 GLN N N 62 124.740 124.740 125.095 -0.355 17919 62408 1 152 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.833 -0.327 17919 62409 1 152 . 1 1 62 62 GLN C C 62 175.970 175.970 175.141 0.829 17919 62410 1 152 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.119 0.541 17919 62411 1 152 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.158 0.492 17919 62412 1 152 . 1 1 62 62 GLN H H 62 7.610 7.610 8.248 -0.638 17919 62413 1 152 . 1 1 63 63 LYS N N 63 120.300 120.300 121.935 -1.635 17919 62414 1 152 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.929 0.072 17919 62415 1 152 . 1 1 63 63 LYS C C 63 175.810 175.810 177.014 -1.204 17919 62416 1 152 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.728 -0.938 17919 62417 1 152 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.220 0.430 17919 62418 1 152 . 1 1 63 63 LYS H H 63 8.490 8.490 8.569 -0.079 17919 62419 1 152 . 1 1 64 64 GLU N N 64 113.950 113.950 121.194 -7.244 17919 62420 1 152 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.915 -0.450 17919 62421 1 152 . 1 1 64 64 GLU C C 64 175.250 175.250 176.442 -1.192 17919 62422 1 152 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.612 0.278 17919 62423 1 152 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.821 -2.921 17919 62424 1 152 . 1 1 64 64 GLU H H 64 9.280 9.280 8.844 0.436 17919 62425 1 152 . 1 1 65 65 SER N N 65 114.730 114.730 115.532 -0.802 17919 62426 1 152 . 1 1 65 65 SER HA H 65 4.640 4.640 4.415 0.225 17919 62427 1 152 . 1 1 65 65 SER C C 65 172.160 172.160 173.873 -1.713 17919 62428 1 152 . 1 1 65 65 SER CA C 65 60.890 60.890 61.100 -0.210 17919 62429 1 152 . 1 1 65 65 SER CB C 65 64.910 64.910 63.902 1.008 17919 62430 1 152 . 1 1 65 65 SER H H 65 7.670 7.670 7.900 -0.230 17919 62431 1 152 . 1 1 66 66 THR N N 66 117.110 117.110 118.244 -1.134 17919 62432 1 152 . 1 1 66 66 THR HA H 66 5.270 5.270 5.186 0.084 17919 62433 1 152 . 1 1 66 66 THR C C 66 173.950 173.950 173.675 0.275 17919 62434 1 152 . 1 1 66 66 THR CA C 66 62.340 62.340 61.795 0.545 17919 62435 1 152 . 1 1 66 66 THR CB C 66 70.080 70.080 70.040 0.040 17919 62436 1 152 . 1 1 66 66 THR H H 66 8.730 8.730 8.260 0.470 17919 62437 1 152 . 1 1 67 67 LEU N N 67 127.110 127.110 126.544 0.566 17919 62438 1 152 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.978 0.082 17919 62439 1 152 . 1 1 67 67 LEU C C 67 175.770 175.770 174.994 0.776 17919 62440 1 152 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.777 0.123 17919 62441 1 152 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.825 -0.565 17919 62442 1 152 . 1 1 67 67 LEU H H 67 9.410 9.410 9.124 0.286 17919 62443 1 152 . 1 1 68 68 HIS N N 68 118.380 118.380 120.395 -2.015 17919 62444 1 152 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.413 -0.173 17919 62445 1 152 . 1 1 68 68 HIS C C 68 173.150 173.150 173.206 -0.056 17919 62446 1 152 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.231 0.769 17919 62447 1 152 . 1 1 68 68 HIS CB C 68 30.530 30.530 33.747 -3.217 17919 62448 1 152 . 1 1 68 68 HIS H H 68 9.230 9.230 8.987 0.243 17919 62449 1 152 . 1 1 69 69 LEU N N 69 124.460 124.460 128.658 -4.198 17919 62450 1 152 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.495 0.695 17919 62451 1 152 . 1 1 69 69 LEU C C 69 175.270 175.270 173.600 1.670 17919 62452 1 152 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.416 0.474 17919 62453 1 152 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.920 -0.540 17919 62454 1 152 . 1 1 69 69 LEU H H 69 8.340 8.340 8.512 -0.172 17919 62455 1 152 . 1 1 70 70 VAL N N 70 126.940 126.940 126.956 -0.016 17919 62456 1 152 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.396 -0.046 17919 62457 1 152 . 1 1 70 70 VAL C C 70 174.000 174.000 174.400 -0.400 17919 62458 1 152 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.465 0.335 17919 62459 1 152 . 1 1 70 70 VAL CB C 70 34.910 34.910 34.810 0.100 17919 62460 1 152 . 1 1 70 70 VAL H H 70 9.200 9.200 8.685 0.515 17919 62461 1 152 . 1 1 71 71 LEU N N 71 123.130 123.130 124.715 -1.585 17919 62462 1 152 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.027 0.033 17919 62463 1 152 . 1 1 71 71 LEU C C 71 177.830 177.830 177.158 0.672 17919 62464 1 152 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.386 0.554 17919 62465 1 152 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.348 -0.498 17919 62466 1 152 . 1 1 71 71 LEU H H 71 8.120 8.120 8.554 -0.434 17919 62467 1 152 . 1 1 72 72 ARG N N 72 123.490 123.490 120.921 2.569 17919 62468 1 152 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.537 -0.236 17919 62469 1 152 . 1 1 72 72 ARG C C 72 175.350 175.350 175.385 -0.035 17919 62470 1 152 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.018 0.592 17919 62471 1 152 . 1 1 72 72 ARG CB C 72 31.350 31.350 31.647 -0.297 17919 62472 1 152 . 1 1 72 72 ARG H H 72 8.580 8.580 8.643 -0.063 17919 62473 1 153 . 1 1 2 2 GLN N N 2 123.220 123.220 119.034 4.186 17919 62474 1 153 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.391 -0.142 17919 62475 1 153 . 1 1 2 2 GLN C C 2 175.920 175.920 175.715 0.205 17919 62476 1 153 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.545 0.535 17919 62477 1 153 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.781 -0.021 17919 62478 1 153 . 1 1 2 2 GLN H H 2 8.900 8.900 8.256 0.644 17919 62479 1 153 . 1 1 3 3 ILE N N 3 115.340 115.340 116.109 -0.769 17919 62480 1 153 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.377 -0.164 17919 62481 1 153 . 1 1 3 3 ILE C C 3 172.450 172.450 173.466 -1.016 17919 62482 1 153 . 1 1 3 3 ILE CA C 3 59.570 59.570 58.938 0.632 17919 62483 1 153 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.902 0.308 17919 62484 1 153 . 1 1 3 3 ILE H H 3 8.320 8.320 8.825 -0.505 17919 62485 1 153 . 1 1 4 4 PHE N N 4 118.110 118.110 119.206 -1.096 17919 62486 1 153 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.592 0.038 17919 62487 1 153 . 1 1 4 4 PHE C C 4 175.320 175.320 175.041 0.279 17919 62488 1 153 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.259 -0.049 17919 62489 1 153 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.403 -0.923 17919 62490 1 153 . 1 1 4 4 PHE H H 4 8.610 8.610 8.633 -0.023 17919 62491 1 153 . 1 1 5 5 VAL N N 5 121.000 121.000 121.999 -0.999 17919 62492 1 153 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.646 0.079 17919 62493 1 153 . 1 1 5 5 VAL C C 5 174.870 174.870 174.332 0.538 17919 62494 1 153 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.456 -0.836 17919 62495 1 153 . 1 1 5 5 VAL CB C 5 34.230 34.230 35.311 -1.081 17919 62496 1 153 . 1 1 5 5 VAL H H 5 9.300 9.300 9.302 -0.002 17919 62497 1 153 . 1 1 6 6 LYS N N 6 127.520 127.520 126.337 1.183 17919 62498 1 153 . 1 1 6 6 LYS HA H 6 5.367 5.367 4.918 0.449 17919 62499 1 153 . 1 1 6 6 LYS C C 6 177.140 177.140 176.273 0.867 17919 62500 1 153 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.178 0.342 17919 62501 1 153 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.696 0.354 17919 62502 1 153 . 1 1 6 6 LYS H H 6 8.820 8.820 9.107 -0.287 17919 62503 1 153 . 1 1 7 7 THR N N 7 115.400 115.400 115.280 0.120 17919 62504 1 153 . 1 1 7 7 THR HA H 7 4.970 4.970 4.401 0.569 17919 62505 1 153 . 1 1 7 7 THR C C 7 176.910 176.910 176.765 0.145 17919 62506 1 153 . 1 1 7 7 THR CA C 7 60.470 60.470 61.156 -0.686 17919 62507 1 153 . 1 1 7 7 THR CB C 7 70.630 70.630 70.134 0.496 17919 62508 1 153 . 1 1 7 7 THR H H 7 8.730 8.730 8.094 0.636 17919 62509 1 153 . 1 1 8 8 LEU N N 8 121.330 121.330 120.982 0.348 17919 62510 1 153 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.202 0.108 17919 62511 1 153 . 1 1 8 8 LEU C C 8 178.800 178.800 178.224 0.576 17919 62512 1 153 . 1 1 8 8 LEU CA C 8 57.580 57.580 58.361 -0.781 17919 62513 1 153 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.785 0.185 17919 62514 1 153 . 1 1 8 8 LEU H H 8 9.100 9.100 8.870 0.230 17919 62515 1 153 . 1 1 9 9 THR N N 9 105.590 105.590 106.346 -0.756 17919 62516 1 153 . 1 1 9 9 THR HA H 9 4.428 4.428 4.142 0.286 17919 62517 1 153 . 1 1 9 9 THR C C 9 175.520 175.520 175.799 -0.279 17919 62518 1 153 . 1 1 9 9 THR CA C 9 61.400 61.400 63.147 -1.747 17919 62519 1 153 . 1 1 9 9 THR CB C 9 69.140 69.140 68.495 0.645 17919 62520 1 153 . 1 1 9 9 THR H H 9 7.630 7.630 7.683 -0.053 17919 62521 1 153 . 1 1 10 10 GLY N N 10 108.890 108.890 110.277 -1.387 17919 62522 1 153 . 1 1 10 10 GLY C C 10 174.070 174.070 174.083 -0.013 17919 62523 1 153 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.160 0.300 17919 62524 1 153 . 1 1 10 10 GLY H H 10 7.810 7.810 7.912 -0.102 17919 62525 1 153 . 1 1 11 11 LYS N N 11 121.600 121.600 122.629 -1.029 17919 62526 1 153 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.503 -0.142 17919 62527 1 153 . 1 1 11 11 LYS C C 11 175.940 175.940 176.185 -0.245 17919 62528 1 153 . 1 1 11 11 LYS CA C 11 56.280 56.280 54.909 1.371 17919 62529 1 153 . 1 1 11 11 LYS CB C 11 33.200 33.200 32.912 0.288 17919 62530 1 153 . 1 1 11 11 LYS H H 11 7.280 7.280 7.917 -0.637 17919 62531 1 153 . 1 1 12 12 THR N N 12 120.440 120.440 120.914 -0.474 17919 62532 1 153 . 1 1 12 12 THR HA H 12 5.046 5.046 4.699 0.347 17919 62533 1 153 . 1 1 12 12 THR C C 12 174.320 174.320 175.027 -0.707 17919 62534 1 153 . 1 1 12 12 THR CA C 12 62.390 62.390 63.444 -1.054 17919 62535 1 153 . 1 1 12 12 THR CB C 12 69.910 69.910 69.464 0.446 17919 62536 1 153 . 1 1 12 12 THR H H 12 8.650 8.650 8.547 0.103 17919 62537 1 153 . 1 1 13 13 ILE N N 13 127.110 127.110 122.362 4.748 17919 62538 1 153 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.685 -0.141 17919 62539 1 153 . 1 1 13 13 ILE C C 13 175.220 175.220 175.055 0.165 17919 62540 1 153 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.481 0.499 17919 62541 1 153 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.162 -0.212 17919 62542 1 153 . 1 1 13 13 ILE H H 13 9.450 9.450 9.126 0.324 17919 62543 1 153 . 1 1 14 14 THR N N 14 121.520 121.520 122.668 -1.148 17919 62544 1 153 . 1 1 14 14 THR HA H 14 4.964 4.964 5.345 -0.381 17919 62545 1 153 . 1 1 14 14 THR C C 14 173.790 173.790 173.849 -0.059 17919 62546 1 153 . 1 1 14 14 THR CA C 14 61.940 61.940 62.455 -0.515 17919 62547 1 153 . 1 1 14 14 THR CB C 14 69.650 69.650 70.012 -0.362 17919 62548 1 153 . 1 1 14 14 THR H H 14 8.710 8.710 8.631 0.079 17919 62549 1 153 . 1 1 15 15 LEU N N 15 124.800 124.800 124.992 -0.192 17919 62550 1 153 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.814 -0.034 17919 62551 1 153 . 1 1 15 15 LEU C C 15 174.670 174.670 174.949 -0.279 17919 62552 1 153 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.861 -1.031 17919 62553 1 153 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.616 1.454 17919 62554 1 153 . 1 1 15 15 LEU H H 15 8.710 8.710 9.110 -0.400 17919 62555 1 153 . 1 1 16 16 GLU N N 16 122.160 122.160 122.056 0.104 17919 62556 1 153 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.395 -0.478 17919 62557 1 153 . 1 1 16 16 GLU C C 16 175.860 175.860 176.028 -0.168 17919 62558 1 153 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.152 -0.332 17919 62559 1 153 . 1 1 16 16 GLU CB C 16 29.450 29.450 31.021 -1.571 17919 62560 1 153 . 1 1 16 16 GLU H H 16 8.140 8.140 8.652 -0.512 17919 62561 1 153 . 1 1 17 17 VAL N N 17 117.210 117.210 117.612 -0.402 17919 62562 1 153 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.895 -0.181 17919 62563 1 153 . 1 1 17 17 VAL C C 17 174.160 174.160 174.682 -0.522 17919 62564 1 153 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.014 -0.584 17919 62565 1 153 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.588 0.812 17919 62566 1 153 . 1 1 17 17 VAL H H 17 8.900 8.900 8.431 0.469 17919 62567 1 153 . 1 1 18 18 GLU N N 18 118.990 118.990 121.598 -2.608 17919 62568 1 153 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.759 0.320 17919 62569 1 153 . 1 1 18 18 GLU C C 18 176.160 176.160 175.022 1.138 17919 62570 1 153 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.753 -0.033 17919 62571 1 153 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.362 -0.052 17919 62572 1 153 . 1 1 18 18 GLU H H 18 8.640 8.640 8.239 0.401 17919 62573 1 153 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.262 -0.121 17919 62574 1 153 . 1 1 19 19 PRO C C 19 175.310 175.310 178.063 -2.753 17919 62575 1 153 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.571 -0.101 17919 62576 1 153 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.944 0.006 17919 62577 1 153 . 1 1 20 20 SER N N 20 103.400 103.400 109.219 -5.819 17919 62578 1 153 . 1 1 20 20 SER HA H 20 4.370 4.370 4.294 0.076 17919 62579 1 153 . 1 1 20 20 SER C C 20 174.660 174.660 174.670 -0.010 17919 62580 1 153 . 1 1 20 20 SER CA C 20 57.400 57.400 58.595 -1.195 17919 62581 1 153 . 1 1 20 20 SER CB C 20 63.370 63.370 62.711 0.659 17919 62582 1 153 . 1 1 20 20 SER H H 20 7.040 7.040 8.049 -1.009 17919 62583 1 153 . 1 1 21 21 ASP N N 21 123.480 123.480 125.354 -1.874 17919 62584 1 153 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.756 -0.061 17919 62585 1 153 . 1 1 21 21 ASP C C 21 176.360 176.360 175.806 0.554 17919 62586 1 153 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.117 0.583 17919 62587 1 153 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.735 -0.935 17919 62588 1 153 . 1 1 21 21 ASP H H 21 8.030 8.030 7.686 0.344 17919 62589 1 153 . 1 1 22 22 THR N N 22 108.800 108.800 114.210 -5.410 17919 62590 1 153 . 1 1 22 22 THR HA H 22 4.920 4.920 4.999 -0.079 17919 62591 1 153 . 1 1 22 22 THR C C 22 176.750 176.750 176.515 0.235 17919 62592 1 153 . 1 1 22 22 THR CA C 22 59.690 59.690 61.109 -1.419 17919 62593 1 153 . 1 1 22 22 THR CB C 22 71.200 71.200 70.363 0.837 17919 62594 1 153 . 1 1 22 22 THR H H 22 7.900 7.900 8.196 -0.296 17919 62595 1 153 . 1 1 23 23 ILE N N 23 121.190 121.190 122.902 -1.712 17919 62596 1 153 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.666 -0.009 17919 62597 1 153 . 1 1 23 23 ILE C C 23 179.040 179.040 177.740 1.300 17919 62598 1 153 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.734 -1.474 17919 62599 1 153 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.375 -2.025 17919 62600 1 153 . 1 1 23 23 ILE H H 23 8.560 8.560 8.673 -0.113 17919 62601 1 153 . 1 1 24 24 GLU N N 24 120.830 120.830 120.068 0.762 17919 62602 1 153 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.869 0.048 17919 62603 1 153 . 1 1 24 24 GLU C C 24 178.640 178.640 178.819 -0.179 17919 62604 1 153 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.977 0.243 17919 62605 1 153 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.408 -1.128 17919 62606 1 153 . 1 1 24 24 GLU H H 24 9.760 9.760 8.350 1.410 17919 62607 1 153 . 1 1 25 25 ASN N N 25 120.570 120.570 117.892 2.678 17919 62608 1 153 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.508 0.017 17919 62609 1 153 . 1 1 25 25 ASN C C 25 178.380 178.380 177.774 0.606 17919 62610 1 153 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.074 -0.014 17919 62611 1 153 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.734 -0.284 17919 62612 1 153 . 1 1 25 25 ASN H H 25 7.920 7.920 7.546 0.374 17919 62613 1 153 . 1 1 26 26 VAL N N 26 121.710 121.710 120.438 1.272 17919 62614 1 153 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.554 -0.157 17919 62615 1 153 . 1 1 26 26 VAL C C 26 177.950 177.950 178.220 -0.270 17919 62616 1 153 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.812 0.848 17919 62617 1 153 . 1 1 26 26 VAL CB C 26 30.840 30.840 30.836 0.004 17919 62618 1 153 . 1 1 26 26 VAL H H 26 8.070 8.070 8.389 -0.319 17919 62619 1 153 . 1 1 27 27 LYS N N 27 118.860 118.860 119.597 -0.737 17919 62620 1 153 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.192 0.388 17919 62621 1 153 . 1 1 27 27 LYS C C 27 180.550 180.550 179.164 1.386 17919 62622 1 153 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.669 -0.418 17919 62623 1 153 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.124 1.606 17919 62624 1 153 . 1 1 27 27 LYS H H 27 8.560 8.560 8.356 0.204 17919 62625 1 153 . 1 1 28 28 ALA N N 28 123.440 123.440 122.257 1.183 17919 62626 1 153 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.145 0.015 17919 62627 1 153 . 1 1 28 28 ALA C C 28 180.300 180.300 179.273 1.027 17919 62628 1 153 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.813 0.557 17919 62629 1 153 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.466 -0.756 17919 62630 1 153 . 1 1 28 28 ALA H H 28 8.060 8.060 7.920 0.140 17919 62631 1 153 . 1 1 29 29 LYS N N 29 119.940 119.940 119.155 0.785 17919 62632 1 153 . 1 1 29 29 LYS HA H 29 4.207 4.207 3.995 0.212 17919 62633 1 153 . 1 1 29 29 LYS C C 29 180.320 180.320 179.057 1.263 17919 62634 1 153 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.366 0.284 17919 62635 1 153 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.344 0.945 17919 62636 1 153 . 1 1 29 29 LYS H H 29 7.850 7.850 7.969 -0.119 17919 62637 1 153 . 1 1 30 30 ILE N N 30 121.080 121.080 120.426 0.654 17919 62638 1 153 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.611 -0.104 17919 62639 1 153 . 1 1 30 30 ILE C C 30 178.310 178.310 177.193 1.117 17919 62640 1 153 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.185 0.965 17919 62641 1 153 . 1 1 30 30 ILE CB C 30 36.800 36.800 38.045 -1.245 17919 62642 1 153 . 1 1 30 30 ILE H H 30 8.280 8.280 8.210 0.070 17919 62643 1 153 . 1 1 31 31 GLN N N 31 123.490 123.490 120.622 2.868 17919 62644 1 153 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.958 -0.129 17919 62645 1 153 . 1 1 31 31 GLN C C 31 178.890 178.890 178.261 0.629 17919 62646 1 153 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.223 0.777 17919 62647 1 153 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.398 -0.678 17919 62648 1 153 . 1 1 31 31 GLN H H 31 8.580 8.580 8.088 0.492 17919 62649 1 153 . 1 1 32 32 ASP N N 32 119.360 119.360 118.243 1.117 17919 62650 1 153 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.392 -0.038 17919 62651 1 153 . 1 1 32 32 ASP C C 32 177.250 177.250 178.005 -0.755 17919 62652 1 153 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.757 0.433 17919 62653 1 153 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.795 -0.215 17919 62654 1 153 . 1 1 32 32 ASP H H 32 8.010 8.010 7.857 0.153 17919 62655 1 153 . 1 1 33 33 LYS N N 33 115.130 115.130 117.836 -2.706 17919 62656 1 153 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.283 0.054 17919 62657 1 153 . 1 1 33 33 LYS C C 33 177.870 177.870 178.245 -0.375 17919 62658 1 153 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.910 0.140 17919 62659 1 153 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.555 0.615 17919 62660 1 153 . 1 1 33 33 LYS H H 33 7.430 7.430 7.651 -0.221 17919 62661 1 153 . 1 1 34 34 GLU N N 34 113.870 113.870 116.628 -2.758 17919 62662 1 153 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.416 0.209 17919 62663 1 153 . 1 1 34 34 GLU C C 34 177.840 177.840 177.567 0.273 17919 62664 1 153 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.409 -1.239 17919 62665 1 153 . 1 1 34 34 GLU CB C 34 32.660 32.660 30.765 1.895 17919 62666 1 153 . 1 1 34 34 GLU H H 34 8.740 8.740 7.773 0.967 17919 62667 1 153 . 1 1 35 35 GLY N N 35 108.650 108.650 109.895 -1.245 17919 62668 1 153 . 1 1 35 35 GLY C C 35 173.960 173.960 174.276 -0.316 17919 62669 1 153 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.815 0.265 17919 62670 1 153 . 1 1 35 35 GLY H H 35 8.530 8.530 8.071 0.459 17919 62671 1 153 . 1 1 36 36 ILE N N 36 119.880 119.880 116.907 2.973 17919 62672 1 153 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.597 -0.152 17919 62673 1 153 . 1 1 36 36 ILE C C 36 173.590 173.590 173.803 -0.213 17919 62674 1 153 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.325 0.425 17919 62675 1 153 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.575 2.005 17919 62676 1 153 . 1 1 36 36 ILE H H 36 6.150 6.150 7.353 -1.203 17919 62677 1 153 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.547 0.087 17919 62678 1 153 . 1 1 37 37 PRO C C 37 176.940 176.940 176.757 0.183 17919 62679 1 153 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.659 0.001 17919 62680 1 153 . 1 1 37 37 PRO CB C 37 31.850 31.850 30.758 1.092 17919 62681 1 153 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.145 -0.028 17919 62682 1 153 . 1 1 38 38 PRO C C 38 178.320 178.320 178.383 -0.063 17919 62683 1 153 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.719 0.541 17919 62684 1 153 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.835 1.055 17919 62685 1 153 . 1 1 39 39 ASP N N 39 113.380 113.380 118.346 -4.966 17919 62686 1 153 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.447 -0.017 17919 62687 1 153 . 1 1 39 39 ASP C C 39 177.090 177.090 177.969 -0.879 17919 62688 1 153 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.598 -0.958 17919 62689 1 153 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.650 -1.109 17919 62690 1 153 . 1 1 39 39 ASP H H 39 8.550 8.550 8.582 -0.032 17919 62691 1 153 . 1 1 40 40 GLN N N 40 116.780 116.780 117.392 -0.612 17919 62692 1 153 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.264 0.200 17919 62693 1 153 . 1 1 40 40 GLN C C 40 175.380 175.380 175.859 -0.479 17919 62694 1 153 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.715 -1.075 17919 62695 1 153 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.485 0.655 17919 62696 1 153 . 1 1 40 40 GLN H H 40 7.820 7.820 8.294 -0.474 17919 62697 1 153 . 1 1 41 41 GLN N N 41 117.720 117.720 118.777 -1.057 17919 62698 1 153 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.337 -0.093 17919 62699 1 153 . 1 1 41 41 GLN C C 41 176.300 176.300 175.452 0.848 17919 62700 1 153 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.096 0.374 17919 62701 1 153 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.564 2.086 17919 62702 1 153 . 1 1 41 41 GLN H H 41 7.480 7.480 7.212 0.268 17919 62703 1 153 . 1 1 42 42 ARG N N 42 122.680 122.680 123.759 -1.079 17919 62704 1 153 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.656 -0.156 17919 62705 1 153 . 1 1 42 42 ARG C C 42 174.050 174.050 174.213 -0.163 17919 62706 1 153 . 1 1 42 42 ARG CA C 42 55.050 55.050 53.492 1.558 17919 62707 1 153 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.836 -1.086 17919 62708 1 153 . 1 1 42 42 ARG H H 42 8.530 8.530 9.118 -0.588 17919 62709 1 153 . 1 1 43 43 LEU N N 43 124.040 124.040 124.921 -0.881 17919 62710 1 153 . 1 1 43 43 LEU C C 43 175.290 175.290 175.464 -0.174 17919 62711 1 153 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.775 -0.795 17919 62712 1 153 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.703 2.087 17919 62713 1 153 . 1 1 43 43 LEU H H 43 8.820 8.820 8.885 -0.065 17919 62714 1 153 . 1 1 44 44 ILE N N 44 121.920 121.920 123.623 -1.703 17919 62715 1 153 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.091 -0.099 17919 62716 1 153 . 1 1 44 44 ILE C C 44 176.060 176.060 174.501 1.559 17919 62717 1 153 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.355 -1.375 17919 62718 1 153 . 1 1 44 44 ILE CB C 44 41.420 41.420 40.826 0.594 17919 62719 1 153 . 1 1 44 44 ILE H H 44 9.030 9.030 8.907 0.123 17919 62720 1 153 . 1 1 45 45 PHE N N 45 125.390 125.390 128.081 -2.691 17919 62721 1 153 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.006 0.039 17919 62722 1 153 . 1 1 45 45 PHE C C 45 174.470 174.470 174.660 -0.190 17919 62723 1 153 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.538 0.482 17919 62724 1 153 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.022 0.738 17919 62725 1 153 . 1 1 45 45 PHE H H 45 8.830 8.830 8.696 0.134 17919 62726 1 153 . 1 1 46 46 ALA N N 46 132.200 132.200 130.084 2.116 17919 62727 1 153 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.718 -0.028 17919 62728 1 153 . 1 1 46 46 ALA C C 46 177.290 177.290 177.665 -0.375 17919 62729 1 153 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.288 0.252 17919 62730 1 153 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.367 0.203 17919 62731 1 153 . 1 1 46 46 ALA H H 46 8.810 8.810 8.928 -0.118 17919 62732 1 153 . 1 1 47 47 GLY N N 47 102.340 102.340 104.568 -2.228 17919 62733 1 153 . 1 1 47 47 GLY C C 47 173.810 173.810 174.312 -0.502 17919 62734 1 153 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.793 0.557 17919 62735 1 153 . 1 1 47 47 GLY H H 47 8.130 8.130 8.524 -0.394 17919 62736 1 153 . 1 1 48 48 LYS N N 48 121.570 121.570 121.256 0.314 17919 62737 1 153 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.625 -0.003 17919 62738 1 153 . 1 1 48 48 LYS C C 48 174.700 174.700 175.319 -0.619 17919 62739 1 153 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.811 -0.261 17919 62740 1 153 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.733 -0.203 17919 62741 1 153 . 1 1 48 48 LYS H H 48 7.980 7.980 7.876 0.104 17919 62742 1 153 . 1 1 49 49 GLN N N 49 122.410 122.410 121.325 1.085 17919 62743 1 153 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.506 0.054 17919 62744 1 153 . 1 1 49 49 GLN C C 49 175.670 175.670 176.112 -0.442 17919 62745 1 153 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.097 -0.357 17919 62746 1 153 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.058 -0.059 17919 62747 1 153 . 1 1 49 49 GLN H H 49 8.600 8.600 8.435 0.165 17919 62748 1 153 . 1 1 50 50 LEU N N 50 125.520 125.520 128.586 -3.066 17919 62749 1 153 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.038 0.052 17919 62750 1 153 . 1 1 50 50 LEU C C 50 176.660 176.660 176.270 0.390 17919 62751 1 153 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.599 -0.359 17919 62752 1 153 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.627 -0.057 17919 62753 1 153 . 1 1 50 50 LEU H H 50 8.530 8.530 8.918 -0.388 17919 62754 1 153 . 1 1 51 51 GLU N N 51 122.940 122.940 122.161 0.779 17919 62755 1 153 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.645 -0.157 17919 62756 1 153 . 1 1 51 51 GLU C C 51 175.870 175.870 177.093 -1.223 17919 62757 1 153 . 1 1 51 51 GLU CA C 51 55.960 55.960 54.834 1.126 17919 62758 1 153 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.276 -0.706 17919 62759 1 153 . 1 1 51 51 GLU H H 51 8.400 8.400 8.619 -0.219 17919 62760 1 153 . 1 1 52 52 ASP N N 52 120.030 120.030 124.018 -3.988 17919 62761 1 153 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.376 -0.017 17919 62762 1 153 . 1 1 52 52 ASP C C 52 177.330 177.330 177.123 0.207 17919 62763 1 153 . 1 1 52 52 ASP CA C 52 56.960 56.960 58.085 -1.125 17919 62764 1 153 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.969 -0.119 17919 62765 1 153 . 1 1 52 52 ASP H H 52 8.160 8.160 8.828 -0.667 17919 62766 1 153 . 1 1 53 53 GLY N N 53 106.660 106.660 103.695 2.965 17919 62767 1 153 . 1 1 53 53 GLY C C 53 174.870 174.870 174.496 0.374 17919 62768 1 153 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.550 0.620 17919 62769 1 153 . 1 1 53 53 GLY H H 53 9.390 9.390 8.487 0.903 17919 62770 1 153 . 1 1 54 54 ARG N N 54 119.050 119.050 120.359 -1.309 17919 62771 1 153 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.703 -0.008 17919 62772 1 153 . 1 1 54 54 ARG C C 54 175.350 175.350 175.703 -0.353 17919 62773 1 153 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.479 -0.089 17919 62774 1 153 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.712 -0.061 17919 62775 1 153 . 1 1 54 54 ARG H H 54 7.460 7.460 7.356 0.104 17919 62776 1 153 . 1 1 55 55 THR N N 55 108.400 108.400 112.905 -4.505 17919 62777 1 153 . 1 1 55 55 THR HA H 55 5.240 5.240 4.939 0.301 17919 62778 1 153 . 1 1 55 55 THR C C 55 176.560 176.560 176.004 0.556 17919 62779 1 153 . 1 1 55 55 THR CA C 55 59.690 59.690 60.627 -0.937 17919 62780 1 153 . 1 1 55 55 THR CB C 55 72.260 72.260 70.749 1.511 17919 62781 1 153 . 1 1 55 55 THR H H 55 8.730 8.730 8.661 0.069 17919 62782 1 153 . 1 1 56 56 LEU N N 56 117.920 117.920 121.124 -3.204 17919 62783 1 153 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.127 -0.067 17919 62784 1 153 . 1 1 56 56 LEU C C 56 180.810 180.810 179.030 1.780 17919 62785 1 153 . 1 1 56 56 LEU CA C 56 58.710 58.710 57.909 0.801 17919 62786 1 153 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.454 -1.084 17919 62787 1 153 . 1 1 56 56 LEU H H 56 8.140 8.140 8.383 -0.243 17919 62788 1 153 . 1 1 57 57 SER N N 57 113.330 113.330 116.274 -2.944 17919 62789 1 153 . 1 1 57 57 SER HA H 57 4.370 4.370 4.207 0.163 17919 62790 1 153 . 1 1 57 57 SER C C 57 178.310 178.310 176.870 1.440 17919 62791 1 153 . 1 1 57 57 SER CA C 57 61.080 61.080 62.343 -1.264 17919 62792 1 153 . 1 1 57 57 SER CB C 57 62.530 62.530 62.746 -0.216 17919 62793 1 153 . 1 1 57 57 SER H H 57 8.470 8.470 8.021 0.449 17919 62794 1 153 . 1 1 58 58 ASP N N 58 124.190 124.190 121.586 2.604 17919 62795 1 153 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.378 -0.082 17919 62796 1 153 . 1 1 58 58 ASP C C 58 177.400 177.400 176.872 0.528 17919 62797 1 153 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.787 0.393 17919 62798 1 153 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.630 -0.530 17919 62799 1 153 . 1 1 58 58 ASP H H 58 7.930 7.930 8.023 -0.093 17919 62800 1 153 . 1 1 59 59 TYR N N 59 115.510 115.510 115.718 -0.208 17919 62801 1 153 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.675 -0.005 17919 62802 1 153 . 1 1 59 59 TYR C C 59 174.700 174.700 174.989 -0.289 17919 62803 1 153 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.288 0.962 17919 62804 1 153 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.607 1.463 17919 62805 1 153 . 1 1 59 59 TYR H H 59 7.250 7.250 7.231 0.019 17919 62806 1 153 . 1 1 60 60 ASN N N 60 115.900 115.900 117.791 -1.891 17919 62807 1 153 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.414 -0.059 17919 62808 1 153 . 1 1 60 60 ASN C C 60 174.340 174.340 174.721 -0.381 17919 62809 1 153 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.190 -0.070 17919 62810 1 153 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.084 0.326 17919 62811 1 153 . 1 1 60 60 ASN H H 60 8.150 8.150 7.899 0.251 17919 62812 1 153 . 1 1 61 61 ILE N N 61 118.600 118.600 120.347 -1.747 17919 62813 1 153 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.855 -0.462 17919 62814 1 153 . 1 1 61 61 ILE C C 61 174.610 174.610 175.248 -0.638 17919 62815 1 153 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.960 0.460 17919 62816 1 153 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.800 -1.060 17919 62817 1 153 . 1 1 61 61 ILE H H 61 7.250 7.250 8.087 -0.837 17919 62818 1 153 . 1 1 62 62 GLN N N 62 124.740 124.740 126.477 -1.737 17919 62819 1 153 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.760 -0.254 17919 62820 1 153 . 1 1 62 62 GLN C C 62 175.970 175.970 175.576 0.394 17919 62821 1 153 . 1 1 62 62 GLN CA C 62 53.660 53.660 52.877 0.783 17919 62822 1 153 . 1 1 62 62 GLN CB C 62 31.650 31.650 30.686 0.964 17919 62823 1 153 . 1 1 62 62 GLN H H 62 7.610 7.610 7.968 -0.358 17919 62824 1 153 . 1 1 63 63 LYS N N 63 120.300 120.300 121.056 -0.756 17919 62825 1 153 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.198 -0.197 17919 62826 1 153 . 1 1 63 63 LYS C C 63 175.810 175.810 177.045 -1.235 17919 62827 1 153 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.561 0.229 17919 62828 1 153 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.363 0.287 17919 62829 1 153 . 1 1 63 63 LYS H H 63 8.490 8.490 8.512 -0.022 17919 62830 1 153 . 1 1 64 64 GLU N N 64 113.950 113.950 118.301 -4.351 17919 62831 1 153 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.484 -0.019 17919 62832 1 153 . 1 1 64 64 GLU C C 64 175.250 175.250 175.754 -0.504 17919 62833 1 153 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.807 0.083 17919 62834 1 153 . 1 1 64 64 GLU CB C 64 25.900 25.900 29.015 -3.115 17919 62835 1 153 . 1 1 64 64 GLU H H 64 9.280 9.280 8.574 0.706 17919 62836 1 153 . 1 1 65 65 SER N N 65 114.730 114.730 116.069 -1.339 17919 62837 1 153 . 1 1 65 65 SER HA H 65 4.640 4.640 4.419 0.221 17919 62838 1 153 . 1 1 65 65 SER C C 65 172.160 172.160 173.939 -1.779 17919 62839 1 153 . 1 1 65 65 SER CA C 65 60.890 60.890 60.420 0.470 17919 62840 1 153 . 1 1 65 65 SER CB C 65 64.910 64.910 63.972 0.938 17919 62841 1 153 . 1 1 65 65 SER H H 65 7.670 7.670 7.332 0.338 17919 62842 1 153 . 1 1 66 66 THR N N 66 117.110 117.110 119.695 -2.585 17919 62843 1 153 . 1 1 66 66 THR HA H 66 5.270 5.270 4.955 0.315 17919 62844 1 153 . 1 1 66 66 THR C C 66 173.950 173.950 174.034 -0.084 17919 62845 1 153 . 1 1 66 66 THR CA C 66 62.340 62.340 61.945 0.395 17919 62846 1 153 . 1 1 66 66 THR CB C 66 70.080 70.080 70.545 -0.465 17919 62847 1 153 . 1 1 66 66 THR H H 66 8.730 8.730 8.490 0.240 17919 62848 1 153 . 1 1 67 67 LEU N N 67 127.110 127.110 126.674 0.436 17919 62849 1 153 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.794 0.266 17919 62850 1 153 . 1 1 67 67 LEU C C 67 175.770 175.770 175.710 0.060 17919 62851 1 153 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.816 0.084 17919 62852 1 153 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.050 0.210 17919 62853 1 153 . 1 1 67 67 LEU H H 67 9.410 9.410 9.150 0.260 17919 62854 1 153 . 1 1 68 68 HIS N N 68 118.380 118.380 120.099 -1.719 17919 62855 1 153 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.286 -0.046 17919 62856 1 153 . 1 1 68 68 HIS C C 68 173.150 173.150 173.814 -0.664 17919 62857 1 153 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.564 0.436 17919 62858 1 153 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.500 -1.970 17919 62859 1 153 . 1 1 68 68 HIS H H 68 9.230 9.230 8.970 0.260 17919 62860 1 153 . 1 1 69 69 LEU N N 69 124.460 124.460 130.608 -6.148 17919 62861 1 153 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.024 0.166 17919 62862 1 153 . 1 1 69 69 LEU C C 69 175.270 175.270 174.256 1.014 17919 62863 1 153 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.404 0.486 17919 62864 1 153 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.072 0.308 17919 62865 1 153 . 1 1 69 69 LEU H H 69 8.340 8.340 8.354 -0.014 17919 62866 1 153 . 1 1 70 70 VAL N N 70 126.940 126.940 124.394 2.546 17919 62867 1 153 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.543 -0.193 17919 62868 1 153 . 1 1 70 70 VAL C C 70 174.000 174.000 173.556 0.444 17919 62869 1 153 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.520 1.280 17919 62870 1 153 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.862 -0.952 17919 62871 1 153 . 1 1 70 70 VAL H H 70 9.200 9.200 8.970 0.230 17919 62872 1 153 . 1 1 71 71 LEU N N 71 123.130 123.130 123.011 0.119 17919 62873 1 153 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.123 -0.063 17919 62874 1 153 . 1 1 71 71 LEU C C 71 177.830 177.830 177.794 0.036 17919 62875 1 153 . 1 1 71 71 LEU CA C 71 53.940 53.940 52.670 1.270 17919 62876 1 153 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.666 0.184 17919 62877 1 153 . 1 1 71 71 LEU H H 71 8.120 8.120 8.323 -0.203 17919 62878 1 153 . 1 1 72 72 ARG N N 72 123.490 123.490 122.931 0.559 17919 62879 1 153 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.227 0.074 17919 62880 1 153 . 1 1 72 72 ARG C C 72 175.350 175.350 175.446 -0.096 17919 62881 1 153 . 1 1 72 72 ARG CA C 72 55.610 55.610 57.020 -1.410 17919 62882 1 153 . 1 1 72 72 ARG CB C 72 31.350 31.350 31.009 0.341 17919 62883 1 153 . 1 1 72 72 ARG H H 72 8.580 8.580 8.448 0.132 17919 62884 1 154 . 1 1 2 2 GLN N N 2 123.220 123.220 122.103 1.117 17919 62885 1 154 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.369 -0.120 17919 62886 1 154 . 1 1 2 2 GLN C C 2 175.920 175.920 175.066 0.854 17919 62887 1 154 . 1 1 2 2 GLN CA C 2 55.080 55.080 55.063 0.017 17919 62888 1 154 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.335 0.425 17919 62889 1 154 . 1 1 2 2 GLN H H 2 8.900 8.900 8.422 0.478 17919 62890 1 154 . 1 1 3 3 ILE N N 3 115.340 115.340 119.118 -3.778 17919 62891 1 154 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.389 -0.176 17919 62892 1 154 . 1 1 3 3 ILE C C 3 172.450 172.450 173.323 -0.873 17919 62893 1 154 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.261 0.309 17919 62894 1 154 . 1 1 3 3 ILE CB C 3 42.210 42.210 42.044 0.167 17919 62895 1 154 . 1 1 3 3 ILE H H 3 8.320 8.320 8.250 0.070 17919 62896 1 154 . 1 1 4 4 PHE N N 4 118.110 118.110 120.549 -2.439 17919 62897 1 154 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.300 0.330 17919 62898 1 154 . 1 1 4 4 PHE C C 4 175.320 175.320 175.048 0.272 17919 62899 1 154 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.584 -0.374 17919 62900 1 154 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.456 0.024 17919 62901 1 154 . 1 1 4 4 PHE H H 4 8.610 8.610 8.441 0.169 17919 62902 1 154 . 1 1 5 5 VAL N N 5 121.000 121.000 123.571 -2.571 17919 62903 1 154 . 1 1 5 5 VAL HA H 5 4.725 4.725 5.138 -0.413 17919 62904 1 154 . 1 1 5 5 VAL C C 5 174.870 174.870 175.040 -0.170 17919 62905 1 154 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.311 -0.691 17919 62906 1 154 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.351 0.879 17919 62907 1 154 . 1 1 5 5 VAL H H 5 9.300 9.300 8.830 0.470 17919 62908 1 154 . 1 1 6 6 LYS N N 6 127.520 127.520 126.887 0.633 17919 62909 1 154 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.529 -0.162 17919 62910 1 154 . 1 1 6 6 LYS C C 6 177.140 177.140 176.763 0.377 17919 62911 1 154 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.116 0.404 17919 62912 1 154 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.996 -0.946 17919 62913 1 154 . 1 1 6 6 LYS H H 6 8.820 8.820 9.407 -0.587 17919 62914 1 154 . 1 1 7 7 THR N N 7 115.400 115.400 116.359 -0.959 17919 62915 1 154 . 1 1 7 7 THR HA H 7 4.970 4.970 4.893 0.077 17919 62916 1 154 . 1 1 7 7 THR C C 7 176.910 176.910 177.319 -0.409 17919 62917 1 154 . 1 1 7 7 THR CA C 7 60.470 60.470 60.814 -0.344 17919 62918 1 154 . 1 1 7 7 THR CB C 7 70.630 70.630 70.359 0.271 17919 62919 1 154 . 1 1 7 7 THR H H 7 8.730 8.730 8.758 -0.028 17919 62920 1 154 . 1 1 8 8 LEU N N 8 121.330 121.330 120.550 0.780 17919 62921 1 154 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.411 -0.101 17919 62922 1 154 . 1 1 8 8 LEU C C 8 178.800 178.800 176.988 1.812 17919 62923 1 154 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.634 -0.054 17919 62924 1 154 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.087 0.883 17919 62925 1 154 . 1 1 8 8 LEU H H 8 9.100 9.100 8.496 0.604 17919 62926 1 154 . 1 1 9 9 THR N N 9 105.590 105.590 105.410 0.180 17919 62927 1 154 . 1 1 9 9 THR HA H 9 4.428 4.428 4.472 -0.044 17919 62928 1 154 . 1 1 9 9 THR C C 9 175.520 175.520 175.455 0.065 17919 62929 1 154 . 1 1 9 9 THR CA C 9 61.400 61.400 61.165 0.235 17919 62930 1 154 . 1 1 9 9 THR CB C 9 69.140 69.140 69.148 -0.008 17919 62931 1 154 . 1 1 9 9 THR H H 9 7.630 7.630 7.651 -0.021 17919 62932 1 154 . 1 1 10 10 GLY N N 10 108.890 108.890 110.663 -1.773 17919 62933 1 154 . 1 1 10 10 GLY C C 10 174.070 174.070 173.696 0.374 17919 62934 1 154 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.870 0.590 17919 62935 1 154 . 1 1 10 10 GLY H H 10 7.810 7.810 8.044 -0.234 17919 62936 1 154 . 1 1 11 11 LYS N N 11 121.600 121.600 122.186 -0.586 17919 62937 1 154 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.527 -0.166 17919 62938 1 154 . 1 1 11 11 LYS C C 11 175.940 175.940 175.852 0.088 17919 62939 1 154 . 1 1 11 11 LYS CA C 11 56.280 56.280 55.720 0.560 17919 62940 1 154 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.695 -0.495 17919 62941 1 154 . 1 1 11 11 LYS H H 11 7.280 7.280 7.971 -0.691 17919 62942 1 154 . 1 1 12 12 THR N N 12 120.440 120.440 121.520 -1.080 17919 62943 1 154 . 1 1 12 12 THR HA H 12 5.046 5.046 5.055 -0.009 17919 62944 1 154 . 1 1 12 12 THR C C 12 174.320 174.320 174.812 -0.492 17919 62945 1 154 . 1 1 12 12 THR CA C 12 62.390 62.390 62.292 0.098 17919 62946 1 154 . 1 1 12 12 THR CB C 12 69.910 69.910 69.451 0.459 17919 62947 1 154 . 1 1 12 12 THR H H 12 8.650 8.650 8.384 0.266 17919 62948 1 154 . 1 1 13 13 ILE N N 13 127.110 127.110 128.056 -0.946 17919 62949 1 154 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.440 0.104 17919 62950 1 154 . 1 1 13 13 ILE C C 13 175.220 175.220 174.798 0.422 17919 62951 1 154 . 1 1 13 13 ILE CA C 13 59.980 59.980 61.065 -1.085 17919 62952 1 154 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.034 0.916 17919 62953 1 154 . 1 1 13 13 ILE H H 13 9.450 9.450 8.855 0.595 17919 62954 1 154 . 1 1 14 14 THR N N 14 121.520 121.520 123.068 -1.548 17919 62955 1 154 . 1 1 14 14 THR HA H 14 4.964 4.964 4.786 0.178 17919 62956 1 154 . 1 1 14 14 THR C C 14 173.790 173.790 173.683 0.107 17919 62957 1 154 . 1 1 14 14 THR CA C 14 61.940 61.940 62.333 -0.393 17919 62958 1 154 . 1 1 14 14 THR CB C 14 69.650 69.650 69.586 0.064 17919 62959 1 154 . 1 1 14 14 THR H H 14 8.710 8.710 8.493 0.217 17919 62960 1 154 . 1 1 15 15 LEU N N 15 124.800 124.800 125.475 -0.675 17919 62961 1 154 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.797 -0.017 17919 62962 1 154 . 1 1 15 15 LEU C C 15 174.670 174.670 175.296 -0.626 17919 62963 1 154 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.595 -0.765 17919 62964 1 154 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.462 1.609 17919 62965 1 154 . 1 1 15 15 LEU H H 15 8.710 8.710 8.507 0.203 17919 62966 1 154 . 1 1 16 16 GLU N N 16 122.160 122.160 121.121 1.039 17919 62967 1 154 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.452 -0.535 17919 62968 1 154 . 1 1 16 16 GLU C C 16 175.860 175.860 175.823 0.037 17919 62969 1 154 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.232 -0.412 17919 62970 1 154 . 1 1 16 16 GLU CB C 16 29.450 29.450 31.999 -2.549 17919 62971 1 154 . 1 1 16 16 GLU H H 16 8.140 8.140 8.596 -0.456 17919 62972 1 154 . 1 1 17 17 VAL N N 17 117.210 117.210 118.313 -1.103 17919 62973 1 154 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.843 -0.129 17919 62974 1 154 . 1 1 17 17 VAL C C 17 174.160 174.160 174.534 -0.374 17919 62975 1 154 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.937 -0.506 17919 62976 1 154 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.762 0.638 17919 62977 1 154 . 1 1 17 17 VAL H H 17 8.900 8.900 8.706 0.194 17919 62978 1 154 . 1 1 18 18 GLU N N 18 118.990 118.990 121.279 -2.289 17919 62979 1 154 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.879 0.200 17919 62980 1 154 . 1 1 18 18 GLU C C 18 176.160 176.160 175.537 0.623 17919 62981 1 154 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.182 0.538 17919 62982 1 154 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.634 -0.324 17919 62983 1 154 . 1 1 18 18 GLU H H 18 8.640 8.640 8.521 0.119 17919 62984 1 154 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.299 -0.158 17919 62985 1 154 . 1 1 19 19 PRO C C 19 175.310 175.310 177.474 -2.164 17919 62986 1 154 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.052 0.418 17919 62987 1 154 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.865 0.085 17919 62988 1 154 . 1 1 20 20 SER N N 20 103.400 103.400 110.457 -7.057 17919 62989 1 154 . 1 1 20 20 SER HA H 20 4.370 4.370 4.360 0.010 17919 62990 1 154 . 1 1 20 20 SER C C 20 174.660 174.660 174.484 0.176 17919 62991 1 154 . 1 1 20 20 SER CA C 20 57.400 57.400 59.602 -2.202 17919 62992 1 154 . 1 1 20 20 SER CB C 20 63.370 63.370 62.941 0.429 17919 62993 1 154 . 1 1 20 20 SER H H 20 7.040 7.040 8.126 -1.086 17919 62994 1 154 . 1 1 21 21 ASP N N 21 123.480 123.480 122.999 0.481 17919 62995 1 154 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.513 0.182 17919 62996 1 154 . 1 1 21 21 ASP C C 21 176.360 176.360 175.889 0.471 17919 62997 1 154 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.751 -0.051 17919 62998 1 154 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.255 -0.456 17919 62999 1 154 . 1 1 21 21 ASP H H 21 8.030 8.030 7.432 0.598 17919 63000 1 154 . 1 1 22 22 THR N N 22 108.800 108.800 113.185 -4.385 17919 63001 1 154 . 1 1 22 22 THR HA H 22 4.920 4.920 4.995 -0.075 17919 63002 1 154 . 1 1 22 22 THR C C 22 176.750 176.750 176.425 0.325 17919 63003 1 154 . 1 1 22 22 THR CA C 22 59.690 59.690 60.250 -0.560 17919 63004 1 154 . 1 1 22 22 THR CB C 22 71.200 71.200 70.798 0.402 17919 63005 1 154 . 1 1 22 22 THR H H 22 7.900 7.900 8.877 -0.977 17919 63006 1 154 . 1 1 23 23 ILE N N 23 121.190 121.190 121.723 -0.533 17919 63007 1 154 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.820 -0.163 17919 63008 1 154 . 1 1 23 23 ILE C C 23 179.040 179.040 177.712 1.328 17919 63009 1 154 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.824 -0.564 17919 63010 1 154 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.318 -1.968 17919 63011 1 154 . 1 1 23 23 ILE H H 23 8.560 8.560 8.552 0.008 17919 63012 1 154 . 1 1 24 24 GLU N N 24 120.830 120.830 121.832 -1.002 17919 63013 1 154 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.876 0.041 17919 63014 1 154 . 1 1 24 24 GLU C C 24 178.640 178.640 178.614 0.026 17919 63015 1 154 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.393 -0.173 17919 63016 1 154 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.450 -1.170 17919 63017 1 154 . 1 1 24 24 GLU H H 24 9.760 9.760 8.500 1.260 17919 63018 1 154 . 1 1 25 25 ASN N N 25 120.570 120.570 118.321 2.249 17919 63019 1 154 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.436 0.089 17919 63020 1 154 . 1 1 25 25 ASN C C 25 178.380 178.380 178.082 0.298 17919 63021 1 154 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.292 -0.232 17919 63022 1 154 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.443 0.007 17919 63023 1 154 . 1 1 25 25 ASN H H 25 7.920 7.920 7.982 -0.062 17919 63024 1 154 . 1 1 26 26 VAL N N 26 121.710 121.710 120.898 0.812 17919 63025 1 154 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.617 -0.220 17919 63026 1 154 . 1 1 26 26 VAL C C 26 177.950 177.950 177.606 0.344 17919 63027 1 154 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.561 1.099 17919 63028 1 154 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.091 -0.251 17919 63029 1 154 . 1 1 26 26 VAL H H 26 8.070 8.070 8.429 -0.359 17919 63030 1 154 . 1 1 27 27 LYS N N 27 118.860 118.860 120.166 -1.306 17919 63031 1 154 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.178 0.402 17919 63032 1 154 . 1 1 27 27 LYS C C 27 180.550 180.550 179.194 1.356 17919 63033 1 154 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.812 -0.562 17919 63034 1 154 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.212 1.518 17919 63035 1 154 . 1 1 27 27 LYS H H 27 8.560 8.560 8.497 0.063 17919 63036 1 154 . 1 1 28 28 ALA N N 28 123.440 123.440 121.818 1.622 17919 63037 1 154 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.195 -0.035 17919 63038 1 154 . 1 1 28 28 ALA C C 28 180.300 180.300 178.861 1.439 17919 63039 1 154 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.631 0.739 17919 63040 1 154 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.588 -0.878 17919 63041 1 154 . 1 1 28 28 ALA H H 28 8.060 8.060 8.335 -0.275 17919 63042 1 154 . 1 1 29 29 LYS N N 29 119.940 119.940 119.877 0.063 17919 63043 1 154 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.042 0.165 17919 63044 1 154 . 1 1 29 29 LYS C C 29 180.320 180.320 179.177 1.143 17919 63045 1 154 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.317 0.333 17919 63046 1 154 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.437 0.853 17919 63047 1 154 . 1 1 29 29 LYS H H 29 7.850 7.850 7.973 -0.123 17919 63048 1 154 . 1 1 30 30 ILE N N 30 121.080 121.080 119.935 1.145 17919 63049 1 154 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.627 -0.120 17919 63050 1 154 . 1 1 30 30 ILE C C 30 178.310 178.310 177.403 0.907 17919 63051 1 154 . 1 1 30 30 ILE CA C 30 66.150 66.150 64.707 1.443 17919 63052 1 154 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.725 -0.925 17919 63053 1 154 . 1 1 30 30 ILE H H 30 8.280 8.280 8.198 0.082 17919 63054 1 154 . 1 1 31 31 GLN N N 31 123.490 123.490 120.206 3.284 17919 63055 1 154 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.850 -0.021 17919 63056 1 154 . 1 1 31 31 GLN C C 31 178.890 178.890 178.315 0.575 17919 63057 1 154 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.541 0.459 17919 63058 1 154 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.332 -0.613 17919 63059 1 154 . 1 1 31 31 GLN H H 31 8.580 8.580 7.759 0.821 17919 63060 1 154 . 1 1 32 32 ASP N N 32 119.360 119.360 119.759 -0.399 17919 63061 1 154 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.386 -0.032 17919 63062 1 154 . 1 1 32 32 ASP C C 32 177.250 177.250 177.949 -0.699 17919 63063 1 154 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.927 0.263 17919 63064 1 154 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.739 -0.159 17919 63065 1 154 . 1 1 32 32 ASP H H 32 8.010 8.010 7.925 0.085 17919 63066 1 154 . 1 1 33 33 LYS N N 33 115.130 115.130 117.655 -2.525 17919 63067 1 154 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.227 0.110 17919 63068 1 154 . 1 1 33 33 LYS C C 33 177.870 177.870 177.814 0.056 17919 63069 1 154 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.291 -0.241 17919 63070 1 154 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.145 1.025 17919 63071 1 154 . 1 1 33 33 LYS H H 33 7.430 7.430 7.733 -0.303 17919 63072 1 154 . 1 1 34 34 GLU N N 34 113.870 113.870 114.901 -1.031 17919 63073 1 154 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.505 0.120 17919 63074 1 154 . 1 1 34 34 GLU C C 34 177.840 177.840 177.262 0.578 17919 63075 1 154 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.824 -0.654 17919 63076 1 154 . 1 1 34 34 GLU CB C 34 32.660 32.660 30.922 1.738 17919 63077 1 154 . 1 1 34 34 GLU H H 34 8.740 8.740 8.085 0.655 17919 63078 1 154 . 1 1 35 35 GLY N N 35 108.650 108.650 108.859 -0.209 17919 63079 1 154 . 1 1 35 35 GLY C C 35 173.960 173.960 174.323 -0.363 17919 63080 1 154 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.737 0.343 17919 63081 1 154 . 1 1 35 35 GLY H H 35 8.530 8.530 8.293 0.237 17919 63082 1 154 . 1 1 36 36 ILE N N 36 119.880 119.880 121.992 -2.112 17919 63083 1 154 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.316 0.129 17919 63084 1 154 . 1 1 36 36 ILE C C 36 173.590 173.590 174.059 -0.469 17919 63085 1 154 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.882 -0.132 17919 63086 1 154 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.822 1.758 17919 63087 1 154 . 1 1 36 36 ILE H H 36 6.150 6.150 7.678 -1.528 17919 63088 1 154 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.453 0.181 17919 63089 1 154 . 1 1 37 37 PRO C C 37 176.940 176.940 176.076 0.864 17919 63090 1 154 . 1 1 37 37 PRO CA C 37 61.660 61.660 62.154 -0.494 17919 63091 1 154 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.489 0.361 17919 63092 1 154 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.197 -0.080 17919 63093 1 154 . 1 1 38 38 PRO C C 38 178.320 178.320 177.826 0.494 17919 63094 1 154 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.515 0.745 17919 63095 1 154 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.906 0.984 17919 63096 1 154 . 1 1 39 39 ASP N N 39 113.380 113.380 113.709 -0.329 17919 63097 1 154 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.564 -0.134 17919 63098 1 154 . 1 1 39 39 ASP C C 39 177.090 177.090 176.940 0.150 17919 63099 1 154 . 1 1 39 39 ASP CA C 39 55.640 55.640 54.763 0.877 17919 63100 1 154 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.660 -1.121 17919 63101 1 154 . 1 1 39 39 ASP H H 39 8.550 8.550 8.377 0.173 17919 63102 1 154 . 1 1 40 40 GLN N N 40 116.780 116.780 117.745 -0.965 17919 63103 1 154 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.429 0.035 17919 63104 1 154 . 1 1 40 40 GLN C C 40 175.380 175.380 175.348 0.032 17919 63105 1 154 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.904 -0.264 17919 63106 1 154 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.688 0.452 17919 63107 1 154 . 1 1 40 40 GLN H H 40 7.820 7.820 7.656 0.164 17919 63108 1 154 . 1 1 41 41 GLN N N 41 117.720 117.720 118.879 -1.159 17919 63109 1 154 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.420 -0.176 17919 63110 1 154 . 1 1 41 41 GLN C C 41 176.300 176.300 175.058 1.242 17919 63111 1 154 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.443 1.027 17919 63112 1 154 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.949 1.701 17919 63113 1 154 . 1 1 41 41 GLN H H 41 7.480 7.480 7.203 0.277 17919 63114 1 154 . 1 1 42 42 ARG N N 42 122.680 122.680 126.101 -3.421 17919 63115 1 154 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.596 -0.096 17919 63116 1 154 . 1 1 42 42 ARG C C 42 174.050 174.050 174.155 -0.105 17919 63117 1 154 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.820 0.230 17919 63118 1 154 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.535 -0.785 17919 63119 1 154 . 1 1 42 42 ARG H H 42 8.530 8.530 8.689 -0.159 17919 63120 1 154 . 1 1 43 43 LEU N N 43 124.040 124.040 127.505 -3.465 17919 63121 1 154 . 1 1 43 43 LEU C C 43 175.290 175.290 175.802 -0.512 17919 63122 1 154 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.759 -0.779 17919 63123 1 154 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.893 1.897 17919 63124 1 154 . 1 1 43 43 LEU H H 43 8.820 8.820 8.812 0.008 17919 63125 1 154 . 1 1 44 44 ILE N N 44 121.920 121.920 121.956 -0.036 17919 63126 1 154 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.887 0.105 17919 63127 1 154 . 1 1 44 44 ILE C C 44 176.060 176.060 174.163 1.897 17919 63128 1 154 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.499 -1.519 17919 63129 1 154 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.303 0.117 17919 63130 1 154 . 1 1 44 44 ILE H H 44 9.030 9.030 8.603 0.427 17919 63131 1 154 . 1 1 45 45 PHE N N 45 125.390 125.390 127.438 -2.048 17919 63132 1 154 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.007 0.038 17919 63133 1 154 . 1 1 45 45 PHE C C 45 174.470 174.470 174.463 0.007 17919 63134 1 154 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.884 0.136 17919 63135 1 154 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.366 0.394 17919 63136 1 154 . 1 1 45 45 PHE H H 45 8.830 8.830 8.602 0.228 17919 63137 1 154 . 1 1 46 46 ALA N N 46 132.200 132.200 128.186 4.014 17919 63138 1 154 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.633 0.057 17919 63139 1 154 . 1 1 46 46 ALA C C 46 177.290 177.290 177.555 -0.265 17919 63140 1 154 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.220 0.320 17919 63141 1 154 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.692 -0.122 17919 63142 1 154 . 1 1 46 46 ALA H H 46 8.810 8.810 8.344 0.466 17919 63143 1 154 . 1 1 47 47 GLY N N 47 102.340 102.340 105.062 -2.722 17919 63144 1 154 . 1 1 47 47 GLY C C 47 173.810 173.810 174.420 -0.610 17919 63145 1 154 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.768 0.582 17919 63146 1 154 . 1 1 47 47 GLY H H 47 8.130 8.130 8.405 -0.275 17919 63147 1 154 . 1 1 48 48 LYS N N 48 121.570 121.570 122.190 -0.620 17919 63148 1 154 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.679 -0.057 17919 63149 1 154 . 1 1 48 48 LYS C C 48 174.700 174.700 175.281 -0.581 17919 63150 1 154 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.848 -0.298 17919 63151 1 154 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.316 0.214 17919 63152 1 154 . 1 1 48 48 LYS H H 48 7.980 7.980 7.778 0.202 17919 63153 1 154 . 1 1 49 49 GLN N N 49 122.410 122.410 120.775 1.635 17919 63154 1 154 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.632 -0.072 17919 63155 1 154 . 1 1 49 49 GLN C C 49 175.670 175.670 175.758 -0.088 17919 63156 1 154 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.775 -0.035 17919 63157 1 154 . 1 1 49 49 GLN CB C 49 29.000 29.000 28.825 0.175 17919 63158 1 154 . 1 1 49 49 GLN H H 49 8.600 8.600 8.385 0.215 17919 63159 1 154 . 1 1 50 50 LEU N N 50 125.520 125.520 126.665 -1.145 17919 63160 1 154 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.110 -0.020 17919 63161 1 154 . 1 1 50 50 LEU C C 50 176.660 176.660 176.708 -0.048 17919 63162 1 154 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.718 -0.478 17919 63163 1 154 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.113 -0.543 17919 63164 1 154 . 1 1 50 50 LEU H H 50 8.530 8.530 8.293 0.237 17919 63165 1 154 . 1 1 51 51 GLU N N 51 122.940 122.940 122.669 0.271 17919 63166 1 154 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.521 -0.033 17919 63167 1 154 . 1 1 51 51 GLU C C 51 175.870 175.870 177.050 -1.180 17919 63168 1 154 . 1 1 51 51 GLU CA C 51 55.960 55.960 54.645 1.315 17919 63169 1 154 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.228 -0.658 17919 63170 1 154 . 1 1 51 51 GLU H H 51 8.400 8.400 8.470 -0.070 17919 63171 1 154 . 1 1 52 52 ASP N N 52 120.030 120.030 126.234 -6.204 17919 63172 1 154 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.440 -0.081 17919 63173 1 154 . 1 1 52 52 ASP C C 52 177.330 177.330 177.715 -0.385 17919 63174 1 154 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.619 -0.659 17919 63175 1 154 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.852 -0.003 17919 63176 1 154 . 1 1 52 52 ASP H H 52 8.160 8.160 8.889 -0.729 17919 63177 1 154 . 1 1 53 53 GLY N N 53 106.660 106.660 105.943 0.717 17919 63178 1 154 . 1 1 53 53 GLY C C 53 174.870 174.870 173.656 1.214 17919 63179 1 154 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.689 0.481 17919 63180 1 154 . 1 1 53 53 GLY H H 53 9.390 9.390 8.585 0.805 17919 63181 1 154 . 1 1 54 54 ARG N N 54 119.050 119.050 120.585 -1.535 17919 63182 1 154 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.677 0.018 17919 63183 1 154 . 1 1 54 54 ARG C C 54 175.350 175.350 175.818 -0.468 17919 63184 1 154 . 1 1 54 54 ARG CA C 54 54.390 54.390 53.692 0.698 17919 63185 1 154 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.967 -0.317 17919 63186 1 154 . 1 1 54 54 ARG H H 54 7.460 7.460 7.428 0.032 17919 63187 1 154 . 1 1 55 55 THR N N 55 108.400 108.400 112.839 -4.439 17919 63188 1 154 . 1 1 55 55 THR HA H 55 5.240 5.240 4.865 0.375 17919 63189 1 154 . 1 1 55 55 THR C C 55 176.560 176.560 176.152 0.408 17919 63190 1 154 . 1 1 55 55 THR CA C 55 59.690 59.690 60.756 -1.066 17919 63191 1 154 . 1 1 55 55 THR CB C 55 72.260 72.260 70.709 1.551 17919 63192 1 154 . 1 1 55 55 THR H H 55 8.730 8.730 8.876 -0.146 17919 63193 1 154 . 1 1 56 56 LEU N N 56 117.920 117.920 121.294 -3.374 17919 63194 1 154 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.968 0.092 17919 63195 1 154 . 1 1 56 56 LEU C C 56 180.810 180.810 178.853 1.957 17919 63196 1 154 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.139 0.571 17919 63197 1 154 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.354 -0.984 17919 63198 1 154 . 1 1 56 56 LEU H H 56 8.140 8.140 8.794 -0.654 17919 63199 1 154 . 1 1 57 57 SER N N 57 113.330 113.330 114.693 -1.363 17919 63200 1 154 . 1 1 57 57 SER HA H 57 4.370 4.370 4.302 0.068 17919 63201 1 154 . 1 1 57 57 SER C C 57 178.310 178.310 176.863 1.447 17919 63202 1 154 . 1 1 57 57 SER CA C 57 61.080 61.080 61.358 -0.278 17919 63203 1 154 . 1 1 57 57 SER CB C 57 62.530 62.530 62.517 0.013 17919 63204 1 154 . 1 1 57 57 SER H H 57 8.470 8.470 8.019 0.451 17919 63205 1 154 . 1 1 58 58 ASP N N 58 124.190 124.190 123.106 1.084 17919 63206 1 154 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.295 0.001 17919 63207 1 154 . 1 1 58 58 ASP C C 58 177.400 177.400 177.589 -0.189 17919 63208 1 154 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.919 0.261 17919 63209 1 154 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.385 -0.285 17919 63210 1 154 . 1 1 58 58 ASP H H 58 7.930 7.930 7.664 0.266 17919 63211 1 154 . 1 1 59 59 TYR N N 59 115.510 115.510 115.153 0.357 17919 63212 1 154 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.657 0.013 17919 63213 1 154 . 1 1 59 59 TYR C C 59 174.700 174.700 175.111 -0.411 17919 63214 1 154 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.250 1.000 17919 63215 1 154 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.346 1.724 17919 63216 1 154 . 1 1 59 59 TYR H H 59 7.250 7.250 7.442 -0.192 17919 63217 1 154 . 1 1 60 60 ASN N N 60 115.900 115.900 117.575 -1.675 17919 63218 1 154 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.336 0.019 17919 63219 1 154 . 1 1 60 60 ASN C C 60 174.340 174.340 174.504 -0.164 17919 63220 1 154 . 1 1 60 60 ASN CA C 60 54.120 54.120 53.990 0.130 17919 63221 1 154 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.550 -0.140 17919 63222 1 154 . 1 1 60 60 ASN H H 60 8.150 8.150 7.682 0.468 17919 63223 1 154 . 1 1 61 61 ILE N N 61 118.600 118.600 120.222 -1.622 17919 63224 1 154 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.701 -0.308 17919 63225 1 154 . 1 1 61 61 ILE C C 61 174.610 174.610 175.243 -0.633 17919 63226 1 154 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.216 0.204 17919 63227 1 154 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.608 -0.868 17919 63228 1 154 . 1 1 61 61 ILE H H 61 7.250 7.250 7.998 -0.748 17919 63229 1 154 . 1 1 62 62 GLN N N 62 124.740 124.740 126.158 -1.418 17919 63230 1 154 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.679 -0.173 17919 63231 1 154 . 1 1 62 62 GLN C C 62 175.970 175.970 175.189 0.781 17919 63232 1 154 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.597 0.063 17919 63233 1 154 . 1 1 62 62 GLN CB C 62 31.650 31.650 32.241 -0.591 17919 63234 1 154 . 1 1 62 62 GLN H H 62 7.610 7.610 8.097 -0.487 17919 63235 1 154 . 1 1 63 63 LYS N N 63 120.300 120.300 119.232 1.068 17919 63236 1 154 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.134 -0.133 17919 63237 1 154 . 1 1 63 63 LYS C C 63 175.810 175.810 177.573 -1.763 17919 63238 1 154 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.984 -0.194 17919 63239 1 154 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.255 0.396 17919 63240 1 154 . 1 1 63 63 LYS H H 63 8.490 8.490 8.508 -0.018 17919 63241 1 154 . 1 1 64 64 GLU N N 64 113.950 113.950 118.563 -4.613 17919 63242 1 154 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.835 -0.370 17919 63243 1 154 . 1 1 64 64 GLU C C 64 175.250 175.250 175.968 -0.718 17919 63244 1 154 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.800 0.090 17919 63245 1 154 . 1 1 64 64 GLU CB C 64 25.900 25.900 29.254 -3.354 17919 63246 1 154 . 1 1 64 64 GLU H H 64 9.280 9.280 8.985 0.295 17919 63247 1 154 . 1 1 65 65 SER N N 65 114.730 114.730 116.306 -1.576 17919 63248 1 154 . 1 1 65 65 SER HA H 65 4.640 4.640 4.540 0.100 17919 63249 1 154 . 1 1 65 65 SER C C 65 172.160 172.160 173.715 -1.555 17919 63250 1 154 . 1 1 65 65 SER CA C 65 60.890 60.890 60.251 0.639 17919 63251 1 154 . 1 1 65 65 SER CB C 65 64.910 64.910 64.227 0.683 17919 63252 1 154 . 1 1 65 65 SER H H 65 7.670 7.670 7.596 0.074 17919 63253 1 154 . 1 1 66 66 THR N N 66 117.110 117.110 120.479 -3.369 17919 63254 1 154 . 1 1 66 66 THR HA H 66 5.270 5.270 5.438 -0.168 17919 63255 1 154 . 1 1 66 66 THR C C 66 173.950 173.950 174.336 -0.386 17919 63256 1 154 . 1 1 66 66 THR CA C 66 62.340 62.340 61.880 0.460 17919 63257 1 154 . 1 1 66 66 THR CB C 66 70.080 70.080 70.778 -0.699 17919 63258 1 154 . 1 1 66 66 THR H H 66 8.730 8.730 8.441 0.289 17919 63259 1 154 . 1 1 67 67 LEU N N 67 127.110 127.110 126.967 0.143 17919 63260 1 154 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.879 0.181 17919 63261 1 154 . 1 1 67 67 LEU C C 67 175.770 175.770 175.391 0.379 17919 63262 1 154 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.798 0.102 17919 63263 1 154 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.114 0.146 17919 63264 1 154 . 1 1 67 67 LEU H H 67 9.410 9.410 9.317 0.093 17919 63265 1 154 . 1 1 68 68 HIS N N 68 118.380 118.380 121.142 -2.762 17919 63266 1 154 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.489 -0.249 17919 63267 1 154 . 1 1 68 68 HIS C C 68 173.150 173.150 173.915 -0.765 17919 63268 1 154 . 1 1 68 68 HIS CA C 68 55.000 55.000 53.743 1.257 17919 63269 1 154 . 1 1 68 68 HIS CB C 68 30.530 30.530 31.856 -1.326 17919 63270 1 154 . 1 1 68 68 HIS H H 68 9.230 9.230 8.632 0.598 17919 63271 1 154 . 1 1 69 69 LEU N N 69 124.460 124.460 129.557 -5.097 17919 63272 1 154 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.968 0.222 17919 63273 1 154 . 1 1 69 69 LEU C C 69 175.270 175.270 174.096 1.174 17919 63274 1 154 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.815 0.075 17919 63275 1 154 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.614 -0.234 17919 63276 1 154 . 1 1 69 69 LEU H H 69 8.340 8.340 8.377 -0.037 17919 63277 1 154 . 1 1 70 70 VAL N N 70 126.940 126.940 127.052 -0.112 17919 63278 1 154 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.371 -0.021 17919 63279 1 154 . 1 1 70 70 VAL C C 70 174.000 174.000 174.293 -0.293 17919 63280 1 154 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.966 0.834 17919 63281 1 154 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.034 -0.124 17919 63282 1 154 . 1 1 70 70 VAL H H 70 9.200 9.200 9.002 0.198 17919 63283 1 154 . 1 1 71 71 LEU N N 71 123.130 123.130 124.579 -1.449 17919 63284 1 154 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.892 0.168 17919 63285 1 154 . 1 1 71 71 LEU C C 71 177.830 177.830 177.530 0.300 17919 63286 1 154 . 1 1 71 71 LEU CA C 71 53.940 53.940 52.925 1.015 17919 63287 1 154 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.717 0.133 17919 63288 1 154 . 1 1 71 71 LEU H H 71 8.120 8.120 8.365 -0.245 17919 63289 1 154 . 1 1 72 72 ARG N N 72 123.490 123.490 123.322 0.168 17919 63290 1 154 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.186 0.115 17919 63291 1 154 . 1 1 72 72 ARG C C 72 175.350 175.350 175.834 -0.484 17919 63292 1 154 . 1 1 72 72 ARG CA C 72 55.610 55.610 57.044 -1.434 17919 63293 1 154 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.235 1.115 17919 63294 1 154 . 1 1 72 72 ARG H H 72 8.580 8.580 8.140 0.440 17919 63295 1 155 . 1 1 2 2 GLN N N 2 123.220 123.220 121.036 2.184 17919 63296 1 155 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.274 -0.025 17919 63297 1 155 . 1 1 2 2 GLN C C 2 175.920 175.920 175.472 0.448 17919 63298 1 155 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.791 0.289 17919 63299 1 155 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.119 0.641 17919 63300 1 155 . 1 1 2 2 GLN H H 2 8.900 8.900 8.412 0.488 17919 63301 1 155 . 1 1 3 3 ILE N N 3 115.340 115.340 116.788 -1.448 17919 63302 1 155 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.598 -0.385 17919 63303 1 155 . 1 1 3 3 ILE C C 3 172.450 172.450 173.430 -0.980 17919 63304 1 155 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.016 0.554 17919 63305 1 155 . 1 1 3 3 ILE CB C 3 42.210 42.210 42.117 0.093 17919 63306 1 155 . 1 1 3 3 ILE H H 3 8.320 8.320 8.456 -0.136 17919 63307 1 155 . 1 1 4 4 PHE N N 4 118.110 118.110 118.371 -0.261 17919 63308 1 155 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.531 0.099 17919 63309 1 155 . 1 1 4 4 PHE C C 4 175.320 175.320 175.273 0.047 17919 63310 1 155 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.766 -0.556 17919 63311 1 155 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.985 -0.505 17919 63312 1 155 . 1 1 4 4 PHE H H 4 8.610 8.610 8.441 0.169 17919 63313 1 155 . 1 1 5 5 VAL N N 5 121.000 121.000 121.878 -0.878 17919 63314 1 155 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.740 -0.015 17919 63315 1 155 . 1 1 5 5 VAL C C 5 174.870 174.870 174.296 0.574 17919 63316 1 155 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.199 -0.579 17919 63317 1 155 . 1 1 5 5 VAL CB C 5 34.230 34.230 35.253 -1.023 17919 63318 1 155 . 1 1 5 5 VAL H H 5 9.300 9.300 9.443 -0.143 17919 63319 1 155 . 1 1 6 6 LYS N N 6 127.520 127.520 129.256 -1.736 17919 63320 1 155 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.107 0.260 17919 63321 1 155 . 1 1 6 6 LYS C C 6 177.140 177.140 175.856 1.284 17919 63322 1 155 . 1 1 6 6 LYS CA C 6 54.520 54.520 53.815 0.705 17919 63323 1 155 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.117 0.933 17919 63324 1 155 . 1 1 6 6 LYS H H 6 8.820 8.820 9.431 -0.611 17919 63325 1 155 . 1 1 7 7 THR N N 7 115.400 115.400 119.811 -4.411 17919 63326 1 155 . 1 1 7 7 THR HA H 7 4.970 4.970 4.762 0.208 17919 63327 1 155 . 1 1 7 7 THR C C 7 176.910 176.910 175.936 0.974 17919 63328 1 155 . 1 1 7 7 THR CA C 7 60.470 60.470 60.757 -0.287 17919 63329 1 155 . 1 1 7 7 THR CB C 7 70.630 70.630 70.378 0.252 17919 63330 1 155 . 1 1 7 7 THR H H 7 8.730 8.730 8.664 0.066 17919 63331 1 155 . 1 1 8 8 LEU N N 8 121.330 121.330 125.642 -4.312 17919 63332 1 155 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.130 0.180 17919 63333 1 155 . 1 1 8 8 LEU C C 8 178.800 178.800 177.186 1.614 17919 63334 1 155 . 1 1 8 8 LEU CA C 8 57.580 57.580 58.392 -0.812 17919 63335 1 155 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.113 -0.143 17919 63336 1 155 . 1 1 8 8 LEU H H 8 9.100 9.100 8.600 0.500 17919 63337 1 155 . 1 1 9 9 THR N N 9 105.590 105.590 107.224 -1.634 17919 63338 1 155 . 1 1 9 9 THR HA H 9 4.428 4.428 4.341 0.087 17919 63339 1 155 . 1 1 9 9 THR C C 9 175.520 175.520 175.690 -0.170 17919 63340 1 155 . 1 1 9 9 THR CA C 9 61.400 61.400 61.593 -0.193 17919 63341 1 155 . 1 1 9 9 THR CB C 9 69.140 69.140 68.195 0.945 17919 63342 1 155 . 1 1 9 9 THR H H 9 7.630 7.630 7.648 -0.018 17919 63343 1 155 . 1 1 10 10 GLY N N 10 108.890 108.890 110.630 -1.740 17919 63344 1 155 . 1 1 10 10 GLY C C 10 174.070 174.070 174.134 -0.064 17919 63345 1 155 . 1 1 10 10 GLY CA C 10 45.460 45.460 46.059 -0.598 17919 63346 1 155 . 1 1 10 10 GLY H H 10 7.810 7.810 8.697 -0.887 17919 63347 1 155 . 1 1 11 11 LYS N N 11 121.600 121.600 121.458 0.142 17919 63348 1 155 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.510 -0.149 17919 63349 1 155 . 1 1 11 11 LYS C C 11 175.940 175.940 175.721 0.219 17919 63350 1 155 . 1 1 11 11 LYS CA C 11 56.280 56.280 55.815 0.465 17919 63351 1 155 . 1 1 11 11 LYS CB C 11 33.200 33.200 32.847 0.353 17919 63352 1 155 . 1 1 11 11 LYS H H 11 7.280 7.280 7.652 -0.372 17919 63353 1 155 . 1 1 12 12 THR N N 12 120.440 120.440 116.139 4.301 17919 63354 1 155 . 1 1 12 12 THR HA H 12 5.046 5.046 5.264 -0.218 17919 63355 1 155 . 1 1 12 12 THR C C 12 174.320 174.320 174.183 0.137 17919 63356 1 155 . 1 1 12 12 THR CA C 12 62.390 62.390 61.131 1.259 17919 63357 1 155 . 1 1 12 12 THR CB C 12 69.910 69.910 70.854 -0.944 17919 63358 1 155 . 1 1 12 12 THR H H 12 8.650 8.650 8.137 0.513 17919 63359 1 155 . 1 1 13 13 ILE N N 13 127.110 127.110 121.449 5.661 17919 63360 1 155 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.739 -0.195 17919 63361 1 155 . 1 1 13 13 ILE C C 13 175.220 175.220 174.628 0.592 17919 63362 1 155 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.132 0.848 17919 63363 1 155 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.303 -0.353 17919 63364 1 155 . 1 1 13 13 ILE H H 13 9.450 9.450 9.288 0.162 17919 63365 1 155 . 1 1 14 14 THR N N 14 121.520 121.520 121.448 0.072 17919 63366 1 155 . 1 1 14 14 THR HA H 14 4.964 4.964 5.129 -0.165 17919 63367 1 155 . 1 1 14 14 THR C C 14 173.790 173.790 173.747 0.043 17919 63368 1 155 . 1 1 14 14 THR CA C 14 61.940 61.940 62.218 -0.278 17919 63369 1 155 . 1 1 14 14 THR CB C 14 69.650 69.650 69.630 0.020 17919 63370 1 155 . 1 1 14 14 THR H H 14 8.710 8.710 8.672 0.038 17919 63371 1 155 . 1 1 15 15 LEU N N 15 124.800 124.800 125.880 -1.080 17919 63372 1 155 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.718 0.062 17919 63373 1 155 . 1 1 15 15 LEU C C 15 174.670 174.670 174.606 0.064 17919 63374 1 155 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.611 -0.781 17919 63375 1 155 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.031 2.039 17919 63376 1 155 . 1 1 15 15 LEU H H 15 8.710 8.710 8.550 0.160 17919 63377 1 155 . 1 1 16 16 GLU N N 16 122.160 122.160 123.640 -1.480 17919 63378 1 155 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.123 -0.206 17919 63379 1 155 . 1 1 16 16 GLU C C 16 175.860 175.860 175.662 0.198 17919 63380 1 155 . 1 1 16 16 GLU CA C 16 54.820 54.820 54.989 -0.168 17919 63381 1 155 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.320 -0.870 17919 63382 1 155 . 1 1 16 16 GLU H H 16 8.140 8.140 8.611 -0.471 17919 63383 1 155 . 1 1 17 17 VAL N N 17 117.210 117.210 121.209 -3.999 17919 63384 1 155 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.532 0.182 17919 63385 1 155 . 1 1 17 17 VAL C C 17 174.160 174.160 174.923 -0.763 17919 63386 1 155 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.930 -0.500 17919 63387 1 155 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.079 1.321 17919 63388 1 155 . 1 1 17 17 VAL H H 17 8.900 8.900 9.000 -0.100 17919 63389 1 155 . 1 1 18 18 GLU N N 18 118.990 118.990 121.203 -2.213 17919 63390 1 155 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.774 0.305 17919 63391 1 155 . 1 1 18 18 GLU C C 18 176.160 176.160 175.988 0.172 17919 63392 1 155 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.859 -0.139 17919 63393 1 155 . 1 1 18 18 GLU CB C 18 30.310 30.310 29.802 0.508 17919 63394 1 155 . 1 1 18 18 GLU H H 18 8.640 8.640 8.490 0.150 17919 63395 1 155 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.333 -0.192 17919 63396 1 155 . 1 1 19 19 PRO C C 19 175.310 175.310 178.074 -2.764 17919 63397 1 155 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.185 0.285 17919 63398 1 155 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.056 -0.106 17919 63399 1 155 . 1 1 20 20 SER N N 20 103.400 103.400 111.955 -8.555 17919 63400 1 155 . 1 1 20 20 SER HA H 20 4.370 4.370 4.380 -0.010 17919 63401 1 155 . 1 1 20 20 SER C C 20 174.660 174.660 173.958 0.702 17919 63402 1 155 . 1 1 20 20 SER CA C 20 57.400 57.400 59.139 -1.738 17919 63403 1 155 . 1 1 20 20 SER CB C 20 63.370 63.370 63.352 0.018 17919 63404 1 155 . 1 1 20 20 SER H H 20 7.040 7.040 8.332 -1.292 17919 63405 1 155 . 1 1 21 21 ASP N N 21 123.480 123.480 122.385 1.095 17919 63406 1 155 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.859 -0.164 17919 63407 1 155 . 1 1 21 21 ASP C C 21 176.360 176.360 175.030 1.330 17919 63408 1 155 . 1 1 21 21 ASP CA C 21 55.700 55.700 53.086 2.614 17919 63409 1 155 . 1 1 21 21 ASP CB C 21 40.800 40.800 42.754 -1.954 17919 63410 1 155 . 1 1 21 21 ASP H H 21 8.030 8.030 7.464 0.566 17919 63411 1 155 . 1 1 22 22 THR N N 22 108.800 108.800 110.689 -1.889 17919 63412 1 155 . 1 1 22 22 THR HA H 22 4.920 4.920 5.099 -0.179 17919 63413 1 155 . 1 1 22 22 THR C C 22 176.750 176.750 176.399 0.351 17919 63414 1 155 . 1 1 22 22 THR CA C 22 59.690 59.690 60.820 -1.130 17919 63415 1 155 . 1 1 22 22 THR CB C 22 71.200 71.200 71.250 -0.050 17919 63416 1 155 . 1 1 22 22 THR H H 22 7.900 7.900 8.138 -0.238 17919 63417 1 155 . 1 1 23 23 ILE N N 23 121.190 121.190 121.798 -0.608 17919 63418 1 155 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.817 -0.160 17919 63419 1 155 . 1 1 23 23 ILE C C 23 179.040 179.040 177.561 1.479 17919 63420 1 155 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.190 0.070 17919 63421 1 155 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.022 -1.672 17919 63422 1 155 . 1 1 23 23 ILE H H 23 8.560 8.560 8.689 -0.129 17919 63423 1 155 . 1 1 24 24 GLU N N 24 120.830 120.830 121.629 -0.799 17919 63424 1 155 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.835 0.082 17919 63425 1 155 . 1 1 24 24 GLU C C 24 178.640 178.640 178.516 0.124 17919 63426 1 155 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.307 -0.087 17919 63427 1 155 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.202 -0.922 17919 63428 1 155 . 1 1 24 24 GLU H H 24 9.760 9.760 8.073 1.687 17919 63429 1 155 . 1 1 25 25 ASN N N 25 120.570 120.570 117.797 2.773 17919 63430 1 155 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.481 0.044 17919 63431 1 155 . 1 1 25 25 ASN C C 25 178.380 178.380 177.842 0.538 17919 63432 1 155 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.804 0.256 17919 63433 1 155 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.081 0.369 17919 63434 1 155 . 1 1 25 25 ASN H H 25 7.920 7.920 7.717 0.203 17919 63435 1 155 . 1 1 26 26 VAL N N 26 121.710 121.710 120.244 1.466 17919 63436 1 155 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.530 -0.133 17919 63437 1 155 . 1 1 26 26 VAL C C 26 177.950 177.950 177.792 0.158 17919 63438 1 155 . 1 1 26 26 VAL CA C 26 67.660 67.660 67.066 0.594 17919 63439 1 155 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.585 -0.745 17919 63440 1 155 . 1 1 26 26 VAL H H 26 8.070 8.070 7.622 0.448 17919 63441 1 155 . 1 1 27 27 LYS N N 27 118.860 118.860 120.291 -1.431 17919 63442 1 155 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.091 0.489 17919 63443 1 155 . 1 1 27 27 LYS C C 27 180.550 180.550 179.109 1.441 17919 63444 1 155 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.737 -0.487 17919 63445 1 155 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.088 1.642 17919 63446 1 155 . 1 1 27 27 LYS H H 27 8.560 8.560 8.288 0.272 17919 63447 1 155 . 1 1 28 28 ALA N N 28 123.440 123.440 122.052 1.388 17919 63448 1 155 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.057 0.103 17919 63449 1 155 . 1 1 28 28 ALA C C 28 180.300 180.300 179.407 0.893 17919 63450 1 155 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.158 0.212 17919 63451 1 155 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.324 -0.614 17919 63452 1 155 . 1 1 28 28 ALA H H 28 8.060 8.060 8.218 -0.158 17919 63453 1 155 . 1 1 29 29 LYS N N 29 119.940 119.940 119.167 0.773 17919 63454 1 155 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.028 0.179 17919 63455 1 155 . 1 1 29 29 LYS C C 29 180.320 180.320 179.188 1.132 17919 63456 1 155 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.341 0.309 17919 63457 1 155 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.383 0.907 17919 63458 1 155 . 1 1 29 29 LYS H H 29 7.850 7.850 7.979 -0.129 17919 63459 1 155 . 1 1 30 30 ILE N N 30 121.080 121.080 121.151 -0.071 17919 63460 1 155 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.570 -0.063 17919 63461 1 155 . 1 1 30 30 ILE C C 30 178.310 178.310 177.431 0.879 17919 63462 1 155 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.444 0.707 17919 63463 1 155 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.747 -0.947 17919 63464 1 155 . 1 1 30 30 ILE H H 30 8.280 8.280 8.184 0.096 17919 63465 1 155 . 1 1 31 31 GLN N N 31 123.490 123.490 120.023 3.467 17919 63466 1 155 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.873 -0.044 17919 63467 1 155 . 1 1 31 31 GLN C C 31 178.890 178.890 178.471 0.419 17919 63468 1 155 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.211 0.789 17919 63469 1 155 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.507 -0.787 17919 63470 1 155 . 1 1 31 31 GLN H H 31 8.580 8.580 8.256 0.324 17919 63471 1 155 . 1 1 32 32 ASP N N 32 119.360 119.360 118.939 0.421 17919 63472 1 155 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.425 -0.071 17919 63473 1 155 . 1 1 32 32 ASP C C 32 177.250 177.250 177.973 -0.723 17919 63474 1 155 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.710 0.480 17919 63475 1 155 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.891 -0.311 17919 63476 1 155 . 1 1 32 32 ASP H H 32 8.010 8.010 8.048 -0.038 17919 63477 1 155 . 1 1 33 33 LYS N N 33 115.130 115.130 117.771 -2.641 17919 63478 1 155 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.330 0.007 17919 63479 1 155 . 1 1 33 33 LYS C C 33 177.870 177.870 178.001 -0.131 17919 63480 1 155 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.077 -0.027 17919 63481 1 155 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.572 0.598 17919 63482 1 155 . 1 1 33 33 LYS H H 33 7.430 7.430 7.526 -0.096 17919 63483 1 155 . 1 1 34 34 GLU N N 34 113.870 113.870 115.230 -1.360 17919 63484 1 155 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.459 0.166 17919 63485 1 155 . 1 1 34 34 GLU C C 34 177.840 177.840 176.968 0.872 17919 63486 1 155 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.197 -1.026 17919 63487 1 155 . 1 1 34 34 GLU CB C 34 32.660 32.660 32.358 0.302 17919 63488 1 155 . 1 1 34 34 GLU H H 34 8.740 8.740 8.365 0.375 17919 63489 1 155 . 1 1 35 35 GLY N N 35 108.650 108.650 110.309 -1.659 17919 63490 1 155 . 1 1 35 35 GLY C C 35 173.960 173.960 174.222 -0.262 17919 63491 1 155 . 1 1 35 35 GLY CA C 35 46.080 46.080 46.084 -0.004 17919 63492 1 155 . 1 1 35 35 GLY H H 35 8.530 8.530 8.170 0.360 17919 63493 1 155 . 1 1 36 36 ILE N N 36 119.880 119.880 116.865 3.015 17919 63494 1 155 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.576 -0.131 17919 63495 1 155 . 1 1 36 36 ILE C C 36 173.590 173.590 174.121 -0.531 17919 63496 1 155 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.245 0.505 17919 63497 1 155 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.959 1.621 17919 63498 1 155 . 1 1 36 36 ILE H H 36 6.150 6.150 7.406 -1.256 17919 63499 1 155 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.796 -0.162 17919 63500 1 155 . 1 1 37 37 PRO C C 37 176.940 176.940 176.578 0.362 17919 63501 1 155 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.179 0.481 17919 63502 1 155 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.050 0.800 17919 63503 1 155 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.171 -0.054 17919 63504 1 155 . 1 1 38 38 PRO C C 38 178.320 178.320 178.804 -0.484 17919 63505 1 155 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.647 0.613 17919 63506 1 155 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.856 1.034 17919 63507 1 155 . 1 1 39 39 ASP N N 39 113.380 113.380 119.039 -5.659 17919 63508 1 155 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.333 0.097 17919 63509 1 155 . 1 1 39 39 ASP C C 39 177.090 177.090 177.505 -0.415 17919 63510 1 155 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.928 -1.288 17919 63511 1 155 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.536 -0.996 17919 63512 1 155 . 1 1 39 39 ASP H H 39 8.550 8.550 8.549 0.001 17919 63513 1 155 . 1 1 40 40 GLN N N 40 116.780 116.780 115.798 0.982 17919 63514 1 155 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.369 0.095 17919 63515 1 155 . 1 1 40 40 GLN C C 40 175.380 175.380 175.751 -0.371 17919 63516 1 155 . 1 1 40 40 GLN CA C 40 55.640 55.640 54.950 0.690 17919 63517 1 155 . 1 1 40 40 GLN CB C 40 30.140 30.140 28.803 1.337 17919 63518 1 155 . 1 1 40 40 GLN H H 40 7.820 7.820 8.088 -0.268 17919 63519 1 155 . 1 1 41 41 GLN N N 41 117.720 117.720 118.980 -1.260 17919 63520 1 155 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.596 -0.352 17919 63521 1 155 . 1 1 41 41 GLN C C 41 176.300 176.300 175.977 0.323 17919 63522 1 155 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.010 0.460 17919 63523 1 155 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.589 2.061 17919 63524 1 155 . 1 1 41 41 GLN H H 41 7.480 7.480 7.276 0.204 17919 63525 1 155 . 1 1 42 42 ARG N N 42 122.680 122.680 124.157 -1.477 17919 63526 1 155 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.626 -0.126 17919 63527 1 155 . 1 1 42 42 ARG C C 42 174.050 174.050 174.407 -0.357 17919 63528 1 155 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.233 0.817 17919 63529 1 155 . 1 1 42 42 ARG CB C 42 31.750 31.750 31.993 -0.243 17919 63530 1 155 . 1 1 42 42 ARG H H 42 8.530 8.530 8.643 -0.113 17919 63531 1 155 . 1 1 43 43 LEU N N 43 124.040 124.040 126.193 -2.153 17919 63532 1 155 . 1 1 43 43 LEU C C 43 175.290 175.290 175.922 -0.632 17919 63533 1 155 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.998 -1.018 17919 63534 1 155 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.020 2.770 17919 63535 1 155 . 1 1 43 43 LEU H H 43 8.820 8.820 8.777 0.043 17919 63536 1 155 . 1 1 44 44 ILE N N 44 121.920 121.920 122.782 -0.862 17919 63537 1 155 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.840 0.152 17919 63538 1 155 . 1 1 44 44 ILE C C 44 176.060 176.060 174.269 1.791 17919 63539 1 155 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.294 -1.314 17919 63540 1 155 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.004 0.416 17919 63541 1 155 . 1 1 44 44 ILE H H 44 9.030 9.030 9.225 -0.195 17919 63542 1 155 . 1 1 45 45 PHE N N 45 125.390 125.390 128.108 -2.718 17919 63543 1 155 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.064 -0.019 17919 63544 1 155 . 1 1 45 45 PHE C C 45 174.470 174.470 174.758 -0.288 17919 63545 1 155 . 1 1 45 45 PHE CA C 45 57.020 57.020 55.865 1.155 17919 63546 1 155 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.103 1.657 17919 63547 1 155 . 1 1 45 45 PHE H H 45 8.830 8.830 9.112 -0.282 17919 63548 1 155 . 1 1 46 46 ALA N N 46 132.200 132.200 130.268 1.932 17919 63549 1 155 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.681 0.009 17919 63550 1 155 . 1 1 46 46 ALA C C 46 177.290 177.290 178.028 -0.738 17919 63551 1 155 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.124 0.416 17919 63552 1 155 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.304 0.266 17919 63553 1 155 . 1 1 46 46 ALA H H 46 8.810 8.810 9.130 -0.320 17919 63554 1 155 . 1 1 47 47 GLY N N 47 102.340 102.340 102.496 -0.156 17919 63555 1 155 . 1 1 47 47 GLY C C 47 173.810 173.810 174.280 -0.470 17919 63556 1 155 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.130 0.220 17919 63557 1 155 . 1 1 47 47 GLY H H 47 8.130 8.130 8.553 -0.423 17919 63558 1 155 . 1 1 48 48 LYS N N 48 121.570 121.570 121.465 0.105 17919 63559 1 155 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.569 0.053 17919 63560 1 155 . 1 1 48 48 LYS C C 48 174.700 174.700 175.823 -1.123 17919 63561 1 155 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.013 -0.463 17919 63562 1 155 . 1 1 48 48 LYS CB C 48 34.530 34.530 33.852 0.678 17919 63563 1 155 . 1 1 48 48 LYS H H 48 7.980 7.980 7.989 -0.009 17919 63564 1 155 . 1 1 49 49 GLN N N 49 122.410 122.410 124.114 -1.704 17919 63565 1 155 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.652 -0.092 17919 63566 1 155 . 1 1 49 49 GLN C C 49 175.670 175.670 176.200 -0.530 17919 63567 1 155 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.883 -0.143 17919 63568 1 155 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.314 -0.314 17919 63569 1 155 . 1 1 49 49 GLN H H 49 8.600 8.600 8.609 -0.009 17919 63570 1 155 . 1 1 50 50 LEU N N 50 125.520 125.520 126.836 -1.316 17919 63571 1 155 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.142 -0.052 17919 63572 1 155 . 1 1 50 50 LEU C C 50 176.660 176.660 176.371 0.289 17919 63573 1 155 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.490 -0.250 17919 63574 1 155 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.910 -0.340 17919 63575 1 155 . 1 1 50 50 LEU H H 50 8.530 8.530 8.162 0.368 17919 63576 1 155 . 1 1 51 51 GLU N N 51 122.940 122.940 123.656 -0.716 17919 63577 1 155 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.660 -0.172 17919 63578 1 155 . 1 1 51 51 GLU C C 51 175.870 175.870 176.965 -1.095 17919 63579 1 155 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.037 0.923 17919 63580 1 155 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.701 -1.131 17919 63581 1 155 . 1 1 51 51 GLU H H 51 8.400 8.400 8.445 -0.045 17919 63582 1 155 . 1 1 52 52 ASP N N 52 120.030 120.030 126.361 -6.331 17919 63583 1 155 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.476 -0.117 17919 63584 1 155 . 1 1 52 52 ASP C C 52 177.330 177.330 177.312 0.018 17919 63585 1 155 . 1 1 52 52 ASP CA C 52 56.960 56.960 56.294 0.666 17919 63586 1 155 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.330 0.520 17919 63587 1 155 . 1 1 52 52 ASP H H 52 8.160 8.160 8.751 -0.591 17919 63588 1 155 . 1 1 53 53 GLY N N 53 106.660 106.660 105.023 1.637 17919 63589 1 155 . 1 1 53 53 GLY C C 53 174.870 174.870 174.107 0.763 17919 63590 1 155 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.575 0.595 17919 63591 1 155 . 1 1 53 53 GLY H H 53 9.390 9.390 8.463 0.927 17919 63592 1 155 . 1 1 54 54 ARG N N 54 119.050 119.050 120.060 -1.010 17919 63593 1 155 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.512 0.183 17919 63594 1 155 . 1 1 54 54 ARG C C 54 175.350 175.350 176.210 -0.860 17919 63595 1 155 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.001 0.389 17919 63596 1 155 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.175 0.475 17919 63597 1 155 . 1 1 54 54 ARG H H 54 7.460 7.460 7.484 -0.024 17919 63598 1 155 . 1 1 55 55 THR N N 55 108.400 108.400 112.339 -3.939 17919 63599 1 155 . 1 1 55 55 THR HA H 55 5.240 5.240 4.934 0.306 17919 63600 1 155 . 1 1 55 55 THR C C 55 176.560 176.560 175.852 0.708 17919 63601 1 155 . 1 1 55 55 THR CA C 55 59.690 59.690 60.767 -1.077 17919 63602 1 155 . 1 1 55 55 THR CB C 55 72.260 72.260 70.998 1.262 17919 63603 1 155 . 1 1 55 55 THR H H 55 8.730 8.730 8.943 -0.213 17919 63604 1 155 . 1 1 56 56 LEU N N 56 117.920 117.920 122.279 -4.359 17919 63605 1 155 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.080 -0.020 17919 63606 1 155 . 1 1 56 56 LEU C C 56 180.810 180.810 178.655 2.155 17919 63607 1 155 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.584 0.126 17919 63608 1 155 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.972 -1.602 17919 63609 1 155 . 1 1 56 56 LEU H H 56 8.140 8.140 8.549 -0.409 17919 63610 1 155 . 1 1 57 57 SER N N 57 113.330 113.330 114.279 -0.949 17919 63611 1 155 . 1 1 57 57 SER HA H 57 4.370 4.370 4.277 0.093 17919 63612 1 155 . 1 1 57 57 SER C C 57 178.310 178.310 176.321 1.989 17919 63613 1 155 . 1 1 57 57 SER CA C 57 61.080 61.080 62.016 -0.936 17919 63614 1 155 . 1 1 57 57 SER CB C 57 62.530 62.530 62.956 -0.426 17919 63615 1 155 . 1 1 57 57 SER H H 57 8.470 8.470 8.542 -0.072 17919 63616 1 155 . 1 1 58 58 ASP N N 58 124.190 124.190 121.769 2.421 17919 63617 1 155 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.351 -0.055 17919 63618 1 155 . 1 1 58 58 ASP C C 58 177.400 177.400 177.133 0.267 17919 63619 1 155 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.702 0.478 17919 63620 1 155 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.579 -0.479 17919 63621 1 155 . 1 1 58 58 ASP H H 58 7.930 7.930 7.756 0.174 17919 63622 1 155 . 1 1 59 59 TYR N N 59 115.510 115.510 115.522 -0.012 17919 63623 1 155 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.566 0.104 17919 63624 1 155 . 1 1 59 59 TYR C C 59 174.700 174.700 175.093 -0.393 17919 63625 1 155 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.578 0.672 17919 63626 1 155 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.282 1.788 17919 63627 1 155 . 1 1 59 59 TYR H H 59 7.250 7.250 7.290 -0.040 17919 63628 1 155 . 1 1 60 60 ASN N N 60 115.900 115.900 118.058 -2.158 17919 63629 1 155 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.383 -0.028 17919 63630 1 155 . 1 1 60 60 ASN C C 60 174.340 174.340 174.818 -0.478 17919 63631 1 155 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.122 -0.002 17919 63632 1 155 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.171 0.239 17919 63633 1 155 . 1 1 60 60 ASN H H 60 8.150 8.150 7.449 0.701 17919 63634 1 155 . 1 1 61 61 ILE N N 61 118.600 118.600 119.310 -0.710 17919 63635 1 155 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.913 -0.520 17919 63636 1 155 . 1 1 61 61 ILE C C 61 174.610 174.610 174.978 -0.368 17919 63637 1 155 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.438 0.982 17919 63638 1 155 . 1 1 61 61 ILE CB C 61 36.740 36.740 38.643 -1.903 17919 63639 1 155 . 1 1 61 61 ILE H H 61 7.250 7.250 7.750 -0.500 17919 63640 1 155 . 1 1 62 62 GLN N N 62 124.740 124.740 123.641 1.099 17919 63641 1 155 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.579 -0.073 17919 63642 1 155 . 1 1 62 62 GLN C C 62 175.970 175.970 175.678 0.292 17919 63643 1 155 . 1 1 62 62 GLN CA C 62 53.660 53.660 54.021 -0.361 17919 63644 1 155 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.805 -0.155 17919 63645 1 155 . 1 1 62 62 GLN H H 62 7.610 7.610 8.090 -0.480 17919 63646 1 155 . 1 1 63 63 LYS N N 63 120.300 120.300 124.363 -4.063 17919 63647 1 155 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.944 0.057 17919 63648 1 155 . 1 1 63 63 LYS C C 63 175.810 175.810 177.004 -1.194 17919 63649 1 155 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.008 -0.218 17919 63650 1 155 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.389 0.261 17919 63651 1 155 . 1 1 63 63 LYS H H 63 8.490 8.490 8.804 -0.314 17919 63652 1 155 . 1 1 64 64 GLU N N 64 113.950 113.950 121.043 -7.093 17919 63653 1 155 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.683 -0.218 17919 63654 1 155 . 1 1 64 64 GLU C C 64 175.250 175.250 175.845 -0.595 17919 63655 1 155 . 1 1 64 64 GLU CA C 64 57.890 57.890 58.276 -0.386 17919 63656 1 155 . 1 1 64 64 GLU CB C 64 25.900 25.900 29.290 -3.389 17919 63657 1 155 . 1 1 64 64 GLU H H 64 9.280 9.280 8.838 0.442 17919 63658 1 155 . 1 1 65 65 SER N N 65 114.730 114.730 114.941 -0.211 17919 63659 1 155 . 1 1 65 65 SER HA H 65 4.640 4.640 4.469 0.171 17919 63660 1 155 . 1 1 65 65 SER C C 65 172.160 172.160 174.366 -2.206 17919 63661 1 155 . 1 1 65 65 SER CA C 65 60.890 60.890 59.857 1.033 17919 63662 1 155 . 1 1 65 65 SER CB C 65 64.910 64.910 64.074 0.836 17919 63663 1 155 . 1 1 65 65 SER H H 65 7.670 7.670 7.850 -0.180 17919 63664 1 155 . 1 1 66 66 THR N N 66 117.110 117.110 117.335 -0.225 17919 63665 1 155 . 1 1 66 66 THR HA H 66 5.270 5.270 5.114 0.156 17919 63666 1 155 . 1 1 66 66 THR C C 66 173.950 173.950 173.790 0.160 17919 63667 1 155 . 1 1 66 66 THR CA C 66 62.340 62.340 62.573 -0.233 17919 63668 1 155 . 1 1 66 66 THR CB C 66 70.080 70.080 70.213 -0.133 17919 63669 1 155 . 1 1 66 66 THR H H 66 8.730 8.730 8.432 0.298 17919 63670 1 155 . 1 1 67 67 LEU N N 67 127.110 127.110 126.547 0.563 17919 63671 1 155 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.865 0.195 17919 63672 1 155 . 1 1 67 67 LEU C C 67 175.770 175.770 175.184 0.586 17919 63673 1 155 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.028 -0.128 17919 63674 1 155 . 1 1 67 67 LEU CB C 67 44.260 44.260 45.384 -1.124 17919 63675 1 155 . 1 1 67 67 LEU H H 67 9.410 9.410 9.241 0.169 17919 63676 1 155 . 1 1 68 68 HIS N N 68 118.380 118.380 121.895 -3.515 17919 63677 1 155 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.435 -0.195 17919 63678 1 155 . 1 1 68 68 HIS C C 68 173.150 173.150 173.697 -0.547 17919 63679 1 155 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.349 0.651 17919 63680 1 155 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.644 -2.114 17919 63681 1 155 . 1 1 68 68 HIS H H 68 9.230 9.230 9.334 -0.104 17919 63682 1 155 . 1 1 69 69 LEU N N 69 124.460 124.460 128.844 -4.384 17919 63683 1 155 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.561 0.629 17919 63684 1 155 . 1 1 69 69 LEU C C 69 175.270 175.270 173.943 1.327 17919 63685 1 155 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.673 0.217 17919 63686 1 155 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.144 0.236 17919 63687 1 155 . 1 1 69 69 LEU H H 69 8.340 8.340 8.688 -0.348 17919 63688 1 155 . 1 1 70 70 VAL N N 70 126.940 126.940 127.143 -0.203 17919 63689 1 155 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.380 -0.030 17919 63690 1 155 . 1 1 70 70 VAL C C 70 174.000 174.000 174.416 -0.416 17919 63691 1 155 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.537 0.263 17919 63692 1 155 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.011 -0.101 17919 63693 1 155 . 1 1 70 70 VAL H H 70 9.200 9.200 8.626 0.574 17919 63694 1 155 . 1 1 71 71 LEU N N 71 123.130 123.130 125.627 -2.497 17919 63695 1 155 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.552 0.508 17919 63696 1 155 . 1 1 71 71 LEU C C 71 177.830 177.830 176.501 1.329 17919 63697 1 155 . 1 1 71 71 LEU CA C 71 53.940 53.940 54.034 -0.094 17919 63698 1 155 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.203 -0.353 17919 63699 1 155 . 1 1 71 71 LEU H H 71 8.120 8.120 8.483 -0.363 17919 63700 1 155 . 1 1 72 72 ARG N N 72 123.490 123.490 124.254 -0.764 17919 63701 1 155 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.423 -0.122 17919 63702 1 155 . 1 1 72 72 ARG C C 72 175.350 175.350 175.788 -0.438 17919 63703 1 155 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.587 0.023 17919 63704 1 155 . 1 1 72 72 ARG CB C 72 31.350 31.350 31.064 0.286 17919 63705 1 155 . 1 1 72 72 ARG H H 72 8.580 8.580 8.051 0.529 17919 63706 1 156 . 1 1 2 2 GLN N N 2 123.220 123.220 119.781 3.439 17919 63707 1 156 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.180 0.069 17919 63708 1 156 . 1 1 2 2 GLN C C 2 175.920 175.920 175.674 0.246 17919 63709 1 156 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.956 0.124 17919 63710 1 156 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.285 0.475 17919 63711 1 156 . 1 1 2 2 GLN H H 2 8.900 8.900 8.321 0.579 17919 63712 1 156 . 1 1 3 3 ILE N N 3 115.340 115.340 116.262 -0.922 17919 63713 1 156 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.339 -0.126 17919 63714 1 156 . 1 1 3 3 ILE C C 3 172.450 172.450 173.720 -1.270 17919 63715 1 156 . 1 1 3 3 ILE CA C 3 59.570 59.570 58.965 0.605 17919 63716 1 156 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.992 0.218 17919 63717 1 156 . 1 1 3 3 ILE H H 3 8.320 8.320 8.797 -0.477 17919 63718 1 156 . 1 1 4 4 PHE N N 4 118.110 118.110 119.057 -0.947 17919 63719 1 156 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.579 0.051 17919 63720 1 156 . 1 1 4 4 PHE C C 4 175.320 175.320 174.828 0.492 17919 63721 1 156 . 1 1 4 4 PHE CA C 4 55.210 55.210 54.740 0.469 17919 63722 1 156 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.300 0.180 17919 63723 1 156 . 1 1 4 4 PHE H H 4 8.610 8.610 8.582 0.028 17919 63724 1 156 . 1 1 5 5 VAL N N 5 121.000 121.000 121.489 -0.489 17919 63725 1 156 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.643 0.082 17919 63726 1 156 . 1 1 5 5 VAL C C 5 174.870 174.870 174.815 0.055 17919 63727 1 156 . 1 1 5 5 VAL CA C 5 60.620 60.620 60.846 -0.226 17919 63728 1 156 . 1 1 5 5 VAL CB C 5 34.230 34.230 35.299 -1.069 17919 63729 1 156 . 1 1 5 5 VAL H H 5 9.300 9.300 9.280 0.020 17919 63730 1 156 . 1 1 6 6 LYS N N 6 127.520 127.520 128.610 -1.090 17919 63731 1 156 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.187 0.180 17919 63732 1 156 . 1 1 6 6 LYS C C 6 177.140 177.140 177.064 0.076 17919 63733 1 156 . 1 1 6 6 LYS CA C 6 54.520 54.520 55.241 -0.721 17919 63734 1 156 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.584 0.466 17919 63735 1 156 . 1 1 6 6 LYS H H 6 8.820 8.820 8.723 0.097 17919 63736 1 156 . 1 1 7 7 THR N N 7 115.400 115.400 117.719 -2.319 17919 63737 1 156 . 1 1 7 7 THR HA H 7 4.970 4.970 4.566 0.404 17919 63738 1 156 . 1 1 7 7 THR C C 7 176.910 176.910 176.381 0.529 17919 63739 1 156 . 1 1 7 7 THR CA C 7 60.470 60.470 61.109 -0.639 17919 63740 1 156 . 1 1 7 7 THR CB C 7 70.630 70.630 70.309 0.321 17919 63741 1 156 . 1 1 7 7 THR H H 7 8.730 8.730 8.835 -0.105 17919 63742 1 156 . 1 1 8 8 LEU N N 8 121.330 121.330 122.387 -1.057 17919 63743 1 156 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.110 0.200 17919 63744 1 156 . 1 1 8 8 LEU C C 8 178.800 178.800 178.152 0.648 17919 63745 1 156 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.932 -0.352 17919 63746 1 156 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.555 0.415 17919 63747 1 156 . 1 1 8 8 LEU H H 8 9.100 9.100 8.701 0.399 17919 63748 1 156 . 1 1 9 9 THR N N 9 105.590 105.590 107.336 -1.746 17919 63749 1 156 . 1 1 9 9 THR HA H 9 4.428 4.428 4.183 0.245 17919 63750 1 156 . 1 1 9 9 THR C C 9 175.520 175.520 175.693 -0.173 17919 63751 1 156 . 1 1 9 9 THR CA C 9 61.400 61.400 62.428 -1.028 17919 63752 1 156 . 1 1 9 9 THR CB C 9 69.140 69.140 68.108 1.032 17919 63753 1 156 . 1 1 9 9 THR H H 9 7.630 7.630 7.691 -0.061 17919 63754 1 156 . 1 1 10 10 GLY N N 10 108.890 108.890 110.277 -1.387 17919 63755 1 156 . 1 1 10 10 GLY C C 10 174.070 174.070 174.446 -0.376 17919 63756 1 156 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.069 0.391 17919 63757 1 156 . 1 1 10 10 GLY H H 10 7.810 7.810 7.936 -0.126 17919 63758 1 156 . 1 1 11 11 LYS N N 11 121.600 121.600 121.034 0.566 17919 63759 1 156 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.276 0.085 17919 63760 1 156 . 1 1 11 11 LYS C C 11 175.940 175.940 175.750 0.190 17919 63761 1 156 . 1 1 11 11 LYS CA C 11 56.280 56.280 57.147 -0.867 17919 63762 1 156 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.371 -0.171 17919 63763 1 156 . 1 1 11 11 LYS H H 11 7.280 7.280 7.620 -0.340 17919 63764 1 156 . 1 1 12 12 THR N N 12 120.440 120.440 119.011 1.429 17919 63765 1 156 . 1 1 12 12 THR HA H 12 5.046 5.046 5.026 0.020 17919 63766 1 156 . 1 1 12 12 THR C C 12 174.320 174.320 174.402 -0.082 17919 63767 1 156 . 1 1 12 12 THR CA C 12 62.390 62.390 61.704 0.686 17919 63768 1 156 . 1 1 12 12 THR CB C 12 69.910 69.910 69.919 -0.009 17919 63769 1 156 . 1 1 12 12 THR H H 12 8.650 8.650 8.313 0.337 17919 63770 1 156 . 1 1 13 13 ILE N N 13 127.110 127.110 121.299 5.811 17919 63771 1 156 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.789 -0.245 17919 63772 1 156 . 1 1 13 13 ILE C C 13 175.220 175.220 173.780 1.440 17919 63773 1 156 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.506 0.474 17919 63774 1 156 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.536 -0.586 17919 63775 1 156 . 1 1 13 13 ILE H H 13 9.450 9.450 8.815 0.635 17919 63776 1 156 . 1 1 14 14 THR N N 14 121.520 121.520 122.703 -1.183 17919 63777 1 156 . 1 1 14 14 THR HA H 14 4.964 4.964 5.590 -0.626 17919 63778 1 156 . 1 1 14 14 THR C C 14 173.790 173.790 173.709 0.081 17919 63779 1 156 . 1 1 14 14 THR CA C 14 61.940 61.940 61.884 0.056 17919 63780 1 156 . 1 1 14 14 THR CB C 14 69.650 69.650 70.209 -0.559 17919 63781 1 156 . 1 1 14 14 THR H H 14 8.710 8.710 8.444 0.266 17919 63782 1 156 . 1 1 15 15 LEU N N 15 124.800 124.800 124.115 0.685 17919 63783 1 156 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.923 -0.143 17919 63784 1 156 . 1 1 15 15 LEU C C 15 174.670 174.670 174.799 -0.129 17919 63785 1 156 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.583 -0.753 17919 63786 1 156 . 1 1 15 15 LEU CB C 15 47.070 47.070 46.102 0.968 17919 63787 1 156 . 1 1 15 15 LEU H H 15 8.710 8.710 8.900 -0.190 17919 63788 1 156 . 1 1 16 16 GLU N N 16 122.160 122.160 122.617 -0.457 17919 63789 1 156 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.535 -0.618 17919 63790 1 156 . 1 1 16 16 GLU C C 16 175.860 175.860 175.542 0.318 17919 63791 1 156 . 1 1 16 16 GLU CA C 16 54.820 54.820 54.167 0.653 17919 63792 1 156 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.933 -1.483 17919 63793 1 156 . 1 1 16 16 GLU H H 16 8.140 8.140 8.577 -0.437 17919 63794 1 156 . 1 1 17 17 VAL N N 17 117.210 117.210 117.499 -0.289 17919 63795 1 156 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.895 -0.181 17919 63796 1 156 . 1 1 17 17 VAL C C 17 174.160 174.160 174.680 -0.520 17919 63797 1 156 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.781 -0.351 17919 63798 1 156 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.300 1.100 17919 63799 1 156 . 1 1 17 17 VAL H H 17 8.900 8.900 8.522 0.378 17919 63800 1 156 . 1 1 18 18 GLU N N 18 118.990 118.990 120.776 -1.786 17919 63801 1 156 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.877 0.202 17919 63802 1 156 . 1 1 18 18 GLU C C 18 176.160 176.160 175.407 0.753 17919 63803 1 156 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.260 0.460 17919 63804 1 156 . 1 1 18 18 GLU CB C 18 30.310 30.310 31.936 -1.626 17919 63805 1 156 . 1 1 18 18 GLU H H 18 8.640 8.640 9.119 -0.479 17919 63806 1 156 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.270 -0.129 17919 63807 1 156 . 1 1 19 19 PRO C C 19 175.310 175.310 177.684 -2.374 17919 63808 1 156 . 1 1 19 19 PRO CA C 19 65.470 65.470 64.964 0.506 17919 63809 1 156 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.827 0.123 17919 63810 1 156 . 1 1 20 20 SER N N 20 103.400 103.400 111.417 -8.017 17919 63811 1 156 . 1 1 20 20 SER HA H 20 4.370 4.370 4.258 0.112 17919 63812 1 156 . 1 1 20 20 SER C C 20 174.660 174.660 173.943 0.717 17919 63813 1 156 . 1 1 20 20 SER CA C 20 57.400 57.400 58.917 -1.517 17919 63814 1 156 . 1 1 20 20 SER CB C 20 63.370 63.370 63.024 0.346 17919 63815 1 156 . 1 1 20 20 SER H H 20 7.040 7.040 8.021 -0.981 17919 63816 1 156 . 1 1 21 21 ASP N N 21 123.480 123.480 122.397 1.083 17919 63817 1 156 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.857 -0.162 17919 63818 1 156 . 1 1 21 21 ASP C C 21 176.360 176.360 175.883 0.477 17919 63819 1 156 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.688 1.012 17919 63820 1 156 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.637 -0.837 17919 63821 1 156 . 1 1 21 21 ASP H H 21 8.030 8.030 7.909 0.121 17919 63822 1 156 . 1 1 22 22 THR N N 22 108.800 108.800 111.873 -3.073 17919 63823 1 156 . 1 1 22 22 THR HA H 22 4.920 4.920 4.580 0.340 17919 63824 1 156 . 1 1 22 22 THR C C 22 176.750 176.750 175.914 0.836 17919 63825 1 156 . 1 1 22 22 THR CA C 22 59.690 59.690 61.767 -2.077 17919 63826 1 156 . 1 1 22 22 THR CB C 22 71.200 71.200 70.168 1.032 17919 63827 1 156 . 1 1 22 22 THR H H 22 7.900 7.900 8.320 -0.420 17919 63828 1 156 . 1 1 23 23 ILE N N 23 121.190 121.190 121.858 -0.668 17919 63829 1 156 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.867 -0.210 17919 63830 1 156 . 1 1 23 23 ILE C C 23 179.040 179.040 177.519 1.521 17919 63831 1 156 . 1 1 23 23 ILE CA C 23 62.260 62.260 61.289 0.971 17919 63832 1 156 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.382 -2.032 17919 63833 1 156 . 1 1 23 23 ILE H H 23 8.560 8.560 8.678 -0.118 17919 63834 1 156 . 1 1 24 24 GLU N N 24 120.830 120.830 121.532 -0.702 17919 63835 1 156 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.841 0.076 17919 63836 1 156 . 1 1 24 24 GLU C C 24 178.640 178.640 178.650 -0.010 17919 63837 1 156 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.124 0.096 17919 63838 1 156 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.358 -1.078 17919 63839 1 156 . 1 1 24 24 GLU H H 24 9.760 9.760 8.095 1.665 17919 63840 1 156 . 1 1 25 25 ASN N N 25 120.570 120.570 116.867 3.703 17919 63841 1 156 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.583 -0.058 17919 63842 1 156 . 1 1 25 25 ASN C C 25 178.380 178.380 177.847 0.533 17919 63843 1 156 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.866 0.194 17919 63844 1 156 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.619 -0.169 17919 63845 1 156 . 1 1 25 25 ASN H H 25 7.920 7.920 7.717 0.203 17919 63846 1 156 . 1 1 26 26 VAL N N 26 121.710 121.710 121.173 0.537 17919 63847 1 156 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.579 -0.182 17919 63848 1 156 . 1 1 26 26 VAL C C 26 177.950 177.950 177.583 0.367 17919 63849 1 156 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.499 1.161 17919 63850 1 156 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.810 -0.970 17919 63851 1 156 . 1 1 26 26 VAL H H 26 8.070 8.070 7.260 0.810 17919 63852 1 156 . 1 1 27 27 LYS N N 27 118.860 118.860 119.839 -0.979 17919 63853 1 156 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.113 0.467 17919 63854 1 156 . 1 1 27 27 LYS C C 27 180.550 180.550 179.122 1.428 17919 63855 1 156 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.696 -0.446 17919 63856 1 156 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.145 1.585 17919 63857 1 156 . 1 1 27 27 LYS H H 27 8.560 8.560 8.589 -0.029 17919 63858 1 156 . 1 1 28 28 ALA N N 28 123.440 123.440 121.850 1.590 17919 63859 1 156 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.252 -0.092 17919 63860 1 156 . 1 1 28 28 ALA C C 28 180.300 180.300 179.055 1.245 17919 63861 1 156 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.647 0.723 17919 63862 1 156 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.650 -0.940 17919 63863 1 156 . 1 1 28 28 ALA H H 28 8.060 8.060 8.160 -0.100 17919 63864 1 156 . 1 1 29 29 LYS N N 29 119.940 119.940 119.436 0.504 17919 63865 1 156 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.045 0.162 17919 63866 1 156 . 1 1 29 29 LYS C C 29 180.320 180.320 179.023 1.297 17919 63867 1 156 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.160 0.490 17919 63868 1 156 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.342 0.948 17919 63869 1 156 . 1 1 29 29 LYS H H 29 7.850 7.850 7.748 0.102 17919 63870 1 156 . 1 1 30 30 ILE N N 30 121.080 121.080 120.576 0.504 17919 63871 1 156 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.627 -0.120 17919 63872 1 156 . 1 1 30 30 ILE C C 30 178.310 178.310 177.256 1.054 17919 63873 1 156 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.367 0.783 17919 63874 1 156 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.932 -1.132 17919 63875 1 156 . 1 1 30 30 ILE H H 30 8.280 8.280 8.589 -0.309 17919 63876 1 156 . 1 1 31 31 GLN N N 31 123.490 123.490 120.587 2.903 17919 63877 1 156 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.883 -0.054 17919 63878 1 156 . 1 1 31 31 GLN C C 31 178.890 178.890 178.495 0.395 17919 63879 1 156 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.334 0.666 17919 63880 1 156 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.405 -0.685 17919 63881 1 156 . 1 1 31 31 GLN H H 31 8.580 8.580 7.771 0.809 17919 63882 1 156 . 1 1 32 32 ASP N N 32 119.360 119.360 117.842 1.518 17919 63883 1 156 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.488 -0.134 17919 63884 1 156 . 1 1 32 32 ASP C C 32 177.250 177.250 177.302 -0.052 17919 63885 1 156 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.246 0.944 17919 63886 1 156 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.688 -0.108 17919 63887 1 156 . 1 1 32 32 ASP H H 32 8.010 8.010 8.163 -0.153 17919 63888 1 156 . 1 1 33 33 LYS N N 33 115.130 115.130 117.331 -2.201 17919 63889 1 156 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.513 -0.176 17919 63890 1 156 . 1 1 33 33 LYS C C 33 177.870 177.870 177.745 0.125 17919 63891 1 156 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.372 0.678 17919 63892 1 156 . 1 1 33 33 LYS CB C 33 34.170 34.170 34.729 -0.559 17919 63893 1 156 . 1 1 33 33 LYS H H 33 7.430 7.430 7.561 -0.131 17919 63894 1 156 . 1 1 34 34 GLU N N 34 113.870 113.870 115.112 -1.242 17919 63895 1 156 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.526 0.099 17919 63896 1 156 . 1 1 34 34 GLU C C 34 177.840 177.840 176.995 0.845 17919 63897 1 156 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.687 -0.517 17919 63898 1 156 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.533 1.127 17919 63899 1 156 . 1 1 34 34 GLU H H 34 8.740 8.740 8.058 0.682 17919 63900 1 156 . 1 1 35 35 GLY N N 35 108.650 108.650 109.206 -0.556 17919 63901 1 156 . 1 1 35 35 GLY C C 35 173.960 173.960 174.342 -0.382 17919 63902 1 156 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.928 0.152 17919 63903 1 156 . 1 1 35 35 GLY H H 35 8.530 8.530 8.298 0.232 17919 63904 1 156 . 1 1 36 36 ILE N N 36 119.880 119.880 121.683 -1.803 17919 63905 1 156 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.133 0.312 17919 63906 1 156 . 1 1 36 36 ILE C C 36 173.590 173.590 174.091 -0.501 17919 63907 1 156 . 1 1 36 36 ILE CA C 36 57.750 57.750 59.210 -1.460 17919 63908 1 156 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.033 2.547 17919 63909 1 156 . 1 1 36 36 ILE H H 36 6.150 6.150 7.805 -1.655 17919 63910 1 156 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.587 0.047 17919 63911 1 156 . 1 1 37 37 PRO C C 37 176.940 176.940 175.621 1.319 17919 63912 1 156 . 1 1 37 37 PRO CA C 37 61.660 61.660 62.178 -0.518 17919 63913 1 156 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.446 0.404 17919 63914 1 156 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.304 -0.187 17919 63915 1 156 . 1 1 38 38 PRO C C 38 178.320 178.320 178.523 -0.203 17919 63916 1 156 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.347 0.914 17919 63917 1 156 . 1 1 38 38 PRO CB C 38 32.890 32.890 32.049 0.841 17919 63918 1 156 . 1 1 39 39 ASP N N 39 113.380 113.380 115.318 -1.938 17919 63919 1 156 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.418 0.012 17919 63920 1 156 . 1 1 39 39 ASP C C 39 177.090 177.090 176.926 0.164 17919 63921 1 156 . 1 1 39 39 ASP CA C 39 55.640 55.640 55.968 -0.328 17919 63922 1 156 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.412 -0.872 17919 63923 1 156 . 1 1 39 39 ASP H H 39 8.550 8.550 8.611 -0.061 17919 63924 1 156 . 1 1 40 40 GLN N N 40 116.780 116.780 116.079 0.701 17919 63925 1 156 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.356 0.108 17919 63926 1 156 . 1 1 40 40 GLN C C 40 175.380 175.380 176.444 -1.064 17919 63927 1 156 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.996 -1.356 17919 63928 1 156 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.802 0.338 17919 63929 1 156 . 1 1 40 40 GLN H H 40 7.820 7.820 7.394 0.426 17919 63930 1 156 . 1 1 41 41 GLN N N 41 117.720 117.720 119.185 -1.465 17919 63931 1 156 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.168 0.076 17919 63932 1 156 . 1 1 41 41 GLN C C 41 176.300 176.300 175.062 1.238 17919 63933 1 156 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.757 -0.286 17919 63934 1 156 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.407 2.243 17919 63935 1 156 . 1 1 41 41 GLN H H 41 7.480 7.480 7.452 0.028 17919 63936 1 156 . 1 1 42 42 ARG N N 42 122.680 122.680 123.417 -0.737 17919 63937 1 156 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.582 -0.082 17919 63938 1 156 . 1 1 42 42 ARG C C 42 174.050 174.050 174.351 -0.301 17919 63939 1 156 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.888 0.162 17919 63940 1 156 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.405 -1.655 17919 63941 1 156 . 1 1 42 42 ARG H H 42 8.530 8.530 7.974 0.556 17919 63942 1 156 . 1 1 43 43 LEU N N 43 124.040 124.040 126.319 -2.279 17919 63943 1 156 . 1 1 43 43 LEU C C 43 175.290 175.290 175.638 -0.348 17919 63944 1 156 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.951 -0.971 17919 63945 1 156 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.740 2.050 17919 63946 1 156 . 1 1 43 43 LEU H H 43 8.820 8.820 8.358 0.462 17919 63947 1 156 . 1 1 44 44 ILE N N 44 121.920 121.920 122.025 -0.105 17919 63948 1 156 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.121 -0.129 17919 63949 1 156 . 1 1 44 44 ILE C C 44 176.060 176.060 174.517 1.543 17919 63950 1 156 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.097 -1.117 17919 63951 1 156 . 1 1 44 44 ILE CB C 44 41.420 41.420 40.759 0.661 17919 63952 1 156 . 1 1 44 44 ILE H H 44 9.030 9.030 9.191 -0.161 17919 63953 1 156 . 1 1 45 45 PHE N N 45 125.390 125.390 127.859 -2.469 17919 63954 1 156 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.909 0.136 17919 63955 1 156 . 1 1 45 45 PHE C C 45 174.470 174.470 174.874 -0.404 17919 63956 1 156 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.052 0.968 17919 63957 1 156 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.122 0.638 17919 63958 1 156 . 1 1 45 45 PHE H H 45 8.830 8.830 8.559 0.271 17919 63959 1 156 . 1 1 46 46 ALA N N 46 132.200 132.200 129.168 3.032 17919 63960 1 156 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.526 0.164 17919 63961 1 156 . 1 1 46 46 ALA C C 46 177.290 177.290 177.647 -0.357 17919 63962 1 156 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.665 -0.125 17919 63963 1 156 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.426 0.144 17919 63964 1 156 . 1 1 46 46 ALA H H 46 8.810 8.810 8.234 0.576 17919 63965 1 156 . 1 1 47 47 GLY N N 47 102.340 102.340 102.075 0.265 17919 63966 1 156 . 1 1 47 47 GLY C C 47 173.810 173.810 174.732 -0.922 17919 63967 1 156 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.144 0.206 17919 63968 1 156 . 1 1 47 47 GLY H H 47 8.130 8.130 8.695 -0.565 17919 63969 1 156 . 1 1 48 48 LYS N N 48 121.570 121.570 119.824 1.746 17919 63970 1 156 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.576 0.046 17919 63971 1 156 . 1 1 48 48 LYS C C 48 174.700 174.700 175.272 -0.572 17919 63972 1 156 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.547 0.003 17919 63973 1 156 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.874 -0.344 17919 63974 1 156 . 1 1 48 48 LYS H H 48 7.980 7.980 7.933 0.047 17919 63975 1 156 . 1 1 49 49 GLN N N 49 122.410 122.410 120.733 1.677 17919 63976 1 156 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.762 -0.202 17919 63977 1 156 . 1 1 49 49 GLN C C 49 175.670 175.670 175.817 -0.147 17919 63978 1 156 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.239 0.501 17919 63979 1 156 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.733 -0.733 17919 63980 1 156 . 1 1 49 49 GLN H H 49 8.600 8.600 8.459 0.141 17919 63981 1 156 . 1 1 50 50 LEU N N 50 125.520 125.520 126.342 -0.822 17919 63982 1 156 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.065 0.025 17919 63983 1 156 . 1 1 50 50 LEU C C 50 176.660 176.660 175.608 1.052 17919 63984 1 156 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.502 0.739 17919 63985 1 156 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.985 -0.415 17919 63986 1 156 . 1 1 50 50 LEU H H 50 8.530 8.530 8.853 -0.323 17919 63987 1 156 . 1 1 51 51 GLU N N 51 122.940 122.940 123.448 -0.508 17919 63988 1 156 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.467 0.021 17919 63989 1 156 . 1 1 51 51 GLU C C 51 175.870 175.870 177.349 -1.479 17919 63990 1 156 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.042 0.918 17919 63991 1 156 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.366 -0.796 17919 63992 1 156 . 1 1 51 51 GLU H H 51 8.400 8.400 7.788 0.612 17919 63993 1 156 . 1 1 52 52 ASP N N 52 120.030 120.030 127.327 -7.297 17919 63994 1 156 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.331 0.028 17919 63995 1 156 . 1 1 52 52 ASP C C 52 177.330 177.330 178.085 -0.755 17919 63996 1 156 . 1 1 52 52 ASP CA C 52 56.960 56.960 58.130 -1.170 17919 63997 1 156 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.521 0.329 17919 63998 1 156 . 1 1 52 52 ASP H H 52 8.160 8.160 8.842 -0.682 17919 63999 1 156 . 1 1 53 53 GLY N N 53 106.660 106.660 105.132 1.528 17919 64000 1 156 . 1 1 53 53 GLY C C 53 174.870 174.870 174.317 0.553 17919 64001 1 156 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.264 -0.094 17919 64002 1 156 . 1 1 53 53 GLY H H 53 9.390 9.390 8.670 0.720 17919 64003 1 156 . 1 1 54 54 ARG N N 54 119.050 119.050 119.122 -0.072 17919 64004 1 156 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.472 0.223 17919 64005 1 156 . 1 1 54 54 ARG C C 54 175.350 175.350 175.513 -0.163 17919 64006 1 156 . 1 1 54 54 ARG CA C 54 54.390 54.390 55.056 -0.666 17919 64007 1 156 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.918 -0.268 17919 64008 1 156 . 1 1 54 54 ARG H H 54 7.460 7.460 7.341 0.119 17919 64009 1 156 . 1 1 55 55 THR N N 55 108.400 108.400 111.757 -3.357 17919 64010 1 156 . 1 1 55 55 THR HA H 55 5.240 5.240 5.107 0.133 17919 64011 1 156 . 1 1 55 55 THR C C 55 176.560 176.560 176.424 0.136 17919 64012 1 156 . 1 1 55 55 THR CA C 55 59.690 59.690 60.127 -0.437 17919 64013 1 156 . 1 1 55 55 THR CB C 55 72.260 72.260 70.906 1.353 17919 64014 1 156 . 1 1 55 55 THR H H 55 8.730 8.730 9.161 -0.431 17919 64015 1 156 . 1 1 56 56 LEU N N 56 117.920 117.920 123.080 -5.160 17919 64016 1 156 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.786 0.274 17919 64017 1 156 . 1 1 56 56 LEU C C 56 180.810 180.810 178.747 2.063 17919 64018 1 156 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.851 -0.141 17919 64019 1 156 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.330 -0.960 17919 64020 1 156 . 1 1 56 56 LEU H H 56 8.140 8.140 8.703 -0.563 17919 64021 1 156 . 1 1 57 57 SER N N 57 113.330 113.330 114.430 -1.100 17919 64022 1 156 . 1 1 57 57 SER HA H 57 4.370 4.370 4.101 0.269 17919 64023 1 156 . 1 1 57 57 SER C C 57 178.310 178.310 176.894 1.416 17919 64024 1 156 . 1 1 57 57 SER CA C 57 61.080 61.080 62.256 -1.176 17919 64025 1 156 . 1 1 57 57 SER CB C 57 62.530 62.530 62.895 -0.365 17919 64026 1 156 . 1 1 57 57 SER H H 57 8.470 8.470 7.910 0.560 17919 64027 1 156 . 1 1 58 58 ASP N N 58 124.190 124.190 121.925 2.265 17919 64028 1 156 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.289 0.007 17919 64029 1 156 . 1 1 58 58 ASP C C 58 177.400 177.400 177.152 0.248 17919 64030 1 156 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.655 0.525 17919 64031 1 156 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.319 -0.219 17919 64032 1 156 . 1 1 58 58 ASP H H 58 7.930 7.930 7.627 0.303 17919 64033 1 156 . 1 1 59 59 TYR N N 59 115.510 115.510 115.881 -0.371 17919 64034 1 156 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.524 0.146 17919 64035 1 156 . 1 1 59 59 TYR C C 59 174.700 174.700 174.844 -0.144 17919 64036 1 156 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.365 0.885 17919 64037 1 156 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.001 2.069 17919 64038 1 156 . 1 1 59 59 TYR H H 59 7.250 7.250 7.464 -0.214 17919 64039 1 156 . 1 1 60 60 ASN N N 60 115.900 115.900 117.172 -1.272 17919 64040 1 156 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.346 0.009 17919 64041 1 156 . 1 1 60 60 ASN C C 60 174.340 174.340 174.604 -0.264 17919 64042 1 156 . 1 1 60 60 ASN CA C 60 54.120 54.120 53.972 0.148 17919 64043 1 156 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.709 -0.299 17919 64044 1 156 . 1 1 60 60 ASN H H 60 8.150 8.150 7.773 0.377 17919 64045 1 156 . 1 1 61 61 ILE N N 61 118.600 118.600 118.937 -0.337 17919 64046 1 156 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.940 -0.547 17919 64047 1 156 . 1 1 61 61 ILE C C 61 174.610 174.610 175.565 -0.955 17919 64048 1 156 . 1 1 61 61 ILE CA C 61 62.420 62.420 60.339 2.081 17919 64049 1 156 . 1 1 61 61 ILE CB C 61 36.740 36.740 36.511 0.229 17919 64050 1 156 . 1 1 61 61 ILE H H 61 7.250 7.250 7.564 -0.314 17919 64051 1 156 . 1 1 62 62 GLN N N 62 124.740 124.740 125.338 -0.598 17919 64052 1 156 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.638 -0.132 17919 64053 1 156 . 1 1 62 62 GLN C C 62 175.970 175.970 175.225 0.745 17919 64054 1 156 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.955 -0.295 17919 64055 1 156 . 1 1 62 62 GLN CB C 62 31.650 31.650 30.368 1.282 17919 64056 1 156 . 1 1 62 62 GLN H H 62 7.610 7.610 8.107 -0.496 17919 64057 1 156 . 1 1 63 63 LYS N N 63 120.300 120.300 119.229 1.071 17919 64058 1 156 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.033 -0.032 17919 64059 1 156 . 1 1 63 63 LYS C C 63 175.810 175.810 176.560 -0.750 17919 64060 1 156 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.203 0.587 17919 64061 1 156 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.565 0.085 17919 64062 1 156 . 1 1 63 63 LYS H H 63 8.490 8.490 8.330 0.160 17919 64063 1 156 . 1 1 64 64 GLU N N 64 113.950 113.950 115.629 -1.679 17919 64064 1 156 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.008 0.457 17919 64065 1 156 . 1 1 64 64 GLU C C 64 175.250 175.250 175.317 -0.067 17919 64066 1 156 . 1 1 64 64 GLU CA C 64 57.890 57.890 58.011 -0.121 17919 64067 1 156 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.597 -2.697 17919 64068 1 156 . 1 1 64 64 GLU H H 64 9.280 9.280 8.649 0.631 17919 64069 1 156 . 1 1 65 65 SER N N 65 114.730 114.730 115.456 -0.726 17919 64070 1 156 . 1 1 65 65 SER HA H 65 4.640 4.640 4.392 0.248 17919 64071 1 156 . 1 1 65 65 SER C C 65 172.160 172.160 173.122 -0.962 17919 64072 1 156 . 1 1 65 65 SER CA C 65 60.890 60.890 58.992 1.898 17919 64073 1 156 . 1 1 65 65 SER CB C 65 64.910 64.910 63.826 1.084 17919 64074 1 156 . 1 1 65 65 SER H H 65 7.670 7.670 7.296 0.374 17919 64075 1 156 . 1 1 66 66 THR N N 66 117.110 117.110 118.471 -1.361 17919 64076 1 156 . 1 1 66 66 THR HA H 66 5.270 5.270 5.323 -0.053 17919 64077 1 156 . 1 1 66 66 THR C C 66 173.950 173.950 173.604 0.346 17919 64078 1 156 . 1 1 66 66 THR CA C 66 62.340 62.340 61.967 0.373 17919 64079 1 156 . 1 1 66 66 THR CB C 66 70.080 70.080 70.015 0.065 17919 64080 1 156 . 1 1 66 66 THR H H 66 8.730 8.730 8.343 0.387 17919 64081 1 156 . 1 1 67 67 LEU N N 67 127.110 127.110 126.831 0.279 17919 64082 1 156 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.799 0.261 17919 64083 1 156 . 1 1 67 67 LEU C C 67 175.770 175.770 175.943 -0.173 17919 64084 1 156 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.919 -0.019 17919 64085 1 156 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.915 0.345 17919 64086 1 156 . 1 1 67 67 LEU H H 67 9.410 9.410 9.075 0.335 17919 64087 1 156 . 1 1 68 68 HIS N N 68 118.380 118.380 116.798 1.582 17919 64088 1 156 . 1 1 68 68 HIS HA H 68 5.240 5.240 4.947 0.293 17919 64089 1 156 . 1 1 68 68 HIS C C 68 173.150 173.150 174.116 -0.966 17919 64090 1 156 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.311 0.689 17919 64091 1 156 . 1 1 68 68 HIS CB C 68 30.530 30.530 33.436 -2.906 17919 64092 1 156 . 1 1 68 68 HIS H H 68 9.230 9.230 8.989 0.241 17919 64093 1 156 . 1 1 69 69 LEU N N 69 124.460 124.460 123.112 1.348 17919 64094 1 156 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.922 0.268 17919 64095 1 156 . 1 1 69 69 LEU C C 69 175.270 175.270 174.745 0.525 17919 64096 1 156 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.093 -0.203 17919 64097 1 156 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.464 -0.084 17919 64098 1 156 . 1 1 69 69 LEU H H 69 8.340 8.340 8.567 -0.227 17919 64099 1 156 . 1 1 70 70 VAL N N 70 126.940 126.940 125.247 1.693 17919 64100 1 156 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.501 -0.151 17919 64101 1 156 . 1 1 70 70 VAL C C 70 174.000 174.000 173.642 0.358 17919 64102 1 156 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.029 0.771 17919 64103 1 156 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.518 -0.608 17919 64104 1 156 . 1 1 70 70 VAL H H 70 9.200 9.200 8.342 0.858 17919 64105 1 156 . 1 1 71 71 LEU N N 71 123.130 123.130 127.486 -4.356 17919 64106 1 156 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.947 0.113 17919 64107 1 156 . 1 1 71 71 LEU C C 71 177.830 177.830 176.232 1.598 17919 64108 1 156 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.663 0.277 17919 64109 1 156 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.767 -0.917 17919 64110 1 156 . 1 1 71 71 LEU H H 71 8.120 8.120 8.399 -0.279 17919 64111 1 156 . 1 1 72 72 ARG N N 72 123.490 123.490 126.352 -2.862 17919 64112 1 156 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.545 -0.244 17919 64113 1 156 . 1 1 72 72 ARG C C 72 175.350 175.350 175.950 -0.600 17919 64114 1 156 . 1 1 72 72 ARG CA C 72 55.610 55.610 54.524 1.086 17919 64115 1 156 . 1 1 72 72 ARG CB C 72 31.350 31.350 29.380 1.970 17919 64116 1 156 . 1 1 72 72 ARG H H 72 8.580 8.580 8.817 -0.237 17919 64117 1 157 . 1 1 2 2 GLN N N 2 123.220 123.220 120.034 3.186 17919 64118 1 157 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.376 -0.127 17919 64119 1 157 . 1 1 2 2 GLN C C 2 175.920 175.920 174.604 1.316 17919 64120 1 157 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.223 0.857 17919 64121 1 157 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.949 -0.189 17919 64122 1 157 . 1 1 2 2 GLN H H 2 8.900 8.900 8.221 0.679 17919 64123 1 157 . 1 1 3 3 ILE N N 3 115.340 115.340 115.120 0.220 17919 64124 1 157 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.230 -0.017 17919 64125 1 157 . 1 1 3 3 ILE C C 3 172.450 172.450 173.329 -0.879 17919 64126 1 157 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.338 0.232 17919 64127 1 157 . 1 1 3 3 ILE CB C 3 42.210 42.210 42.293 -0.083 17919 64128 1 157 . 1 1 3 3 ILE H H 3 8.320 8.320 8.265 0.055 17919 64129 1 157 . 1 1 4 4 PHE N N 4 118.110 118.110 118.606 -0.496 17919 64130 1 157 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.724 -0.094 17919 64131 1 157 . 1 1 4 4 PHE C C 4 175.320 175.320 175.230 0.090 17919 64132 1 157 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.230 -0.020 17919 64133 1 157 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.748 -0.268 17919 64134 1 157 . 1 1 4 4 PHE H H 4 8.610 8.610 8.783 -0.173 17919 64135 1 157 . 1 1 5 5 VAL N N 5 121.000 121.000 122.181 -1.181 17919 64136 1 157 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.735 -0.010 17919 64137 1 157 . 1 1 5 5 VAL C C 5 174.870 174.870 174.483 0.387 17919 64138 1 157 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.111 -0.491 17919 64139 1 157 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.809 -0.579 17919 64140 1 157 . 1 1 5 5 VAL H H 5 9.300 9.300 9.394 -0.094 17919 64141 1 157 . 1 1 6 6 LYS N N 6 127.520 127.520 128.900 -1.380 17919 64142 1 157 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.386 -0.019 17919 64143 1 157 . 1 1 6 6 LYS C C 6 177.140 177.140 175.948 1.192 17919 64144 1 157 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.326 0.194 17919 64145 1 157 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.775 -0.725 17919 64146 1 157 . 1 1 6 6 LYS H H 6 8.820 8.820 8.779 0.041 17919 64147 1 157 . 1 1 7 7 THR N N 7 115.400 115.400 115.601 -0.201 17919 64148 1 157 . 1 1 7 7 THR HA H 7 4.970 4.970 4.752 0.218 17919 64149 1 157 . 1 1 7 7 THR C C 7 176.910 176.910 176.005 0.905 17919 64150 1 157 . 1 1 7 7 THR CA C 7 60.470 60.470 60.109 0.361 17919 64151 1 157 . 1 1 7 7 THR CB C 7 70.630 70.630 71.358 -0.728 17919 64152 1 157 . 1 1 7 7 THR H H 7 8.730 8.730 8.775 -0.045 17919 64153 1 157 . 1 1 8 8 LEU N N 8 121.330 121.330 122.529 -1.199 17919 64154 1 157 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.207 0.103 17919 64155 1 157 . 1 1 8 8 LEU C C 8 178.800 178.800 177.601 1.199 17919 64156 1 157 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.472 0.108 17919 64157 1 157 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.232 -0.262 17919 64158 1 157 . 1 1 8 8 LEU H H 8 9.100 9.100 8.796 0.304 17919 64159 1 157 . 1 1 9 9 THR N N 9 105.590 105.590 108.593 -3.003 17919 64160 1 157 . 1 1 9 9 THR HA H 9 4.428 4.428 4.372 0.056 17919 64161 1 157 . 1 1 9 9 THR C C 9 175.520 175.520 175.398 0.122 17919 64162 1 157 . 1 1 9 9 THR CA C 9 61.400 61.400 61.659 -0.259 17919 64163 1 157 . 1 1 9 9 THR CB C 9 69.140 69.140 69.032 0.108 17919 64164 1 157 . 1 1 9 9 THR H H 9 7.630 7.630 7.513 0.117 17919 64165 1 157 . 1 1 10 10 GLY N N 10 108.890 108.890 110.961 -2.071 17919 64166 1 157 . 1 1 10 10 GLY C C 10 174.070 174.070 174.515 -0.445 17919 64167 1 157 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.541 -0.081 17919 64168 1 157 . 1 1 10 10 GLY H H 10 7.810 7.810 8.205 -0.395 17919 64169 1 157 . 1 1 11 11 LYS N N 11 121.600 121.600 120.945 0.655 17919 64170 1 157 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.235 0.126 17919 64171 1 157 . 1 1 11 11 LYS C C 11 175.940 175.940 175.709 0.231 17919 64172 1 157 . 1 1 11 11 LYS CA C 11 56.280 56.280 57.058 -0.778 17919 64173 1 157 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.033 0.167 17919 64174 1 157 . 1 1 11 11 LYS H H 11 7.280 7.280 7.609 -0.329 17919 64175 1 157 . 1 1 12 12 THR N N 12 120.440 120.440 116.542 3.898 17919 64176 1 157 . 1 1 12 12 THR HA H 12 5.046 5.046 5.302 -0.256 17919 64177 1 157 . 1 1 12 12 THR C C 12 174.320 174.320 174.178 0.142 17919 64178 1 157 . 1 1 12 12 THR CA C 12 62.390 62.390 61.002 1.388 17919 64179 1 157 . 1 1 12 12 THR CB C 12 69.910 69.910 70.387 -0.477 17919 64180 1 157 . 1 1 12 12 THR H H 12 8.650 8.650 8.185 0.465 17919 64181 1 157 . 1 1 13 13 ILE N N 13 127.110 127.110 122.914 4.196 17919 64182 1 157 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.741 -0.197 17919 64183 1 157 . 1 1 13 13 ILE C C 13 175.220 175.220 174.915 0.305 17919 64184 1 157 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.514 0.466 17919 64185 1 157 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.422 -0.472 17919 64186 1 157 . 1 1 13 13 ILE H H 13 9.450 9.450 9.210 0.240 17919 64187 1 157 . 1 1 14 14 THR N N 14 121.520 121.520 121.958 -0.438 17919 64188 1 157 . 1 1 14 14 THR HA H 14 4.964 4.964 5.251 -0.287 17919 64189 1 157 . 1 1 14 14 THR C C 14 173.790 173.790 173.835 -0.045 17919 64190 1 157 . 1 1 14 14 THR CA C 14 61.940 61.940 61.962 -0.022 17919 64191 1 157 . 1 1 14 14 THR CB C 14 69.650 69.650 69.928 -0.278 17919 64192 1 157 . 1 1 14 14 THR H H 14 8.710 8.710 8.462 0.248 17919 64193 1 157 . 1 1 15 15 LEU N N 15 124.800 124.800 124.996 -0.196 17919 64194 1 157 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.781 -0.001 17919 64195 1 157 . 1 1 15 15 LEU C C 15 174.670 174.670 175.218 -0.548 17919 64196 1 157 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.330 -0.500 17919 64197 1 157 . 1 1 15 15 LEU CB C 15 47.070 47.070 46.078 0.992 17919 64198 1 157 . 1 1 15 15 LEU H H 15 8.710 8.710 8.644 0.066 17919 64199 1 157 . 1 1 16 16 GLU N N 16 122.160 122.160 121.866 0.294 17919 64200 1 157 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.371 -0.454 17919 64201 1 157 . 1 1 16 16 GLU C C 16 175.860 175.860 175.740 0.120 17919 64202 1 157 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.050 -0.230 17919 64203 1 157 . 1 1 16 16 GLU CB C 16 29.450 29.450 31.408 -1.958 17919 64204 1 157 . 1 1 16 16 GLU H H 16 8.140 8.140 8.643 -0.503 17919 64205 1 157 . 1 1 17 17 VAL N N 17 117.210 117.210 118.631 -1.421 17919 64206 1 157 . 1 1 17 17 VAL HA H 17 4.714 4.714 5.064 -0.350 17919 64207 1 157 . 1 1 17 17 VAL C C 17 174.160 174.160 175.291 -1.131 17919 64208 1 157 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.567 -0.137 17919 64209 1 157 . 1 1 17 17 VAL CB C 17 36.400 36.400 34.940 1.460 17919 64210 1 157 . 1 1 17 17 VAL H H 17 8.900 8.900 8.189 0.711 17919 64211 1 157 . 1 1 18 18 GLU N N 18 118.990 118.990 121.117 -2.127 17919 64212 1 157 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.610 0.469 17919 64213 1 157 . 1 1 18 18 GLU C C 18 176.160 176.160 175.553 0.607 17919 64214 1 157 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.764 -1.044 17919 64215 1 157 . 1 1 18 18 GLU CB C 18 30.310 30.310 29.467 0.843 17919 64216 1 157 . 1 1 18 18 GLU H H 18 8.640 8.640 8.656 -0.016 17919 64217 1 157 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.317 -0.176 17919 64218 1 157 . 1 1 19 19 PRO C C 19 175.310 175.310 177.661 -2.351 17919 64219 1 157 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.313 0.157 17919 64220 1 157 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.834 0.116 17919 64221 1 157 . 1 1 20 20 SER N N 20 103.400 103.400 110.986 -7.586 17919 64222 1 157 . 1 1 20 20 SER HA H 20 4.370 4.370 4.270 0.100 17919 64223 1 157 . 1 1 20 20 SER C C 20 174.660 174.660 174.466 0.194 17919 64224 1 157 . 1 1 20 20 SER CA C 20 57.400 57.400 58.762 -1.362 17919 64225 1 157 . 1 1 20 20 SER CB C 20 63.370 63.370 62.695 0.675 17919 64226 1 157 . 1 1 20 20 SER H H 20 7.040 7.040 8.340 -1.300 17919 64227 1 157 . 1 1 21 21 ASP N N 21 123.480 123.480 124.254 -0.774 17919 64228 1 157 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.692 0.003 17919 64229 1 157 . 1 1 21 21 ASP C C 21 176.360 176.360 176.658 -0.298 17919 64230 1 157 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.697 1.003 17919 64231 1 157 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.505 -0.705 17919 64232 1 157 . 1 1 21 21 ASP H H 21 8.030 8.030 7.422 0.608 17919 64233 1 157 . 1 1 22 22 THR N N 22 108.800 108.800 115.161 -6.361 17919 64234 1 157 . 1 1 22 22 THR HA H 22 4.920 4.920 4.798 0.122 17919 64235 1 157 . 1 1 22 22 THR C C 22 176.750 176.750 176.441 0.309 17919 64236 1 157 . 1 1 22 22 THR CA C 22 59.690 59.690 61.510 -1.820 17919 64237 1 157 . 1 1 22 22 THR CB C 22 71.200 71.200 70.237 0.963 17919 64238 1 157 . 1 1 22 22 THR H H 22 7.900 7.900 8.405 -0.505 17919 64239 1 157 . 1 1 23 23 ILE N N 23 121.190 121.190 122.067 -0.877 17919 64240 1 157 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.824 -0.167 17919 64241 1 157 . 1 1 23 23 ILE C C 23 179.040 179.040 177.831 1.209 17919 64242 1 157 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.623 -0.363 17919 64243 1 157 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.260 -1.910 17919 64244 1 157 . 1 1 23 23 ILE H H 23 8.560 8.560 8.491 0.069 17919 64245 1 157 . 1 1 24 24 GLU N N 24 120.830 120.830 121.204 -0.374 17919 64246 1 157 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.824 0.093 17919 64247 1 157 . 1 1 24 24 GLU C C 24 178.640 178.640 178.658 -0.018 17919 64248 1 157 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.452 -0.232 17919 64249 1 157 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.277 -0.997 17919 64250 1 157 . 1 1 24 24 GLU H H 24 9.760 9.760 8.252 1.508 17919 64251 1 157 . 1 1 25 25 ASN N N 25 120.570 120.570 118.158 2.412 17919 64252 1 157 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.397 0.128 17919 64253 1 157 . 1 1 25 25 ASN C C 25 178.380 178.380 177.924 0.456 17919 64254 1 157 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.111 -0.051 17919 64255 1 157 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.531 -0.081 17919 64256 1 157 . 1 1 25 25 ASN H H 25 7.920 7.920 8.026 -0.106 17919 64257 1 157 . 1 1 26 26 VAL N N 26 121.710 121.710 120.904 0.806 17919 64258 1 157 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.509 -0.112 17919 64259 1 157 . 1 1 26 26 VAL C C 26 177.950 177.950 177.597 0.353 17919 64260 1 157 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.977 0.683 17919 64261 1 157 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.544 -0.704 17919 64262 1 157 . 1 1 26 26 VAL H H 26 8.070 8.070 7.995 0.075 17919 64263 1 157 . 1 1 27 27 LYS N N 27 118.860 118.860 119.312 -0.452 17919 64264 1 157 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.289 0.291 17919 64265 1 157 . 1 1 27 27 LYS C C 27 180.550 180.550 178.993 1.557 17919 64266 1 157 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.192 0.058 17919 64267 1 157 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.358 1.373 17919 64268 1 157 . 1 1 27 27 LYS H H 27 8.560 8.560 8.326 0.234 17919 64269 1 157 . 1 1 28 28 ALA N N 28 123.440 123.440 122.869 0.571 17919 64270 1 157 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.223 -0.063 17919 64271 1 157 . 1 1 28 28 ALA C C 28 180.300 180.300 179.181 1.119 17919 64272 1 157 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.726 0.644 17919 64273 1 157 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.532 -0.822 17919 64274 1 157 . 1 1 28 28 ALA H H 28 8.060 8.060 8.443 -0.383 17919 64275 1 157 . 1 1 29 29 LYS N N 29 119.940 119.940 119.499 0.441 17919 64276 1 157 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.037 0.170 17919 64277 1 157 . 1 1 29 29 LYS C C 29 180.320 180.320 179.059 1.261 17919 64278 1 157 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.203 0.447 17919 64279 1 157 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.407 0.883 17919 64280 1 157 . 1 1 29 29 LYS H H 29 7.850 7.850 7.912 -0.062 17919 64281 1 157 . 1 1 30 30 ILE N N 30 121.080 121.080 120.549 0.531 17919 64282 1 157 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.566 -0.059 17919 64283 1 157 . 1 1 30 30 ILE C C 30 178.310 178.310 177.254 1.056 17919 64284 1 157 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.841 0.309 17919 64285 1 157 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.673 -0.873 17919 64286 1 157 . 1 1 30 30 ILE H H 30 8.280 8.280 8.274 0.006 17919 64287 1 157 . 1 1 31 31 GLN N N 31 123.490 123.490 120.094 3.396 17919 64288 1 157 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.969 -0.140 17919 64289 1 157 . 1 1 31 31 GLN C C 31 178.890 178.890 178.258 0.632 17919 64290 1 157 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.298 0.702 17919 64291 1 157 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.437 -0.717 17919 64292 1 157 . 1 1 31 31 GLN H H 31 8.580 8.580 7.806 0.774 17919 64293 1 157 . 1 1 32 32 ASP N N 32 119.360 119.360 118.734 0.626 17919 64294 1 157 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.362 -0.008 17919 64295 1 157 . 1 1 32 32 ASP C C 32 177.250 177.250 177.861 -0.611 17919 64296 1 157 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.982 0.208 17919 64297 1 157 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.763 -0.182 17919 64298 1 157 . 1 1 32 32 ASP H H 32 8.010 8.010 7.895 0.115 17919 64299 1 157 . 1 1 33 33 LYS N N 33 115.130 115.130 118.451 -3.321 17919 64300 1 157 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.235 0.102 17919 64301 1 157 . 1 1 33 33 LYS C C 33 177.870 177.870 178.420 -0.550 17919 64302 1 157 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.108 -0.058 17919 64303 1 157 . 1 1 33 33 LYS CB C 33 34.170 34.170 32.999 1.171 17919 64304 1 157 . 1 1 33 33 LYS H H 33 7.430 7.430 7.562 -0.132 17919 64305 1 157 . 1 1 34 34 GLU N N 34 113.870 113.870 115.024 -1.154 17919 64306 1 157 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.445 0.180 17919 64307 1 157 . 1 1 34 34 GLU C C 34 177.840 177.840 177.390 0.450 17919 64308 1 157 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.880 -0.710 17919 64309 1 157 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.628 1.032 17919 64310 1 157 . 1 1 34 34 GLU H H 34 8.740 8.740 8.267 0.473 17919 64311 1 157 . 1 1 35 35 GLY N N 35 108.650 108.650 108.893 -0.243 17919 64312 1 157 . 1 1 35 35 GLY C C 35 173.960 173.960 174.061 -0.101 17919 64313 1 157 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.664 0.416 17919 64314 1 157 . 1 1 35 35 GLY H H 35 8.530 8.530 8.265 0.265 17919 64315 1 157 . 1 1 36 36 ILE N N 36 119.880 119.880 122.092 -2.212 17919 64316 1 157 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.385 0.060 17919 64317 1 157 . 1 1 36 36 ILE C C 36 173.590 173.590 174.226 -0.636 17919 64318 1 157 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.624 0.126 17919 64319 1 157 . 1 1 36 36 ILE CB C 36 40.580 40.580 39.556 1.024 17919 64320 1 157 . 1 1 36 36 ILE H H 36 6.150 6.150 7.600 -1.450 17919 64321 1 157 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.732 -0.098 17919 64322 1 157 . 1 1 37 37 PRO C C 37 176.940 176.940 175.999 0.941 17919 64323 1 157 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.455 0.205 17919 64324 1 157 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.440 0.410 17919 64325 1 157 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.236 -0.119 17919 64326 1 157 . 1 1 38 38 PRO C C 38 178.320 178.320 177.619 0.701 17919 64327 1 157 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.463 0.797 17919 64328 1 157 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.817 1.073 17919 64329 1 157 . 1 1 39 39 ASP N N 39 113.380 113.380 115.217 -1.837 17919 64330 1 157 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.474 -0.044 17919 64331 1 157 . 1 1 39 39 ASP C C 39 177.090 177.090 177.021 0.069 17919 64332 1 157 . 1 1 39 39 ASP CA C 39 55.640 55.640 55.995 -0.355 17919 64333 1 157 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.583 -1.042 17919 64334 1 157 . 1 1 39 39 ASP H H 39 8.550 8.550 8.412 0.138 17919 64335 1 157 . 1 1 40 40 GLN N N 40 116.780 116.780 116.478 0.302 17919 64336 1 157 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.538 -0.074 17919 64337 1 157 . 1 1 40 40 GLN C C 40 175.380 175.380 175.403 -0.023 17919 64338 1 157 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.053 0.587 17919 64339 1 157 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.359 0.781 17919 64340 1 157 . 1 1 40 40 GLN H H 40 7.820 7.820 7.596 0.224 17919 64341 1 157 . 1 1 41 41 GLN N N 41 117.720 117.720 120.113 -2.393 17919 64342 1 157 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.572 -0.328 17919 64343 1 157 . 1 1 41 41 GLN C C 41 176.300 176.300 174.813 1.487 17919 64344 1 157 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.800 0.670 17919 64345 1 157 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.882 1.768 17919 64346 1 157 . 1 1 41 41 GLN H H 41 7.480 7.480 7.294 0.186 17919 64347 1 157 . 1 1 42 42 ARG N N 42 122.680 122.680 123.643 -0.963 17919 64348 1 157 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.628 -0.128 17919 64349 1 157 . 1 1 42 42 ARG C C 42 174.050 174.050 174.078 -0.028 17919 64350 1 157 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.703 0.347 17919 64351 1 157 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.314 -0.564 17919 64352 1 157 . 1 1 42 42 ARG H H 42 8.530 8.530 9.047 -0.517 17919 64353 1 157 . 1 1 43 43 LEU N N 43 124.040 124.040 126.631 -2.591 17919 64354 1 157 . 1 1 43 43 LEU C C 43 175.290 175.290 175.306 -0.016 17919 64355 1 157 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.212 -1.232 17919 64356 1 157 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.580 1.210 17919 64357 1 157 . 1 1 43 43 LEU H H 43 8.820 8.820 8.685 0.135 17919 64358 1 157 . 1 1 44 44 ILE N N 44 121.920 121.920 124.255 -2.335 17919 64359 1 157 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.801 0.191 17919 64360 1 157 . 1 1 44 44 ILE C C 44 176.060 176.060 173.850 2.210 17919 64361 1 157 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.074 -1.094 17919 64362 1 157 . 1 1 44 44 ILE CB C 44 41.420 41.420 42.080 -0.660 17919 64363 1 157 . 1 1 44 44 ILE H H 44 9.030 9.030 9.078 -0.048 17919 64364 1 157 . 1 1 45 45 PHE N N 45 125.390 125.390 124.407 0.983 17919 64365 1 157 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.000 0.045 17919 64366 1 157 . 1 1 45 45 PHE C C 45 174.470 174.470 174.306 0.164 17919 64367 1 157 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.489 0.531 17919 64368 1 157 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.149 0.611 17919 64369 1 157 . 1 1 45 45 PHE H H 45 8.830 8.830 8.819 0.011 17919 64370 1 157 . 1 1 46 46 ALA N N 46 132.200 132.200 128.601 3.599 17919 64371 1 157 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.613 0.077 17919 64372 1 157 . 1 1 46 46 ALA C C 46 177.290 177.290 177.922 -0.632 17919 64373 1 157 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.576 -0.036 17919 64374 1 157 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.519 0.051 17919 64375 1 157 . 1 1 46 46 ALA H H 46 8.810 8.810 8.724 0.086 17919 64376 1 157 . 1 1 47 47 GLY N N 47 102.340 102.340 104.270 -1.930 17919 64377 1 157 . 1 1 47 47 GLY C C 47 173.810 173.810 174.186 -0.376 17919 64378 1 157 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.066 0.284 17919 64379 1 157 . 1 1 47 47 GLY H H 47 8.130 8.130 8.539 -0.409 17919 64380 1 157 . 1 1 48 48 LYS N N 48 121.570 121.570 121.515 0.055 17919 64381 1 157 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.626 -0.004 17919 64382 1 157 . 1 1 48 48 LYS C C 48 174.700 174.700 175.523 -0.823 17919 64383 1 157 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.171 -0.621 17919 64384 1 157 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.151 0.379 17919 64385 1 157 . 1 1 48 48 LYS H H 48 7.980 7.980 7.958 0.022 17919 64386 1 157 . 1 1 49 49 GLN N N 49 122.410 122.410 124.331 -1.921 17919 64387 1 157 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.377 0.183 17919 64388 1 157 . 1 1 49 49 GLN C C 49 175.670 175.670 176.061 -0.391 17919 64389 1 157 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.553 -0.812 17919 64390 1 157 . 1 1 49 49 GLN CB C 49 29.000 29.000 28.948 0.052 17919 64391 1 157 . 1 1 49 49 GLN H H 49 8.600 8.600 8.669 -0.069 17919 64392 1 157 . 1 1 50 50 LEU N N 50 125.520 125.520 125.786 -0.266 17919 64393 1 157 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.337 -0.247 17919 64394 1 157 . 1 1 50 50 LEU C C 50 176.660 176.660 176.739 -0.079 17919 64395 1 157 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.170 0.070 17919 64396 1 157 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.222 -0.652 17919 64397 1 157 . 1 1 50 50 LEU H H 50 8.530 8.530 8.163 0.367 17919 64398 1 157 . 1 1 51 51 GLU N N 51 122.940 122.940 124.685 -1.745 17919 64399 1 157 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.537 -0.049 17919 64400 1 157 . 1 1 51 51 GLU C C 51 175.870 175.870 177.570 -1.700 17919 64401 1 157 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.294 0.666 17919 64402 1 157 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.811 -0.241 17919 64403 1 157 . 1 1 51 51 GLU H H 51 8.400 8.400 8.524 -0.124 17919 64404 1 157 . 1 1 52 52 ASP N N 52 120.030 120.030 127.346 -7.316 17919 64405 1 157 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.466 -0.107 17919 64406 1 157 . 1 1 52 52 ASP C C 52 177.330 177.330 177.498 -0.168 17919 64407 1 157 . 1 1 52 52 ASP CA C 52 56.960 56.960 56.550 0.410 17919 64408 1 157 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.171 0.679 17919 64409 1 157 . 1 1 52 52 ASP H H 52 8.160 8.160 8.717 -0.557 17919 64410 1 157 . 1 1 53 53 GLY N N 53 106.660 106.660 106.769 -0.109 17919 64411 1 157 . 1 1 53 53 GLY C C 53 174.870 174.870 174.571 0.299 17919 64412 1 157 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.971 0.198 17919 64413 1 157 . 1 1 53 53 GLY H H 53 9.390 9.390 8.278 1.112 17919 64414 1 157 . 1 1 54 54 ARG N N 54 119.050 119.050 119.721 -0.671 17919 64415 1 157 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.707 -0.012 17919 64416 1 157 . 1 1 54 54 ARG C C 54 175.350 175.350 175.827 -0.477 17919 64417 1 157 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.098 0.292 17919 64418 1 157 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.545 0.105 17919 64419 1 157 . 1 1 54 54 ARG H H 54 7.460 7.460 7.354 0.106 17919 64420 1 157 . 1 1 55 55 THR N N 55 108.400 108.400 112.643 -4.243 17919 64421 1 157 . 1 1 55 55 THR HA H 55 5.240 5.240 5.025 0.215 17919 64422 1 157 . 1 1 55 55 THR C C 55 176.560 176.560 175.860 0.700 17919 64423 1 157 . 1 1 55 55 THR CA C 55 59.690 59.690 60.331 -0.641 17919 64424 1 157 . 1 1 55 55 THR CB C 55 72.260 72.260 70.849 1.411 17919 64425 1 157 . 1 1 55 55 THR H H 55 8.730 8.730 9.161 -0.431 17919 64426 1 157 . 1 1 56 56 LEU N N 56 117.920 117.920 121.665 -3.745 17919 64427 1 157 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.119 -0.059 17919 64428 1 157 . 1 1 56 56 LEU C C 56 180.810 180.810 179.054 1.756 17919 64429 1 157 . 1 1 56 56 LEU CA C 56 58.710 58.710 57.812 0.898 17919 64430 1 157 . 1 1 56 56 LEU CB C 56 40.370 40.370 40.498 -0.128 17919 64431 1 157 . 1 1 56 56 LEU H H 56 8.140 8.140 8.301 -0.161 17919 64432 1 157 . 1 1 57 57 SER N N 57 113.330 113.330 115.825 -2.495 17919 64433 1 157 . 1 1 57 57 SER HA H 57 4.370 4.370 4.079 0.291 17919 64434 1 157 . 1 1 57 57 SER C C 57 178.310 178.310 176.947 1.363 17919 64435 1 157 . 1 1 57 57 SER CA C 57 61.080 61.080 62.467 -1.387 17919 64436 1 157 . 1 1 57 57 SER CB C 57 62.530 62.530 62.633 -0.103 17919 64437 1 157 . 1 1 57 57 SER H H 57 8.470 8.470 8.685 -0.215 17919 64438 1 157 . 1 1 58 58 ASP N N 58 124.190 124.190 121.300 2.890 17919 64439 1 157 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.341 -0.045 17919 64440 1 157 . 1 1 58 58 ASP C C 58 177.400 177.400 177.599 -0.199 17919 64441 1 157 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.846 0.334 17919 64442 1 157 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.529 -0.429 17919 64443 1 157 . 1 1 58 58 ASP H H 58 7.930 7.930 7.603 0.327 17919 64444 1 157 . 1 1 59 59 TYR N N 59 115.510 115.510 116.180 -0.670 17919 64445 1 157 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.592 0.078 17919 64446 1 157 . 1 1 59 59 TYR C C 59 174.700 174.700 174.459 0.241 17919 64447 1 157 . 1 1 59 59 TYR CA C 59 58.250 58.250 58.220 0.030 17919 64448 1 157 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.468 1.602 17919 64449 1 157 . 1 1 59 59 TYR H H 59 7.250 7.250 7.334 -0.084 17919 64450 1 157 . 1 1 60 60 ASN N N 60 115.900 115.900 115.918 -0.018 17919 64451 1 157 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.362 -0.007 17919 64452 1 157 . 1 1 60 60 ASN C C 60 174.340 174.340 174.468 -0.128 17919 64453 1 157 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.218 -0.098 17919 64454 1 157 . 1 1 60 60 ASN CB C 60 37.410 37.410 36.344 1.066 17919 64455 1 157 . 1 1 60 60 ASN H H 60 8.150 8.150 8.292 -0.142 17919 64456 1 157 . 1 1 61 61 ILE N N 61 118.600 118.600 118.917 -0.317 17919 64457 1 157 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.930 -0.537 17919 64458 1 157 . 1 1 61 61 ILE C C 61 174.610 174.610 175.789 -1.179 17919 64459 1 157 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.910 0.510 17919 64460 1 157 . 1 1 61 61 ILE CB C 61 36.740 36.740 38.246 -1.506 17919 64461 1 157 . 1 1 61 61 ILE H H 61 7.250 7.250 7.962 -0.712 17919 64462 1 157 . 1 1 62 62 GLN N N 62 124.740 124.740 125.628 -0.888 17919 64463 1 157 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.700 -0.194 17919 64464 1 157 . 1 1 62 62 GLN C C 62 175.970 175.970 175.886 0.084 17919 64465 1 157 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.782 -0.122 17919 64466 1 157 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.236 0.414 17919 64467 1 157 . 1 1 62 62 GLN H H 62 7.610 7.610 7.985 -0.375 17919 64468 1 157 . 1 1 63 63 LYS N N 63 120.300 120.300 120.481 -0.181 17919 64469 1 157 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.198 -0.197 17919 64470 1 157 . 1 1 63 63 LYS C C 63 175.810 175.810 177.180 -1.370 17919 64471 1 157 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.162 0.628 17919 64472 1 157 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.039 0.611 17919 64473 1 157 . 1 1 63 63 LYS H H 63 8.490 8.490 8.587 -0.097 17919 64474 1 157 . 1 1 64 64 GLU N N 64 113.950 113.950 120.441 -6.491 17919 64475 1 157 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.471 -0.006 17919 64476 1 157 . 1 1 64 64 GLU C C 64 175.250 175.250 176.062 -0.812 17919 64477 1 157 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.844 0.046 17919 64478 1 157 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.467 -2.567 17919 64479 1 157 . 1 1 64 64 GLU H H 64 9.280 9.280 8.959 0.321 17919 64480 1 157 . 1 1 65 65 SER N N 65 114.730 114.730 116.213 -1.483 17919 64481 1 157 . 1 1 65 65 SER HA H 65 4.640 4.640 4.408 0.232 17919 64482 1 157 . 1 1 65 65 SER C C 65 172.160 172.160 173.570 -1.410 17919 64483 1 157 . 1 1 65 65 SER CA C 65 60.890 60.890 61.009 -0.119 17919 64484 1 157 . 1 1 65 65 SER CB C 65 64.910 64.910 63.813 1.097 17919 64485 1 157 . 1 1 65 65 SER H H 65 7.670 7.670 7.507 0.163 17919 64486 1 157 . 1 1 66 66 THR N N 66 117.110 117.110 120.442 -3.332 17919 64487 1 157 . 1 1 66 66 THR HA H 66 5.270 5.270 5.251 0.019 17919 64488 1 157 . 1 1 66 66 THR C C 66 173.950 173.950 174.109 -0.159 17919 64489 1 157 . 1 1 66 66 THR CA C 66 62.340 62.340 61.855 0.485 17919 64490 1 157 . 1 1 66 66 THR CB C 66 70.080 70.080 69.967 0.113 17919 64491 1 157 . 1 1 66 66 THR H H 66 8.730 8.730 8.338 0.392 17919 64492 1 157 . 1 1 67 67 LEU N N 67 127.110 127.110 125.798 1.312 17919 64493 1 157 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.783 0.277 17919 64494 1 157 . 1 1 67 67 LEU C C 67 175.770 175.770 176.006 -0.236 17919 64495 1 157 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.150 -0.250 17919 64496 1 157 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.301 0.959 17919 64497 1 157 . 1 1 67 67 LEU H H 67 9.410 9.410 9.218 0.192 17919 64498 1 157 . 1 1 68 68 HIS N N 68 118.380 118.380 121.437 -3.057 17919 64499 1 157 . 1 1 68 68 HIS HA H 68 5.240 5.240 4.876 0.364 17919 64500 1 157 . 1 1 68 68 HIS C C 68 173.150 173.150 173.377 -0.227 17919 64501 1 157 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.255 0.745 17919 64502 1 157 . 1 1 68 68 HIS CB C 68 30.530 30.530 31.293 -0.763 17919 64503 1 157 . 1 1 68 68 HIS H H 68 9.230 9.230 9.045 0.185 17919 64504 1 157 . 1 1 69 69 LEU N N 69 124.460 124.460 130.909 -6.449 17919 64505 1 157 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.908 0.282 17919 64506 1 157 . 1 1 69 69 LEU C C 69 175.270 175.270 174.120 1.150 17919 64507 1 157 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.574 0.316 17919 64508 1 157 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.345 0.035 17919 64509 1 157 . 1 1 69 69 LEU H H 69 8.340 8.340 8.485 -0.145 17919 64510 1 157 . 1 1 70 70 VAL N N 70 126.940 126.940 126.674 0.266 17919 64511 1 157 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.331 0.019 17919 64512 1 157 . 1 1 70 70 VAL C C 70 174.000 174.000 174.827 -0.827 17919 64513 1 157 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.631 0.169 17919 64514 1 157 . 1 1 70 70 VAL CB C 70 34.910 34.910 33.221 1.689 17919 64515 1 157 . 1 1 70 70 VAL H H 70 9.200 9.200 9.042 0.158 17919 64516 1 157 . 1 1 71 71 LEU N N 71 123.130 123.130 124.517 -1.387 17919 64517 1 157 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.019 0.041 17919 64518 1 157 . 1 1 71 71 LEU C C 71 177.830 177.830 176.810 1.020 17919 64519 1 157 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.592 0.348 17919 64520 1 157 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.466 -0.616 17919 64521 1 157 . 1 1 71 71 LEU H H 71 8.120 8.120 8.471 -0.351 17919 64522 1 157 . 1 1 72 72 ARG N N 72 123.490 123.490 122.976 0.514 17919 64523 1 157 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.480 -0.179 17919 64524 1 157 . 1 1 72 72 ARG C C 72 175.350 175.350 175.227 0.123 17919 64525 1 157 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.991 -0.381 17919 64526 1 157 . 1 1 72 72 ARG CB C 72 31.350 31.350 31.968 -0.618 17919 64527 1 157 . 1 1 72 72 ARG H H 72 8.580 8.580 8.307 0.273 17919 64528 1 158 . 1 1 2 2 GLN N N 2 123.220 123.220 119.293 3.927 17919 64529 1 158 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.458 -0.209 17919 64530 1 158 . 1 1 2 2 GLN C C 2 175.920 175.920 175.961 -0.041 17919 64531 1 158 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.792 0.288 17919 64532 1 158 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.510 0.250 17919 64533 1 158 . 1 1 2 2 GLN H H 2 8.900 8.900 8.305 0.595 17919 64534 1 158 . 1 1 3 3 ILE N N 3 115.340 115.340 114.670 0.670 17919 64535 1 158 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.137 0.076 17919 64536 1 158 . 1 1 3 3 ILE C C 3 172.450 172.450 173.497 -1.047 17919 64537 1 158 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.327 0.243 17919 64538 1 158 . 1 1 3 3 ILE CB C 3 42.210 42.210 42.006 0.204 17919 64539 1 158 . 1 1 3 3 ILE H H 3 8.320 8.320 8.063 0.257 17919 64540 1 158 . 1 1 4 4 PHE N N 4 118.110 118.110 118.523 -0.413 17919 64541 1 158 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.513 0.117 17919 64542 1 158 . 1 1 4 4 PHE C C 4 175.320 175.320 174.953 0.367 17919 64543 1 158 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.214 -0.004 17919 64544 1 158 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.196 -0.716 17919 64545 1 158 . 1 1 4 4 PHE H H 4 8.610 8.610 8.635 -0.025 17919 64546 1 158 . 1 1 5 5 VAL N N 5 121.000 121.000 120.971 0.029 17919 64547 1 158 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.776 -0.051 17919 64548 1 158 . 1 1 5 5 VAL C C 5 174.870 174.870 174.553 0.317 17919 64549 1 158 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.360 -0.740 17919 64550 1 158 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.494 -0.264 17919 64551 1 158 . 1 1 5 5 VAL H H 5 9.300 9.300 9.307 -0.007 17919 64552 1 158 . 1 1 6 6 LYS N N 6 127.520 127.520 129.416 -1.896 17919 64553 1 158 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.214 0.153 17919 64554 1 158 . 1 1 6 6 LYS C C 6 177.140 177.140 175.962 1.178 17919 64555 1 158 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.858 -0.338 17919 64556 1 158 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.644 -0.594 17919 64557 1 158 . 1 1 6 6 LYS H H 6 8.820 8.820 9.118 -0.298 17919 64558 1 158 . 1 1 7 7 THR N N 7 115.400 115.400 117.496 -2.096 17919 64559 1 158 . 1 1 7 7 THR HA H 7 4.970 4.970 4.920 0.050 17919 64560 1 158 . 1 1 7 7 THR C C 7 176.910 176.910 176.651 0.259 17919 64561 1 158 . 1 1 7 7 THR CA C 7 60.470 60.470 59.889 0.581 17919 64562 1 158 . 1 1 7 7 THR CB C 7 70.630 70.630 71.432 -0.802 17919 64563 1 158 . 1 1 7 7 THR H H 7 8.730 8.730 8.845 -0.115 17919 64564 1 158 . 1 1 8 8 LEU N N 8 121.330 121.330 120.860 0.470 17919 64565 1 158 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.345 -0.035 17919 64566 1 158 . 1 1 8 8 LEU C C 8 178.800 178.800 177.961 0.839 17919 64567 1 158 . 1 1 8 8 LEU CA C 8 57.580 57.580 56.986 0.594 17919 64568 1 158 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.799 0.171 17919 64569 1 158 . 1 1 8 8 LEU H H 8 9.100 9.100 8.930 0.170 17919 64570 1 158 . 1 1 9 9 THR N N 9 105.590 105.590 108.050 -2.460 17919 64571 1 158 . 1 1 9 9 THR HA H 9 4.428 4.428 4.403 0.025 17919 64572 1 158 . 1 1 9 9 THR C C 9 175.520 175.520 175.786 -0.266 17919 64573 1 158 . 1 1 9 9 THR CA C 9 61.400 61.400 62.027 -0.627 17919 64574 1 158 . 1 1 9 9 THR CB C 9 69.140 69.140 69.926 -0.786 17919 64575 1 158 . 1 1 9 9 THR H H 9 7.630 7.630 7.808 -0.178 17919 64576 1 158 . 1 1 10 10 GLY N N 10 108.890 108.890 110.755 -1.865 17919 64577 1 158 . 1 1 10 10 GLY C C 10 174.070 174.070 173.705 0.365 17919 64578 1 158 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.614 0.846 17919 64579 1 158 . 1 1 10 10 GLY H H 10 7.810 7.810 7.901 -0.091 17919 64580 1 158 . 1 1 11 11 LYS N N 11 121.600 121.600 121.794 -0.194 17919 64581 1 158 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.605 -0.244 17919 64582 1 158 . 1 1 11 11 LYS C C 11 175.940 175.940 175.218 0.722 17919 64583 1 158 . 1 1 11 11 LYS CA C 11 56.280 56.280 55.180 1.100 17919 64584 1 158 . 1 1 11 11 LYS CB C 11 33.200 33.200 34.418 -1.218 17919 64585 1 158 . 1 1 11 11 LYS H H 11 7.280 7.280 7.703 -0.423 17919 64586 1 158 . 1 1 12 12 THR N N 12 120.440 120.440 120.208 0.232 17919 64587 1 158 . 1 1 12 12 THR HA H 12 5.046 5.046 5.072 -0.026 17919 64588 1 158 . 1 1 12 12 THR C C 12 174.320 174.320 173.951 0.369 17919 64589 1 158 . 1 1 12 12 THR CA C 12 62.390 62.390 61.375 1.015 17919 64590 1 158 . 1 1 12 12 THR CB C 12 69.910 69.910 70.042 -0.132 17919 64591 1 158 . 1 1 12 12 THR H H 12 8.650 8.650 8.426 0.224 17919 64592 1 158 . 1 1 13 13 ILE N N 13 127.110 127.110 128.654 -1.544 17919 64593 1 158 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.482 0.062 17919 64594 1 158 . 1 1 13 13 ILE C C 13 175.220 175.220 174.981 0.239 17919 64595 1 158 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.632 -0.652 17919 64596 1 158 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.880 0.070 17919 64597 1 158 . 1 1 13 13 ILE H H 13 9.450 9.450 9.105 0.345 17919 64598 1 158 . 1 1 14 14 THR N N 14 121.520 121.520 123.536 -2.016 17919 64599 1 158 . 1 1 14 14 THR HA H 14 4.964 4.964 5.095 -0.131 17919 64600 1 158 . 1 1 14 14 THR C C 14 173.790 173.790 173.895 -0.105 17919 64601 1 158 . 1 1 14 14 THR CA C 14 61.940 61.940 61.793 0.147 17919 64602 1 158 . 1 1 14 14 THR CB C 14 69.650 69.650 70.149 -0.499 17919 64603 1 158 . 1 1 14 14 THR H H 14 8.710 8.710 8.463 0.247 17919 64604 1 158 . 1 1 15 15 LEU N N 15 124.800 124.800 126.671 -1.871 17919 64605 1 158 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.747 0.033 17919 64606 1 158 . 1 1 15 15 LEU C C 15 174.670 174.670 175.731 -1.061 17919 64607 1 158 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.556 -0.725 17919 64608 1 158 . 1 1 15 15 LEU CB C 15 47.070 47.070 44.915 2.155 17919 64609 1 158 . 1 1 15 15 LEU H H 15 8.710 8.710 8.573 0.137 17919 64610 1 158 . 1 1 16 16 GLU N N 16 122.160 122.160 124.087 -1.927 17919 64611 1 158 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.716 0.201 17919 64612 1 158 . 1 1 16 16 GLU C C 16 175.860 175.860 175.964 -0.104 17919 64613 1 158 . 1 1 16 16 GLU CA C 16 54.820 54.820 56.764 -1.944 17919 64614 1 158 . 1 1 16 16 GLU CB C 16 29.450 29.450 29.634 -0.184 17919 64615 1 158 . 1 1 16 16 GLU H H 16 8.140 8.140 8.797 -0.657 17919 64616 1 158 . 1 1 17 17 VAL N N 17 117.210 117.210 120.693 -3.483 17919 64617 1 158 . 1 1 17 17 VAL HA H 17 4.714 4.714 5.116 -0.402 17919 64618 1 158 . 1 1 17 17 VAL C C 17 174.160 174.160 174.740 -0.580 17919 64619 1 158 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.422 -0.992 17919 64620 1 158 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.701 0.699 17919 64621 1 158 . 1 1 17 17 VAL H H 17 8.900 8.900 8.837 0.063 17919 64622 1 158 . 1 1 18 18 GLU N N 18 118.990 118.990 122.860 -3.870 17919 64623 1 158 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.738 0.341 17919 64624 1 158 . 1 1 18 18 GLU C C 18 176.160 176.160 176.530 -0.370 17919 64625 1 158 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.237 -0.517 17919 64626 1 158 . 1 1 18 18 GLU CB C 18 30.310 30.310 29.940 0.370 17919 64627 1 158 . 1 1 18 18 GLU H H 18 8.640 8.640 8.591 0.049 17919 64628 1 158 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.266 -0.125 17919 64629 1 158 . 1 1 19 19 PRO C C 19 175.310 175.310 177.635 -2.325 17919 64630 1 158 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.622 -0.152 17919 64631 1 158 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.046 -0.096 17919 64632 1 158 . 1 1 20 20 SER N N 20 103.400 103.400 109.040 -5.640 17919 64633 1 158 . 1 1 20 20 SER HA H 20 4.370 4.370 4.302 0.068 17919 64634 1 158 . 1 1 20 20 SER C C 20 174.660 174.660 174.447 0.213 17919 64635 1 158 . 1 1 20 20 SER CA C 20 57.400 57.400 59.032 -1.633 17919 64636 1 158 . 1 1 20 20 SER CB C 20 63.370 63.370 62.983 0.387 17919 64637 1 158 . 1 1 20 20 SER H H 20 7.040 7.040 7.955 -0.915 17919 64638 1 158 . 1 1 21 21 ASP N N 21 123.480 123.480 124.454 -0.974 17919 64639 1 158 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.635 0.060 17919 64640 1 158 . 1 1 21 21 ASP C C 21 176.360 176.360 176.104 0.256 17919 64641 1 158 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.546 0.154 17919 64642 1 158 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.392 -0.592 17919 64643 1 158 . 1 1 21 21 ASP H H 21 8.030 8.030 7.729 0.301 17919 64644 1 158 . 1 1 22 22 THR N N 22 108.800 108.800 112.232 -3.432 17919 64645 1 158 . 1 1 22 22 THR HA H 22 4.920 4.920 4.866 0.054 17919 64646 1 158 . 1 1 22 22 THR C C 22 176.750 176.750 176.077 0.673 17919 64647 1 158 . 1 1 22 22 THR CA C 22 59.690 59.690 61.112 -1.422 17919 64648 1 158 . 1 1 22 22 THR CB C 22 71.200 71.200 71.136 0.064 17919 64649 1 158 . 1 1 22 22 THR H H 22 7.900 7.900 8.172 -0.272 17919 64650 1 158 . 1 1 23 23 ILE N N 23 121.190 121.190 123.125 -1.935 17919 64651 1 158 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.789 -0.132 17919 64652 1 158 . 1 1 23 23 ILE C C 23 179.040 179.040 177.749 1.291 17919 64653 1 158 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.506 -0.246 17919 64654 1 158 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.230 -1.880 17919 64655 1 158 . 1 1 23 23 ILE H H 23 8.560 8.560 9.022 -0.462 17919 64656 1 158 . 1 1 24 24 GLU N N 24 120.830 120.830 121.172 -0.342 17919 64657 1 158 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.836 0.081 17919 64658 1 158 . 1 1 24 24 GLU C C 24 178.640 178.640 178.545 0.095 17919 64659 1 158 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.202 0.018 17919 64660 1 158 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.380 -1.100 17919 64661 1 158 . 1 1 24 24 GLU H H 24 9.760 9.760 8.615 1.145 17919 64662 1 158 . 1 1 25 25 ASN N N 25 120.570 120.570 117.258 3.312 17919 64663 1 158 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.508 0.017 17919 64664 1 158 . 1 1 25 25 ASN C C 25 178.380 178.380 177.973 0.407 17919 64665 1 158 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.039 0.021 17919 64666 1 158 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.715 -0.265 17919 64667 1 158 . 1 1 25 25 ASN H H 25 7.920 7.920 7.703 0.217 17919 64668 1 158 . 1 1 26 26 VAL N N 26 121.710 121.710 121.299 0.411 17919 64669 1 158 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.541 -0.144 17919 64670 1 158 . 1 1 26 26 VAL C C 26 177.950 177.950 177.645 0.305 17919 64671 1 158 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.931 0.729 17919 64672 1 158 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.533 -0.693 17919 64673 1 158 . 1 1 26 26 VAL H H 26 8.070 8.070 8.249 -0.179 17919 64674 1 158 . 1 1 27 27 LYS N N 27 118.860 118.860 119.849 -0.989 17919 64675 1 158 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.119 0.461 17919 64676 1 158 . 1 1 27 27 LYS C C 27 180.550 180.550 179.173 1.377 17919 64677 1 158 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.703 -0.453 17919 64678 1 158 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.251 1.479 17919 64679 1 158 . 1 1 27 27 LYS H H 27 8.560 8.560 8.371 0.189 17919 64680 1 158 . 1 1 28 28 ALA N N 28 123.440 123.440 121.141 2.299 17919 64681 1 158 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.160 0.000 17919 64682 1 158 . 1 1 28 28 ALA C C 28 180.300 180.300 179.124 1.176 17919 64683 1 158 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.875 0.495 17919 64684 1 158 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.495 -0.785 17919 64685 1 158 . 1 1 28 28 ALA H H 28 8.060 8.060 7.981 0.079 17919 64686 1 158 . 1 1 29 29 LYS N N 29 119.940 119.940 119.370 0.570 17919 64687 1 158 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.135 0.072 17919 64688 1 158 . 1 1 29 29 LYS C C 29 180.320 180.320 178.997 1.323 17919 64689 1 158 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.102 0.548 17919 64690 1 158 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.452 0.839 17919 64691 1 158 . 1 1 29 29 LYS H H 29 7.850 7.850 7.654 0.196 17919 64692 1 158 . 1 1 30 30 ILE N N 30 121.080 121.080 121.314 -0.234 17919 64693 1 158 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.568 -0.061 17919 64694 1 158 . 1 1 30 30 ILE C C 30 178.310 178.310 177.395 0.915 17919 64695 1 158 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.648 0.502 17919 64696 1 158 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.694 -0.894 17919 64697 1 158 . 1 1 30 30 ILE H H 30 8.280 8.280 8.418 -0.138 17919 64698 1 158 . 1 1 31 31 GLN N N 31 123.490 123.490 120.012 3.478 17919 64699 1 158 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.869 -0.040 17919 64700 1 158 . 1 1 31 31 GLN C C 31 178.890 178.890 178.436 0.454 17919 64701 1 158 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.303 0.697 17919 64702 1 158 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.437 -0.717 17919 64703 1 158 . 1 1 31 31 GLN H H 31 8.580 8.580 8.033 0.547 17919 64704 1 158 . 1 1 32 32 ASP N N 32 119.360 119.360 120.101 -0.741 17919 64705 1 158 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.361 -0.007 17919 64706 1 158 . 1 1 32 32 ASP C C 32 177.250 177.250 178.278 -1.028 17919 64707 1 158 . 1 1 32 32 ASP CA C 32 57.190 57.190 57.041 0.149 17919 64708 1 158 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.763 -0.182 17919 64709 1 158 . 1 1 32 32 ASP H H 32 8.010 8.010 8.551 -0.541 17919 64710 1 158 . 1 1 33 33 LYS N N 33 115.130 115.130 117.521 -2.391 17919 64711 1 158 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.297 0.040 17919 64712 1 158 . 1 1 33 33 LYS C C 33 177.870 177.870 178.252 -0.382 17919 64713 1 158 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.970 0.080 17919 64714 1 158 . 1 1 33 33 LYS CB C 33 34.170 34.170 32.995 1.175 17919 64715 1 158 . 1 1 33 33 LYS H H 33 7.430 7.430 7.570 -0.140 17919 64716 1 158 . 1 1 34 34 GLU N N 34 113.870 113.870 113.805 0.065 17919 64717 1 158 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.537 0.088 17919 64718 1 158 . 1 1 34 34 GLU C C 34 177.840 177.840 177.119 0.721 17919 64719 1 158 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.630 -0.460 17919 64720 1 158 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.723 0.938 17919 64721 1 158 . 1 1 34 34 GLU H H 34 8.740 8.740 7.836 0.904 17919 64722 1 158 . 1 1 35 35 GLY N N 35 108.650 108.650 109.857 -1.207 17919 64723 1 158 . 1 1 35 35 GLY C C 35 173.960 173.960 173.972 -0.012 17919 64724 1 158 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.752 0.328 17919 64725 1 158 . 1 1 35 35 GLY H H 35 8.530 8.530 8.387 0.143 17919 64726 1 158 . 1 1 36 36 ILE N N 36 119.880 119.880 120.914 -1.034 17919 64727 1 158 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.276 0.169 17919 64728 1 158 . 1 1 36 36 ILE C C 36 173.590 173.590 174.175 -0.585 17919 64729 1 158 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.168 -0.418 17919 64730 1 158 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.427 2.153 17919 64731 1 158 . 1 1 36 36 ILE H H 36 6.150 6.150 7.632 -1.482 17919 64732 1 158 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.643 -0.009 17919 64733 1 158 . 1 1 37 37 PRO C C 37 176.940 176.940 175.918 1.022 17919 64734 1 158 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.933 -0.273 17919 64735 1 158 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.453 0.397 17919 64736 1 158 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.168 -0.051 17919 64737 1 158 . 1 1 38 38 PRO C C 38 178.320 178.320 178.412 -0.092 17919 64738 1 158 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.709 0.551 17919 64739 1 158 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.867 1.023 17919 64740 1 158 . 1 1 39 39 ASP N N 39 113.380 113.380 116.795 -3.415 17919 64741 1 158 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.391 0.039 17919 64742 1 158 . 1 1 39 39 ASP C C 39 177.090 177.090 177.724 -0.634 17919 64743 1 158 . 1 1 39 39 ASP CA C 39 55.640 55.640 57.032 -1.392 17919 64744 1 158 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.485 -0.945 17919 64745 1 158 . 1 1 39 39 ASP H H 39 8.550 8.550 8.777 -0.227 17919 64746 1 158 . 1 1 40 40 GLN N N 40 116.780 116.780 117.394 -0.614 17919 64747 1 158 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.294 0.170 17919 64748 1 158 . 1 1 40 40 GLN C C 40 175.380 175.380 174.977 0.403 17919 64749 1 158 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.987 -0.347 17919 64750 1 158 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.180 0.960 17919 64751 1 158 . 1 1 40 40 GLN H H 40 7.820 7.820 7.881 -0.061 17919 64752 1 158 . 1 1 41 41 GLN N N 41 117.720 117.720 118.439 -0.719 17919 64753 1 158 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.546 -0.302 17919 64754 1 158 . 1 1 41 41 GLN C C 41 176.300 176.300 175.509 0.791 17919 64755 1 158 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.581 0.889 17919 64756 1 158 . 1 1 41 41 GLN CB C 41 31.650 31.650 30.078 1.572 17919 64757 1 158 . 1 1 41 41 GLN H H 41 7.480 7.480 7.179 0.301 17919 64758 1 158 . 1 1 42 42 ARG N N 42 122.680 122.680 125.385 -2.705 17919 64759 1 158 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.593 -0.093 17919 64760 1 158 . 1 1 42 42 ARG C C 42 174.050 174.050 173.727 0.323 17919 64761 1 158 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.219 -0.169 17919 64762 1 158 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.427 -0.677 17919 64763 1 158 . 1 1 42 42 ARG H H 42 8.530 8.530 8.273 0.257 17919 64764 1 158 . 1 1 43 43 LEU N N 43 124.040 124.040 127.218 -3.178 17919 64765 1 158 . 1 1 43 43 LEU C C 43 175.290 175.290 176.149 -0.859 17919 64766 1 158 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.236 -1.256 17919 64767 1 158 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.459 2.331 17919 64768 1 158 . 1 1 43 43 LEU H H 43 8.820 8.820 8.771 0.049 17919 64769 1 158 . 1 1 44 44 ILE N N 44 121.920 121.920 122.193 -0.273 17919 64770 1 158 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.154 -0.162 17919 64771 1 158 . 1 1 44 44 ILE C C 44 176.060 176.060 174.422 1.638 17919 64772 1 158 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.187 -1.207 17919 64773 1 158 . 1 1 44 44 ILE CB C 44 41.420 41.420 42.071 -0.651 17919 64774 1 158 . 1 1 44 44 ILE H H 44 9.030 9.030 8.947 0.083 17919 64775 1 158 . 1 1 45 45 PHE N N 45 125.390 125.390 124.798 0.592 17919 64776 1 158 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.986 0.059 17919 64777 1 158 . 1 1 45 45 PHE C C 45 174.470 174.470 174.629 -0.159 17919 64778 1 158 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.984 0.036 17919 64779 1 158 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.792 0.968 17919 64780 1 158 . 1 1 45 45 PHE H H 45 8.830 8.830 8.737 0.093 17919 64781 1 158 . 1 1 46 46 ALA N N 46 132.200 132.200 129.561 2.639 17919 64782 1 158 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.637 0.053 17919 64783 1 158 . 1 1 46 46 ALA C C 46 177.290 177.290 177.852 -0.562 17919 64784 1 158 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.821 -0.281 17919 64785 1 158 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.566 0.004 17919 64786 1 158 . 1 1 46 46 ALA H H 46 8.810 8.810 8.688 0.122 17919 64787 1 158 . 1 1 47 47 GLY N N 47 102.340 102.340 103.690 -1.350 17919 64788 1 158 . 1 1 47 47 GLY C C 47 173.810 173.810 174.051 -0.241 17919 64789 1 158 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.784 0.566 17919 64790 1 158 . 1 1 47 47 GLY H H 47 8.130 8.130 8.373 -0.243 17919 64791 1 158 . 1 1 48 48 LYS N N 48 121.570 121.570 121.372 0.198 17919 64792 1 158 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.616 0.006 17919 64793 1 158 . 1 1 48 48 LYS C C 48 174.700 174.700 175.685 -0.985 17919 64794 1 158 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.892 -0.342 17919 64795 1 158 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.319 0.210 17919 64796 1 158 . 1 1 48 48 LYS H H 48 7.980 7.980 7.789 0.191 17919 64797 1 158 . 1 1 49 49 GLN N N 49 122.410 122.410 124.139 -1.729 17919 64798 1 158 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.389 0.171 17919 64799 1 158 . 1 1 49 49 GLN C C 49 175.670 175.670 175.681 -0.011 17919 64800 1 158 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.502 -0.762 17919 64801 1 158 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.333 -0.333 17919 64802 1 158 . 1 1 49 49 GLN H H 49 8.600 8.600 8.580 0.020 17919 64803 1 158 . 1 1 50 50 LEU N N 50 125.520 125.520 127.954 -2.434 17919 64804 1 158 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.104 -0.014 17919 64805 1 158 . 1 1 50 50 LEU C C 50 176.660 176.660 175.778 0.882 17919 64806 1 158 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.821 0.419 17919 64807 1 158 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.735 -0.165 17919 64808 1 158 . 1 1 50 50 LEU H H 50 8.530 8.530 8.037 0.493 17919 64809 1 158 . 1 1 51 51 GLU N N 51 122.940 122.940 122.884 0.056 17919 64810 1 158 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.589 -0.101 17919 64811 1 158 . 1 1 51 51 GLU C C 51 175.870 175.870 176.805 -0.935 17919 64812 1 158 . 1 1 51 51 GLU CA C 51 55.960 55.960 54.795 1.165 17919 64813 1 158 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.554 -0.984 17919 64814 1 158 . 1 1 51 51 GLU H H 51 8.400 8.400 8.398 0.002 17919 64815 1 158 . 1 1 52 52 ASP N N 52 120.030 120.030 122.707 -2.677 17919 64816 1 158 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.494 -0.135 17919 64817 1 158 . 1 1 52 52 ASP C C 52 177.330 177.330 178.149 -0.819 17919 64818 1 158 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.333 -0.373 17919 64819 1 158 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.634 0.216 17919 64820 1 158 . 1 1 52 52 ASP H H 52 8.160 8.160 8.827 -0.667 17919 64821 1 158 . 1 1 53 53 GLY N N 53 106.660 106.660 106.318 0.342 17919 64822 1 158 . 1 1 53 53 GLY C C 53 174.870 174.870 174.133 0.737 17919 64823 1 158 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.894 0.276 17919 64824 1 158 . 1 1 53 53 GLY H H 53 9.390 9.390 8.482 0.908 17919 64825 1 158 . 1 1 54 54 ARG N N 54 119.050 119.050 119.989 -0.939 17919 64826 1 158 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.728 -0.033 17919 64827 1 158 . 1 1 54 54 ARG C C 54 175.350 175.350 175.456 -0.106 17919 64828 1 158 . 1 1 54 54 ARG CA C 54 54.390 54.390 53.995 0.395 17919 64829 1 158 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.751 -0.101 17919 64830 1 158 . 1 1 54 54 ARG H H 54 7.460 7.460 7.554 -0.094 17919 64831 1 158 . 1 1 55 55 THR N N 55 108.400 108.400 110.279 -1.879 17919 64832 1 158 . 1 1 55 55 THR HA H 55 5.240 5.240 5.261 -0.021 17919 64833 1 158 . 1 1 55 55 THR C C 55 176.560 176.560 176.131 0.429 17919 64834 1 158 . 1 1 55 55 THR CA C 55 59.690 59.690 59.258 0.432 17919 64835 1 158 . 1 1 55 55 THR CB C 55 72.260 72.260 72.115 0.145 17919 64836 1 158 . 1 1 55 55 THR H H 55 8.730 8.730 8.686 0.044 17919 64837 1 158 . 1 1 56 56 LEU N N 56 117.920 117.920 121.543 -3.623 17919 64838 1 158 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.978 0.082 17919 64839 1 158 . 1 1 56 56 LEU C C 56 180.810 180.810 178.887 1.923 17919 64840 1 158 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.341 0.369 17919 64841 1 158 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.621 -1.251 17919 64842 1 158 . 1 1 56 56 LEU H H 56 8.140 8.140 8.515 -0.375 17919 64843 1 158 . 1 1 57 57 SER N N 57 113.330 113.330 115.085 -1.755 17919 64844 1 158 . 1 1 57 57 SER HA H 57 4.370 4.370 4.204 0.166 17919 64845 1 158 . 1 1 57 57 SER C C 57 178.310 178.310 176.712 1.598 17919 64846 1 158 . 1 1 57 57 SER CA C 57 61.080 61.080 62.443 -1.363 17919 64847 1 158 . 1 1 57 57 SER CB C 57 62.530 62.530 62.978 -0.448 17919 64848 1 158 . 1 1 57 57 SER H H 57 8.470 8.470 8.140 0.330 17919 64849 1 158 . 1 1 58 58 ASP N N 58 124.190 124.190 122.756 1.434 17919 64850 1 158 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.349 -0.053 17919 64851 1 158 . 1 1 58 58 ASP C C 58 177.400 177.400 177.297 0.103 17919 64852 1 158 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.452 0.728 17919 64853 1 158 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.348 -0.248 17919 64854 1 158 . 1 1 58 58 ASP H H 58 7.930 7.930 7.649 0.281 17919 64855 1 158 . 1 1 59 59 TYR N N 59 115.510 115.510 116.232 -0.722 17919 64856 1 158 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.598 0.072 17919 64857 1 158 . 1 1 59 59 TYR C C 59 174.700 174.700 174.668 0.032 17919 64858 1 158 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.346 0.904 17919 64859 1 158 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.211 1.859 17919 64860 1 158 . 1 1 59 59 TYR H H 59 7.250 7.250 7.353 -0.103 17919 64861 1 158 . 1 1 60 60 ASN N N 60 115.900 115.900 116.146 -0.246 17919 64862 1 158 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.405 -0.050 17919 64863 1 158 . 1 1 60 60 ASN C C 60 174.340 174.340 174.764 -0.424 17919 64864 1 158 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.395 -0.275 17919 64865 1 158 . 1 1 60 60 ASN CB C 60 37.410 37.410 36.598 0.812 17919 64866 1 158 . 1 1 60 60 ASN H H 60 8.150 8.150 7.752 0.398 17919 64867 1 158 . 1 1 61 61 ILE N N 61 118.600 118.600 119.270 -0.670 17919 64868 1 158 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.958 -0.565 17919 64869 1 158 . 1 1 61 61 ILE C C 61 174.610 174.610 175.489 -0.879 17919 64870 1 158 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.783 0.637 17919 64871 1 158 . 1 1 61 61 ILE CB C 61 36.740 36.740 38.040 -1.300 17919 64872 1 158 . 1 1 61 61 ILE H H 61 7.250 7.250 8.232 -0.982 17919 64873 1 158 . 1 1 62 62 GLN N N 62 124.740 124.740 124.975 -0.235 17919 64874 1 158 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.755 -0.249 17919 64875 1 158 . 1 1 62 62 GLN C C 62 175.970 175.970 175.646 0.324 17919 64876 1 158 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.221 0.439 17919 64877 1 158 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.154 0.496 17919 64878 1 158 . 1 1 62 62 GLN H H 62 7.610 7.610 8.128 -0.518 17919 64879 1 158 . 1 1 63 63 LYS N N 63 120.300 120.300 120.356 -0.056 17919 64880 1 158 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.122 -0.121 17919 64881 1 158 . 1 1 63 63 LYS C C 63 175.810 175.810 177.062 -1.252 17919 64882 1 158 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.675 0.115 17919 64883 1 158 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.919 0.731 17919 64884 1 158 . 1 1 63 63 LYS H H 63 8.490 8.490 8.552 -0.062 17919 64885 1 158 . 1 1 64 64 GLU N N 64 113.950 113.950 119.223 -5.273 17919 64886 1 158 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.421 0.044 17919 64887 1 158 . 1 1 64 64 GLU C C 64 175.250 175.250 176.340 -1.090 17919 64888 1 158 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.562 0.328 17919 64889 1 158 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.759 -2.859 17919 64890 1 158 . 1 1 64 64 GLU H H 64 9.280 9.280 8.413 0.867 17919 64891 1 158 . 1 1 65 65 SER N N 65 114.730 114.730 116.595 -1.865 17919 64892 1 158 . 1 1 65 65 SER HA H 65 4.640 4.640 4.428 0.212 17919 64893 1 158 . 1 1 65 65 SER C C 65 172.160 172.160 173.530 -1.370 17919 64894 1 158 . 1 1 65 65 SER CA C 65 60.890 60.890 60.853 0.037 17919 64895 1 158 . 1 1 65 65 SER CB C 65 64.910 64.910 63.745 1.165 17919 64896 1 158 . 1 1 65 65 SER H H 65 7.670 7.670 7.439 0.231 17919 64897 1 158 . 1 1 66 66 THR N N 66 117.110 117.110 119.599 -2.489 17919 64898 1 158 . 1 1 66 66 THR HA H 66 5.270 5.270 5.199 0.071 17919 64899 1 158 . 1 1 66 66 THR C C 66 173.950 173.950 174.074 -0.124 17919 64900 1 158 . 1 1 66 66 THR CA C 66 62.340 62.340 62.155 0.185 17919 64901 1 158 . 1 1 66 66 THR CB C 66 70.080 70.080 70.072 0.008 17919 64902 1 158 . 1 1 66 66 THR H H 66 8.730 8.730 8.428 0.302 17919 64903 1 158 . 1 1 67 67 LEU N N 67 127.110 127.110 127.221 -0.111 17919 64904 1 158 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.999 0.061 17919 64905 1 158 . 1 1 67 67 LEU C C 67 175.770 175.770 175.333 0.437 17919 64906 1 158 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.073 -0.173 17919 64907 1 158 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.720 -0.460 17919 64908 1 158 . 1 1 67 67 LEU H H 67 9.410 9.410 9.313 0.097 17919 64909 1 158 . 1 1 68 68 HIS N N 68 118.380 118.380 120.374 -1.994 17919 64910 1 158 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.490 -0.250 17919 64911 1 158 . 1 1 68 68 HIS C C 68 173.150 173.150 173.647 -0.497 17919 64912 1 158 . 1 1 68 68 HIS CA C 68 55.000 55.000 53.924 1.076 17919 64913 1 158 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.671 -2.141 17919 64914 1 158 . 1 1 68 68 HIS H H 68 9.230 9.230 8.841 0.389 17919 64915 1 158 . 1 1 69 69 LEU N N 69 124.460 124.460 128.857 -4.397 17919 64916 1 158 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.955 0.235 17919 64917 1 158 . 1 1 69 69 LEU C C 69 175.270 175.270 174.410 0.860 17919 64918 1 158 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.463 0.427 17919 64919 1 158 . 1 1 69 69 LEU CB C 69 44.380 44.380 45.215 -0.835 17919 64920 1 158 . 1 1 69 69 LEU H H 69 8.340 8.340 8.124 0.216 17919 64921 1 158 . 1 1 70 70 VAL N N 70 126.940 126.940 122.675 4.265 17919 64922 1 158 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.502 -0.152 17919 64923 1 158 . 1 1 70 70 VAL C C 70 174.000 174.000 173.711 0.289 17919 64924 1 158 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.766 1.034 17919 64925 1 158 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.531 -0.621 17919 64926 1 158 . 1 1 70 70 VAL H H 70 9.200 9.200 8.508 0.692 17919 64927 1 158 . 1 1 71 71 LEU N N 71 123.130 123.130 122.843 0.287 17919 64928 1 158 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.046 0.014 17919 64929 1 158 . 1 1 71 71 LEU C C 71 177.830 177.830 177.753 0.077 17919 64930 1 158 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.163 0.777 17919 64931 1 158 . 1 1 71 71 LEU CB C 71 42.850 42.850 41.937 0.913 17919 64932 1 158 . 1 1 71 71 LEU H H 71 8.120 8.120 8.282 -0.162 17919 64933 1 158 . 1 1 72 72 ARG N N 72 123.490 123.490 123.146 0.344 17919 64934 1 158 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.327 -0.026 17919 64935 1 158 . 1 1 72 72 ARG C C 72 175.350 175.350 175.558 -0.208 17919 64936 1 158 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.382 -0.772 17919 64937 1 158 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.776 0.574 17919 64938 1 158 . 1 1 72 72 ARG H H 72 8.580 8.580 8.275 0.305 17919 64939 1 159 . 1 1 2 2 GLN N N 2 123.220 123.220 119.517 3.703 17919 64940 1 159 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.019 0.230 17919 64941 1 159 . 1 1 2 2 GLN C C 2 175.920 175.920 175.633 0.287 17919 64942 1 159 . 1 1 2 2 GLN CA C 2 55.080 55.080 55.076 0.004 17919 64943 1 159 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.428 0.332 17919 64944 1 159 . 1 1 2 2 GLN H H 2 8.900 8.900 8.361 0.539 17919 64945 1 159 . 1 1 3 3 ILE N N 3 115.340 115.340 115.884 -0.544 17919 64946 1 159 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.399 -0.186 17919 64947 1 159 . 1 1 3 3 ILE C C 3 172.450 172.450 173.361 -0.911 17919 64948 1 159 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.445 0.125 17919 64949 1 159 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.779 0.431 17919 64950 1 159 . 1 1 3 3 ILE H H 3 8.320 8.320 8.971 -0.651 17919 64951 1 159 . 1 1 4 4 PHE N N 4 118.110 118.110 121.549 -3.439 17919 64952 1 159 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.647 -0.017 17919 64953 1 159 . 1 1 4 4 PHE C C 4 175.320 175.320 174.989 0.331 17919 64954 1 159 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.041 0.169 17919 64955 1 159 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.099 -0.619 17919 64956 1 159 . 1 1 4 4 PHE H H 4 8.610 8.610 8.970 -0.360 17919 64957 1 159 . 1 1 5 5 VAL N N 5 121.000 121.000 122.955 -1.955 17919 64958 1 159 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.748 -0.023 17919 64959 1 159 . 1 1 5 5 VAL C C 5 174.870 174.870 174.556 0.314 17919 64960 1 159 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.262 -0.642 17919 64961 1 159 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.702 0.528 17919 64962 1 159 . 1 1 5 5 VAL H H 5 9.300 9.300 9.200 0.100 17919 64963 1 159 . 1 1 6 6 LYS N N 6 127.520 127.520 129.391 -1.871 17919 64964 1 159 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.352 0.015 17919 64965 1 159 . 1 1 6 6 LYS C C 6 177.140 177.140 176.398 0.742 17919 64966 1 159 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.264 0.256 17919 64967 1 159 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.452 -0.402 17919 64968 1 159 . 1 1 6 6 LYS H H 6 8.820 8.820 9.313 -0.493 17919 64969 1 159 . 1 1 7 7 THR N N 7 115.400 115.400 118.733 -3.333 17919 64970 1 159 . 1 1 7 7 THR HA H 7 4.970 4.970 4.573 0.397 17919 64971 1 159 . 1 1 7 7 THR C C 7 176.910 176.910 175.962 0.948 17919 64972 1 159 . 1 1 7 7 THR CA C 7 60.470 60.470 60.909 -0.439 17919 64973 1 159 . 1 1 7 7 THR CB C 7 70.630 70.630 70.155 0.475 17919 64974 1 159 . 1 1 7 7 THR H H 7 8.730 8.730 8.915 -0.185 17919 64975 1 159 . 1 1 8 8 LEU N N 8 121.330 121.330 123.306 -1.976 17919 64976 1 159 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.426 -0.116 17919 64977 1 159 . 1 1 8 8 LEU C C 8 178.800 178.800 176.925 1.875 17919 64978 1 159 . 1 1 8 8 LEU CA C 8 57.580 57.580 56.988 0.592 17919 64979 1 159 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.054 -0.084 17919 64980 1 159 . 1 1 8 8 LEU H H 8 9.100 9.100 8.365 0.735 17919 64981 1 159 . 1 1 9 9 THR N N 9 105.590 105.590 110.191 -4.601 17919 64982 1 159 . 1 1 9 9 THR HA H 9 4.428 4.428 4.400 0.028 17919 64983 1 159 . 1 1 9 9 THR C C 9 175.520 175.520 175.402 0.118 17919 64984 1 159 . 1 1 9 9 THR CA C 9 61.400 61.400 61.266 0.135 17919 64985 1 159 . 1 1 9 9 THR CB C 9 69.140 69.140 68.853 0.287 17919 64986 1 159 . 1 1 9 9 THR H H 9 7.630 7.630 7.565 0.065 17919 64987 1 159 . 1 1 10 10 GLY N N 10 108.890 108.890 110.482 -1.592 17919 64988 1 159 . 1 1 10 10 GLY C C 10 174.070 174.070 173.973 0.097 17919 64989 1 159 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.181 0.279 17919 64990 1 159 . 1 1 10 10 GLY H H 10 7.810 7.810 8.059 -0.249 17919 64991 1 159 . 1 1 11 11 LYS N N 11 121.600 121.600 121.689 -0.089 17919 64992 1 159 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.384 -0.023 17919 64993 1 159 . 1 1 11 11 LYS C C 11 175.940 175.940 175.425 0.515 17919 64994 1 159 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.560 -0.280 17919 64995 1 159 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.511 -0.312 17919 64996 1 159 . 1 1 11 11 LYS H H 11 7.280 7.280 7.631 -0.351 17919 64997 1 159 . 1 1 12 12 THR N N 12 120.440 120.440 119.431 1.009 17919 64998 1 159 . 1 1 12 12 THR HA H 12 5.046 5.046 5.386 -0.340 17919 64999 1 159 . 1 1 12 12 THR C C 12 174.320 174.320 173.976 0.344 17919 65000 1 159 . 1 1 12 12 THR CA C 12 62.390 62.390 60.775 1.615 17919 65001 1 159 . 1 1 12 12 THR CB C 12 69.910 69.910 70.646 -0.736 17919 65002 1 159 . 1 1 12 12 THR H H 12 8.650 8.650 8.341 0.309 17919 65003 1 159 . 1 1 13 13 ILE N N 13 127.110 127.110 120.616 6.494 17919 65004 1 159 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.796 -0.252 17919 65005 1 159 . 1 1 13 13 ILE C C 13 175.220 175.220 174.493 0.727 17919 65006 1 159 . 1 1 13 13 ILE CA C 13 59.980 59.980 58.918 1.062 17919 65007 1 159 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.929 -0.979 17919 65008 1 159 . 1 1 13 13 ILE H H 13 9.450 9.450 8.911 0.539 17919 65009 1 159 . 1 1 14 14 THR N N 14 121.520 121.520 122.016 -0.496 17919 65010 1 159 . 1 1 14 14 THR HA H 14 4.964 4.964 5.280 -0.316 17919 65011 1 159 . 1 1 14 14 THR C C 14 173.790 173.790 173.889 -0.099 17919 65012 1 159 . 1 1 14 14 THR CA C 14 61.940 61.940 62.163 -0.223 17919 65013 1 159 . 1 1 14 14 THR CB C 14 69.650 69.650 69.686 -0.036 17919 65014 1 159 . 1 1 14 14 THR H H 14 8.710 8.710 8.499 0.211 17919 65015 1 159 . 1 1 15 15 LEU N N 15 124.800 124.800 126.927 -2.127 17919 65016 1 159 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.851 -0.071 17919 65017 1 159 . 1 1 15 15 LEU C C 15 174.670 174.670 175.182 -0.512 17919 65018 1 159 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.711 -0.880 17919 65019 1 159 . 1 1 15 15 LEU CB C 15 47.070 47.070 46.510 0.560 17919 65020 1 159 . 1 1 15 15 LEU H H 15 8.710 8.710 8.690 0.020 17919 65021 1 159 . 1 1 16 16 GLU N N 16 122.160 122.160 122.414 -0.254 17919 65022 1 159 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.451 -0.534 17919 65023 1 159 . 1 1 16 16 GLU C C 16 175.860 175.860 175.450 0.410 17919 65024 1 159 . 1 1 16 16 GLU CA C 16 54.820 54.820 54.761 0.059 17919 65025 1 159 . 1 1 16 16 GLU CB C 16 29.450 29.450 31.098 -1.648 17919 65026 1 159 . 1 1 16 16 GLU H H 16 8.140 8.140 8.596 -0.456 17919 65027 1 159 . 1 1 17 17 VAL N N 17 117.210 117.210 119.273 -2.063 17919 65028 1 159 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.919 -0.205 17919 65029 1 159 . 1 1 17 17 VAL C C 17 174.160 174.160 174.472 -0.312 17919 65030 1 159 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.191 -0.762 17919 65031 1 159 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.309 1.091 17919 65032 1 159 . 1 1 17 17 VAL H H 17 8.900 8.900 8.673 0.227 17919 65033 1 159 . 1 1 18 18 GLU N N 18 118.990 118.990 119.001 -0.011 17919 65034 1 159 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.877 0.202 17919 65035 1 159 . 1 1 18 18 GLU C C 18 176.160 176.160 175.423 0.737 17919 65036 1 159 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.133 -0.413 17919 65037 1 159 . 1 1 18 18 GLU CB C 18 30.310 30.310 31.749 -1.439 17919 65038 1 159 . 1 1 18 18 GLU H H 18 8.640 8.640 8.822 -0.182 17919 65039 1 159 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.262 -0.121 17919 65040 1 159 . 1 1 19 19 PRO C C 19 175.310 175.310 177.402 -2.092 17919 65041 1 159 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.507 -0.037 17919 65042 1 159 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.180 -0.230 17919 65043 1 159 . 1 1 20 20 SER N N 20 103.400 103.400 108.013 -4.613 17919 65044 1 159 . 1 1 20 20 SER HA H 20 4.370 4.370 4.326 0.044 17919 65045 1 159 . 1 1 20 20 SER C C 20 174.660 174.660 174.905 -0.245 17919 65046 1 159 . 1 1 20 20 SER CA C 20 57.400 57.400 58.977 -1.577 17919 65047 1 159 . 1 1 20 20 SER CB C 20 63.370 63.370 63.209 0.161 17919 65048 1 159 . 1 1 20 20 SER H H 20 7.040 7.040 7.866 -0.826 17919 65049 1 159 . 1 1 21 21 ASP N N 21 123.480 123.480 124.560 -1.080 17919 65050 1 159 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.646 0.049 17919 65051 1 159 . 1 1 21 21 ASP C C 21 176.360 176.360 176.208 0.152 17919 65052 1 159 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.425 0.276 17919 65053 1 159 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.572 -0.772 17919 65054 1 159 . 1 1 21 21 ASP H H 21 8.030 8.030 7.642 0.388 17919 65055 1 159 . 1 1 22 22 THR N N 22 108.800 108.800 111.221 -2.421 17919 65056 1 159 . 1 1 22 22 THR HA H 22 4.920 4.920 5.095 -0.175 17919 65057 1 159 . 1 1 22 22 THR C C 22 176.750 176.750 176.566 0.184 17919 65058 1 159 . 1 1 22 22 THR CA C 22 59.690 59.690 60.035 -0.346 17919 65059 1 159 . 1 1 22 22 THR CB C 22 71.200 71.200 71.365 -0.165 17919 65060 1 159 . 1 1 22 22 THR H H 22 7.900 7.900 8.881 -0.981 17919 65061 1 159 . 1 1 23 23 ILE N N 23 121.190 121.190 121.744 -0.554 17919 65062 1 159 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.662 -0.005 17919 65063 1 159 . 1 1 23 23 ILE C C 23 179.040 179.040 177.679 1.361 17919 65064 1 159 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.690 -1.430 17919 65065 1 159 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.320 -1.970 17919 65066 1 159 . 1 1 23 23 ILE H H 23 8.560 8.560 8.638 -0.078 17919 65067 1 159 . 1 1 24 24 GLU N N 24 120.830 120.830 120.854 -0.024 17919 65068 1 159 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.864 0.053 17919 65069 1 159 . 1 1 24 24 GLU C C 24 178.640 178.640 178.369 0.271 17919 65070 1 159 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.424 -0.204 17919 65071 1 159 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.450 -1.170 17919 65072 1 159 . 1 1 24 24 GLU H H 24 9.760 9.760 8.657 1.103 17919 65073 1 159 . 1 1 25 25 ASN N N 25 120.570 120.570 117.870 2.700 17919 65074 1 159 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.447 0.078 17919 65075 1 159 . 1 1 25 25 ASN C C 25 178.380 178.380 178.093 0.287 17919 65076 1 159 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.898 0.162 17919 65077 1 159 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.379 0.071 17919 65078 1 159 . 1 1 25 25 ASN H H 25 7.920 7.920 7.602 0.318 17919 65079 1 159 . 1 1 26 26 VAL N N 26 121.710 121.710 121.945 -0.235 17919 65080 1 159 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.541 -0.144 17919 65081 1 159 . 1 1 26 26 VAL C C 26 177.950 177.950 177.355 0.595 17919 65082 1 159 . 1 1 26 26 VAL CA C 26 67.660 67.660 67.269 0.391 17919 65083 1 159 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.464 -0.624 17919 65084 1 159 . 1 1 26 26 VAL H H 26 8.070 8.070 7.698 0.372 17919 65085 1 159 . 1 1 27 27 LYS N N 27 118.860 118.860 120.291 -1.431 17919 65086 1 159 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.154 0.426 17919 65087 1 159 . 1 1 27 27 LYS C C 27 180.550 180.550 179.169 1.381 17919 65088 1 159 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.727 -0.477 17919 65089 1 159 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.293 1.437 17919 65090 1 159 . 1 1 27 27 LYS H H 27 8.560 8.560 8.219 0.341 17919 65091 1 159 . 1 1 28 28 ALA N N 28 123.440 123.440 121.638 1.802 17919 65092 1 159 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.101 0.059 17919 65093 1 159 . 1 1 28 28 ALA C C 28 180.300 180.300 179.329 0.971 17919 65094 1 159 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.084 0.286 17919 65095 1 159 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.451 -0.741 17919 65096 1 159 . 1 1 28 28 ALA H H 28 8.060 8.060 8.510 -0.450 17919 65097 1 159 . 1 1 29 29 LYS N N 29 119.940 119.940 119.116 0.824 17919 65098 1 159 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.080 0.127 17919 65099 1 159 . 1 1 29 29 LYS C C 29 180.320 180.320 178.978 1.342 17919 65100 1 159 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.057 0.593 17919 65101 1 159 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.467 0.823 17919 65102 1 159 . 1 1 29 29 LYS H H 29 7.850 7.850 7.513 0.337 17919 65103 1 159 . 1 1 30 30 ILE N N 30 121.080 121.080 120.846 0.234 17919 65104 1 159 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.560 -0.053 17919 65105 1 159 . 1 1 30 30 ILE C C 30 178.310 178.310 177.229 1.081 17919 65106 1 159 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.939 0.211 17919 65107 1 159 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.722 -0.922 17919 65108 1 159 . 1 1 30 30 ILE H H 30 8.280 8.280 8.642 -0.362 17919 65109 1 159 . 1 1 31 31 GLN N N 31 123.490 123.490 120.265 3.225 17919 65110 1 159 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.882 -0.053 17919 65111 1 159 . 1 1 31 31 GLN C C 31 178.890 178.890 178.502 0.388 17919 65112 1 159 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.395 0.605 17919 65113 1 159 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.356 -0.636 17919 65114 1 159 . 1 1 31 31 GLN H H 31 8.580 8.580 8.038 0.542 17919 65115 1 159 . 1 1 32 32 ASP N N 32 119.360 119.360 119.420 -0.060 17919 65116 1 159 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.368 -0.014 17919 65117 1 159 . 1 1 32 32 ASP C C 32 177.250 177.250 178.066 -0.816 17919 65118 1 159 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.856 0.334 17919 65119 1 159 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.788 -0.207 17919 65120 1 159 . 1 1 32 32 ASP H H 32 8.010 8.010 8.045 -0.035 17919 65121 1 159 . 1 1 33 33 LYS N N 33 115.130 115.130 117.763 -2.633 17919 65122 1 159 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.395 -0.058 17919 65123 1 159 . 1 1 33 33 LYS C C 33 177.870 177.870 178.552 -0.682 17919 65124 1 159 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.764 0.286 17919 65125 1 159 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.310 0.860 17919 65126 1 159 . 1 1 33 33 LYS H H 33 7.430 7.430 7.486 -0.056 17919 65127 1 159 . 1 1 34 34 GLU N N 34 113.870 113.870 115.424 -1.554 17919 65128 1 159 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.443 0.182 17919 65129 1 159 . 1 1 34 34 GLU C C 34 177.840 177.840 177.426 0.414 17919 65130 1 159 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.123 -0.953 17919 65131 1 159 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.358 1.302 17919 65132 1 159 . 1 1 34 34 GLU H H 34 8.740 8.740 8.395 0.345 17919 65133 1 159 . 1 1 35 35 GLY N N 35 108.650 108.650 108.761 -0.111 17919 65134 1 159 . 1 1 35 35 GLY C C 35 173.960 173.960 174.399 -0.439 17919 65135 1 159 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.575 0.505 17919 65136 1 159 . 1 1 35 35 GLY H H 35 8.530 8.530 8.086 0.444 17919 65137 1 159 . 1 1 36 36 ILE N N 36 119.880 119.880 121.835 -1.955 17919 65138 1 159 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.224 0.221 17919 65139 1 159 . 1 1 36 36 ILE C C 36 173.590 173.590 174.273 -0.683 17919 65140 1 159 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.328 -0.578 17919 65141 1 159 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.108 2.472 17919 65142 1 159 . 1 1 36 36 ILE H H 36 6.150 6.150 7.657 -1.507 17919 65143 1 159 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.502 0.132 17919 65144 1 159 . 1 1 37 37 PRO C C 37 176.940 176.940 176.046 0.894 17919 65145 1 159 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.985 -0.325 17919 65146 1 159 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.362 0.488 17919 65147 1 159 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.220 -0.103 17919 65148 1 159 . 1 1 38 38 PRO C C 38 178.320 178.320 178.088 0.232 17919 65149 1 159 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.369 0.891 17919 65150 1 159 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.936 0.954 17919 65151 1 159 . 1 1 39 39 ASP N N 39 113.380 113.380 114.668 -1.288 17919 65152 1 159 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.451 -0.021 17919 65153 1 159 . 1 1 39 39 ASP C C 39 177.090 177.090 177.489 -0.399 17919 65154 1 159 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.277 -0.637 17919 65155 1 159 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.348 -0.808 17919 65156 1 159 . 1 1 39 39 ASP H H 39 8.550 8.550 8.644 -0.094 17919 65157 1 159 . 1 1 40 40 GLN N N 40 116.780 116.780 117.255 -0.475 17919 65158 1 159 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.365 0.099 17919 65159 1 159 . 1 1 40 40 GLN C C 40 175.380 175.380 176.239 -0.859 17919 65160 1 159 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.112 -0.472 17919 65161 1 159 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.662 0.478 17919 65162 1 159 . 1 1 40 40 GLN H H 40 7.820 7.820 8.169 -0.349 17919 65163 1 159 . 1 1 41 41 GLN N N 41 117.720 117.720 119.269 -1.549 17919 65164 1 159 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.438 -0.194 17919 65165 1 159 . 1 1 41 41 GLN C C 41 176.300 176.300 175.688 0.612 17919 65166 1 159 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.072 0.398 17919 65167 1 159 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.357 2.293 17919 65168 1 159 . 1 1 41 41 GLN H H 41 7.480 7.480 7.311 0.169 17919 65169 1 159 . 1 1 42 42 ARG N N 42 122.680 122.680 126.457 -3.777 17919 65170 1 159 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.639 -0.139 17919 65171 1 159 . 1 1 42 42 ARG C C 42 174.050 174.050 173.942 0.108 17919 65172 1 159 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.885 0.165 17919 65173 1 159 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.216 -0.466 17919 65174 1 159 . 1 1 42 42 ARG H H 42 8.530 8.530 8.830 -0.300 17919 65175 1 159 . 1 1 43 43 LEU N N 43 124.040 124.040 127.785 -3.745 17919 65176 1 159 . 1 1 43 43 LEU C C 43 175.290 175.290 175.545 -0.255 17919 65177 1 159 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.637 -0.657 17919 65178 1 159 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.071 1.719 17919 65179 1 159 . 1 1 43 43 LEU H H 43 8.820 8.820 8.765 0.055 17919 65180 1 159 . 1 1 44 44 ILE N N 44 121.920 121.920 122.297 -0.377 17919 65181 1 159 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.987 0.005 17919 65182 1 159 . 1 1 44 44 ILE C C 44 176.060 176.060 174.154 1.906 17919 65183 1 159 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.602 -1.622 17919 65184 1 159 . 1 1 44 44 ILE CB C 44 41.420 41.420 42.075 -0.655 17919 65185 1 159 . 1 1 44 44 ILE H H 44 9.030 9.030 9.066 -0.036 17919 65186 1 159 . 1 1 45 45 PHE N N 45 125.390 125.390 127.084 -1.694 17919 65187 1 159 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.043 0.002 17919 65188 1 159 . 1 1 45 45 PHE C C 45 174.470 174.470 174.678 -0.208 17919 65189 1 159 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.395 0.625 17919 65190 1 159 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.433 0.327 17919 65191 1 159 . 1 1 45 45 PHE H H 45 8.830 8.830 8.892 -0.062 17919 65192 1 159 . 1 1 46 46 ALA N N 46 132.200 132.200 130.129 2.071 17919 65193 1 159 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.683 0.007 17919 65194 1 159 . 1 1 46 46 ALA C C 46 177.290 177.290 177.586 -0.296 17919 65195 1 159 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.686 -0.146 17919 65196 1 159 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.480 0.090 17919 65197 1 159 . 1 1 46 46 ALA H H 46 8.810 8.810 8.500 0.310 17919 65198 1 159 . 1 1 47 47 GLY N N 47 102.340 102.340 104.421 -2.081 17919 65199 1 159 . 1 1 47 47 GLY C C 47 173.810 173.810 174.443 -0.633 17919 65200 1 159 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.255 0.094 17919 65201 1 159 . 1 1 47 47 GLY H H 47 8.130 8.130 8.448 -0.318 17919 65202 1 159 . 1 1 48 48 LYS N N 48 121.570 121.570 121.622 -0.052 17919 65203 1 159 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.673 -0.051 17919 65204 1 159 . 1 1 48 48 LYS C C 48 174.700 174.700 175.013 -0.313 17919 65205 1 159 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.285 0.265 17919 65206 1 159 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.766 -0.236 17919 65207 1 159 . 1 1 48 48 LYS H H 48 7.980 7.980 7.788 0.192 17919 65208 1 159 . 1 1 49 49 GLN N N 49 122.410 122.410 122.113 0.297 17919 65209 1 159 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.622 -0.062 17919 65210 1 159 . 1 1 49 49 GLN C C 49 175.670 175.670 176.031 -0.361 17919 65211 1 159 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.839 -0.099 17919 65212 1 159 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.464 -0.464 17919 65213 1 159 . 1 1 49 49 GLN H H 49 8.600 8.600 8.535 0.065 17919 65214 1 159 . 1 1 50 50 LEU N N 50 125.520 125.520 128.028 -2.508 17919 65215 1 159 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.320 -0.230 17919 65216 1 159 . 1 1 50 50 LEU C C 50 176.660 176.660 176.552 0.108 17919 65217 1 159 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.485 -0.245 17919 65218 1 159 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.837 -0.268 17919 65219 1 159 . 1 1 50 50 LEU H H 50 8.530 8.530 8.323 0.207 17919 65220 1 159 . 1 1 51 51 GLU N N 51 122.940 122.940 123.747 -0.807 17919 65221 1 159 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.505 -0.017 17919 65222 1 159 . 1 1 51 51 GLU C C 51 175.870 175.870 176.682 -0.812 17919 65223 1 159 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.665 0.295 17919 65224 1 159 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.205 0.365 17919 65225 1 159 . 1 1 51 51 GLU H H 51 8.400 8.400 8.488 -0.088 17919 65226 1 159 . 1 1 52 52 ASP N N 52 120.030 120.030 124.650 -4.620 17919 65227 1 159 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.428 -0.069 17919 65228 1 159 . 1 1 52 52 ASP C C 52 177.330 177.330 177.595 -0.265 17919 65229 1 159 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.191 -0.231 17919 65230 1 159 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.971 -0.121 17919 65231 1 159 . 1 1 52 52 ASP H H 52 8.160 8.160 8.796 -0.636 17919 65232 1 159 . 1 1 53 53 GLY N N 53 106.660 106.660 105.980 0.680 17919 65233 1 159 . 1 1 53 53 GLY C C 53 174.870 174.870 173.996 0.874 17919 65234 1 159 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.681 0.489 17919 65235 1 159 . 1 1 53 53 GLY H H 53 9.390 9.390 8.441 0.949 17919 65236 1 159 . 1 1 54 54 ARG N N 54 119.050 119.050 120.759 -1.709 17919 65237 1 159 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.778 -0.083 17919 65238 1 159 . 1 1 54 54 ARG C C 54 175.350 175.350 174.567 0.783 17919 65239 1 159 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.105 0.285 17919 65240 1 159 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.853 -0.203 17919 65241 1 159 . 1 1 54 54 ARG H H 54 7.460 7.460 7.545 -0.085 17919 65242 1 159 . 1 1 55 55 THR N N 55 108.400 108.400 115.321 -6.921 17919 65243 1 159 . 1 1 55 55 THR HA H 55 5.240 5.240 4.786 0.454 17919 65244 1 159 . 1 1 55 55 THR C C 55 176.560 176.560 176.150 0.410 17919 65245 1 159 . 1 1 55 55 THR CA C 55 59.690 59.690 60.945 -1.255 17919 65246 1 159 . 1 1 55 55 THR CB C 55 72.260 72.260 69.909 2.351 17919 65247 1 159 . 1 1 55 55 THR H H 55 8.730 8.730 8.272 0.458 17919 65248 1 159 . 1 1 56 56 LEU N N 56 117.920 117.920 123.776 -5.856 17919 65249 1 159 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.951 0.109 17919 65250 1 159 . 1 1 56 56 LEU C C 56 180.810 180.810 178.757 2.053 17919 65251 1 159 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.521 0.189 17919 65252 1 159 . 1 1 56 56 LEU CB C 56 40.370 40.370 40.867 -0.497 17919 65253 1 159 . 1 1 56 56 LEU H H 56 8.140 8.140 9.064 -0.924 17919 65254 1 159 . 1 1 57 57 SER N N 57 113.330 113.330 113.799 -0.469 17919 65255 1 159 . 1 1 57 57 SER HA H 57 4.370 4.370 4.085 0.285 17919 65256 1 159 . 1 1 57 57 SER C C 57 178.310 178.310 176.859 1.451 17919 65257 1 159 . 1 1 57 57 SER CA C 57 61.080 61.080 61.300 -0.220 17919 65258 1 159 . 1 1 57 57 SER CB C 57 62.530 62.530 62.376 0.154 17919 65259 1 159 . 1 1 57 57 SER H H 57 8.470 8.470 8.416 0.054 17919 65260 1 159 . 1 1 58 58 ASP N N 58 124.190 124.190 122.158 2.032 17919 65261 1 159 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.321 -0.025 17919 65262 1 159 . 1 1 58 58 ASP C C 58 177.400 177.400 176.888 0.512 17919 65263 1 159 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.215 0.965 17919 65264 1 159 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.551 -0.451 17919 65265 1 159 . 1 1 58 58 ASP H H 58 7.930 7.930 7.972 -0.042 17919 65266 1 159 . 1 1 59 59 TYR N N 59 115.510 115.510 116.247 -0.737 17919 65267 1 159 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.548 0.122 17919 65268 1 159 . 1 1 59 59 TYR C C 59 174.700 174.700 175.195 -0.495 17919 65269 1 159 . 1 1 59 59 TYR CA C 59 58.250 58.250 58.250 -0.000 17919 65270 1 159 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.889 1.181 17919 65271 1 159 . 1 1 59 59 TYR H H 59 7.250 7.250 7.423 -0.173 17919 65272 1 159 . 1 1 60 60 ASN N N 60 115.900 115.900 115.651 0.249 17919 65273 1 159 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.431 -0.076 17919 65274 1 159 . 1 1 60 60 ASN C C 60 174.340 174.340 174.612 -0.272 17919 65275 1 159 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.080 0.040 17919 65276 1 159 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.647 -0.237 17919 65277 1 159 . 1 1 60 60 ASN H H 60 8.150 8.150 7.944 0.206 17919 65278 1 159 . 1 1 61 61 ILE N N 61 118.600 118.600 119.837 -1.237 17919 65279 1 159 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.738 -0.345 17919 65280 1 159 . 1 1 61 61 ILE C C 61 174.610 174.610 174.655 -0.045 17919 65281 1 159 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.112 0.308 17919 65282 1 159 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.483 -0.743 17919 65283 1 159 . 1 1 61 61 ILE H H 61 7.250 7.250 8.155 -0.905 17919 65284 1 159 . 1 1 62 62 GLN N N 62 124.740 124.740 124.940 -0.200 17919 65285 1 159 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.850 -0.344 17919 65286 1 159 . 1 1 62 62 GLN C C 62 175.970 175.970 175.355 0.615 17919 65287 1 159 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.064 0.596 17919 65288 1 159 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.809 -0.159 17919 65289 1 159 . 1 1 62 62 GLN H H 62 7.610 7.610 8.350 -0.740 17919 65290 1 159 . 1 1 63 63 LYS N N 63 120.300 120.300 122.312 -2.012 17919 65291 1 159 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.020 -0.019 17919 65292 1 159 . 1 1 63 63 LYS C C 63 175.810 175.810 176.973 -1.163 17919 65293 1 159 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.118 -0.328 17919 65294 1 159 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.072 0.578 17919 65295 1 159 . 1 1 63 63 LYS H H 63 8.490 8.490 8.492 -0.003 17919 65296 1 159 . 1 1 64 64 GLU N N 64 113.950 113.950 122.545 -8.595 17919 65297 1 159 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.398 0.067 17919 65298 1 159 . 1 1 64 64 GLU C C 64 175.250 175.250 176.477 -1.227 17919 65299 1 159 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.796 0.094 17919 65300 1 159 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.321 -2.421 17919 65301 1 159 . 1 1 64 64 GLU H H 64 9.280 9.280 8.860 0.420 17919 65302 1 159 . 1 1 65 65 SER N N 65 114.730 114.730 115.539 -0.809 17919 65303 1 159 . 1 1 65 65 SER HA H 65 4.640 4.640 4.361 0.279 17919 65304 1 159 . 1 1 65 65 SER C C 65 172.160 172.160 173.807 -1.647 17919 65305 1 159 . 1 1 65 65 SER CA C 65 60.890 60.890 60.910 -0.020 17919 65306 1 159 . 1 1 65 65 SER CB C 65 64.910 64.910 63.867 1.043 17919 65307 1 159 . 1 1 65 65 SER H H 65 7.670 7.670 7.900 -0.230 17919 65308 1 159 . 1 1 66 66 THR N N 66 117.110 117.110 118.727 -1.617 17919 65309 1 159 . 1 1 66 66 THR HA H 66 5.270 5.270 5.173 0.097 17919 65310 1 159 . 1 1 66 66 THR C C 66 173.950 173.950 174.210 -0.260 17919 65311 1 159 . 1 1 66 66 THR CA C 66 62.340 62.340 62.077 0.264 17919 65312 1 159 . 1 1 66 66 THR CB C 66 70.080 70.080 70.171 -0.091 17919 65313 1 159 . 1 1 66 66 THR H H 66 8.730 8.730 8.532 0.198 17919 65314 1 159 . 1 1 67 67 LEU N N 67 127.110 127.110 127.731 -0.621 17919 65315 1 159 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.738 0.322 17919 65316 1 159 . 1 1 67 67 LEU C C 67 175.770 175.770 175.286 0.484 17919 65317 1 159 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.848 0.052 17919 65318 1 159 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.618 -0.358 17919 65319 1 159 . 1 1 67 67 LEU H H 67 9.410 9.410 9.288 0.122 17919 65320 1 159 . 1 1 68 68 HIS N N 68 118.380 118.380 123.436 -5.056 17919 65321 1 159 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.387 -0.147 17919 65322 1 159 . 1 1 68 68 HIS C C 68 173.150 173.150 173.766 -0.616 17919 65323 1 159 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.704 0.296 17919 65324 1 159 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.221 -1.691 17919 65325 1 159 . 1 1 68 68 HIS H H 68 9.230 9.230 9.105 0.125 17919 65326 1 159 . 1 1 69 69 LEU N N 69 124.460 124.460 129.721 -5.261 17919 65327 1 159 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.775 0.415 17919 65328 1 159 . 1 1 69 69 LEU C C 69 175.270 175.270 173.885 1.385 17919 65329 1 159 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.639 0.251 17919 65330 1 159 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.732 -0.352 17919 65331 1 159 . 1 1 69 69 LEU H H 69 8.340 8.340 8.141 0.199 17919 65332 1 159 . 1 1 70 70 VAL N N 70 126.940 126.940 126.206 0.734 17919 65333 1 159 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.374 -0.024 17919 65334 1 159 . 1 1 70 70 VAL C C 70 174.000 174.000 174.222 -0.222 17919 65335 1 159 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.231 0.569 17919 65336 1 159 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.664 -0.754 17919 65337 1 159 . 1 1 70 70 VAL H H 70 9.200 9.200 9.017 0.183 17919 65338 1 159 . 1 1 71 71 LEU N N 71 123.130 123.130 124.702 -1.572 17919 65339 1 159 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.972 0.088 17919 65340 1 159 . 1 1 71 71 LEU C C 71 177.830 177.830 177.201 0.629 17919 65341 1 159 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.882 0.058 17919 65342 1 159 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.139 -0.289 17919 65343 1 159 . 1 1 71 71 LEU H H 71 8.120 8.120 8.477 -0.357 17919 65344 1 159 . 1 1 72 72 ARG N N 72 123.490 123.490 123.459 0.031 17919 65345 1 159 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.347 -0.046 17919 65346 1 159 . 1 1 72 72 ARG C C 72 175.350 175.350 175.664 -0.314 17919 65347 1 159 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.142 -0.531 17919 65348 1 159 . 1 1 72 72 ARG CB C 72 31.350 31.350 29.967 1.383 17919 65349 1 159 . 1 1 72 72 ARG H H 72 8.580 8.580 8.482 0.098 17919 65350 1 160 . 1 1 2 2 GLN N N 2 123.220 123.220 122.219 1.001 17919 65351 1 160 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.434 -0.185 17919 65352 1 160 . 1 1 2 2 GLN C C 2 175.920 175.920 174.514 1.406 17919 65353 1 160 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.386 0.694 17919 65354 1 160 . 1 1 2 2 GLN CB C 2 30.760 30.760 31.418 -0.658 17919 65355 1 160 . 1 1 2 2 GLN H H 2 8.900 8.900 8.452 0.448 17919 65356 1 160 . 1 1 3 3 ILE N N 3 115.340 115.340 119.484 -4.144 17919 65357 1 160 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.698 -0.485 17919 65358 1 160 . 1 1 3 3 ILE C C 3 172.450 172.450 173.379 -0.929 17919 65359 1 160 . 1 1 3 3 ILE CA C 3 59.570 59.570 58.547 1.023 17919 65360 1 160 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.447 0.763 17919 65361 1 160 . 1 1 3 3 ILE H H 3 8.320 8.320 8.353 -0.033 17919 65362 1 160 . 1 1 4 4 PHE N N 4 118.110 118.110 119.573 -1.463 17919 65363 1 160 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.402 0.228 17919 65364 1 160 . 1 1 4 4 PHE C C 4 175.320 175.320 175.410 -0.090 17919 65365 1 160 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.690 -0.480 17919 65366 1 160 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.835 -0.355 17919 65367 1 160 . 1 1 4 4 PHE H H 4 8.610 8.610 8.181 0.429 17919 65368 1 160 . 1 1 5 5 VAL N N 5 121.000 121.000 122.019 -1.019 17919 65369 1 160 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.431 0.294 17919 65370 1 160 . 1 1 5 5 VAL C C 5 174.870 174.870 174.593 0.277 17919 65371 1 160 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.490 -0.870 17919 65372 1 160 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.641 0.589 17919 65373 1 160 . 1 1 5 5 VAL H H 5 9.300 9.300 8.998 0.302 17919 65374 1 160 . 1 1 6 6 LYS N N 6 127.520 127.520 128.807 -1.287 17919 65375 1 160 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.160 0.207 17919 65376 1 160 . 1 1 6 6 LYS C C 6 177.140 177.140 176.108 1.032 17919 65377 1 160 . 1 1 6 6 LYS CA C 6 54.520 54.520 53.903 0.617 17919 65378 1 160 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.472 -0.422 17919 65379 1 160 . 1 1 6 6 LYS H H 6 8.820 8.820 9.013 -0.193 17919 65380 1 160 . 1 1 7 7 THR N N 7 115.400 115.400 118.098 -2.698 17919 65381 1 160 . 1 1 7 7 THR HA H 7 4.970 4.970 4.936 0.034 17919 65382 1 160 . 1 1 7 7 THR C C 7 176.910 176.910 175.843 1.067 17919 65383 1 160 . 1 1 7 7 THR CA C 7 60.470 60.470 60.315 0.155 17919 65384 1 160 . 1 1 7 7 THR CB C 7 70.630 70.630 70.882 -0.252 17919 65385 1 160 . 1 1 7 7 THR H H 7 8.730 8.730 8.771 -0.041 17919 65386 1 160 . 1 1 8 8 LEU N N 8 121.330 121.330 121.101 0.229 17919 65387 1 160 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.313 -0.003 17919 65388 1 160 . 1 1 8 8 LEU C C 8 178.800 178.800 177.557 1.243 17919 65389 1 160 . 1 1 8 8 LEU CA C 8 57.580 57.580 56.844 0.736 17919 65390 1 160 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.296 -0.326 17919 65391 1 160 . 1 1 8 8 LEU H H 8 9.100 9.100 8.582 0.518 17919 65392 1 160 . 1 1 9 9 THR N N 9 105.590 105.590 109.656 -4.066 17919 65393 1 160 . 1 1 9 9 THR HA H 9 4.428 4.428 4.348 0.080 17919 65394 1 160 . 1 1 9 9 THR C C 9 175.520 175.520 175.699 -0.179 17919 65395 1 160 . 1 1 9 9 THR CA C 9 61.400 61.400 61.691 -0.291 17919 65396 1 160 . 1 1 9 9 THR CB C 9 69.140 69.140 69.484 -0.344 17919 65397 1 160 . 1 1 9 9 THR H H 9 7.630 7.630 7.684 -0.054 17919 65398 1 160 . 1 1 10 10 GLY N N 10 108.890 108.890 111.444 -2.554 17919 65399 1 160 . 1 1 10 10 GLY C C 10 174.070 174.070 173.751 0.319 17919 65400 1 160 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.109 0.351 17919 65401 1 160 . 1 1 10 10 GLY H H 10 7.810 7.810 7.857 -0.047 17919 65402 1 160 . 1 1 11 11 LYS N N 11 121.600 121.600 122.605 -1.005 17919 65403 1 160 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.578 -0.217 17919 65404 1 160 . 1 1 11 11 LYS C C 11 175.940 175.940 175.701 0.239 17919 65405 1 160 . 1 1 11 11 LYS CA C 11 56.280 56.280 55.118 1.162 17919 65406 1 160 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.437 -0.237 17919 65407 1 160 . 1 1 11 11 LYS H H 11 7.280 7.280 7.832 -0.552 17919 65408 1 160 . 1 1 12 12 THR N N 12 120.440 120.440 121.270 -0.830 17919 65409 1 160 . 1 1 12 12 THR HA H 12 5.046 5.046 5.047 -0.001 17919 65410 1 160 . 1 1 12 12 THR C C 12 174.320 174.320 174.599 -0.279 17919 65411 1 160 . 1 1 12 12 THR CA C 12 62.390 62.390 61.909 0.481 17919 65412 1 160 . 1 1 12 12 THR CB C 12 69.910 69.910 69.603 0.307 17919 65413 1 160 . 1 1 12 12 THR H H 12 8.650 8.650 8.491 0.159 17919 65414 1 160 . 1 1 13 13 ILE N N 13 127.110 127.110 127.970 -0.860 17919 65415 1 160 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.602 -0.058 17919 65416 1 160 . 1 1 13 13 ILE C C 13 175.220 175.220 175.234 -0.014 17919 65417 1 160 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.628 -0.648 17919 65418 1 160 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.029 0.921 17919 65419 1 160 . 1 1 13 13 ILE H H 13 9.450 9.450 9.027 0.423 17919 65420 1 160 . 1 1 14 14 THR N N 14 121.520 121.520 122.198 -0.678 17919 65421 1 160 . 1 1 14 14 THR HA H 14 4.964 4.964 4.931 0.033 17919 65422 1 160 . 1 1 14 14 THR C C 14 173.790 173.790 173.756 0.034 17919 65423 1 160 . 1 1 14 14 THR CA C 14 61.940 61.940 61.436 0.504 17919 65424 1 160 . 1 1 14 14 THR CB C 14 69.650 69.650 70.004 -0.354 17919 65425 1 160 . 1 1 14 14 THR H H 14 8.710 8.710 8.244 0.466 17919 65426 1 160 . 1 1 15 15 LEU N N 15 124.800 124.800 126.867 -2.067 17919 65427 1 160 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.726 0.054 17919 65428 1 160 . 1 1 15 15 LEU C C 15 174.670 174.670 175.253 -0.583 17919 65429 1 160 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.458 -0.628 17919 65430 1 160 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.508 1.562 17919 65431 1 160 . 1 1 15 15 LEU H H 15 8.710 8.710 8.905 -0.195 17919 65432 1 160 . 1 1 16 16 GLU N N 16 122.160 122.160 121.089 1.071 17919 65433 1 160 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.452 -0.535 17919 65434 1 160 . 1 1 16 16 GLU C C 16 175.860 175.860 176.192 -0.332 17919 65435 1 160 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.190 -0.370 17919 65436 1 160 . 1 1 16 16 GLU CB C 16 29.450 29.450 31.709 -2.259 17919 65437 1 160 . 1 1 16 16 GLU H H 16 8.140 8.140 8.579 -0.439 17919 65438 1 160 . 1 1 17 17 VAL N N 17 117.210 117.210 117.892 -0.682 17919 65439 1 160 . 1 1 17 17 VAL HA H 17 4.714 4.714 5.053 -0.339 17919 65440 1 160 . 1 1 17 17 VAL C C 17 174.160 174.160 174.580 -0.420 17919 65441 1 160 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.741 -0.311 17919 65442 1 160 . 1 1 17 17 VAL CB C 17 36.400 36.400 36.061 0.339 17919 65443 1 160 . 1 1 17 17 VAL H H 17 8.900 8.900 9.033 -0.133 17919 65444 1 160 . 1 1 18 18 GLU N N 18 118.990 118.990 119.846 -0.856 17919 65445 1 160 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.861 0.218 17919 65446 1 160 . 1 1 18 18 GLU C C 18 176.160 176.160 175.150 1.010 17919 65447 1 160 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.378 0.342 17919 65448 1 160 . 1 1 18 18 GLU CB C 18 30.310 30.310 29.579 0.731 17919 65449 1 160 . 1 1 18 18 GLU H H 18 8.640 8.640 9.189 -0.549 17919 65450 1 160 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.277 -0.136 17919 65451 1 160 . 1 1 19 19 PRO C C 19 175.310 175.310 177.819 -2.509 17919 65452 1 160 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.332 0.138 17919 65453 1 160 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.938 0.012 17919 65454 1 160 . 1 1 20 20 SER N N 20 103.400 103.400 111.198 -7.798 17919 65455 1 160 . 1 1 20 20 SER HA H 20 4.370 4.370 4.364 0.006 17919 65456 1 160 . 1 1 20 20 SER C C 20 174.660 174.660 174.635 0.025 17919 65457 1 160 . 1 1 20 20 SER CA C 20 57.400 57.400 59.294 -1.894 17919 65458 1 160 . 1 1 20 20 SER CB C 20 63.370 63.370 62.834 0.536 17919 65459 1 160 . 1 1 20 20 SER H H 20 7.040 7.040 8.117 -1.077 17919 65460 1 160 . 1 1 21 21 ASP N N 21 123.480 123.480 123.788 -0.308 17919 65461 1 160 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.826 -0.131 17919 65462 1 160 . 1 1 21 21 ASP C C 21 176.360 176.360 175.655 0.705 17919 65463 1 160 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.062 0.638 17919 65464 1 160 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.829 -1.029 17919 65465 1 160 . 1 1 21 21 ASP H H 21 8.030 8.030 7.942 0.088 17919 65466 1 160 . 1 1 22 22 THR N N 22 108.800 108.800 113.972 -5.172 17919 65467 1 160 . 1 1 22 22 THR HA H 22 4.920 4.920 4.705 0.215 17919 65468 1 160 . 1 1 22 22 THR C C 22 176.750 176.750 176.272 0.478 17919 65469 1 160 . 1 1 22 22 THR CA C 22 59.690 59.690 61.782 -2.092 17919 65470 1 160 . 1 1 22 22 THR CB C 22 71.200 71.200 70.146 1.054 17919 65471 1 160 . 1 1 22 22 THR H H 22 7.900 7.900 8.300 -0.400 17919 65472 1 160 . 1 1 23 23 ILE N N 23 121.190 121.190 122.009 -0.819 17919 65473 1 160 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.778 -0.121 17919 65474 1 160 . 1 1 23 23 ILE C C 23 179.040 179.040 177.658 1.382 17919 65475 1 160 . 1 1 23 23 ILE CA C 23 62.260 62.260 61.772 0.488 17919 65476 1 160 . 1 1 23 23 ILE CB C 23 34.350 34.350 35.761 -1.411 17919 65477 1 160 . 1 1 23 23 ILE H H 23 8.560 8.560 8.330 0.230 17919 65478 1 160 . 1 1 24 24 GLU N N 24 120.830 120.830 121.243 -0.413 17919 65479 1 160 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.875 0.042 17919 65480 1 160 . 1 1 24 24 GLU C C 24 178.640 178.640 178.730 -0.090 17919 65481 1 160 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.068 0.152 17919 65482 1 160 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.495 -1.215 17919 65483 1 160 . 1 1 24 24 GLU H H 24 9.760 9.760 8.808 0.952 17919 65484 1 160 . 1 1 25 25 ASN N N 25 120.570 120.570 118.006 2.564 17919 65485 1 160 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.464 0.061 17919 65486 1 160 . 1 1 25 25 ASN C C 25 178.380 178.380 177.857 0.523 17919 65487 1 160 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.290 -0.230 17919 65488 1 160 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.533 -0.083 17919 65489 1 160 . 1 1 25 25 ASN H H 25 7.920 7.920 7.641 0.279 17919 65490 1 160 . 1 1 26 26 VAL N N 26 121.710 121.710 120.728 0.982 17919 65491 1 160 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.624 -0.227 17919 65492 1 160 . 1 1 26 26 VAL C C 26 177.950 177.950 177.810 0.140 17919 65493 1 160 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.548 1.112 17919 65494 1 160 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.638 -0.798 17919 65495 1 160 . 1 1 26 26 VAL H H 26 8.070 8.070 7.877 0.193 17919 65496 1 160 . 1 1 27 27 LYS N N 27 118.860 118.860 120.412 -1.552 17919 65497 1 160 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.113 0.467 17919 65498 1 160 . 1 1 27 27 LYS C C 27 180.550 180.550 179.023 1.527 17919 65499 1 160 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.831 -0.581 17919 65500 1 160 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.231 1.499 17919 65501 1 160 . 1 1 27 27 LYS H H 27 8.560 8.560 8.452 0.108 17919 65502 1 160 . 1 1 28 28 ALA N N 28 123.440 123.440 121.557 1.883 17919 65503 1 160 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.105 0.055 17919 65504 1 160 . 1 1 28 28 ALA C C 28 180.300 180.300 179.430 0.870 17919 65505 1 160 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.914 0.456 17919 65506 1 160 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.298 -0.588 17919 65507 1 160 . 1 1 28 28 ALA H H 28 8.060 8.060 8.109 -0.049 17919 65508 1 160 . 1 1 29 29 LYS N N 29 119.940 119.940 118.878 1.062 17919 65509 1 160 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.056 0.151 17919 65510 1 160 . 1 1 29 29 LYS C C 29 180.320 180.320 178.773 1.547 17919 65511 1 160 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.166 0.484 17919 65512 1 160 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.409 0.881 17919 65513 1 160 . 1 1 29 29 LYS H H 29 7.850 7.850 7.619 0.231 17919 65514 1 160 . 1 1 30 30 ILE N N 30 121.080 121.080 119.686 1.394 17919 65515 1 160 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.724 -0.217 17919 65516 1 160 . 1 1 30 30 ILE C C 30 178.310 178.310 177.340 0.970 17919 65517 1 160 . 1 1 30 30 ILE CA C 30 66.150 66.150 64.517 1.633 17919 65518 1 160 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.933 -1.133 17919 65519 1 160 . 1 1 30 30 ILE H H 30 8.280 8.280 7.721 0.559 17919 65520 1 160 . 1 1 31 31 GLN N N 31 123.490 123.490 121.413 2.077 17919 65521 1 160 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.149 -0.320 17919 65522 1 160 . 1 1 31 31 GLN C C 31 178.890 178.890 178.072 0.818 17919 65523 1 160 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.255 0.745 17919 65524 1 160 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.723 -1.003 17919 65525 1 160 . 1 1 31 31 GLN H H 31 8.580 8.580 8.608 -0.028 17919 65526 1 160 . 1 1 32 32 ASP N N 32 119.360 119.360 117.928 1.432 17919 65527 1 160 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.407 -0.053 17919 65528 1 160 . 1 1 32 32 ASP C C 32 177.250 177.250 177.589 -0.339 17919 65529 1 160 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.493 0.697 17919 65530 1 160 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.694 -0.113 17919 65531 1 160 . 1 1 32 32 ASP H H 32 8.010 8.010 7.923 0.087 17919 65532 1 160 . 1 1 33 33 LYS N N 33 115.130 115.130 118.295 -3.165 17919 65533 1 160 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.371 -0.034 17919 65534 1 160 . 1 1 33 33 LYS C C 33 177.870 177.870 178.226 -0.356 17919 65535 1 160 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.700 0.350 17919 65536 1 160 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.546 0.624 17919 65537 1 160 . 1 1 33 33 LYS H H 33 7.430 7.430 7.548 -0.118 17919 65538 1 160 . 1 1 34 34 GLU N N 34 113.870 113.870 115.202 -1.332 17919 65539 1 160 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.491 0.134 17919 65540 1 160 . 1 1 34 34 GLU C C 34 177.840 177.840 177.366 0.474 17919 65541 1 160 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.992 -0.822 17919 65542 1 160 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.790 0.870 17919 65543 1 160 . 1 1 34 34 GLU H H 34 8.740 8.740 8.090 0.650 17919 65544 1 160 . 1 1 35 35 GLY N N 35 108.650 108.650 108.680 -0.030 17919 65545 1 160 . 1 1 35 35 GLY C C 35 173.960 173.960 174.210 -0.250 17919 65546 1 160 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.944 0.136 17919 65547 1 160 . 1 1 35 35 GLY H H 35 8.530 8.530 8.428 0.102 17919 65548 1 160 . 1 1 36 36 ILE N N 36 119.880 119.880 121.938 -2.058 17919 65549 1 160 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.462 -0.017 17919 65550 1 160 . 1 1 36 36 ILE C C 36 173.590 173.590 174.627 -1.037 17919 65551 1 160 . 1 1 36 36 ILE CA C 36 57.750 57.750 56.462 1.288 17919 65552 1 160 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.052 2.528 17919 65553 1 160 . 1 1 36 36 ILE H H 36 6.150 6.150 7.629 -1.479 17919 65554 1 160 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.830 -0.196 17919 65555 1 160 . 1 1 37 37 PRO C C 37 176.940 176.940 176.276 0.664 17919 65556 1 160 . 1 1 37 37 PRO CA C 37 61.660 61.660 62.020 -0.360 17919 65557 1 160 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.355 0.495 17919 65558 1 160 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.154 -0.037 17919 65559 1 160 . 1 1 38 38 PRO C C 38 178.320 178.320 178.277 0.043 17919 65560 1 160 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.844 0.416 17919 65561 1 160 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.863 1.028 17919 65562 1 160 . 1 1 39 39 ASP N N 39 113.380 113.380 115.800 -2.420 17919 65563 1 160 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.411 0.019 17919 65564 1 160 . 1 1 39 39 ASP C C 39 177.090 177.090 177.783 -0.693 17919 65565 1 160 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.724 -1.083 17919 65566 1 160 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.601 -1.061 17919 65567 1 160 . 1 1 39 39 ASP H H 39 8.550 8.550 8.668 -0.118 17919 65568 1 160 . 1 1 40 40 GLN N N 40 116.780 116.780 117.024 -0.244 17919 65569 1 160 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.208 0.256 17919 65570 1 160 . 1 1 40 40 GLN C C 40 175.380 175.380 175.924 -0.544 17919 65571 1 160 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.720 -1.080 17919 65572 1 160 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.579 0.561 17919 65573 1 160 . 1 1 40 40 GLN H H 40 7.820 7.820 7.809 0.011 17919 65574 1 160 . 1 1 41 41 GLN N N 41 117.720 117.720 119.094 -1.374 17919 65575 1 160 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.707 -0.463 17919 65576 1 160 . 1 1 41 41 GLN C C 41 176.300 176.300 175.549 0.751 17919 65577 1 160 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.172 1.298 17919 65578 1 160 . 1 1 41 41 GLN CB C 41 31.650 31.650 28.993 2.657 17919 65579 1 160 . 1 1 41 41 GLN H H 41 7.480 7.480 7.249 0.231 17919 65580 1 160 . 1 1 42 42 ARG N N 42 122.680 122.680 126.063 -3.383 17919 65581 1 160 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.420 0.080 17919 65582 1 160 . 1 1 42 42 ARG C C 42 174.050 174.050 174.796 -0.746 17919 65583 1 160 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.632 -0.582 17919 65584 1 160 . 1 1 42 42 ARG CB C 42 31.750 31.750 31.446 0.304 17919 65585 1 160 . 1 1 42 42 ARG H H 42 8.530 8.530 8.612 -0.082 17919 65586 1 160 . 1 1 43 43 LEU N N 43 124.040 124.040 127.634 -3.594 17919 65587 1 160 . 1 1 43 43 LEU C C 43 175.290 175.290 175.556 -0.266 17919 65588 1 160 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.667 -0.687 17919 65589 1 160 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.188 2.602 17919 65590 1 160 . 1 1 43 43 LEU H H 43 8.820 8.820 8.859 -0.039 17919 65591 1 160 . 1 1 44 44 ILE N N 44 121.920 121.920 124.358 -2.438 17919 65592 1 160 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.873 0.119 17919 65593 1 160 . 1 1 44 44 ILE C C 44 176.060 176.060 174.951 1.109 17919 65594 1 160 . 1 1 44 44 ILE CA C 44 58.980 58.980 58.965 0.015 17919 65595 1 160 . 1 1 44 44 ILE CB C 44 41.420 41.420 38.511 2.909 17919 65596 1 160 . 1 1 44 44 ILE H H 44 9.030 9.030 8.610 0.420 17919 65597 1 160 . 1 1 45 45 PHE N N 45 125.390 125.390 127.869 -2.479 17919 65598 1 160 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.949 0.096 17919 65599 1 160 . 1 1 45 45 PHE C C 45 174.470 174.470 174.278 0.192 17919 65600 1 160 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.631 0.389 17919 65601 1 160 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.506 1.254 17919 65602 1 160 . 1 1 45 45 PHE H H 45 8.830 8.830 9.129 -0.299 17919 65603 1 160 . 1 1 46 46 ALA N N 46 132.200 132.200 131.567 0.633 17919 65604 1 160 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.722 -0.032 17919 65605 1 160 . 1 1 46 46 ALA C C 46 177.290 177.290 177.147 0.143 17919 65606 1 160 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.597 -0.057 17919 65607 1 160 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.765 -0.195 17919 65608 1 160 . 1 1 46 46 ALA H H 46 8.810 8.810 9.157 -0.347 17919 65609 1 160 . 1 1 47 47 GLY N N 47 102.340 102.340 104.073 -1.733 17919 65610 1 160 . 1 1 47 47 GLY C C 47 173.810 173.810 174.265 -0.455 17919 65611 1 160 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.450 -0.100 17919 65612 1 160 . 1 1 47 47 GLY H H 47 8.130 8.130 8.683 -0.553 17919 65613 1 160 . 1 1 48 48 LYS N N 48 121.570 121.570 120.952 0.618 17919 65614 1 160 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.608 0.014 17919 65615 1 160 . 1 1 48 48 LYS C C 48 174.700 174.700 175.492 -0.792 17919 65616 1 160 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.873 -0.323 17919 65617 1 160 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.643 -0.113 17919 65618 1 160 . 1 1 48 48 LYS H H 48 7.980 7.980 7.749 0.231 17919 65619 1 160 . 1 1 49 49 GLN N N 49 122.410 122.410 122.840 -0.430 17919 65620 1 160 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.690 -0.130 17919 65621 1 160 . 1 1 49 49 GLN C C 49 175.670 175.670 176.009 -0.339 17919 65622 1 160 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.861 -0.121 17919 65623 1 160 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.312 -0.312 17919 65624 1 160 . 1 1 49 49 GLN H H 49 8.600 8.600 8.605 -0.005 17919 65625 1 160 . 1 1 50 50 LEU N N 50 125.520 125.520 127.679 -2.159 17919 65626 1 160 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.125 -0.035 17919 65627 1 160 . 1 1 50 50 LEU C C 50 176.660 176.660 175.719 0.941 17919 65628 1 160 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.242 -0.002 17919 65629 1 160 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.808 -0.238 17919 65630 1 160 . 1 1 50 50 LEU H H 50 8.530 8.530 8.854 -0.324 17919 65631 1 160 . 1 1 51 51 GLU N N 51 122.940 122.940 124.072 -1.132 17919 65632 1 160 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.597 -0.109 17919 65633 1 160 . 1 1 51 51 GLU C C 51 175.870 175.870 176.863 -0.993 17919 65634 1 160 . 1 1 51 51 GLU CA C 51 55.960 55.960 54.483 1.477 17919 65635 1 160 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.907 -1.337 17919 65636 1 160 . 1 1 51 51 GLU H H 51 8.400 8.400 8.417 -0.017 17919 65637 1 160 . 1 1 52 52 ASP N N 52 120.030 120.030 125.181 -5.151 17919 65638 1 160 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.426 -0.067 17919 65639 1 160 . 1 1 52 52 ASP C C 52 177.330 177.330 178.056 -0.726 17919 65640 1 160 . 1 1 52 52 ASP CA C 52 56.960 56.960 58.209 -1.249 17919 65641 1 160 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.856 -0.006 17919 65642 1 160 . 1 1 52 52 ASP H H 52 8.160 8.160 8.953 -0.793 17919 65643 1 160 . 1 1 53 53 GLY N N 53 106.660 106.660 107.004 -0.344 17919 65644 1 160 . 1 1 53 53 GLY C C 53 174.870 174.870 174.772 0.098 17919 65645 1 160 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.593 -0.423 17919 65646 1 160 . 1 1 53 53 GLY H H 53 9.390 9.390 8.360 1.030 17919 65647 1 160 . 1 1 54 54 ARG N N 54 119.050 119.050 121.016 -1.966 17919 65648 1 160 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.097 0.598 17919 65649 1 160 . 1 1 54 54 ARG C C 54 175.350 175.350 175.977 -0.627 17919 65650 1 160 . 1 1 54 54 ARG CA C 54 54.390 54.390 57.019 -2.628 17919 65651 1 160 . 1 1 54 54 ARG CB C 54 32.650 32.650 30.642 2.008 17919 65652 1 160 . 1 1 54 54 ARG H H 54 7.460 7.460 8.243 -0.783 17919 65653 1 160 . 1 1 55 55 THR N N 55 108.400 108.400 110.328 -1.928 17919 65654 1 160 . 1 1 55 55 THR HA H 55 5.240 5.240 5.151 0.089 17919 65655 1 160 . 1 1 55 55 THR C C 55 176.560 176.560 176.186 0.374 17919 65656 1 160 . 1 1 55 55 THR CA C 55 59.690 59.690 59.734 -0.044 17919 65657 1 160 . 1 1 55 55 THR CB C 55 72.260 72.260 71.389 0.871 17919 65658 1 160 . 1 1 55 55 THR H H 55 8.730 8.730 8.829 -0.099 17919 65659 1 160 . 1 1 56 56 LEU N N 56 117.920 117.920 120.776 -2.856 17919 65660 1 160 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.094 -0.034 17919 65661 1 160 . 1 1 56 56 LEU C C 56 180.810 180.810 178.788 2.022 17919 65662 1 160 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.379 0.331 17919 65663 1 160 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.400 -1.030 17919 65664 1 160 . 1 1 56 56 LEU H H 56 8.140 8.140 8.631 -0.491 17919 65665 1 160 . 1 1 57 57 SER N N 57 113.330 113.330 115.588 -2.258 17919 65666 1 160 . 1 1 57 57 SER HA H 57 4.370 4.370 4.222 0.148 17919 65667 1 160 . 1 1 57 57 SER C C 57 178.310 178.310 176.706 1.604 17919 65668 1 160 . 1 1 57 57 SER CA C 57 61.080 61.080 62.225 -1.145 17919 65669 1 160 . 1 1 57 57 SER CB C 57 62.530 62.530 62.630 -0.101 17919 65670 1 160 . 1 1 57 57 SER H H 57 8.470 8.470 8.605 -0.135 17919 65671 1 160 . 1 1 58 58 ASP N N 58 124.190 124.190 120.694 3.496 17919 65672 1 160 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.312 -0.016 17919 65673 1 160 . 1 1 58 58 ASP C C 58 177.400 177.400 176.622 0.778 17919 65674 1 160 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.416 0.764 17919 65675 1 160 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.254 -0.154 17919 65676 1 160 . 1 1 58 58 ASP H H 58 7.930 7.930 7.704 0.226 17919 65677 1 160 . 1 1 59 59 TYR N N 59 115.510 115.510 115.586 -0.076 17919 65678 1 160 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.547 0.123 17919 65679 1 160 . 1 1 59 59 TYR C C 59 174.700 174.700 175.483 -0.783 17919 65680 1 160 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.893 0.357 17919 65681 1 160 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.825 1.245 17919 65682 1 160 . 1 1 59 59 TYR H H 59 7.250 7.250 7.258 -0.008 17919 65683 1 160 . 1 1 60 60 ASN N N 60 115.900 115.900 117.332 -1.432 17919 65684 1 160 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.363 -0.008 17919 65685 1 160 . 1 1 60 60 ASN C C 60 174.340 174.340 174.526 -0.186 17919 65686 1 160 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.100 0.020 17919 65687 1 160 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.591 -0.181 17919 65688 1 160 . 1 1 60 60 ASN H H 60 8.150 8.150 8.190 -0.040 17919 65689 1 160 . 1 1 61 61 ILE N N 61 118.600 118.600 119.073 -0.473 17919 65690 1 160 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.741 -0.348 17919 65691 1 160 . 1 1 61 61 ILE C C 61 174.610 174.610 175.084 -0.474 17919 65692 1 160 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.041 0.379 17919 65693 1 160 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.709 -0.968 17919 65694 1 160 . 1 1 61 61 ILE H H 61 7.250 7.250 8.023 -0.773 17919 65695 1 160 . 1 1 62 62 GLN N N 62 124.740 124.740 126.891 -2.151 17919 65696 1 160 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.767 -0.261 17919 65697 1 160 . 1 1 62 62 GLN C C 62 175.970 175.970 174.740 1.230 17919 65698 1 160 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.542 0.118 17919 65699 1 160 . 1 1 62 62 GLN CB C 62 31.650 31.650 30.839 0.811 17919 65700 1 160 . 1 1 62 62 GLN H H 62 7.610 7.610 8.111 -0.501 17919 65701 1 160 . 1 1 63 63 LYS N N 63 120.300 120.300 119.559 0.741 17919 65702 1 160 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.176 -0.175 17919 65703 1 160 . 1 1 63 63 LYS C C 63 175.810 175.810 176.698 -0.888 17919 65704 1 160 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.973 -0.183 17919 65705 1 160 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.617 0.033 17919 65706 1 160 . 1 1 63 63 LYS H H 63 8.490 8.490 8.398 0.092 17919 65707 1 160 . 1 1 64 64 GLU N N 64 113.950 113.950 118.879 -4.929 17919 65708 1 160 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.957 -0.491 17919 65709 1 160 . 1 1 64 64 GLU C C 64 175.250 175.250 176.257 -1.007 17919 65710 1 160 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.776 0.114 17919 65711 1 160 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.639 -2.739 17919 65712 1 160 . 1 1 64 64 GLU H H 64 9.280 9.280 9.259 0.021 17919 65713 1 160 . 1 1 65 65 SER N N 65 114.730 114.730 116.185 -1.455 17919 65714 1 160 . 1 1 65 65 SER HA H 65 4.640 4.640 4.406 0.234 17919 65715 1 160 . 1 1 65 65 SER C C 65 172.160 172.160 173.991 -1.831 17919 65716 1 160 . 1 1 65 65 SER CA C 65 60.890 60.890 60.590 0.300 17919 65717 1 160 . 1 1 65 65 SER CB C 65 64.910 64.910 64.066 0.844 17919 65718 1 160 . 1 1 65 65 SER H H 65 7.670 7.670 7.214 0.456 17919 65719 1 160 . 1 1 66 66 THR N N 66 117.110 117.110 119.964 -2.854 17919 65720 1 160 . 1 1 66 66 THR HA H 66 5.270 5.270 5.110 0.160 17919 65721 1 160 . 1 1 66 66 THR C C 66 173.950 173.950 174.269 -0.319 17919 65722 1 160 . 1 1 66 66 THR CA C 66 62.340 62.340 61.830 0.510 17919 65723 1 160 . 1 1 66 66 THR CB C 66 70.080 70.080 70.302 -0.221 17919 65724 1 160 . 1 1 66 66 THR H H 66 8.730 8.730 8.448 0.282 17919 65725 1 160 . 1 1 67 67 LEU N N 67 127.110 127.110 127.888 -0.778 17919 65726 1 160 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.893 0.167 17919 65727 1 160 . 1 1 67 67 LEU C C 67 175.770 175.770 176.073 -0.303 17919 65728 1 160 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.784 0.116 17919 65729 1 160 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.794 0.466 17919 65730 1 160 . 1 1 67 67 LEU H H 67 9.410 9.410 9.099 0.311 17919 65731 1 160 . 1 1 68 68 HIS N N 68 118.380 118.380 119.591 -1.211 17919 65732 1 160 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.330 -0.090 17919 65733 1 160 . 1 1 68 68 HIS C C 68 173.150 173.150 174.436 -1.286 17919 65734 1 160 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.807 0.193 17919 65735 1 160 . 1 1 68 68 HIS CB C 68 30.530 30.530 31.640 -1.110 17919 65736 1 160 . 1 1 68 68 HIS H H 68 9.230 9.230 9.055 0.175 17919 65737 1 160 . 1 1 69 69 LEU N N 69 124.460 124.460 127.919 -3.459 17919 65738 1 160 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.840 0.350 17919 65739 1 160 . 1 1 69 69 LEU C C 69 175.270 175.270 174.627 0.643 17919 65740 1 160 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.127 -0.237 17919 65741 1 160 . 1 1 69 69 LEU CB C 69 44.380 44.380 43.366 1.014 17919 65742 1 160 . 1 1 69 69 LEU H H 69 8.340 8.340 9.072 -0.732 17919 65743 1 160 . 1 1 70 70 VAL N N 70 126.940 126.940 126.100 0.840 17919 65744 1 160 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.421 -0.071 17919 65745 1 160 . 1 1 70 70 VAL C C 70 174.000 174.000 174.935 -0.935 17919 65746 1 160 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.688 0.112 17919 65747 1 160 . 1 1 70 70 VAL CB C 70 34.910 34.910 34.313 0.597 17919 65748 1 160 . 1 1 70 70 VAL H H 70 9.200 9.200 9.126 0.074 17919 65749 1 160 . 1 1 71 71 LEU N N 71 123.130 123.130 124.895 -1.765 17919 65750 1 160 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.140 -0.080 17919 65751 1 160 . 1 1 71 71 LEU C C 71 177.830 177.830 176.545 1.285 17919 65752 1 160 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.718 0.222 17919 65753 1 160 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.130 -0.280 17919 65754 1 160 . 1 1 71 71 LEU H H 71 8.120 8.120 8.589 -0.469 17919 65755 1 160 . 1 1 72 72 ARG N N 72 123.490 123.490 123.866 -0.376 17919 65756 1 160 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.592 -0.291 17919 65757 1 160 . 1 1 72 72 ARG C C 72 175.350 175.350 175.093 0.257 17919 65758 1 160 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.590 0.020 17919 65759 1 160 . 1 1 72 72 ARG CB C 72 31.350 31.350 32.354 -1.004 17919 65760 1 160 . 1 1 72 72 ARG H H 72 8.580 8.580 8.751 -0.171 17919 65761 1 161 . 1 1 2 2 GLN N N 2 123.220 123.220 121.975 1.245 17919 65762 1 161 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.170 0.079 17919 65763 1 161 . 1 1 2 2 GLN C C 2 175.920 175.920 174.825 1.095 17919 65764 1 161 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.371 0.709 17919 65765 1 161 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.317 0.443 17919 65766 1 161 . 1 1 2 2 GLN H H 2 8.900 8.900 8.372 0.528 17919 65767 1 161 . 1 1 3 3 ILE N N 3 115.340 115.340 119.601 -4.261 17919 65768 1 161 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.684 -0.471 17919 65769 1 161 . 1 1 3 3 ILE C C 3 172.450 172.450 173.564 -1.114 17919 65770 1 161 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.038 0.532 17919 65771 1 161 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.744 0.466 17919 65772 1 161 . 1 1 3 3 ILE H H 3 8.320 8.320 8.780 -0.460 17919 65773 1 161 . 1 1 4 4 PHE N N 4 118.110 118.110 119.965 -1.855 17919 65774 1 161 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.416 0.214 17919 65775 1 161 . 1 1 4 4 PHE C C 4 175.320 175.320 174.438 0.882 17919 65776 1 161 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.903 -0.693 17919 65777 1 161 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.295 -0.815 17919 65778 1 161 . 1 1 4 4 PHE H H 4 8.610 8.610 8.392 0.218 17919 65779 1 161 . 1 1 5 5 VAL N N 5 121.000 121.000 123.281 -2.281 17919 65780 1 161 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.781 -0.056 17919 65781 1 161 . 1 1 5 5 VAL C C 5 174.870 174.870 174.508 0.362 17919 65782 1 161 . 1 1 5 5 VAL CA C 5 60.620 60.620 60.245 0.375 17919 65783 1 161 . 1 1 5 5 VAL CB C 5 34.230 34.230 35.485 -1.255 17919 65784 1 161 . 1 1 5 5 VAL H H 5 9.300 9.300 9.271 0.029 17919 65785 1 161 . 1 1 6 6 LYS N N 6 127.520 127.520 129.281 -1.761 17919 65786 1 161 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.195 0.172 17919 65787 1 161 . 1 1 6 6 LYS C C 6 177.140 177.140 176.374 0.766 17919 65788 1 161 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.481 0.039 17919 65789 1 161 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.722 0.328 17919 65790 1 161 . 1 1 6 6 LYS H H 6 8.820 8.820 8.823 -0.003 17919 65791 1 161 . 1 1 7 7 THR N N 7 115.400 115.400 115.304 0.096 17919 65792 1 161 . 1 1 7 7 THR HA H 7 4.970 4.970 4.799 0.171 17919 65793 1 161 . 1 1 7 7 THR C C 7 176.910 176.910 176.444 0.466 17919 65794 1 161 . 1 1 7 7 THR CA C 7 60.470 60.470 60.797 -0.327 17919 65795 1 161 . 1 1 7 7 THR CB C 7 70.630 70.630 70.636 -0.006 17919 65796 1 161 . 1 1 7 7 THR H H 7 8.730 8.730 8.178 0.552 17919 65797 1 161 . 1 1 8 8 LEU N N 8 121.330 121.330 122.115 -0.785 17919 65798 1 161 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.328 -0.018 17919 65799 1 161 . 1 1 8 8 LEU C C 8 178.800 178.800 177.666 1.134 17919 65800 1 161 . 1 1 8 8 LEU CA C 8 57.580 57.580 58.012 -0.432 17919 65801 1 161 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.887 0.083 17919 65802 1 161 . 1 1 8 8 LEU H H 8 9.100 9.100 8.779 0.321 17919 65803 1 161 . 1 1 9 9 THR N N 9 105.590 105.590 108.716 -3.126 17919 65804 1 161 . 1 1 9 9 THR HA H 9 4.428 4.428 4.422 0.006 17919 65805 1 161 . 1 1 9 9 THR C C 9 175.520 175.520 175.039 0.481 17919 65806 1 161 . 1 1 9 9 THR CA C 9 61.400 61.400 61.405 -0.005 17919 65807 1 161 . 1 1 9 9 THR CB C 9 69.140 69.140 69.081 0.059 17919 65808 1 161 . 1 1 9 9 THR H H 9 7.630 7.630 7.882 -0.252 17919 65809 1 161 . 1 1 10 10 GLY N N 10 108.890 108.890 110.301 -1.411 17919 65810 1 161 . 1 1 10 10 GLY C C 10 174.070 174.070 173.583 0.487 17919 65811 1 161 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.813 0.647 17919 65812 1 161 . 1 1 10 10 GLY H H 10 7.810 7.810 7.641 0.169 17919 65813 1 161 . 1 1 11 11 LYS N N 11 121.600 121.600 122.346 -0.746 17919 65814 1 161 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.347 0.014 17919 65815 1 161 . 1 1 11 11 LYS C C 11 175.940 175.940 175.872 0.068 17919 65816 1 161 . 1 1 11 11 LYS CA C 11 56.280 56.280 55.974 0.306 17919 65817 1 161 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.027 0.173 17919 65818 1 161 . 1 1 11 11 LYS H H 11 7.280 7.280 7.596 -0.316 17919 65819 1 161 . 1 1 12 12 THR N N 12 120.440 120.440 122.419 -1.979 17919 65820 1 161 . 1 1 12 12 THR HA H 12 5.046 5.046 4.839 0.207 17919 65821 1 161 . 1 1 12 12 THR C C 12 174.320 174.320 174.697 -0.377 17919 65822 1 161 . 1 1 12 12 THR CA C 12 62.390 62.390 63.151 -0.761 17919 65823 1 161 . 1 1 12 12 THR CB C 12 69.910 69.910 69.525 0.385 17919 65824 1 161 . 1 1 12 12 THR H H 12 8.650 8.650 8.441 0.209 17919 65825 1 161 . 1 1 13 13 ILE N N 13 127.110 127.110 126.183 0.927 17919 65826 1 161 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.565 -0.021 17919 65827 1 161 . 1 1 13 13 ILE C C 13 175.220 175.220 175.090 0.130 17919 65828 1 161 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.955 0.025 17919 65829 1 161 . 1 1 13 13 ILE CB C 13 40.950 40.950 42.031 -1.081 17919 65830 1 161 . 1 1 13 13 ILE H H 13 9.450 9.450 8.709 0.741 17919 65831 1 161 . 1 1 14 14 THR N N 14 121.520 121.520 119.982 1.538 17919 65832 1 161 . 1 1 14 14 THR HA H 14 4.964 4.964 5.022 -0.058 17919 65833 1 161 . 1 1 14 14 THR C C 14 173.790 173.790 173.960 -0.170 17919 65834 1 161 . 1 1 14 14 THR CA C 14 61.940 61.940 61.077 0.863 17919 65835 1 161 . 1 1 14 14 THR CB C 14 69.650 69.650 69.624 0.026 17919 65836 1 161 . 1 1 14 14 THR H H 14 8.710 8.710 8.358 0.352 17919 65837 1 161 . 1 1 15 15 LEU N N 15 124.800 124.800 124.331 0.469 17919 65838 1 161 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.692 0.088 17919 65839 1 161 . 1 1 15 15 LEU C C 15 174.670 174.670 175.447 -0.777 17919 65840 1 161 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.721 -0.891 17919 65841 1 161 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.822 1.248 17919 65842 1 161 . 1 1 15 15 LEU H H 15 8.710 8.710 8.703 0.007 17919 65843 1 161 . 1 1 16 16 GLU N N 16 122.160 122.160 123.625 -1.465 17919 65844 1 161 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.171 -0.254 17919 65845 1 161 . 1 1 16 16 GLU C C 16 175.860 175.860 176.215 -0.355 17919 65846 1 161 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.679 -0.859 17919 65847 1 161 . 1 1 16 16 GLU CB C 16 29.450 29.450 29.578 -0.129 17919 65848 1 161 . 1 1 16 16 GLU H H 16 8.140 8.140 8.753 -0.613 17919 65849 1 161 . 1 1 17 17 VAL N N 17 117.210 117.210 119.314 -2.104 17919 65850 1 161 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.852 -0.138 17919 65851 1 161 . 1 1 17 17 VAL C C 17 174.160 174.160 174.932 -0.772 17919 65852 1 161 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.904 -0.474 17919 65853 1 161 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.521 0.879 17919 65854 1 161 . 1 1 17 17 VAL H H 17 8.900 8.900 8.685 0.215 17919 65855 1 161 . 1 1 18 18 GLU N N 18 118.990 118.990 121.264 -2.274 17919 65856 1 161 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.820 0.259 17919 65857 1 161 . 1 1 18 18 GLU C C 18 176.160 176.160 175.511 0.649 17919 65858 1 161 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.516 0.205 17919 65859 1 161 . 1 1 18 18 GLU CB C 18 30.310 30.310 31.036 -0.726 17919 65860 1 161 . 1 1 18 18 GLU H H 18 8.640 8.640 8.515 0.125 17919 65861 1 161 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.323 -0.182 17919 65862 1 161 . 1 1 19 19 PRO C C 19 175.310 175.310 177.709 -2.399 17919 65863 1 161 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.660 -0.190 17919 65864 1 161 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.183 -0.233 17919 65865 1 161 . 1 1 20 20 SER N N 20 103.400 103.400 109.803 -6.403 17919 65866 1 161 . 1 1 20 20 SER HA H 20 4.370 4.370 4.237 0.133 17919 65867 1 161 . 1 1 20 20 SER C C 20 174.660 174.660 174.292 0.368 17919 65868 1 161 . 1 1 20 20 SER CA C 20 57.400 57.400 58.892 -1.492 17919 65869 1 161 . 1 1 20 20 SER CB C 20 63.370 63.370 62.530 0.840 17919 65870 1 161 . 1 1 20 20 SER H H 20 7.040 7.040 8.381 -1.341 17919 65871 1 161 . 1 1 21 21 ASP N N 21 123.480 123.480 124.403 -0.923 17919 65872 1 161 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.647 0.048 17919 65873 1 161 . 1 1 21 21 ASP C C 21 176.360 176.360 175.790 0.570 17919 65874 1 161 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.244 0.456 17919 65875 1 161 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.338 -0.538 17919 65876 1 161 . 1 1 21 21 ASP H H 21 8.030 8.030 7.497 0.533 17919 65877 1 161 . 1 1 22 22 THR N N 22 108.800 108.800 112.546 -3.746 17919 65878 1 161 . 1 1 22 22 THR HA H 22 4.920 4.920 4.869 0.051 17919 65879 1 161 . 1 1 22 22 THR C C 22 176.750 176.750 175.980 0.770 17919 65880 1 161 . 1 1 22 22 THR CA C 22 59.690 59.690 60.390 -0.700 17919 65881 1 161 . 1 1 22 22 THR CB C 22 71.200 71.200 70.835 0.365 17919 65882 1 161 . 1 1 22 22 THR H H 22 7.900 7.900 8.322 -0.422 17919 65883 1 161 . 1 1 23 23 ILE N N 23 121.190 121.190 121.899 -0.709 17919 65884 1 161 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.833 -0.176 17919 65885 1 161 . 1 1 23 23 ILE C C 23 179.040 179.040 177.637 1.403 17919 65886 1 161 . 1 1 23 23 ILE CA C 23 62.260 62.260 61.331 0.929 17919 65887 1 161 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.008 -1.658 17919 65888 1 161 . 1 1 23 23 ILE H H 23 8.560 8.560 8.438 0.122 17919 65889 1 161 . 1 1 24 24 GLU N N 24 120.830 120.830 120.829 0.001 17919 65890 1 161 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.842 0.075 17919 65891 1 161 . 1 1 24 24 GLU C C 24 178.640 178.640 178.126 0.514 17919 65892 1 161 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.204 0.016 17919 65893 1 161 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.375 -1.095 17919 65894 1 161 . 1 1 24 24 GLU H H 24 9.760 9.760 7.831 1.929 17919 65895 1 161 . 1 1 25 25 ASN N N 25 120.570 120.570 117.044 3.526 17919 65896 1 161 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.555 -0.030 17919 65897 1 161 . 1 1 25 25 ASN C C 25 178.380 178.380 177.811 0.569 17919 65898 1 161 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.718 0.342 17919 65899 1 161 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.862 -0.412 17919 65900 1 161 . 1 1 25 25 ASN H H 25 7.920 7.920 7.564 0.356 17919 65901 1 161 . 1 1 26 26 VAL N N 26 121.710 121.710 121.178 0.532 17919 65902 1 161 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.642 -0.245 17919 65903 1 161 . 1 1 26 26 VAL C C 26 177.950 177.950 177.635 0.315 17919 65904 1 161 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.922 0.738 17919 65905 1 161 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.613 -0.773 17919 65906 1 161 . 1 1 26 26 VAL H H 26 8.070 8.070 8.541 -0.471 17919 65907 1 161 . 1 1 27 27 LYS N N 27 118.860 118.860 120.233 -1.373 17919 65908 1 161 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.216 0.364 17919 65909 1 161 . 1 1 27 27 LYS C C 27 180.550 180.550 178.927 1.623 17919 65910 1 161 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.507 -0.257 17919 65911 1 161 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.149 1.581 17919 65912 1 161 . 1 1 27 27 LYS H H 27 8.560 8.560 8.378 0.182 17919 65913 1 161 . 1 1 28 28 ALA N N 28 123.440 123.440 122.714 0.726 17919 65914 1 161 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.032 0.128 17919 65915 1 161 . 1 1 28 28 ALA C C 28 180.300 180.300 179.073 1.227 17919 65916 1 161 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.282 0.088 17919 65917 1 161 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.402 -0.692 17919 65918 1 161 . 1 1 28 28 ALA H H 28 8.060 8.060 7.707 0.353 17919 65919 1 161 . 1 1 29 29 LYS N N 29 119.940 119.940 119.240 0.700 17919 65920 1 161 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.071 0.136 17919 65921 1 161 . 1 1 29 29 LYS C C 29 180.320 180.320 178.943 1.377 17919 65922 1 161 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.288 0.363 17919 65923 1 161 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.433 0.857 17919 65924 1 161 . 1 1 29 29 LYS H H 29 7.850 7.850 7.965 -0.115 17919 65925 1 161 . 1 1 30 30 ILE N N 30 121.080 121.080 121.078 0.002 17919 65926 1 161 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.589 -0.082 17919 65927 1 161 . 1 1 30 30 ILE C C 30 178.310 178.310 177.411 0.899 17919 65928 1 161 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.568 0.582 17919 65929 1 161 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.734 -0.934 17919 65930 1 161 . 1 1 30 30 ILE H H 30 8.280 8.280 8.338 -0.058 17919 65931 1 161 . 1 1 31 31 GLN N N 31 123.490 123.490 119.907 3.583 17919 65932 1 161 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.856 -0.027 17919 65933 1 161 . 1 1 31 31 GLN C C 31 178.890 178.890 178.200 0.690 17919 65934 1 161 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.423 0.577 17919 65935 1 161 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.468 -0.748 17919 65936 1 161 . 1 1 31 31 GLN H H 31 8.580 8.580 8.059 0.521 17919 65937 1 161 . 1 1 32 32 ASP N N 32 119.360 119.360 118.696 0.664 17919 65938 1 161 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.414 -0.060 17919 65939 1 161 . 1 1 32 32 ASP C C 32 177.250 177.250 178.306 -1.056 17919 65940 1 161 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.651 0.539 17919 65941 1 161 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.971 -0.391 17919 65942 1 161 . 1 1 32 32 ASP H H 32 8.010 8.010 7.937 0.073 17919 65943 1 161 . 1 1 33 33 LYS N N 33 115.130 115.130 118.953 -3.823 17919 65944 1 161 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.184 0.153 17919 65945 1 161 . 1 1 33 33 LYS C C 33 177.870 177.870 178.212 -0.342 17919 65946 1 161 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.096 -0.046 17919 65947 1 161 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.018 1.152 17919 65948 1 161 . 1 1 33 33 LYS H H 33 7.430 7.430 7.800 -0.370 17919 65949 1 161 . 1 1 34 34 GLU N N 34 113.870 113.870 115.737 -1.867 17919 65950 1 161 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.476 0.149 17919 65951 1 161 . 1 1 34 34 GLU C C 34 177.840 177.840 176.756 1.084 17919 65952 1 161 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.331 -0.161 17919 65953 1 161 . 1 1 34 34 GLU CB C 34 32.660 32.660 30.965 1.695 17919 65954 1 161 . 1 1 34 34 GLU H H 34 8.740 8.740 8.187 0.553 17919 65955 1 161 . 1 1 35 35 GLY N N 35 108.650 108.650 108.110 0.540 17919 65956 1 161 . 1 1 35 35 GLY C C 35 173.960 173.960 174.878 -0.918 17919 65957 1 161 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.427 0.653 17919 65958 1 161 . 1 1 35 35 GLY H H 35 8.530 8.530 7.722 0.808 17919 65959 1 161 . 1 1 36 36 ILE N N 36 119.880 119.880 122.582 -2.702 17919 65960 1 161 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.358 0.087 17919 65961 1 161 . 1 1 36 36 ILE C C 36 173.590 173.590 174.036 -0.446 17919 65962 1 161 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.073 -0.323 17919 65963 1 161 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.414 2.166 17919 65964 1 161 . 1 1 36 36 ILE H H 36 6.150 6.150 7.671 -1.521 17919 65965 1 161 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.839 -0.205 17919 65966 1 161 . 1 1 37 37 PRO C C 37 176.940 176.940 176.187 0.753 17919 65967 1 161 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.645 0.015 17919 65968 1 161 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.411 0.439 17919 65969 1 161 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.112 0.005 17919 65970 1 161 . 1 1 38 38 PRO C C 38 178.320 178.320 178.663 -0.343 17919 65971 1 161 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.907 0.353 17919 65972 1 161 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.733 1.157 17919 65973 1 161 . 1 1 39 39 ASP N N 39 113.380 113.380 116.322 -2.942 17919 65974 1 161 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.349 0.081 17919 65975 1 161 . 1 1 39 39 ASP C C 39 177.090 177.090 177.056 0.034 17919 65976 1 161 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.602 -0.963 17919 65977 1 161 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.338 -0.798 17919 65978 1 161 . 1 1 39 39 ASP H H 39 8.550 8.550 8.795 -0.245 17919 65979 1 161 . 1 1 40 40 GLN N N 40 116.780 116.780 116.466 0.314 17919 65980 1 161 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.533 -0.069 17919 65981 1 161 . 1 1 40 40 GLN C C 40 175.380 175.380 175.589 -0.209 17919 65982 1 161 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.057 0.583 17919 65983 1 161 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.335 0.805 17919 65984 1 161 . 1 1 40 40 GLN H H 40 7.820 7.820 8.242 -0.422 17919 65985 1 161 . 1 1 41 41 GLN N N 41 117.720 117.720 119.363 -1.643 17919 65986 1 161 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.733 -0.489 17919 65987 1 161 . 1 1 41 41 GLN C C 41 176.300 176.300 175.081 1.219 17919 65988 1 161 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.948 0.522 17919 65989 1 161 . 1 1 41 41 GLN CB C 41 31.650 31.650 30.525 1.125 17919 65990 1 161 . 1 1 41 41 GLN H H 41 7.480 7.480 7.470 0.010 17919 65991 1 161 . 1 1 42 42 ARG N N 42 122.680 122.680 120.503 2.177 17919 65992 1 161 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.754 -0.254 17919 65993 1 161 . 1 1 42 42 ARG C C 42 174.050 174.050 174.005 0.045 17919 65994 1 161 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.559 0.490 17919 65995 1 161 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.291 -1.541 17919 65996 1 161 . 1 1 42 42 ARG H H 42 8.530 8.530 8.811 -0.281 17919 65997 1 161 . 1 1 43 43 LEU N N 43 124.040 124.040 124.041 -0.001 17919 65998 1 161 . 1 1 43 43 LEU C C 43 175.290 175.290 176.191 -0.901 17919 65999 1 161 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.465 -0.485 17919 66000 1 161 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.947 1.843 17919 66001 1 161 . 1 1 43 43 LEU H H 43 8.820 8.820 8.780 0.040 17919 66002 1 161 . 1 1 44 44 ILE N N 44 121.920 121.920 121.582 0.338 17919 66003 1 161 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.815 0.177 17919 66004 1 161 . 1 1 44 44 ILE C C 44 176.060 176.060 174.271 1.789 17919 66005 1 161 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.541 -1.561 17919 66006 1 161 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.203 0.217 17919 66007 1 161 . 1 1 44 44 ILE H H 44 9.030 9.030 9.161 -0.131 17919 66008 1 161 . 1 1 45 45 PHE N N 45 125.390 125.390 126.720 -1.330 17919 66009 1 161 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.010 0.035 17919 66010 1 161 . 1 1 45 45 PHE C C 45 174.470 174.470 174.544 -0.074 17919 66011 1 161 . 1 1 45 45 PHE CA C 45 57.020 57.020 57.223 -0.203 17919 66012 1 161 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.640 1.120 17919 66013 1 161 . 1 1 45 45 PHE H H 45 8.830 8.830 8.890 -0.060 17919 66014 1 161 . 1 1 46 46 ALA N N 46 132.200 132.200 130.508 1.692 17919 66015 1 161 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.651 0.039 17919 66016 1 161 . 1 1 46 46 ALA C C 46 177.290 177.290 177.819 -0.529 17919 66017 1 161 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.824 -0.284 17919 66018 1 161 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.623 -0.053 17919 66019 1 161 . 1 1 46 46 ALA H H 46 8.810 8.810 8.827 -0.017 17919 66020 1 161 . 1 1 47 47 GLY N N 47 102.340 102.340 104.273 -1.933 17919 66021 1 161 . 1 1 47 47 GLY C C 47 173.810 173.810 174.203 -0.393 17919 66022 1 161 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.919 0.431 17919 66023 1 161 . 1 1 47 47 GLY H H 47 8.130 8.130 8.411 -0.281 17919 66024 1 161 . 1 1 48 48 LYS N N 48 121.570 121.570 120.337 1.233 17919 66025 1 161 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.509 0.113 17919 66026 1 161 . 1 1 48 48 LYS C C 48 174.700 174.700 175.322 -0.622 17919 66027 1 161 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.708 -0.158 17919 66028 1 161 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.668 -0.138 17919 66029 1 161 . 1 1 48 48 LYS H H 48 7.980 7.980 7.901 0.079 17919 66030 1 161 . 1 1 49 49 GLN N N 49 122.410 122.410 125.883 -3.473 17919 66031 1 161 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.634 -0.074 17919 66032 1 161 . 1 1 49 49 GLN C C 49 175.670 175.670 175.562 0.108 17919 66033 1 161 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.448 -0.708 17919 66034 1 161 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.769 -0.769 17919 66035 1 161 . 1 1 49 49 GLN H H 49 8.600 8.600 8.610 -0.010 17919 66036 1 161 . 1 1 50 50 LEU N N 50 125.520 125.520 124.917 0.603 17919 66037 1 161 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.164 -0.074 17919 66038 1 161 . 1 1 50 50 LEU C C 50 176.660 176.660 175.540 1.120 17919 66039 1 161 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.867 0.373 17919 66040 1 161 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.300 -0.730 17919 66041 1 161 . 1 1 50 50 LEU H H 50 8.530 8.530 8.078 0.452 17919 66042 1 161 . 1 1 51 51 GLU N N 51 122.940 122.940 123.548 -0.608 17919 66043 1 161 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.594 -0.106 17919 66044 1 161 . 1 1 51 51 GLU C C 51 175.870 175.870 176.480 -0.610 17919 66045 1 161 . 1 1 51 51 GLU CA C 51 55.960 55.960 54.624 1.336 17919 66046 1 161 . 1 1 51 51 GLU CB C 51 31.570 31.570 33.120 -1.550 17919 66047 1 161 . 1 1 51 51 GLU H H 51 8.400 8.400 8.567 -0.167 17919 66048 1 161 . 1 1 52 52 ASP N N 52 120.030 120.030 125.519 -5.489 17919 66049 1 161 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.524 -0.165 17919 66050 1 161 . 1 1 52 52 ASP C C 52 177.330 177.330 177.814 -0.484 17919 66051 1 161 . 1 1 52 52 ASP CA C 52 56.960 56.960 56.900 0.060 17919 66052 1 161 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.662 0.188 17919 66053 1 161 . 1 1 52 52 ASP H H 52 8.160 8.160 8.824 -0.664 17919 66054 1 161 . 1 1 53 53 GLY N N 53 106.660 106.660 107.026 -0.366 17919 66055 1 161 . 1 1 53 53 GLY C C 53 174.870 174.870 174.543 0.327 17919 66056 1 161 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.022 0.148 17919 66057 1 161 . 1 1 53 53 GLY H H 53 9.390 9.390 8.461 0.929 17919 66058 1 161 . 1 1 54 54 ARG N N 54 119.050 119.050 121.269 -2.219 17919 66059 1 161 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.645 0.050 17919 66060 1 161 . 1 1 54 54 ARG C C 54 175.350 175.350 175.412 -0.062 17919 66061 1 161 . 1 1 54 54 ARG CA C 54 54.390 54.390 55.327 -0.937 17919 66062 1 161 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.480 0.170 17919 66063 1 161 . 1 1 54 54 ARG H H 54 7.460 7.460 7.565 -0.105 17919 66064 1 161 . 1 1 55 55 THR N N 55 108.400 108.400 110.879 -2.479 17919 66065 1 161 . 1 1 55 55 THR HA H 55 5.240 5.240 5.097 0.143 17919 66066 1 161 . 1 1 55 55 THR C C 55 176.560 176.560 175.986 0.574 17919 66067 1 161 . 1 1 55 55 THR CA C 55 59.690 59.690 59.683 0.007 17919 66068 1 161 . 1 1 55 55 THR CB C 55 72.260 72.260 71.412 0.849 17919 66069 1 161 . 1 1 55 55 THR H H 55 8.730 8.730 9.005 -0.275 17919 66070 1 161 . 1 1 56 56 LEU N N 56 117.920 117.920 120.134 -2.214 17919 66071 1 161 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.040 0.020 17919 66072 1 161 . 1 1 56 56 LEU C C 56 180.810 180.810 178.697 2.113 17919 66073 1 161 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.154 0.556 17919 66074 1 161 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.500 -1.130 17919 66075 1 161 . 1 1 56 56 LEU H H 56 8.140 8.140 8.420 -0.280 17919 66076 1 161 . 1 1 57 57 SER N N 57 113.330 113.330 113.855 -0.525 17919 66077 1 161 . 1 1 57 57 SER HA H 57 4.370 4.370 4.338 0.032 17919 66078 1 161 . 1 1 57 57 SER C C 57 178.310 178.310 176.984 1.326 17919 66079 1 161 . 1 1 57 57 SER CA C 57 61.080 61.080 60.980 0.100 17919 66080 1 161 . 1 1 57 57 SER CB C 57 62.530 62.530 62.303 0.227 17919 66081 1 161 . 1 1 57 57 SER H H 57 8.470 8.470 8.249 0.221 17919 66082 1 161 . 1 1 58 58 ASP N N 58 124.190 124.190 123.310 0.880 17919 66083 1 161 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.366 -0.070 17919 66084 1 161 . 1 1 58 58 ASP C C 58 177.400 177.400 176.862 0.538 17919 66085 1 161 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.534 0.646 17919 66086 1 161 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.202 -0.102 17919 66087 1 161 . 1 1 58 58 ASP H H 58 7.930 7.930 7.790 0.140 17919 66088 1 161 . 1 1 59 59 TYR N N 59 115.510 115.510 115.988 -0.478 17919 66089 1 161 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.580 0.090 17919 66090 1 161 . 1 1 59 59 TYR C C 59 174.700 174.700 175.409 -0.709 17919 66091 1 161 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.437 0.813 17919 66092 1 161 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.645 1.425 17919 66093 1 161 . 1 1 59 59 TYR H H 59 7.250 7.250 7.281 -0.031 17919 66094 1 161 . 1 1 60 60 ASN N N 60 115.900 115.900 117.414 -1.514 17919 66095 1 161 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.450 -0.095 17919 66096 1 161 . 1 1 60 60 ASN C C 60 174.340 174.340 174.529 -0.189 17919 66097 1 161 . 1 1 60 60 ASN CA C 60 54.120 54.120 53.851 0.269 17919 66098 1 161 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.612 -0.202 17919 66099 1 161 . 1 1 60 60 ASN H H 60 8.150 8.150 7.749 0.401 17919 66100 1 161 . 1 1 61 61 ILE N N 61 118.600 118.600 120.503 -1.903 17919 66101 1 161 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.797 -0.404 17919 66102 1 161 . 1 1 61 61 ILE C C 61 174.610 174.610 175.359 -0.749 17919 66103 1 161 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.760 0.660 17919 66104 1 161 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.258 -0.517 17919 66105 1 161 . 1 1 61 61 ILE H H 61 7.250 7.250 8.277 -1.027 17919 66106 1 161 . 1 1 62 62 GLN N N 62 124.740 124.740 126.375 -1.635 17919 66107 1 161 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.744 -0.238 17919 66108 1 161 . 1 1 62 62 GLN C C 62 175.970 175.970 175.891 0.079 17919 66109 1 161 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.575 0.085 17919 66110 1 161 . 1 1 62 62 GLN CB C 62 31.650 31.650 32.836 -1.186 17919 66111 1 161 . 1 1 62 62 GLN H H 62 7.610 7.610 8.065 -0.455 17919 66112 1 161 . 1 1 63 63 LYS N N 63 120.300 120.300 121.242 -0.942 17919 66113 1 161 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.136 -0.135 17919 66114 1 161 . 1 1 63 63 LYS C C 63 175.810 175.810 176.805 -0.995 17919 66115 1 161 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.613 0.177 17919 66116 1 161 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.944 0.706 17919 66117 1 161 . 1 1 63 63 LYS H H 63 8.490 8.490 8.735 -0.245 17919 66118 1 161 . 1 1 64 64 GLU N N 64 113.950 113.950 120.480 -6.530 17919 66119 1 161 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.724 -0.259 17919 66120 1 161 . 1 1 64 64 GLU C C 64 175.250 175.250 176.099 -0.849 17919 66121 1 161 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.810 0.079 17919 66122 1 161 . 1 1 64 64 GLU CB C 64 25.900 25.900 29.031 -3.131 17919 66123 1 161 . 1 1 64 64 GLU H H 64 9.280 9.280 9.091 0.189 17919 66124 1 161 . 1 1 65 65 SER N N 65 114.730 114.730 115.043 -0.313 17919 66125 1 161 . 1 1 65 65 SER HA H 65 4.640 4.640 4.473 0.167 17919 66126 1 161 . 1 1 65 65 SER C C 65 172.160 172.160 173.756 -1.596 17919 66127 1 161 . 1 1 65 65 SER CA C 65 60.890 60.890 60.868 0.022 17919 66128 1 161 . 1 1 65 65 SER CB C 65 64.910 64.910 63.975 0.935 17919 66129 1 161 . 1 1 65 65 SER H H 65 7.670 7.670 8.016 -0.346 17919 66130 1 161 . 1 1 66 66 THR N N 66 117.110 117.110 118.634 -1.524 17919 66131 1 161 . 1 1 66 66 THR HA H 66 5.270 5.270 5.082 0.188 17919 66132 1 161 . 1 1 66 66 THR C C 66 173.950 173.950 174.042 -0.092 17919 66133 1 161 . 1 1 66 66 THR CA C 66 62.340 62.340 62.122 0.218 17919 66134 1 161 . 1 1 66 66 THR CB C 66 70.080 70.080 69.570 0.510 17919 66135 1 161 . 1 1 66 66 THR H H 66 8.730 8.730 8.383 0.347 17919 66136 1 161 . 1 1 67 67 LEU N N 67 127.110 127.110 126.788 0.322 17919 66137 1 161 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.876 0.184 17919 66138 1 161 . 1 1 67 67 LEU C C 67 175.770 175.770 175.558 0.212 17919 66139 1 161 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.350 -0.450 17919 66140 1 161 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.144 0.116 17919 66141 1 161 . 1 1 67 67 LEU H H 67 9.410 9.410 9.123 0.287 17919 66142 1 161 . 1 1 68 68 HIS N N 68 118.380 118.380 119.286 -0.906 17919 66143 1 161 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.267 -0.027 17919 66144 1 161 . 1 1 68 68 HIS C C 68 173.150 173.150 173.187 -0.037 17919 66145 1 161 . 1 1 68 68 HIS CA C 68 55.000 55.000 55.003 -0.003 17919 66146 1 161 . 1 1 68 68 HIS CB C 68 30.530 30.530 33.724 -3.194 17919 66147 1 161 . 1 1 68 68 HIS H H 68 9.230 9.230 8.885 0.345 17919 66148 1 161 . 1 1 69 69 LEU N N 69 124.460 124.460 128.537 -4.077 17919 66149 1 161 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.183 0.007 17919 66150 1 161 . 1 1 69 69 LEU C C 69 175.270 175.270 174.334 0.936 17919 66151 1 161 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.342 0.548 17919 66152 1 161 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.933 -0.553 17919 66153 1 161 . 1 1 69 69 LEU H H 69 8.340 8.340 8.387 -0.047 17919 66154 1 161 . 1 1 70 70 VAL N N 70 126.940 126.940 125.087 1.853 17919 66155 1 161 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.438 -0.088 17919 66156 1 161 . 1 1 70 70 VAL C C 70 174.000 174.000 174.137 -0.137 17919 66157 1 161 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.415 0.385 17919 66158 1 161 . 1 1 70 70 VAL CB C 70 34.910 34.910 36.282 -1.373 17919 66159 1 161 . 1 1 70 70 VAL H H 70 9.200 9.200 8.857 0.343 17919 66160 1 161 . 1 1 71 71 LEU N N 71 123.130 123.130 124.750 -1.620 17919 66161 1 161 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.914 0.146 17919 66162 1 161 . 1 1 71 71 LEU C C 71 177.830 177.830 176.256 1.574 17919 66163 1 161 . 1 1 71 71 LEU CA C 71 53.940 53.940 54.622 -0.682 17919 66164 1 161 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.916 -0.066 17919 66165 1 161 . 1 1 71 71 LEU H H 71 8.120 8.120 8.455 -0.335 17919 66166 1 161 . 1 1 72 72 ARG N N 72 123.490 123.490 126.691 -3.201 17919 66167 1 161 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.681 -0.380 17919 66168 1 161 . 1 1 72 72 ARG C C 72 175.350 175.350 174.987 0.363 17919 66169 1 161 . 1 1 72 72 ARG CA C 72 55.610 55.610 54.948 0.662 17919 66170 1 161 . 1 1 72 72 ARG CB C 72 31.350 31.350 31.210 0.140 17919 66171 1 161 . 1 1 72 72 ARG H H 72 8.580 8.580 8.758 -0.178 17919 66172 1 162 . 1 1 2 2 GLN N N 2 123.220 123.220 119.752 3.468 17919 66173 1 162 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.243 0.006 17919 66174 1 162 . 1 1 2 2 GLN C C 2 175.920 175.920 175.891 0.029 17919 66175 1 162 . 1 1 2 2 GLN CA C 2 55.080 55.080 55.051 0.029 17919 66176 1 162 . 1 1 2 2 GLN CB C 2 30.760 30.760 29.245 1.515 17919 66177 1 162 . 1 1 2 2 GLN H H 2 8.900 8.900 8.257 0.643 17919 66178 1 162 . 1 1 3 3 ILE N N 3 115.340 115.340 117.440 -2.100 17919 66179 1 162 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.398 -0.185 17919 66180 1 162 . 1 1 3 3 ILE C C 3 172.450 172.450 173.473 -1.023 17919 66181 1 162 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.022 0.548 17919 66182 1 162 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.762 0.448 17919 66183 1 162 . 1 1 3 3 ILE H H 3 8.320 8.320 8.638 -0.318 17919 66184 1 162 . 1 1 4 4 PHE N N 4 118.110 118.110 120.282 -2.172 17919 66185 1 162 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.644 -0.014 17919 66186 1 162 . 1 1 4 4 PHE C C 4 175.320 175.320 175.063 0.257 17919 66187 1 162 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.339 -0.129 17919 66188 1 162 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.788 -0.308 17919 66189 1 162 . 1 1 4 4 PHE H H 4 8.610 8.610 8.443 0.167 17919 66190 1 162 . 1 1 5 5 VAL N N 5 121.000 121.000 123.871 -2.871 17919 66191 1 162 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.709 0.016 17919 66192 1 162 . 1 1 5 5 VAL C C 5 174.870 174.870 175.369 -0.499 17919 66193 1 162 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.108 -0.487 17919 66194 1 162 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.309 -0.079 17919 66195 1 162 . 1 1 5 5 VAL H H 5 9.300 9.300 9.194 0.106 17919 66196 1 162 . 1 1 6 6 LYS N N 6 127.520 127.520 128.319 -0.799 17919 66197 1 162 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.155 0.212 17919 66198 1 162 . 1 1 6 6 LYS C C 6 177.140 177.140 176.699 0.441 17919 66199 1 162 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.964 -0.444 17919 66200 1 162 . 1 1 6 6 LYS CB C 6 35.050 35.050 33.624 1.426 17919 66201 1 162 . 1 1 6 6 LYS H H 6 8.820 8.820 9.222 -0.402 17919 66202 1 162 . 1 1 7 7 THR N N 7 115.400 115.400 115.538 -0.138 17919 66203 1 162 . 1 1 7 7 THR HA H 7 4.970 4.970 4.672 0.298 17919 66204 1 162 . 1 1 7 7 THR C C 7 176.910 176.910 175.990 0.920 17919 66205 1 162 . 1 1 7 7 THR CA C 7 60.470 60.470 60.157 0.313 17919 66206 1 162 . 1 1 7 7 THR CB C 7 70.630 70.630 70.737 -0.107 17919 66207 1 162 . 1 1 7 7 THR H H 7 8.730 8.730 8.636 0.094 17919 66208 1 162 . 1 1 8 8 LEU N N 8 121.330 121.330 121.426 -0.096 17919 66209 1 162 . 1 1 8 8 LEU HA H 8 4.310 4.310 3.936 0.374 17919 66210 1 162 . 1 1 8 8 LEU C C 8 178.800 178.800 178.105 0.695 17919 66211 1 162 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.438 0.143 17919 66212 1 162 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.117 0.853 17919 66213 1 162 . 1 1 8 8 LEU H H 8 9.100 9.100 8.838 0.262 17919 66214 1 162 . 1 1 9 9 THR N N 9 105.590 105.590 107.374 -1.784 17919 66215 1 162 . 1 1 9 9 THR HA H 9 4.428 4.428 4.264 0.164 17919 66216 1 162 . 1 1 9 9 THR C C 9 175.520 175.520 175.891 -0.371 17919 66217 1 162 . 1 1 9 9 THR CA C 9 61.400 61.400 62.119 -0.719 17919 66218 1 162 . 1 1 9 9 THR CB C 9 69.140 69.140 68.441 0.700 17919 66219 1 162 . 1 1 9 9 THR H H 9 7.630 7.630 7.961 -0.331 17919 66220 1 162 . 1 1 10 10 GLY N N 10 108.890 108.890 110.560 -1.670 17919 66221 1 162 . 1 1 10 10 GLY C C 10 174.070 174.070 173.885 0.185 17919 66222 1 162 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.862 -0.402 17919 66223 1 162 . 1 1 10 10 GLY H H 10 7.810 7.810 8.379 -0.569 17919 66224 1 162 . 1 1 11 11 LYS N N 11 121.600 121.600 119.955 1.645 17919 66225 1 162 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.606 -0.245 17919 66226 1 162 . 1 1 11 11 LYS C C 11 175.940 175.940 175.530 0.410 17919 66227 1 162 . 1 1 11 11 LYS CA C 11 56.280 56.280 53.655 2.625 17919 66228 1 162 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.119 0.081 17919 66229 1 162 . 1 1 11 11 LYS H H 11 7.280 7.280 7.530 -0.250 17919 66230 1 162 . 1 1 12 12 THR N N 12 120.440 120.440 116.252 4.188 17919 66231 1 162 . 1 1 12 12 THR HA H 12 5.046 5.046 5.098 -0.052 17919 66232 1 162 . 1 1 12 12 THR C C 12 174.320 174.320 174.826 -0.506 17919 66233 1 162 . 1 1 12 12 THR CA C 12 62.390 62.390 61.820 0.570 17919 66234 1 162 . 1 1 12 12 THR CB C 12 69.910 69.910 69.914 -0.004 17919 66235 1 162 . 1 1 12 12 THR H H 12 8.650 8.650 8.308 0.342 17919 66236 1 162 . 1 1 13 13 ILE N N 13 127.110 127.110 127.660 -0.550 17919 66237 1 162 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.463 0.081 17919 66238 1 162 . 1 1 13 13 ILE C C 13 175.220 175.220 175.824 -0.604 17919 66239 1 162 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.234 -0.254 17919 66240 1 162 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.765 0.185 17919 66241 1 162 . 1 1 13 13 ILE H H 13 9.450 9.450 9.218 0.232 17919 66242 1 162 . 1 1 14 14 THR N N 14 121.520 121.520 123.791 -2.271 17919 66243 1 162 . 1 1 14 14 THR HA H 14 4.964 4.964 5.043 -0.079 17919 66244 1 162 . 1 1 14 14 THR C C 14 173.790 173.790 174.029 -0.239 17919 66245 1 162 . 1 1 14 14 THR CA C 14 61.940 61.940 62.602 -0.663 17919 66246 1 162 . 1 1 14 14 THR CB C 14 69.650 69.650 69.604 0.046 17919 66247 1 162 . 1 1 14 14 THR H H 14 8.710 8.710 8.516 0.194 17919 66248 1 162 . 1 1 15 15 LEU N N 15 124.800 124.800 126.208 -1.408 17919 66249 1 162 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.757 0.023 17919 66250 1 162 . 1 1 15 15 LEU C C 15 174.670 174.670 175.718 -1.048 17919 66251 1 162 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.507 -0.677 17919 66252 1 162 . 1 1 15 15 LEU CB C 15 47.070 47.070 46.230 0.840 17919 66253 1 162 . 1 1 15 15 LEU H H 15 8.710 8.710 8.867 -0.157 17919 66254 1 162 . 1 1 16 16 GLU N N 16 122.160 122.160 122.153 0.007 17919 66255 1 162 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.275 -0.358 17919 66256 1 162 . 1 1 16 16 GLU C C 16 175.860 175.860 175.915 -0.055 17919 66257 1 162 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.417 -0.598 17919 66258 1 162 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.326 -0.876 17919 66259 1 162 . 1 1 16 16 GLU H H 16 8.140 8.140 8.621 -0.481 17919 66260 1 162 . 1 1 17 17 VAL N N 17 117.210 117.210 118.408 -1.198 17919 66261 1 162 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.876 -0.162 17919 66262 1 162 . 1 1 17 17 VAL C C 17 174.160 174.160 174.495 -0.335 17919 66263 1 162 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.585 -1.155 17919 66264 1 162 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.326 1.074 17919 66265 1 162 . 1 1 17 17 VAL H H 17 8.900 8.900 8.467 0.433 17919 66266 1 162 . 1 1 18 18 GLU N N 18 118.990 118.990 122.900 -3.910 17919 66267 1 162 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.863 0.216 17919 66268 1 162 . 1 1 18 18 GLU C C 18 176.160 176.160 175.695 0.465 17919 66269 1 162 . 1 1 18 18 GLU CA C 18 52.720 52.720 51.852 0.868 17919 66270 1 162 . 1 1 18 18 GLU CB C 18 30.310 30.310 31.805 -1.495 17919 66271 1 162 . 1 1 18 18 GLU H H 18 8.640 8.640 8.862 -0.222 17919 66272 1 162 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.341 -0.200 17919 66273 1 162 . 1 1 19 19 PRO C C 19 175.310 175.310 177.376 -2.066 17919 66274 1 162 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.020 0.450 17919 66275 1 162 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.967 -0.017 17919 66276 1 162 . 1 1 20 20 SER N N 20 103.400 103.400 110.666 -7.266 17919 66277 1 162 . 1 1 20 20 SER HA H 20 4.370 4.370 4.262 0.108 17919 66278 1 162 . 1 1 20 20 SER C C 20 174.660 174.660 173.626 1.034 17919 66279 1 162 . 1 1 20 20 SER CA C 20 57.400 57.400 58.705 -1.305 17919 66280 1 162 . 1 1 20 20 SER CB C 20 63.370 63.370 62.936 0.434 17919 66281 1 162 . 1 1 20 20 SER H H 20 7.040 7.040 8.031 -0.991 17919 66282 1 162 . 1 1 21 21 ASP N N 21 123.480 123.480 122.803 0.677 17919 66283 1 162 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.806 -0.111 17919 66284 1 162 . 1 1 21 21 ASP C C 21 176.360 176.360 175.747 0.613 17919 66285 1 162 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.296 1.404 17919 66286 1 162 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.638 -0.838 17919 66287 1 162 . 1 1 21 21 ASP H H 21 8.030 8.030 7.469 0.561 17919 66288 1 162 . 1 1 22 22 THR N N 22 108.800 108.800 113.179 -4.379 17919 66289 1 162 . 1 1 22 22 THR HA H 22 4.920 4.920 4.867 0.053 17919 66290 1 162 . 1 1 22 22 THR C C 22 176.750 176.750 175.920 0.830 17919 66291 1 162 . 1 1 22 22 THR CA C 22 59.690 59.690 61.007 -1.317 17919 66292 1 162 . 1 1 22 22 THR CB C 22 71.200 71.200 70.649 0.551 17919 66293 1 162 . 1 1 22 22 THR H H 22 7.900 7.900 8.297 -0.397 17919 66294 1 162 . 1 1 23 23 ILE N N 23 121.190 121.190 121.717 -0.527 17919 66295 1 162 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.971 -0.314 17919 66296 1 162 . 1 1 23 23 ILE C C 23 179.040 179.040 177.686 1.354 17919 66297 1 162 . 1 1 23 23 ILE CA C 23 62.260 62.260 60.579 1.681 17919 66298 1 162 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.227 -1.877 17919 66299 1 162 . 1 1 23 23 ILE H H 23 8.560 8.560 8.730 -0.170 17919 66300 1 162 . 1 1 24 24 GLU N N 24 120.830 120.830 121.907 -1.077 17919 66301 1 162 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.841 0.076 17919 66302 1 162 . 1 1 24 24 GLU C C 24 178.640 178.640 178.401 0.239 17919 66303 1 162 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.235 -0.015 17919 66304 1 162 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.419 -1.139 17919 66305 1 162 . 1 1 24 24 GLU H H 24 9.760 9.760 8.231 1.529 17919 66306 1 162 . 1 1 25 25 ASN N N 25 120.570 120.570 117.388 3.182 17919 66307 1 162 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.532 -0.007 17919 66308 1 162 . 1 1 25 25 ASN C C 25 178.380 178.380 177.961 0.419 17919 66309 1 162 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.849 0.211 17919 66310 1 162 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.694 -0.244 17919 66311 1 162 . 1 1 25 25 ASN H H 25 7.920 7.920 7.665 0.255 17919 66312 1 162 . 1 1 26 26 VAL N N 26 121.710 121.710 121.325 0.385 17919 66313 1 162 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.645 -0.248 17919 66314 1 162 . 1 1 26 26 VAL C C 26 177.950 177.950 177.801 0.149 17919 66315 1 162 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.302 1.358 17919 66316 1 162 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.291 -0.451 17919 66317 1 162 . 1 1 26 26 VAL H H 26 8.070 8.070 8.174 -0.104 17919 66318 1 162 . 1 1 27 27 LYS N N 27 118.860 118.860 119.825 -0.965 17919 66319 1 162 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.131 0.449 17919 66320 1 162 . 1 1 27 27 LYS C C 27 180.550 180.550 179.209 1.341 17919 66321 1 162 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.830 -0.579 17919 66322 1 162 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.186 1.544 17919 66323 1 162 . 1 1 27 27 LYS H H 27 8.560 8.560 8.479 0.081 17919 66324 1 162 . 1 1 28 28 ALA N N 28 123.440 123.440 121.008 2.432 17919 66325 1 162 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.216 -0.056 17919 66326 1 162 . 1 1 28 28 ALA C C 28 180.300 180.300 179.418 0.882 17919 66327 1 162 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.656 0.715 17919 66328 1 162 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.519 -0.809 17919 66329 1 162 . 1 1 28 28 ALA H H 28 8.060 8.060 8.109 -0.049 17919 66330 1 162 . 1 1 29 29 LYS N N 29 119.940 119.940 119.175 0.765 17919 66331 1 162 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.065 0.142 17919 66332 1 162 . 1 1 29 29 LYS C C 29 180.320 180.320 178.912 1.408 17919 66333 1 162 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.227 0.423 17919 66334 1 162 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.365 0.925 17919 66335 1 162 . 1 1 29 29 LYS H H 29 7.850 7.850 7.520 0.330 17919 66336 1 162 . 1 1 30 30 ILE N N 30 121.080 121.080 119.668 1.412 17919 66337 1 162 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.734 -0.227 17919 66338 1 162 . 1 1 30 30 ILE C C 30 178.310 178.310 177.274 1.036 17919 66339 1 162 . 1 1 30 30 ILE CA C 30 66.150 66.150 64.401 1.749 17919 66340 1 162 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.889 -1.089 17919 66341 1 162 . 1 1 30 30 ILE H H 30 8.280 8.280 7.551 0.729 17919 66342 1 162 . 1 1 31 31 GLN N N 31 123.490 123.490 120.966 2.524 17919 66343 1 162 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.906 -0.077 17919 66344 1 162 . 1 1 31 31 GLN C C 31 178.890 178.890 178.380 0.510 17919 66345 1 162 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.306 0.694 17919 66346 1 162 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.528 -0.808 17919 66347 1 162 . 1 1 31 31 GLN H H 31 8.580 8.580 8.522 0.058 17919 66348 1 162 . 1 1 32 32 ASP N N 32 119.360 119.360 118.322 1.038 17919 66349 1 162 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.491 -0.137 17919 66350 1 162 . 1 1 32 32 ASP C C 32 177.250 177.250 177.794 -0.544 17919 66351 1 162 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.397 0.793 17919 66352 1 162 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.838 -0.258 17919 66353 1 162 . 1 1 32 32 ASP H H 32 8.010 8.010 7.837 0.173 17919 66354 1 162 . 1 1 33 33 LYS N N 33 115.130 115.130 118.052 -2.922 17919 66355 1 162 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.330 0.007 17919 66356 1 162 . 1 1 33 33 LYS C C 33 177.870 177.870 177.713 0.157 17919 66357 1 162 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.812 0.238 17919 66358 1 162 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.851 0.319 17919 66359 1 162 . 1 1 33 33 LYS H H 33 7.430 7.430 7.559 -0.129 17919 66360 1 162 . 1 1 34 34 GLU N N 34 113.870 113.870 115.379 -1.509 17919 66361 1 162 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.503 0.122 17919 66362 1 162 . 1 1 34 34 GLU C C 34 177.840 177.840 177.092 0.748 17919 66363 1 162 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.933 -0.763 17919 66364 1 162 . 1 1 34 34 GLU CB C 34 32.660 32.660 30.875 1.785 17919 66365 1 162 . 1 1 34 34 GLU H H 34 8.740 8.740 7.966 0.774 17919 66366 1 162 . 1 1 35 35 GLY N N 35 108.650 108.650 109.437 -0.787 17919 66367 1 162 . 1 1 35 35 GLY C C 35 173.960 173.960 174.209 -0.249 17919 66368 1 162 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.910 0.170 17919 66369 1 162 . 1 1 35 35 GLY H H 35 8.530 8.530 8.298 0.232 17919 66370 1 162 . 1 1 36 36 ILE N N 36 119.880 119.880 122.509 -2.629 17919 66371 1 162 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.340 0.105 17919 66372 1 162 . 1 1 36 36 ILE C C 36 173.590 173.590 173.906 -0.316 17919 66373 1 162 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.703 0.047 17919 66374 1 162 . 1 1 36 36 ILE CB C 36 40.580 40.580 39.168 1.412 17919 66375 1 162 . 1 1 36 36 ILE H H 36 6.150 6.150 7.649 -1.499 17919 66376 1 162 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.563 0.071 17919 66377 1 162 . 1 1 37 37 PRO C C 37 176.940 176.940 175.803 1.137 17919 66378 1 162 . 1 1 37 37 PRO CA C 37 61.660 61.660 62.140 -0.480 17919 66379 1 162 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.121 0.729 17919 66380 1 162 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.202 -0.085 17919 66381 1 162 . 1 1 38 38 PRO C C 38 178.320 178.320 178.567 -0.247 17919 66382 1 162 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.761 0.499 17919 66383 1 162 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.810 1.080 17919 66384 1 162 . 1 1 39 39 ASP N N 39 113.380 113.380 114.854 -1.474 17919 66385 1 162 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.388 0.042 17919 66386 1 162 . 1 1 39 39 ASP C C 39 177.090 177.090 177.705 -0.615 17919 66387 1 162 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.763 -1.123 17919 66388 1 162 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.298 -0.758 17919 66389 1 162 . 1 1 39 39 ASP H H 39 8.550 8.550 8.797 -0.247 17919 66390 1 162 . 1 1 40 40 GLN N N 40 116.780 116.780 117.980 -1.200 17919 66391 1 162 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.335 0.129 17919 66392 1 162 . 1 1 40 40 GLN C C 40 175.380 175.380 177.075 -1.695 17919 66393 1 162 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.604 -0.964 17919 66394 1 162 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.580 0.560 17919 66395 1 162 . 1 1 40 40 GLN H H 40 7.820 7.820 7.889 -0.069 17919 66396 1 162 . 1 1 41 41 GLN N N 41 117.720 117.720 119.927 -2.207 17919 66397 1 162 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.213 0.031 17919 66398 1 162 . 1 1 41 41 GLN C C 41 176.300 176.300 176.039 0.261 17919 66399 1 162 . 1 1 41 41 GLN CA C 41 56.470 56.470 57.103 -0.633 17919 66400 1 162 . 1 1 41 41 GLN CB C 41 31.650 31.650 28.490 3.160 17919 66401 1 162 . 1 1 41 41 GLN H H 41 7.480 7.480 7.986 -0.506 17919 66402 1 162 . 1 1 42 42 ARG N N 42 122.680 122.680 124.273 -1.593 17919 66403 1 162 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.519 -0.019 17919 66404 1 162 . 1 1 42 42 ARG C C 42 174.050 174.050 174.643 -0.593 17919 66405 1 162 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.090 -0.040 17919 66406 1 162 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.207 -0.457 17919 66407 1 162 . 1 1 42 42 ARG H H 42 8.530 8.530 8.995 -0.465 17919 66408 1 162 . 1 1 43 43 LEU N N 43 124.040 124.040 125.157 -1.117 17919 66409 1 162 . 1 1 43 43 LEU C C 43 175.290 175.290 175.279 0.011 17919 66410 1 162 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.704 -0.724 17919 66411 1 162 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.538 1.252 17919 66412 1 162 . 1 1 43 43 LEU H H 43 8.820 8.820 8.793 0.027 17919 66413 1 162 . 1 1 44 44 ILE N N 44 121.920 121.920 122.319 -0.399 17919 66414 1 162 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.205 -0.213 17919 66415 1 162 . 1 1 44 44 ILE C C 44 176.060 176.060 174.226 1.834 17919 66416 1 162 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.831 -0.851 17919 66417 1 162 . 1 1 44 44 ILE CB C 44 41.420 41.420 42.014 -0.594 17919 66418 1 162 . 1 1 44 44 ILE H H 44 9.030 9.030 8.913 0.117 17919 66419 1 162 . 1 1 45 45 PHE N N 45 125.390 125.390 126.354 -0.964 17919 66420 1 162 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.010 0.035 17919 66421 1 162 . 1 1 45 45 PHE C C 45 174.470 174.470 174.354 0.116 17919 66422 1 162 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.442 0.578 17919 66423 1 162 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.979 0.781 17919 66424 1 162 . 1 1 45 45 PHE H H 45 8.830 8.830 8.819 0.011 17919 66425 1 162 . 1 1 46 46 ALA N N 46 132.200 132.200 130.828 1.372 17919 66426 1 162 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.667 0.023 17919 66427 1 162 . 1 1 46 46 ALA C C 46 177.290 177.290 177.480 -0.190 17919 66428 1 162 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.493 0.047 17919 66429 1 162 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.269 0.301 17919 66430 1 162 . 1 1 46 46 ALA H H 46 8.810 8.810 8.738 0.072 17919 66431 1 162 . 1 1 47 47 GLY N N 47 102.340 102.340 103.391 -1.051 17919 66432 1 162 . 1 1 47 47 GLY C C 47 173.810 173.810 174.413 -0.603 17919 66433 1 162 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.315 0.035 17919 66434 1 162 . 1 1 47 47 GLY H H 47 8.130 8.130 8.473 -0.343 17919 66435 1 162 . 1 1 48 48 LYS N N 48 121.570 121.570 120.770 0.800 17919 66436 1 162 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.538 0.084 17919 66437 1 162 . 1 1 48 48 LYS C C 48 174.700 174.700 175.316 -0.616 17919 66438 1 162 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.015 -0.465 17919 66439 1 162 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.218 0.312 17919 66440 1 162 . 1 1 48 48 LYS H H 48 7.980 7.980 7.902 0.078 17919 66441 1 162 . 1 1 49 49 GLN N N 49 122.410 122.410 124.296 -1.886 17919 66442 1 162 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.324 0.236 17919 66443 1 162 . 1 1 49 49 GLN C C 49 175.670 175.670 175.595 0.075 17919 66444 1 162 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.903 -0.162 17919 66445 1 162 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.131 -0.131 17919 66446 1 162 . 1 1 49 49 GLN H H 49 8.600 8.600 8.578 0.022 17919 66447 1 162 . 1 1 50 50 LEU N N 50 125.520 125.520 129.825 -4.305 17919 66448 1 162 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.388 -0.298 17919 66449 1 162 . 1 1 50 50 LEU C C 50 176.660 176.660 176.373 0.287 17919 66450 1 162 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.204 0.036 17919 66451 1 162 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.407 0.163 17919 66452 1 162 . 1 1 50 50 LEU H H 50 8.530 8.530 8.549 -0.019 17919 66453 1 162 . 1 1 51 51 GLU N N 51 122.940 122.940 122.743 0.197 17919 66454 1 162 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.521 -0.033 17919 66455 1 162 . 1 1 51 51 GLU C C 51 175.870 175.870 177.225 -1.355 17919 66456 1 162 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.416 0.543 17919 66457 1 162 . 1 1 51 51 GLU CB C 51 31.570 31.570 30.863 0.707 17919 66458 1 162 . 1 1 51 51 GLU H H 51 8.400 8.400 8.428 -0.028 17919 66459 1 162 . 1 1 52 52 ASP N N 52 120.030 120.030 124.192 -4.162 17919 66460 1 162 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.397 -0.038 17919 66461 1 162 . 1 1 52 52 ASP C C 52 177.330 177.330 178.068 -0.738 17919 66462 1 162 . 1 1 52 52 ASP CA C 52 56.960 56.960 58.123 -1.163 17919 66463 1 162 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.663 0.187 17919 66464 1 162 . 1 1 52 52 ASP H H 52 8.160 8.160 8.850 -0.690 17919 66465 1 162 . 1 1 53 53 GLY N N 53 106.660 106.660 105.628 1.032 17919 66466 1 162 . 1 1 53 53 GLY C C 53 174.870 174.870 174.186 0.684 17919 66467 1 162 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.065 0.105 17919 66468 1 162 . 1 1 53 53 GLY H H 53 9.390 9.390 8.713 0.678 17919 66469 1 162 . 1 1 54 54 ARG N N 54 119.050 119.050 120.484 -1.434 17919 66470 1 162 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.633 0.062 17919 66471 1 162 . 1 1 54 54 ARG C C 54 175.350 175.350 175.362 -0.012 17919 66472 1 162 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.387 0.003 17919 66473 1 162 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.035 -0.385 17919 66474 1 162 . 1 1 54 54 ARG H H 54 7.460 7.460 7.445 0.015 17919 66475 1 162 . 1 1 55 55 THR N N 55 108.400 108.400 111.722 -3.322 17919 66476 1 162 . 1 1 55 55 THR HA H 55 5.240 5.240 4.928 0.312 17919 66477 1 162 . 1 1 55 55 THR C C 55 176.560 176.560 175.998 0.562 17919 66478 1 162 . 1 1 55 55 THR CA C 55 59.690 59.690 60.054 -0.364 17919 66479 1 162 . 1 1 55 55 THR CB C 55 72.260 72.260 71.486 0.775 17919 66480 1 162 . 1 1 55 55 THR H H 55 8.730 8.730 8.769 -0.039 17919 66481 1 162 . 1 1 56 56 LEU N N 56 117.920 117.920 121.108 -3.188 17919 66482 1 162 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.992 0.068 17919 66483 1 162 . 1 1 56 56 LEU C C 56 180.810 180.810 179.079 1.731 17919 66484 1 162 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.303 0.407 17919 66485 1 162 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.092 -0.722 17919 66486 1 162 . 1 1 56 56 LEU H H 56 8.140 8.140 8.799 -0.659 17919 66487 1 162 . 1 1 57 57 SER N N 57 113.330 113.330 114.815 -1.485 17919 66488 1 162 . 1 1 57 57 SER HA H 57 4.370 4.370 4.162 0.208 17919 66489 1 162 . 1 1 57 57 SER C C 57 178.310 178.310 177.099 1.211 17919 66490 1 162 . 1 1 57 57 SER CA C 57 61.080 61.080 61.484 -0.404 17919 66491 1 162 . 1 1 57 57 SER CB C 57 62.530 62.530 62.388 0.142 17919 66492 1 162 . 1 1 57 57 SER H H 57 8.470 8.470 8.347 0.123 17919 66493 1 162 . 1 1 58 58 ASP N N 58 124.190 124.190 122.446 1.744 17919 66494 1 162 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.301 -0.005 17919 66495 1 162 . 1 1 58 58 ASP C C 58 177.400 177.400 176.688 0.712 17919 66496 1 162 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.592 0.588 17919 66497 1 162 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.360 -0.260 17919 66498 1 162 . 1 1 58 58 ASP H H 58 7.930 7.930 7.956 -0.026 17919 66499 1 162 . 1 1 59 59 TYR N N 59 115.510 115.510 115.145 0.365 17919 66500 1 162 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.621 0.049 17919 66501 1 162 . 1 1 59 59 TYR C C 59 174.700 174.700 175.078 -0.378 17919 66502 1 162 . 1 1 59 59 TYR CA C 59 58.250 58.250 56.454 1.796 17919 66503 1 162 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.542 1.528 17919 66504 1 162 . 1 1 59 59 TYR H H 59 7.250 7.250 7.336 -0.086 17919 66505 1 162 . 1 1 60 60 ASN N N 60 115.900 115.900 118.043 -2.143 17919 66506 1 162 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.369 -0.014 17919 66507 1 162 . 1 1 60 60 ASN C C 60 174.340 174.340 174.885 -0.545 17919 66508 1 162 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.044 0.076 17919 66509 1 162 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.553 -0.143 17919 66510 1 162 . 1 1 60 60 ASN H H 60 8.150 8.150 7.663 0.487 17919 66511 1 162 . 1 1 61 61 ILE N N 61 118.600 118.600 119.029 -0.429 17919 66512 1 162 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.860 -0.467 17919 66513 1 162 . 1 1 61 61 ILE C C 61 174.610 174.610 175.834 -1.224 17919 66514 1 162 . 1 1 61 61 ILE CA C 61 62.420 62.420 60.852 1.567 17919 66515 1 162 . 1 1 61 61 ILE CB C 61 36.740 36.740 36.642 0.098 17919 66516 1 162 . 1 1 61 61 ILE H H 61 7.250 7.250 7.681 -0.431 17919 66517 1 162 . 1 1 62 62 GLN N N 62 124.740 124.740 125.987 -1.247 17919 66518 1 162 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.578 -0.072 17919 66519 1 162 . 1 1 62 62 GLN C C 62 175.970 175.970 175.092 0.878 17919 66520 1 162 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.845 -0.185 17919 66521 1 162 . 1 1 62 62 GLN CB C 62 31.650 31.650 30.745 0.905 17919 66522 1 162 . 1 1 62 62 GLN H H 62 7.610 7.610 8.241 -0.631 17919 66523 1 162 . 1 1 63 63 LYS N N 63 120.300 120.300 119.500 0.800 17919 66524 1 162 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.035 -0.034 17919 66525 1 162 . 1 1 63 63 LYS C C 63 175.810 175.810 176.678 -0.868 17919 66526 1 162 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.217 -0.427 17919 66527 1 162 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.756 0.894 17919 66528 1 162 . 1 1 63 63 LYS H H 63 8.490 8.490 8.427 0.063 17919 66529 1 162 . 1 1 64 64 GLU N N 64 113.950 113.950 119.775 -5.825 17919 66530 1 162 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.447 0.018 17919 66531 1 162 . 1 1 64 64 GLU C C 64 175.250 175.250 175.932 -0.682 17919 66532 1 162 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.739 0.151 17919 66533 1 162 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.411 -2.511 17919 66534 1 162 . 1 1 64 64 GLU H H 64 9.280 9.280 8.525 0.755 17919 66535 1 162 . 1 1 65 65 SER N N 65 114.730 114.730 114.336 0.394 17919 66536 1 162 . 1 1 65 65 SER HA H 65 4.640 4.640 4.628 0.012 17919 66537 1 162 . 1 1 65 65 SER C C 65 172.160 172.160 172.934 -0.774 17919 66538 1 162 . 1 1 65 65 SER CA C 65 60.890 60.890 58.318 2.572 17919 66539 1 162 . 1 1 65 65 SER CB C 65 64.910 64.910 64.555 0.355 17919 66540 1 162 . 1 1 65 65 SER H H 65 7.670 7.670 7.707 -0.037 17919 66541 1 162 . 1 1 66 66 THR N N 66 117.110 117.110 120.712 -3.602 17919 66542 1 162 . 1 1 66 66 THR HA H 66 5.270 5.270 5.284 -0.014 17919 66543 1 162 . 1 1 66 66 THR C C 66 173.950 173.950 174.166 -0.216 17919 66544 1 162 . 1 1 66 66 THR CA C 66 62.340 62.340 62.003 0.337 17919 66545 1 162 . 1 1 66 66 THR CB C 66 70.080 70.080 70.252 -0.172 17919 66546 1 162 . 1 1 66 66 THR H H 66 8.730 8.730 8.536 0.194 17919 66547 1 162 . 1 1 67 67 LEU N N 67 127.110 127.110 125.905 1.205 17919 66548 1 162 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.899 0.161 17919 66549 1 162 . 1 1 67 67 LEU C C 67 175.770 175.770 175.213 0.557 17919 66550 1 162 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.918 -0.018 17919 66551 1 162 . 1 1 67 67 LEU CB C 67 44.260 44.260 45.048 -0.789 17919 66552 1 162 . 1 1 67 67 LEU H H 67 9.410 9.410 8.982 0.428 17919 66553 1 162 . 1 1 68 68 HIS N N 68 118.380 118.380 120.267 -1.887 17919 66554 1 162 . 1 1 68 68 HIS HA H 68 5.240 5.240 4.931 0.309 17919 66555 1 162 . 1 1 68 68 HIS C C 68 173.150 173.150 173.190 -0.040 17919 66556 1 162 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.351 0.649 17919 66557 1 162 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.139 -1.609 17919 66558 1 162 . 1 1 68 68 HIS H H 68 9.230 9.230 9.086 0.144 17919 66559 1 162 . 1 1 69 69 LEU N N 69 124.460 124.460 129.194 -4.734 17919 66560 1 162 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.187 0.003 17919 66561 1 162 . 1 1 69 69 LEU C C 69 175.270 175.270 173.982 1.288 17919 66562 1 162 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.493 0.397 17919 66563 1 162 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.660 -0.280 17919 66564 1 162 . 1 1 69 69 LEU H H 69 8.340 8.340 7.993 0.347 17919 66565 1 162 . 1 1 70 70 VAL N N 70 126.940 126.940 124.009 2.931 17919 66566 1 162 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.386 -0.036 17919 66567 1 162 . 1 1 70 70 VAL C C 70 174.000 174.000 173.617 0.383 17919 66568 1 162 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.459 1.341 17919 66569 1 162 . 1 1 70 70 VAL CB C 70 34.910 34.910 36.176 -1.266 17919 66570 1 162 . 1 1 70 70 VAL H H 70 9.200 9.200 8.794 0.406 17919 66571 1 162 . 1 1 71 71 LEU N N 71 123.130 123.130 124.542 -1.412 17919 66572 1 162 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.788 0.272 17919 66573 1 162 . 1 1 71 71 LEU C C 71 177.830 177.830 176.675 1.155 17919 66574 1 162 . 1 1 71 71 LEU CA C 71 53.940 53.940 54.324 -0.384 17919 66575 1 162 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.403 0.447 17919 66576 1 162 . 1 1 71 71 LEU H H 71 8.120 8.120 8.413 -0.293 17919 66577 1 162 . 1 1 72 72 ARG N N 72 123.490 123.490 122.680 0.810 17919 66578 1 162 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.432 -0.131 17919 66579 1 162 . 1 1 72 72 ARG C C 72 175.350 175.350 175.016 0.334 17919 66580 1 162 . 1 1 72 72 ARG CA C 72 55.610 55.610 54.821 0.789 17919 66581 1 162 . 1 1 72 72 ARG CB C 72 31.350 31.350 32.191 -0.841 17919 66582 1 162 . 1 1 72 72 ARG H H 72 8.580 8.580 8.279 0.301 17919 66583 1 163 . 1 1 2 2 GLN N N 2 123.220 123.220 120.770 2.450 17919 66584 1 163 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.166 0.083 17919 66585 1 163 . 1 1 2 2 GLN C C 2 175.920 175.920 175.014 0.906 17919 66586 1 163 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.983 0.097 17919 66587 1 163 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.603 0.157 17919 66588 1 163 . 1 1 2 2 GLN H H 2 8.900 8.900 8.334 0.566 17919 66589 1 163 . 1 1 3 3 ILE N N 3 115.340 115.340 117.686 -2.346 17919 66590 1 163 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.472 -0.259 17919 66591 1 163 . 1 1 3 3 ILE C C 3 172.450 172.450 173.053 -0.603 17919 66592 1 163 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.206 0.364 17919 66593 1 163 . 1 1 3 3 ILE CB C 3 42.210 42.210 42.105 0.105 17919 66594 1 163 . 1 1 3 3 ILE H H 3 8.320 8.320 8.462 -0.142 17919 66595 1 163 . 1 1 4 4 PHE N N 4 118.110 118.110 118.119 -0.009 17919 66596 1 163 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.549 0.081 17919 66597 1 163 . 1 1 4 4 PHE C C 4 175.320 175.320 174.971 0.349 17919 66598 1 163 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.627 -0.417 17919 66599 1 163 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.088 -0.608 17919 66600 1 163 . 1 1 4 4 PHE H H 4 8.610 8.610 8.714 -0.104 17919 66601 1 163 . 1 1 5 5 VAL N N 5 121.000 121.000 121.550 -0.550 17919 66602 1 163 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.898 -0.173 17919 66603 1 163 . 1 1 5 5 VAL C C 5 174.870 174.870 174.401 0.469 17919 66604 1 163 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.096 -0.476 17919 66605 1 163 . 1 1 5 5 VAL CB C 5 34.230 34.230 35.233 -1.004 17919 66606 1 163 . 1 1 5 5 VAL H H 5 9.300 9.300 9.299 0.001 17919 66607 1 163 . 1 1 6 6 LYS N N 6 127.520 127.520 128.339 -0.819 17919 66608 1 163 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.194 0.173 17919 66609 1 163 . 1 1 6 6 LYS C C 6 177.140 177.140 176.283 0.857 17919 66610 1 163 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.391 0.129 17919 66611 1 163 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.708 -0.658 17919 66612 1 163 . 1 1 6 6 LYS H H 6 8.820 8.820 9.265 -0.445 17919 66613 1 163 . 1 1 7 7 THR N N 7 115.400 115.400 118.121 -2.721 17919 66614 1 163 . 1 1 7 7 THR HA H 7 4.970 4.970 4.481 0.489 17919 66615 1 163 . 1 1 7 7 THR C C 7 176.910 176.910 176.476 0.434 17919 66616 1 163 . 1 1 7 7 THR CA C 7 60.470 60.470 60.508 -0.038 17919 66617 1 163 . 1 1 7 7 THR CB C 7 70.630 70.630 70.163 0.467 17919 66618 1 163 . 1 1 7 7 THR H H 7 8.730 8.730 8.482 0.248 17919 66619 1 163 . 1 1 8 8 LEU N N 8 121.330 121.330 118.987 2.343 17919 66620 1 163 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.480 -0.170 17919 66621 1 163 . 1 1 8 8 LEU C C 8 178.800 178.800 177.826 0.974 17919 66622 1 163 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.103 0.477 17919 66623 1 163 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.733 0.237 17919 66624 1 163 . 1 1 8 8 LEU H H 8 9.100 9.100 8.797 0.303 17919 66625 1 163 . 1 1 9 9 THR N N 9 105.590 105.590 107.452 -1.862 17919 66626 1 163 . 1 1 9 9 THR HA H 9 4.428 4.428 4.380 0.049 17919 66627 1 163 . 1 1 9 9 THR C C 9 175.520 175.520 175.709 -0.189 17919 66628 1 163 . 1 1 9 9 THR CA C 9 61.400 61.400 61.481 -0.081 17919 66629 1 163 . 1 1 9 9 THR CB C 9 69.140 69.140 68.671 0.469 17919 66630 1 163 . 1 1 9 9 THR H H 9 7.630 7.630 7.677 -0.047 17919 66631 1 163 . 1 1 10 10 GLY N N 10 108.890 108.890 110.480 -1.590 17919 66632 1 163 . 1 1 10 10 GLY C C 10 174.070 174.070 174.034 0.036 17919 66633 1 163 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.093 0.367 17919 66634 1 163 . 1 1 10 10 GLY H H 10 7.810 7.810 7.827 -0.017 17919 66635 1 163 . 1 1 11 11 LYS N N 11 121.600 121.600 122.381 -0.781 17919 66636 1 163 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.393 -0.032 17919 66637 1 163 . 1 1 11 11 LYS C C 11 175.940 175.940 175.801 0.139 17919 66638 1 163 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.248 0.032 17919 66639 1 163 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.588 -0.388 17919 66640 1 163 . 1 1 11 11 LYS H H 11 7.280 7.280 7.811 -0.531 17919 66641 1 163 . 1 1 12 12 THR N N 12 120.440 120.440 120.953 -0.513 17919 66642 1 163 . 1 1 12 12 THR HA H 12 5.046 5.046 4.835 0.211 17919 66643 1 163 . 1 1 12 12 THR C C 12 174.320 174.320 174.702 -0.382 17919 66644 1 163 . 1 1 12 12 THR CA C 12 62.390 62.390 63.349 -0.959 17919 66645 1 163 . 1 1 12 12 THR CB C 12 69.910 69.910 69.690 0.220 17919 66646 1 163 . 1 1 12 12 THR H H 12 8.650 8.650 8.370 0.280 17919 66647 1 163 . 1 1 13 13 ILE N N 13 127.110 127.110 127.367 -0.257 17919 66648 1 163 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.562 -0.018 17919 66649 1 163 . 1 1 13 13 ILE C C 13 175.220 175.220 175.116 0.104 17919 66650 1 163 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.709 -0.729 17919 66651 1 163 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.044 -0.094 17919 66652 1 163 . 1 1 13 13 ILE H H 13 9.450 9.450 8.957 0.493 17919 66653 1 163 . 1 1 14 14 THR N N 14 121.520 121.520 123.316 -1.796 17919 66654 1 163 . 1 1 14 14 THR HA H 14 4.964 4.964 4.965 -0.001 17919 66655 1 163 . 1 1 14 14 THR C C 14 173.790 173.790 173.993 -0.203 17919 66656 1 163 . 1 1 14 14 THR CA C 14 61.940 61.940 61.751 0.189 17919 66657 1 163 . 1 1 14 14 THR CB C 14 69.650 69.650 69.641 0.009 17919 66658 1 163 . 1 1 14 14 THR H H 14 8.710 8.710 8.269 0.441 17919 66659 1 163 . 1 1 15 15 LEU N N 15 124.800 124.800 126.721 -1.921 17919 66660 1 163 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.698 0.082 17919 66661 1 163 . 1 1 15 15 LEU C C 15 174.670 174.670 175.589 -0.919 17919 66662 1 163 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.431 -0.600 17919 66663 1 163 . 1 1 15 15 LEU CB C 15 47.070 47.070 44.720 2.350 17919 66664 1 163 . 1 1 15 15 LEU H H 15 8.710 8.710 8.816 -0.106 17919 66665 1 163 . 1 1 16 16 GLU N N 16 122.160 122.160 125.297 -3.137 17919 66666 1 163 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.931 -0.014 17919 66667 1 163 . 1 1 16 16 GLU C C 16 175.860 175.860 175.953 -0.093 17919 66668 1 163 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.770 -0.950 17919 66669 1 163 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.311 -0.861 17919 66670 1 163 . 1 1 16 16 GLU H H 16 8.140 8.140 8.746 -0.606 17919 66671 1 163 . 1 1 17 17 VAL N N 17 117.210 117.210 120.999 -3.789 17919 66672 1 163 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.952 -0.238 17919 66673 1 163 . 1 1 17 17 VAL C C 17 174.160 174.160 174.941 -0.781 17919 66674 1 163 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.678 -0.248 17919 66675 1 163 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.346 1.054 17919 66676 1 163 . 1 1 17 17 VAL H H 17 8.900 8.900 8.922 -0.022 17919 66677 1 163 . 1 1 18 18 GLU N N 18 118.990 118.990 122.887 -3.897 17919 66678 1 163 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.847 0.232 17919 66679 1 163 . 1 1 18 18 GLU C C 18 176.160 176.160 175.735 0.425 17919 66680 1 163 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.205 0.515 17919 66681 1 163 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.381 -0.071 17919 66682 1 163 . 1 1 18 18 GLU H H 18 8.640 8.640 8.533 0.107 17919 66683 1 163 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.303 -0.162 17919 66684 1 163 . 1 1 19 19 PRO C C 19 175.310 175.310 177.587 -2.277 17919 66685 1 163 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.121 0.349 17919 66686 1 163 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.976 -0.026 17919 66687 1 163 . 1 1 20 20 SER N N 20 103.400 103.400 111.799 -8.399 17919 66688 1 163 . 1 1 20 20 SER HA H 20 4.370 4.370 4.334 0.036 17919 66689 1 163 . 1 1 20 20 SER C C 20 174.660 174.660 174.574 0.086 17919 66690 1 163 . 1 1 20 20 SER CA C 20 57.400 57.400 59.969 -2.569 17919 66691 1 163 . 1 1 20 20 SER CB C 20 63.370 63.370 62.723 0.647 17919 66692 1 163 . 1 1 20 20 SER H H 20 7.040 7.040 8.146 -1.106 17919 66693 1 163 . 1 1 21 21 ASP N N 21 123.480 123.480 123.115 0.365 17919 66694 1 163 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.798 -0.103 17919 66695 1 163 . 1 1 21 21 ASP C C 21 176.360 176.360 175.872 0.488 17919 66696 1 163 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.634 1.066 17919 66697 1 163 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.559 -0.759 17919 66698 1 163 . 1 1 21 21 ASP H H 21 8.030 8.030 7.777 0.253 17919 66699 1 163 . 1 1 22 22 THR N N 22 108.800 108.800 114.380 -5.580 17919 66700 1 163 . 1 1 22 22 THR HA H 22 4.920 4.920 4.990 -0.070 17919 66701 1 163 . 1 1 22 22 THR C C 22 176.750 176.750 176.351 0.399 17919 66702 1 163 . 1 1 22 22 THR CA C 22 59.690 59.690 60.514 -0.824 17919 66703 1 163 . 1 1 22 22 THR CB C 22 71.200 71.200 70.726 0.474 17919 66704 1 163 . 1 1 22 22 THR H H 22 7.900 7.900 8.912 -1.012 17919 66705 1 163 . 1 1 23 23 ILE N N 23 121.190 121.190 120.851 0.339 17919 66706 1 163 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.786 -0.129 17919 66707 1 163 . 1 1 23 23 ILE C C 23 179.040 179.040 177.795 1.245 17919 66708 1 163 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.402 -0.142 17919 66709 1 163 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.133 -1.782 17919 66710 1 163 . 1 1 23 23 ILE H H 23 8.560 8.560 8.282 0.278 17919 66711 1 163 . 1 1 24 24 GLU N N 24 120.830 120.830 120.493 0.337 17919 66712 1 163 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.946 -0.029 17919 66713 1 163 . 1 1 24 24 GLU C C 24 178.640 178.640 178.455 0.185 17919 66714 1 163 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.962 0.258 17919 66715 1 163 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.414 -1.134 17919 66716 1 163 . 1 1 24 24 GLU H H 24 9.760 9.760 8.427 1.333 17919 66717 1 163 . 1 1 25 25 ASN N N 25 120.570 120.570 118.647 1.923 17919 66718 1 163 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.464 0.061 17919 66719 1 163 . 1 1 25 25 ASN C C 25 178.380 178.380 177.790 0.590 17919 66720 1 163 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.115 -0.055 17919 66721 1 163 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.441 0.009 17919 66722 1 163 . 1 1 25 25 ASN H H 25 7.920 7.920 7.586 0.334 17919 66723 1 163 . 1 1 26 26 VAL N N 26 121.710 121.710 121.789 -0.079 17919 66724 1 163 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.603 -0.206 17919 66725 1 163 . 1 1 26 26 VAL C C 26 177.950 177.950 177.450 0.500 17919 66726 1 163 . 1 1 26 26 VAL CA C 26 67.660 67.660 67.065 0.595 17919 66727 1 163 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.462 -0.622 17919 66728 1 163 . 1 1 26 26 VAL H H 26 8.070 8.070 8.117 -0.047 17919 66729 1 163 . 1 1 27 27 LYS N N 27 118.860 118.860 119.991 -1.131 17919 66730 1 163 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.232 0.348 17919 66731 1 163 . 1 1 27 27 LYS C C 27 180.550 180.550 178.839 1.711 17919 66732 1 163 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.502 -0.251 17919 66733 1 163 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.331 1.399 17919 66734 1 163 . 1 1 27 27 LYS H H 27 8.560 8.560 8.475 0.085 17919 66735 1 163 . 1 1 28 28 ALA N N 28 123.440 123.440 121.440 2.000 17919 66736 1 163 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.333 -0.173 17919 66737 1 163 . 1 1 28 28 ALA C C 28 180.300 180.300 178.926 1.374 17919 66738 1 163 . 1 1 28 28 ALA CA C 28 55.370 55.370 53.952 1.419 17919 66739 1 163 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.591 -0.881 17919 66740 1 163 . 1 1 28 28 ALA H H 28 8.060 8.060 7.894 0.166 17919 66741 1 163 . 1 1 29 29 LYS N N 29 119.940 119.940 120.408 -0.468 17919 66742 1 163 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.003 0.204 17919 66743 1 163 . 1 1 29 29 LYS C C 29 180.320 180.320 178.925 1.395 17919 66744 1 163 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.555 0.095 17919 66745 1 163 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.389 0.901 17919 66746 1 163 . 1 1 29 29 LYS H H 29 7.850 7.850 8.150 -0.300 17919 66747 1 163 . 1 1 30 30 ILE N N 30 121.080 121.080 119.724 1.356 17919 66748 1 163 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.667 -0.160 17919 66749 1 163 . 1 1 30 30 ILE C C 30 178.310 178.310 177.144 1.166 17919 66750 1 163 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.319 0.831 17919 66751 1 163 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.971 -1.171 17919 66752 1 163 . 1 1 30 30 ILE H H 30 8.280 8.280 8.171 0.109 17919 66753 1 163 . 1 1 31 31 GLN N N 31 123.490 123.490 120.599 2.891 17919 66754 1 163 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.996 -0.167 17919 66755 1 163 . 1 1 31 31 GLN C C 31 178.890 178.890 178.162 0.728 17919 66756 1 163 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.114 0.886 17919 66757 1 163 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.458 -0.738 17919 66758 1 163 . 1 1 31 31 GLN H H 31 8.580 8.580 7.776 0.804 17919 66759 1 163 . 1 1 32 32 ASP N N 32 119.360 119.360 118.991 0.369 17919 66760 1 163 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.393 -0.039 17919 66761 1 163 . 1 1 32 32 ASP C C 32 177.250 177.250 177.753 -0.503 17919 66762 1 163 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.908 0.282 17919 66763 1 163 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.834 -0.254 17919 66764 1 163 . 1 1 32 32 ASP H H 32 8.010 8.010 8.005 0.005 17919 66765 1 163 . 1 1 33 33 LYS N N 33 115.130 115.130 118.265 -3.135 17919 66766 1 163 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.339 -0.002 17919 66767 1 163 . 1 1 33 33 LYS C C 33 177.870 177.870 178.192 -0.322 17919 66768 1 163 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.670 0.380 17919 66769 1 163 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.467 0.703 17919 66770 1 163 . 1 1 33 33 LYS H H 33 7.430 7.430 7.594 -0.164 17919 66771 1 163 . 1 1 34 34 GLU N N 34 113.870 113.870 115.083 -1.213 17919 66772 1 163 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.453 0.172 17919 66773 1 163 . 1 1 34 34 GLU C C 34 177.840 177.840 177.549 0.291 17919 66774 1 163 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.732 -0.562 17919 66775 1 163 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.063 1.597 17919 66776 1 163 . 1 1 34 34 GLU H H 34 8.740 8.740 8.015 0.725 17919 66777 1 163 . 1 1 35 35 GLY N N 35 108.650 108.650 109.524 -0.874 17919 66778 1 163 . 1 1 35 35 GLY C C 35 173.960 173.960 174.117 -0.157 17919 66779 1 163 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.993 0.087 17919 66780 1 163 . 1 1 35 35 GLY H H 35 8.530 8.530 8.092 0.438 17919 66781 1 163 . 1 1 36 36 ILE N N 36 119.880 119.880 121.763 -1.883 17919 66782 1 163 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.352 0.093 17919 66783 1 163 . 1 1 36 36 ILE C C 36 173.590 173.590 174.704 -1.114 17919 66784 1 163 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.676 0.074 17919 66785 1 163 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.771 1.809 17919 66786 1 163 . 1 1 36 36 ILE H H 36 6.150 6.150 7.733 -1.583 17919 66787 1 163 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.549 0.085 17919 66788 1 163 . 1 1 37 37 PRO C C 37 176.940 176.940 176.160 0.780 17919 66789 1 163 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.840 -0.180 17919 66790 1 163 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.158 0.692 17919 66791 1 163 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.169 -0.052 17919 66792 1 163 . 1 1 38 38 PRO C C 38 178.320 178.320 178.662 -0.342 17919 66793 1 163 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.804 0.456 17919 66794 1 163 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.782 1.108 17919 66795 1 163 . 1 1 39 39 ASP N N 39 113.380 113.380 117.007 -3.627 17919 66796 1 163 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.392 0.038 17919 66797 1 163 . 1 1 39 39 ASP C C 39 177.090 177.090 177.855 -0.765 17919 66798 1 163 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.843 -1.204 17919 66799 1 163 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.432 -0.892 17919 66800 1 163 . 1 1 39 39 ASP H H 39 8.550 8.550 8.548 0.002 17919 66801 1 163 . 1 1 40 40 GLN N N 40 116.780 116.780 117.173 -0.393 17919 66802 1 163 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.367 0.097 17919 66803 1 163 . 1 1 40 40 GLN C C 40 175.380 175.380 175.838 -0.458 17919 66804 1 163 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.337 0.303 17919 66805 1 163 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.064 1.076 17919 66806 1 163 . 1 1 40 40 GLN H H 40 7.820 7.820 8.000 -0.180 17919 66807 1 163 . 1 1 41 41 GLN N N 41 117.720 117.720 119.422 -1.702 17919 66808 1 163 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.758 -0.514 17919 66809 1 163 . 1 1 41 41 GLN C C 41 176.300 176.300 175.432 0.868 17919 66810 1 163 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.008 0.462 17919 66811 1 163 . 1 1 41 41 GLN CB C 41 31.650 31.650 30.003 1.647 17919 66812 1 163 . 1 1 41 41 GLN H H 41 7.480 7.480 7.364 0.116 17919 66813 1 163 . 1 1 42 42 ARG N N 42 122.680 122.680 122.165 0.515 17919 66814 1 163 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.647 -0.147 17919 66815 1 163 . 1 1 42 42 ARG C C 42 174.050 174.050 174.305 -0.255 17919 66816 1 163 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.888 0.162 17919 66817 1 163 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.437 -1.687 17919 66818 1 163 . 1 1 42 42 ARG H H 42 8.530 8.530 8.505 0.025 17919 66819 1 163 . 1 1 43 43 LEU N N 43 124.040 124.040 123.995 0.045 17919 66820 1 163 . 1 1 43 43 LEU C C 43 175.290 175.290 175.943 -0.653 17919 66821 1 163 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.976 -0.996 17919 66822 1 163 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.663 1.127 17919 66823 1 163 . 1 1 43 43 LEU H H 43 8.820 8.820 8.724 0.096 17919 66824 1 163 . 1 1 44 44 ILE N N 44 121.920 121.920 121.403 0.517 17919 66825 1 163 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.924 0.068 17919 66826 1 163 . 1 1 44 44 ILE C C 44 176.060 176.060 174.496 1.564 17919 66827 1 163 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.845 -1.865 17919 66828 1 163 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.075 0.345 17919 66829 1 163 . 1 1 44 44 ILE H H 44 9.030 9.030 8.160 0.870 17919 66830 1 163 . 1 1 45 45 PHE N N 45 125.390 125.390 126.953 -1.563 17919 66831 1 163 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.960 0.085 17919 66832 1 163 . 1 1 45 45 PHE C C 45 174.470 174.470 175.041 -0.571 17919 66833 1 163 . 1 1 45 45 PHE CA C 45 57.020 57.020 55.917 1.103 17919 66834 1 163 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.724 0.036 17919 66835 1 163 . 1 1 45 45 PHE H H 45 8.830 8.830 8.966 -0.136 17919 66836 1 163 . 1 1 46 46 ALA N N 46 132.200 132.200 125.937 6.263 17919 66837 1 163 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.513 0.177 17919 66838 1 163 . 1 1 46 46 ALA C C 46 177.290 177.290 177.922 -0.632 17919 66839 1 163 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.116 0.424 17919 66840 1 163 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.393 0.177 17919 66841 1 163 . 1 1 46 46 ALA H H 46 8.810 8.810 8.175 0.635 17919 66842 1 163 . 1 1 47 47 GLY N N 47 102.340 102.340 105.281 -2.941 17919 66843 1 163 . 1 1 47 47 GLY C C 47 173.810 173.810 174.312 -0.502 17919 66844 1 163 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.064 0.286 17919 66845 1 163 . 1 1 47 47 GLY H H 47 8.130 8.130 8.415 -0.285 17919 66846 1 163 . 1 1 48 48 LYS N N 48 121.570 121.570 121.415 0.155 17919 66847 1 163 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.665 -0.043 17919 66848 1 163 . 1 1 48 48 LYS C C 48 174.700 174.700 175.095 -0.395 17919 66849 1 163 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.913 -0.363 17919 66850 1 163 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.992 -0.462 17919 66851 1 163 . 1 1 48 48 LYS H H 48 7.980 7.980 7.998 -0.018 17919 66852 1 163 . 1 1 49 49 GLN N N 49 122.410 122.410 125.088 -2.678 17919 66853 1 163 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.527 0.033 17919 66854 1 163 . 1 1 49 49 GLN C C 49 175.670 175.670 175.622 0.048 17919 66855 1 163 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.458 -0.718 17919 66856 1 163 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.654 -0.654 17919 66857 1 163 . 1 1 49 49 GLN H H 49 8.600 8.600 8.642 -0.042 17919 66858 1 163 . 1 1 50 50 LEU N N 50 125.520 125.520 127.348 -1.828 17919 66859 1 163 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.539 -0.449 17919 66860 1 163 . 1 1 50 50 LEU C C 50 176.660 176.660 176.289 0.371 17919 66861 1 163 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.241 -0.001 17919 66862 1 163 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.304 -0.734 17919 66863 1 163 . 1 1 50 50 LEU H H 50 8.530 8.530 8.746 -0.216 17919 66864 1 163 . 1 1 51 51 GLU N N 51 122.940 122.940 124.810 -1.870 17919 66865 1 163 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.528 -0.040 17919 66866 1 163 . 1 1 51 51 GLU C C 51 175.870 175.870 177.104 -1.234 17919 66867 1 163 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.685 0.275 17919 66868 1 163 . 1 1 51 51 GLU CB C 51 31.570 31.570 30.734 0.836 17919 66869 1 163 . 1 1 51 51 GLU H H 51 8.400 8.400 8.711 -0.311 17919 66870 1 163 . 1 1 52 52 ASP N N 52 120.030 120.030 126.256 -6.226 17919 66871 1 163 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.363 -0.004 17919 66872 1 163 . 1 1 52 52 ASP C C 52 177.330 177.330 177.935 -0.605 17919 66873 1 163 . 1 1 52 52 ASP CA C 52 56.960 56.960 58.118 -1.158 17919 66874 1 163 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.835 0.015 17919 66875 1 163 . 1 1 52 52 ASP H H 52 8.160 8.160 8.912 -0.752 17919 66876 1 163 . 1 1 53 53 GLY N N 53 106.660 106.660 104.913 1.747 17919 66877 1 163 . 1 1 53 53 GLY C C 53 174.870 174.870 174.064 0.806 17919 66878 1 163 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.420 0.750 17919 66879 1 163 . 1 1 53 53 GLY H H 53 9.390 9.390 8.252 1.138 17919 66880 1 163 . 1 1 54 54 ARG N N 54 119.050 119.050 121.251 -2.201 17919 66881 1 163 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.601 0.094 17919 66882 1 163 . 1 1 54 54 ARG C C 54 175.350 175.350 175.435 -0.085 17919 66883 1 163 . 1 1 54 54 ARG CA C 54 54.390 54.390 55.006 -0.616 17919 66884 1 163 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.232 0.418 17919 66885 1 163 . 1 1 54 54 ARG H H 54 7.460 7.460 7.401 0.059 17919 66886 1 163 . 1 1 55 55 THR N N 55 108.400 108.400 115.020 -6.620 17919 66887 1 163 . 1 1 55 55 THR HA H 55 5.240 5.240 4.640 0.600 17919 66888 1 163 . 1 1 55 55 THR C C 55 176.560 176.560 175.574 0.986 17919 66889 1 163 . 1 1 55 55 THR CA C 55 59.690 59.690 61.227 -1.537 17919 66890 1 163 . 1 1 55 55 THR CB C 55 72.260 72.260 69.936 2.324 17919 66891 1 163 . 1 1 55 55 THR H H 55 8.730 8.730 8.286 0.444 17919 66892 1 163 . 1 1 56 56 LEU N N 56 117.920 117.920 122.738 -4.818 17919 66893 1 163 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.174 -0.114 17919 66894 1 163 . 1 1 56 56 LEU C C 56 180.810 180.810 178.678 2.132 17919 66895 1 163 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.520 0.190 17919 66896 1 163 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.628 -1.258 17919 66897 1 163 . 1 1 56 56 LEU H H 56 8.140 8.140 8.460 -0.320 17919 66898 1 163 . 1 1 57 57 SER N N 57 113.330 113.330 114.566 -1.236 17919 66899 1 163 . 1 1 57 57 SER HA H 57 4.370 4.370 4.105 0.265 17919 66900 1 163 . 1 1 57 57 SER C C 57 178.310 178.310 176.794 1.516 17919 66901 1 163 . 1 1 57 57 SER CA C 57 61.080 61.080 61.314 -0.234 17919 66902 1 163 . 1 1 57 57 SER CB C 57 62.530 62.530 62.709 -0.179 17919 66903 1 163 . 1 1 57 57 SER H H 57 8.470 8.470 8.638 -0.168 17919 66904 1 163 . 1 1 58 58 ASP N N 58 124.190 124.190 121.765 2.425 17919 66905 1 163 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.409 -0.113 17919 66906 1 163 . 1 1 58 58 ASP C C 58 177.400 177.400 176.876 0.524 17919 66907 1 163 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.163 1.017 17919 66908 1 163 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.792 -0.693 17919 66909 1 163 . 1 1 58 58 ASP H H 58 7.930 7.930 7.903 0.027 17919 66910 1 163 . 1 1 59 59 TYR N N 59 115.510 115.510 116.456 -0.946 17919 66911 1 163 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.491 0.179 17919 66912 1 163 . 1 1 59 59 TYR C C 59 174.700 174.700 175.347 -0.647 17919 66913 1 163 . 1 1 59 59 TYR CA C 59 58.250 58.250 58.068 0.182 17919 66914 1 163 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.379 1.692 17919 66915 1 163 . 1 1 59 59 TYR H H 59 7.250 7.250 7.394 -0.144 17919 66916 1 163 . 1 1 60 60 ASN N N 60 115.900 115.900 116.827 -0.927 17919 66917 1 163 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.436 -0.081 17919 66918 1 163 . 1 1 60 60 ASN C C 60 174.340 174.340 174.497 -0.157 17919 66919 1 163 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.277 -0.157 17919 66920 1 163 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.671 -0.261 17919 66921 1 163 . 1 1 60 60 ASN H H 60 8.150 8.150 7.850 0.300 17919 66922 1 163 . 1 1 61 61 ILE N N 61 118.600 118.600 119.713 -1.113 17919 66923 1 163 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.938 -0.545 17919 66924 1 163 . 1 1 61 61 ILE C C 61 174.610 174.610 175.302 -0.692 17919 66925 1 163 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.428 0.992 17919 66926 1 163 . 1 1 61 61 ILE CB C 61 36.740 36.740 36.639 0.101 17919 66927 1 163 . 1 1 61 61 ILE H H 61 7.250 7.250 7.936 -0.686 17919 66928 1 163 . 1 1 62 62 GLN N N 62 124.740 124.740 125.158 -0.418 17919 66929 1 163 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.803 -0.297 17919 66930 1 163 . 1 1 62 62 GLN C C 62 175.970 175.970 175.692 0.278 17919 66931 1 163 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.769 -0.109 17919 66932 1 163 . 1 1 62 62 GLN CB C 62 31.650 31.650 33.137 -1.487 17919 66933 1 163 . 1 1 62 62 GLN H H 62 7.610 7.610 7.961 -0.351 17919 66934 1 163 . 1 1 63 63 LYS N N 63 120.300 120.300 120.836 -0.536 17919 66935 1 163 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.142 -0.141 17919 66936 1 163 . 1 1 63 63 LYS C C 63 175.810 175.810 176.729 -0.919 17919 66937 1 163 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.439 0.351 17919 66938 1 163 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.307 0.343 17919 66939 1 163 . 1 1 63 63 LYS H H 63 8.490 8.490 8.650 -0.160 17919 66940 1 163 . 1 1 64 64 GLU N N 64 113.950 113.950 118.745 -4.795 17919 66941 1 163 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.647 -0.182 17919 66942 1 163 . 1 1 64 64 GLU C C 64 175.250 175.250 175.813 -0.563 17919 66943 1 163 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.656 0.234 17919 66944 1 163 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.980 -3.080 17919 66945 1 163 . 1 1 64 64 GLU H H 64 9.280 9.280 8.896 0.384 17919 66946 1 163 . 1 1 65 65 SER N N 65 114.730 114.730 114.455 0.275 17919 66947 1 163 . 1 1 65 65 SER HA H 65 4.640 4.640 4.394 0.246 17919 66948 1 163 . 1 1 65 65 SER C C 65 172.160 172.160 173.754 -1.594 17919 66949 1 163 . 1 1 65 65 SER CA C 65 60.890 60.890 60.360 0.530 17919 66950 1 163 . 1 1 65 65 SER CB C 65 64.910 64.910 63.947 0.963 17919 66951 1 163 . 1 1 65 65 SER H H 65 7.670 7.670 7.720 -0.050 17919 66952 1 163 . 1 1 66 66 THR N N 66 117.110 117.110 118.888 -1.778 17919 66953 1 163 . 1 1 66 66 THR HA H 66 5.270 5.270 5.267 0.003 17919 66954 1 163 . 1 1 66 66 THR C C 66 173.950 173.950 174.227 -0.277 17919 66955 1 163 . 1 1 66 66 THR CA C 66 62.340 62.340 61.835 0.505 17919 66956 1 163 . 1 1 66 66 THR CB C 66 70.080 70.080 70.137 -0.057 17919 66957 1 163 . 1 1 66 66 THR H H 66 8.730 8.730 8.269 0.461 17919 66958 1 163 . 1 1 67 67 LEU N N 67 127.110 127.110 126.899 0.211 17919 66959 1 163 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.569 0.491 17919 66960 1 163 . 1 1 67 67 LEU C C 67 175.770 175.770 175.263 0.507 17919 66961 1 163 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.177 -0.277 17919 66962 1 163 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.408 0.852 17919 66963 1 163 . 1 1 67 67 LEU H H 67 9.410 9.410 8.998 0.412 17919 66964 1 163 . 1 1 68 68 HIS N N 68 118.380 118.380 122.538 -4.158 17919 66965 1 163 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.215 0.025 17919 66966 1 163 . 1 1 68 68 HIS C C 68 173.150 173.150 173.597 -0.447 17919 66967 1 163 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.492 0.508 17919 66968 1 163 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.140 -1.610 17919 66969 1 163 . 1 1 68 68 HIS H H 68 9.230 9.230 8.622 0.608 17919 66970 1 163 . 1 1 69 69 LEU N N 69 124.460 124.460 129.677 -5.217 17919 66971 1 163 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.914 0.276 17919 66972 1 163 . 1 1 69 69 LEU C C 69 175.270 175.270 174.666 0.604 17919 66973 1 163 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.379 0.511 17919 66974 1 163 . 1 1 69 69 LEU CB C 69 44.380 44.380 43.614 0.766 17919 66975 1 163 . 1 1 69 69 LEU H H 69 8.340 8.340 7.812 0.528 17919 66976 1 163 . 1 1 70 70 VAL N N 70 126.940 126.940 127.887 -0.947 17919 66977 1 163 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.307 0.043 17919 66978 1 163 . 1 1 70 70 VAL C C 70 174.000 174.000 174.673 -0.673 17919 66979 1 163 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.782 0.018 17919 66980 1 163 . 1 1 70 70 VAL CB C 70 34.910 34.910 34.221 0.689 17919 66981 1 163 . 1 1 70 70 VAL H H 70 9.200 9.200 8.968 0.232 17919 66982 1 163 . 1 1 71 71 LEU N N 71 123.130 123.130 126.384 -3.254 17919 66983 1 163 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.548 0.512 17919 66984 1 163 . 1 1 71 71 LEU C C 71 177.830 177.830 176.492 1.338 17919 66985 1 163 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.888 0.052 17919 66986 1 163 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.476 -0.626 17919 66987 1 163 . 1 1 71 71 LEU H H 71 8.120 8.120 8.522 -0.402 17919 66988 1 163 . 1 1 72 72 ARG N N 72 123.490 123.490 125.649 -2.159 17919 66989 1 163 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.296 0.005 17919 66990 1 163 . 1 1 72 72 ARG C C 72 175.350 175.350 175.032 0.318 17919 66991 1 163 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.687 -1.077 17919 66992 1 163 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.424 0.926 17919 66993 1 163 . 1 1 72 72 ARG H H 72 8.580 8.580 8.423 0.157 17919 66994 1 164 . 1 1 2 2 GLN N N 2 123.220 123.220 120.830 2.390 17919 66995 1 164 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.161 0.088 17919 66996 1 164 . 1 1 2 2 GLN C C 2 175.920 175.920 174.801 1.119 17919 66997 1 164 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.982 0.098 17919 66998 1 164 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.158 0.602 17919 66999 1 164 . 1 1 2 2 GLN H H 2 8.900 8.900 8.393 0.507 17919 67000 1 164 . 1 1 3 3 ILE N N 3 115.340 115.340 117.765 -2.425 17919 67001 1 164 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.267 -0.054 17919 67002 1 164 . 1 1 3 3 ILE C C 3 172.450 172.450 173.522 -1.072 17919 67003 1 164 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.832 -0.262 17919 67004 1 164 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.586 0.624 17919 67005 1 164 . 1 1 3 3 ILE H H 3 8.320 8.320 8.634 -0.314 17919 67006 1 164 . 1 1 4 4 PHE N N 4 118.110 118.110 121.899 -3.789 17919 67007 1 164 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.458 0.172 17919 67008 1 164 . 1 1 4 4 PHE C C 4 175.320 175.320 175.649 -0.329 17919 67009 1 164 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.737 -0.527 17919 67010 1 164 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.326 0.154 17919 67011 1 164 . 1 1 4 4 PHE H H 4 8.610 8.610 8.634 -0.024 17919 67012 1 164 . 1 1 5 5 VAL N N 5 121.000 121.000 121.682 -0.682 17919 67013 1 164 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.917 -0.192 17919 67014 1 164 . 1 1 5 5 VAL C C 5 174.870 174.870 174.394 0.476 17919 67015 1 164 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.296 -0.676 17919 67016 1 164 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.171 0.059 17919 67017 1 164 . 1 1 5 5 VAL H H 5 9.300 9.300 9.308 -0.008 17919 67018 1 164 . 1 1 6 6 LYS N N 6 127.520 127.520 128.205 -0.685 17919 67019 1 164 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.489 -0.122 17919 67020 1 164 . 1 1 6 6 LYS C C 6 177.140 177.140 176.125 1.015 17919 67021 1 164 . 1 1 6 6 LYS CA C 6 54.520 54.520 53.885 0.635 17919 67022 1 164 . 1 1 6 6 LYS CB C 6 35.050 35.050 36.594 -1.544 17919 67023 1 164 . 1 1 6 6 LYS H H 6 8.820 8.820 9.285 -0.465 17919 67024 1 164 . 1 1 7 7 THR N N 7 115.400 115.400 117.305 -1.905 17919 67025 1 164 . 1 1 7 7 THR HA H 7 4.970 4.970 4.542 0.428 17919 67026 1 164 . 1 1 7 7 THR C C 7 176.910 176.910 176.633 0.277 17919 67027 1 164 . 1 1 7 7 THR CA C 7 60.470 60.470 61.342 -0.872 17919 67028 1 164 . 1 1 7 7 THR CB C 7 70.630 70.630 70.065 0.565 17919 67029 1 164 . 1 1 7 7 THR H H 7 8.730 8.730 8.809 -0.079 17919 67030 1 164 . 1 1 8 8 LEU N N 8 121.330 121.330 122.795 -1.465 17919 67031 1 164 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.272 0.038 17919 67032 1 164 . 1 1 8 8 LEU C C 8 178.800 178.800 177.128 1.672 17919 67033 1 164 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.939 -0.359 17919 67034 1 164 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.012 -0.042 17919 67035 1 164 . 1 1 8 8 LEU H H 8 9.100 9.100 8.306 0.794 17919 67036 1 164 . 1 1 9 9 THR N N 9 105.590 105.590 108.093 -2.503 17919 67037 1 164 . 1 1 9 9 THR HA H 9 4.428 4.428 4.316 0.112 17919 67038 1 164 . 1 1 9 9 THR C C 9 175.520 175.520 175.227 0.293 17919 67039 1 164 . 1 1 9 9 THR CA C 9 61.400 61.400 62.407 -1.007 17919 67040 1 164 . 1 1 9 9 THR CB C 9 69.140 69.140 69.073 0.067 17919 67041 1 164 . 1 1 9 9 THR H H 9 7.630 7.630 7.492 0.138 17919 67042 1 164 . 1 1 10 10 GLY N N 10 108.890 108.890 109.896 -1.006 17919 67043 1 164 . 1 1 10 10 GLY C C 10 174.070 174.070 173.624 0.446 17919 67044 1 164 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.803 0.657 17919 67045 1 164 . 1 1 10 10 GLY H H 10 7.810 7.810 7.611 0.199 17919 67046 1 164 . 1 1 11 11 LYS N N 11 121.600 121.600 122.246 -0.646 17919 67047 1 164 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.277 0.084 17919 67048 1 164 . 1 1 11 11 LYS C C 11 175.940 175.940 175.284 0.656 17919 67049 1 164 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.737 -0.457 17919 67050 1 164 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.391 -0.191 17919 67051 1 164 . 1 1 11 11 LYS H H 11 7.280 7.280 7.633 -0.353 17919 67052 1 164 . 1 1 12 12 THR N N 12 120.440 120.440 122.002 -1.562 17919 67053 1 164 . 1 1 12 12 THR HA H 12 5.046 5.046 4.862 0.184 17919 67054 1 164 . 1 1 12 12 THR C C 12 174.320 174.320 174.565 -0.245 17919 67055 1 164 . 1 1 12 12 THR CA C 12 62.390 62.390 62.727 -0.337 17919 67056 1 164 . 1 1 12 12 THR CB C 12 69.910 69.910 69.716 0.194 17919 67057 1 164 . 1 1 12 12 THR H H 12 8.650 8.650 8.482 0.168 17919 67058 1 164 . 1 1 13 13 ILE N N 13 127.110 127.110 127.597 -0.487 17919 67059 1 164 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.590 -0.046 17919 67060 1 164 . 1 1 13 13 ILE C C 13 175.220 175.220 174.976 0.244 17919 67061 1 164 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.300 -0.320 17919 67062 1 164 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.646 -0.696 17919 67063 1 164 . 1 1 13 13 ILE H H 13 9.450 9.450 9.283 0.167 17919 67064 1 164 . 1 1 14 14 THR N N 14 121.520 121.520 123.481 -1.961 17919 67065 1 164 . 1 1 14 14 THR HA H 14 4.964 4.964 4.593 0.371 17919 67066 1 164 . 1 1 14 14 THR C C 14 173.790 173.790 173.289 0.501 17919 67067 1 164 . 1 1 14 14 THR CA C 14 61.940 61.940 62.381 -0.441 17919 67068 1 164 . 1 1 14 14 THR CB C 14 69.650 69.650 69.469 0.181 17919 67069 1 164 . 1 1 14 14 THR H H 14 8.710 8.710 8.306 0.404 17919 67070 1 164 . 1 1 15 15 LEU N N 15 124.800 124.800 126.743 -1.943 17919 67071 1 164 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.697 0.083 17919 67072 1 164 . 1 1 15 15 LEU C C 15 174.670 174.670 174.988 -0.318 17919 67073 1 164 . 1 1 15 15 LEU CA C 15 52.830 52.830 54.064 -1.234 17919 67074 1 164 . 1 1 15 15 LEU CB C 15 47.070 47.070 46.099 0.971 17919 67075 1 164 . 1 1 15 15 LEU H H 15 8.710 8.710 8.806 -0.096 17919 67076 1 164 . 1 1 16 16 GLU N N 16 122.160 122.160 122.622 -0.462 17919 67077 1 164 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.388 -0.471 17919 67078 1 164 . 1 1 16 16 GLU C C 16 175.860 175.860 176.090 -0.230 17919 67079 1 164 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.615 -0.795 17919 67080 1 164 . 1 1 16 16 GLU CB C 16 29.450 29.450 31.028 -1.578 17919 67081 1 164 . 1 1 16 16 GLU H H 16 8.140 8.140 8.677 -0.537 17919 67082 1 164 . 1 1 17 17 VAL N N 17 117.210 117.210 119.565 -2.355 17919 67083 1 164 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.831 -0.117 17919 67084 1 164 . 1 1 17 17 VAL C C 17 174.160 174.160 174.846 -0.686 17919 67085 1 164 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.837 -0.407 17919 67086 1 164 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.647 0.753 17919 67087 1 164 . 1 1 17 17 VAL H H 17 8.900 8.900 8.825 0.075 17919 67088 1 164 . 1 1 18 18 GLU N N 18 118.990 118.990 119.931 -0.941 17919 67089 1 164 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.837 0.242 17919 67090 1 164 . 1 1 18 18 GLU C C 18 176.160 176.160 175.055 1.105 17919 67091 1 164 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.585 0.135 17919 67092 1 164 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.515 -0.205 17919 67093 1 164 . 1 1 18 18 GLU H H 18 8.640 8.640 8.369 0.271 17919 67094 1 164 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.250 -0.109 17919 67095 1 164 . 1 1 19 19 PRO C C 19 175.310 175.310 176.985 -1.675 17919 67096 1 164 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.383 0.087 17919 67097 1 164 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.017 -0.067 17919 67098 1 164 . 1 1 20 20 SER N N 20 103.400 103.400 109.549 -6.149 17919 67099 1 164 . 1 1 20 20 SER HA H 20 4.370 4.370 4.248 0.122 17919 67100 1 164 . 1 1 20 20 SER C C 20 174.660 174.660 174.858 -0.198 17919 67101 1 164 . 1 1 20 20 SER CA C 20 57.400 57.400 58.936 -1.536 17919 67102 1 164 . 1 1 20 20 SER CB C 20 63.370 63.370 62.765 0.605 17919 67103 1 164 . 1 1 20 20 SER H H 20 7.040 7.040 8.224 -1.184 17919 67104 1 164 . 1 1 21 21 ASP N N 21 123.480 123.480 125.473 -1.993 17919 67105 1 164 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.724 -0.029 17919 67106 1 164 . 1 1 21 21 ASP C C 21 176.360 176.360 176.245 0.115 17919 67107 1 164 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.200 0.500 17919 67108 1 164 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.308 -0.508 17919 67109 1 164 . 1 1 21 21 ASP H H 21 8.030 8.030 7.990 0.040 17919 67110 1 164 . 1 1 22 22 THR N N 22 108.800 108.800 112.781 -3.981 17919 67111 1 164 . 1 1 22 22 THR HA H 22 4.920 4.920 4.707 0.213 17919 67112 1 164 . 1 1 22 22 THR C C 22 176.750 176.750 176.560 0.190 17919 67113 1 164 . 1 1 22 22 THR CA C 22 59.690 59.690 61.460 -1.770 17919 67114 1 164 . 1 1 22 22 THR CB C 22 71.200 71.200 70.382 0.818 17919 67115 1 164 . 1 1 22 22 THR H H 22 7.900 7.900 8.165 -0.265 17919 67116 1 164 . 1 1 23 23 ILE N N 23 121.190 121.190 122.166 -0.976 17919 67117 1 164 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.743 -0.086 17919 67118 1 164 . 1 1 23 23 ILE C C 23 179.040 179.040 178.019 1.021 17919 67119 1 164 . 1 1 23 23 ILE CA C 23 62.260 62.260 61.848 0.412 17919 67120 1 164 . 1 1 23 23 ILE CB C 23 34.350 34.350 35.379 -1.029 17919 67121 1 164 . 1 1 23 23 ILE H H 23 8.560 8.560 8.990 -0.430 17919 67122 1 164 . 1 1 24 24 GLU N N 24 120.830 120.830 121.171 -0.341 17919 67123 1 164 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.855 0.062 17919 67124 1 164 . 1 1 24 24 GLU C C 24 178.640 178.640 178.552 0.088 17919 67125 1 164 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.096 0.124 17919 67126 1 164 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.482 -1.202 17919 67127 1 164 . 1 1 24 24 GLU H H 24 9.760 9.760 8.185 1.575 17919 67128 1 164 . 1 1 25 25 ASN N N 25 120.570 120.570 118.095 2.475 17919 67129 1 164 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.485 0.040 17919 67130 1 164 . 1 1 25 25 ASN C C 25 178.380 178.380 177.905 0.475 17919 67131 1 164 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.143 -0.083 17919 67132 1 164 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.746 -0.296 17919 67133 1 164 . 1 1 25 25 ASN H H 25 7.920 7.920 7.744 0.176 17919 67134 1 164 . 1 1 26 26 VAL N N 26 121.710 121.710 120.506 1.204 17919 67135 1 164 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.664 -0.267 17919 67136 1 164 . 1 1 26 26 VAL C C 26 177.950 177.950 177.934 0.016 17919 67137 1 164 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.550 1.110 17919 67138 1 164 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.138 -0.298 17919 67139 1 164 . 1 1 26 26 VAL H H 26 8.070 8.070 8.614 -0.544 17919 67140 1 164 . 1 1 27 27 LYS N N 27 118.860 118.860 120.069 -1.209 17919 67141 1 164 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.004 0.576 17919 67142 1 164 . 1 1 27 27 LYS C C 27 180.550 180.550 179.288 1.262 17919 67143 1 164 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.742 -0.492 17919 67144 1 164 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.138 1.592 17919 67145 1 164 . 1 1 27 27 LYS H H 27 8.560 8.560 8.201 0.359 17919 67146 1 164 . 1 1 28 28 ALA N N 28 123.440 123.440 122.033 1.407 17919 67147 1 164 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.167 -0.007 17919 67148 1 164 . 1 1 28 28 ALA C C 28 180.300 180.300 179.322 0.978 17919 67149 1 164 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.671 0.699 17919 67150 1 164 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.407 -0.697 17919 67151 1 164 . 1 1 28 28 ALA H H 28 8.060 8.060 7.991 0.069 17919 67152 1 164 . 1 1 29 29 LYS N N 29 119.940 119.940 120.028 -0.088 17919 67153 1 164 . 1 1 29 29 LYS HA H 29 4.207 4.207 3.976 0.231 17919 67154 1 164 . 1 1 29 29 LYS C C 29 180.320 180.320 179.141 1.179 17919 67155 1 164 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.817 -0.167 17919 67156 1 164 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.435 0.855 17919 67157 1 164 . 1 1 29 29 LYS H H 29 7.850 7.850 8.152 -0.302 17919 67158 1 164 . 1 1 30 30 ILE N N 30 121.080 121.080 119.274 1.806 17919 67159 1 164 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.621 -0.114 17919 67160 1 164 . 1 1 30 30 ILE C C 30 178.310 178.310 177.347 0.963 17919 67161 1 164 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.282 0.868 17919 67162 1 164 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.681 -0.881 17919 67163 1 164 . 1 1 30 30 ILE H H 30 8.280 8.280 8.356 -0.076 17919 67164 1 164 . 1 1 31 31 GLN N N 31 123.490 123.490 120.678 2.812 17919 67165 1 164 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.098 -0.269 17919 67166 1 164 . 1 1 31 31 GLN C C 31 178.890 178.890 178.427 0.463 17919 67167 1 164 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.172 0.827 17919 67168 1 164 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.462 -0.742 17919 67169 1 164 . 1 1 31 31 GLN H H 31 8.580 8.580 7.929 0.651 17919 67170 1 164 . 1 1 32 32 ASP N N 32 119.360 119.360 118.005 1.355 17919 67171 1 164 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.461 -0.107 17919 67172 1 164 . 1 1 32 32 ASP C C 32 177.250 177.250 177.973 -0.723 17919 67173 1 164 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.294 0.896 17919 67174 1 164 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.740 -0.160 17919 67175 1 164 . 1 1 32 32 ASP H H 32 8.010 8.010 7.813 0.197 17919 67176 1 164 . 1 1 33 33 LYS N N 33 115.130 115.130 118.951 -3.821 17919 67177 1 164 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.260 0.077 17919 67178 1 164 . 1 1 33 33 LYS C C 33 177.870 177.870 178.269 -0.399 17919 67179 1 164 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.135 -0.085 17919 67180 1 164 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.037 1.133 17919 67181 1 164 . 1 1 33 33 LYS H H 33 7.430 7.430 7.470 -0.040 17919 67182 1 164 . 1 1 34 34 GLU N N 34 113.870 113.870 115.680 -1.810 17919 67183 1 164 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.414 0.211 17919 67184 1 164 . 1 1 34 34 GLU C C 34 177.840 177.840 177.014 0.826 17919 67185 1 164 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.311 -0.141 17919 67186 1 164 . 1 1 34 34 GLU CB C 34 32.660 32.660 30.971 1.688 17919 67187 1 164 . 1 1 34 34 GLU H H 34 8.740 8.740 8.034 0.706 17919 67188 1 164 . 1 1 35 35 GLY N N 35 108.650 108.650 108.041 0.609 17919 67189 1 164 . 1 1 35 35 GLY C C 35 173.960 173.960 174.495 -0.535 17919 67190 1 164 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.555 0.525 17919 67191 1 164 . 1 1 35 35 GLY H H 35 8.530 8.530 7.998 0.532 17919 67192 1 164 . 1 1 36 36 ILE N N 36 119.880 119.880 117.525 2.355 17919 67193 1 164 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.635 -0.190 17919 67194 1 164 . 1 1 36 36 ILE C C 36 173.590 173.590 173.802 -0.212 17919 67195 1 164 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.455 0.295 17919 67196 1 164 . 1 1 36 36 ILE CB C 36 40.580 40.580 39.123 1.457 17919 67197 1 164 . 1 1 36 36 ILE H H 36 6.150 6.150 7.514 -1.364 17919 67198 1 164 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.706 -0.072 17919 67199 1 164 . 1 1 37 37 PRO C C 37 176.940 176.940 176.061 0.879 17919 67200 1 164 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.284 0.376 17919 67201 1 164 . 1 1 37 37 PRO CB C 37 31.850 31.850 30.892 0.958 17919 67202 1 164 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.161 -0.044 17919 67203 1 164 . 1 1 38 38 PRO C C 38 178.320 178.320 178.774 -0.454 17919 67204 1 164 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.611 0.649 17919 67205 1 164 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.783 1.107 17919 67206 1 164 . 1 1 39 39 ASP N N 39 113.380 113.380 117.075 -3.695 17919 67207 1 164 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.378 0.052 17919 67208 1 164 . 1 1 39 39 ASP C C 39 177.090 177.090 177.090 0.000 17919 67209 1 164 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.278 -0.638 17919 67210 1 164 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.524 -0.984 17919 67211 1 164 . 1 1 39 39 ASP H H 39 8.550 8.550 8.585 -0.035 17919 67212 1 164 . 1 1 40 40 GLN N N 40 116.780 116.780 116.066 0.714 17919 67213 1 164 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.292 0.172 17919 67214 1 164 . 1 1 40 40 GLN C C 40 175.380 175.380 175.904 -0.524 17919 67215 1 164 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.855 -0.215 17919 67216 1 164 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.420 0.720 17919 67217 1 164 . 1 1 40 40 GLN H H 40 7.820 7.820 7.667 0.153 17919 67218 1 164 . 1 1 41 41 GLN N N 41 117.720 117.720 119.001 -1.281 17919 67219 1 164 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.705 -0.461 17919 67220 1 164 . 1 1 41 41 GLN C C 41 176.300 176.300 175.724 0.576 17919 67221 1 164 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.475 0.995 17919 67222 1 164 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.549 2.100 17919 67223 1 164 . 1 1 41 41 GLN H H 41 7.480 7.480 7.425 0.055 17919 67224 1 164 . 1 1 42 42 ARG N N 42 122.680 122.680 126.067 -3.387 17919 67225 1 164 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.623 -0.123 17919 67226 1 164 . 1 1 42 42 ARG C C 42 174.050 174.050 173.868 0.182 17919 67227 1 164 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.021 1.029 17919 67228 1 164 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.046 -0.296 17919 67229 1 164 . 1 1 42 42 ARG H H 42 8.530 8.530 8.449 0.081 17919 67230 1 164 . 1 1 43 43 LEU N N 43 124.040 124.040 128.852 -4.812 17919 67231 1 164 . 1 1 43 43 LEU C C 43 175.290 175.290 174.845 0.445 17919 67232 1 164 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.792 -0.812 17919 67233 1 164 . 1 1 43 43 LEU CB C 43 45.790 45.790 45.804 -0.014 17919 67234 1 164 . 1 1 43 43 LEU H H 43 8.820 8.820 8.777 0.043 17919 67235 1 164 . 1 1 44 44 ILE N N 44 121.920 121.920 121.853 0.067 17919 67236 1 164 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.974 0.018 17919 67237 1 164 . 1 1 44 44 ILE C C 44 176.060 176.060 173.307 2.753 17919 67238 1 164 . 1 1 44 44 ILE CA C 44 58.980 58.980 58.319 0.661 17919 67239 1 164 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.135 0.285 17919 67240 1 164 . 1 1 44 44 ILE H H 44 9.030 9.030 8.916 0.114 17919 67241 1 164 . 1 1 45 45 PHE N N 45 125.390 125.390 124.964 0.426 17919 67242 1 164 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.971 0.074 17919 67243 1 164 . 1 1 45 45 PHE C C 45 174.470 174.470 175.132 -0.662 17919 67244 1 164 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.163 0.857 17919 67245 1 164 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.310 1.450 17919 67246 1 164 . 1 1 45 45 PHE H H 45 8.830 8.830 7.974 0.856 17919 67247 1 164 . 1 1 46 46 ALA N N 46 132.200 132.200 130.713 1.487 17919 67248 1 164 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.715 -0.025 17919 67249 1 164 . 1 1 46 46 ALA C C 46 177.290 177.290 177.426 -0.136 17919 67250 1 164 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.742 -0.202 17919 67251 1 164 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.527 0.043 17919 67252 1 164 . 1 1 46 46 ALA H H 46 8.810 8.810 8.552 0.258 17919 67253 1 164 . 1 1 47 47 GLY N N 47 102.340 102.340 103.569 -1.229 17919 67254 1 164 . 1 1 47 47 GLY C C 47 173.810 173.810 174.360 -0.550 17919 67255 1 164 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.263 0.087 17919 67256 1 164 . 1 1 47 47 GLY H H 47 8.130 8.130 8.466 -0.336 17919 67257 1 164 . 1 1 48 48 LYS N N 48 121.570 121.570 120.843 0.727 17919 67258 1 164 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.604 0.019 17919 67259 1 164 . 1 1 48 48 LYS C C 48 174.700 174.700 175.438 -0.738 17919 67260 1 164 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.964 -0.414 17919 67261 1 164 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.278 0.252 17919 67262 1 164 . 1 1 48 48 LYS H H 48 7.980 7.980 7.990 -0.010 17919 67263 1 164 . 1 1 49 49 GLN N N 49 122.410 122.410 123.975 -1.565 17919 67264 1 164 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.301 0.260 17919 67265 1 164 . 1 1 49 49 GLN C C 49 175.670 175.670 175.887 -0.217 17919 67266 1 164 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.820 -0.080 17919 67267 1 164 . 1 1 49 49 GLN CB C 49 29.000 29.000 28.446 0.554 17919 67268 1 164 . 1 1 49 49 GLN H H 49 8.600 8.600 8.616 -0.016 17919 67269 1 164 . 1 1 50 50 LEU N N 50 125.520 125.520 126.018 -0.498 17919 67270 1 164 . 1 1 50 50 LEU HA H 50 4.090 4.090 3.803 0.287 17919 67271 1 164 . 1 1 50 50 LEU C C 50 176.660 176.660 176.421 0.239 17919 67272 1 164 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.316 -0.076 17919 67273 1 164 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.541 0.029 17919 67274 1 164 . 1 1 50 50 LEU H H 50 8.530 8.530 8.059 0.471 17919 67275 1 164 . 1 1 51 51 GLU N N 51 122.940 122.940 122.794 0.146 17919 67276 1 164 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.594 -0.106 17919 67277 1 164 . 1 1 51 51 GLU C C 51 175.870 175.870 176.454 -0.584 17919 67278 1 164 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.303 0.657 17919 67279 1 164 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.024 -0.454 17919 67280 1 164 . 1 1 51 51 GLU H H 51 8.400 8.400 8.458 -0.058 17919 67281 1 164 . 1 1 52 52 ASP N N 52 120.030 120.030 124.195 -4.165 17919 67282 1 164 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.374 -0.015 17919 67283 1 164 . 1 1 52 52 ASP C C 52 177.330 177.330 178.081 -0.751 17919 67284 1 164 . 1 1 52 52 ASP CA C 52 56.960 56.960 58.433 -1.473 17919 67285 1 164 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.706 0.144 17919 67286 1 164 . 1 1 52 52 ASP H H 52 8.160 8.160 8.917 -0.757 17919 67287 1 164 . 1 1 53 53 GLY N N 53 106.660 106.660 105.269 1.391 17919 67288 1 164 . 1 1 53 53 GLY C C 53 174.870 174.870 174.223 0.647 17919 67289 1 164 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.933 0.237 17919 67290 1 164 . 1 1 53 53 GLY H H 53 9.390 9.390 8.391 0.999 17919 67291 1 164 . 1 1 54 54 ARG N N 54 119.050 119.050 119.924 -0.874 17919 67292 1 164 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.728 -0.033 17919 67293 1 164 . 1 1 54 54 ARG C C 54 175.350 175.350 175.196 0.154 17919 67294 1 164 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.057 0.333 17919 67295 1 164 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.404 -0.754 17919 67296 1 164 . 1 1 54 54 ARG H H 54 7.460 7.460 7.653 -0.193 17919 67297 1 164 . 1 1 55 55 THR N N 55 108.400 108.400 111.723 -3.323 17919 67298 1 164 . 1 1 55 55 THR HA H 55 5.240 5.240 5.013 0.227 17919 67299 1 164 . 1 1 55 55 THR C C 55 176.560 176.560 176.512 0.048 17919 67300 1 164 . 1 1 55 55 THR CA C 55 59.690 59.690 59.921 -0.231 17919 67301 1 164 . 1 1 55 55 THR CB C 55 72.260 72.260 70.870 1.390 17919 67302 1 164 . 1 1 55 55 THR H H 55 8.730 8.730 8.682 0.048 17919 67303 1 164 . 1 1 56 56 LEU N N 56 117.920 117.920 120.369 -2.449 17919 67304 1 164 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.935 0.125 17919 67305 1 164 . 1 1 56 56 LEU C C 56 180.810 180.810 178.740 2.070 17919 67306 1 164 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.258 0.452 17919 67307 1 164 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.031 -0.661 17919 67308 1 164 . 1 1 56 56 LEU H H 56 8.140 8.140 8.613 -0.473 17919 67309 1 164 . 1 1 57 57 SER N N 57 113.330 113.330 114.582 -1.252 17919 67310 1 164 . 1 1 57 57 SER HA H 57 4.370 4.370 4.231 0.139 17919 67311 1 164 . 1 1 57 57 SER C C 57 178.310 178.310 177.082 1.228 17919 67312 1 164 . 1 1 57 57 SER CA C 57 61.080 61.080 61.487 -0.407 17919 67313 1 164 . 1 1 57 57 SER CB C 57 62.530 62.530 62.370 0.160 17919 67314 1 164 . 1 1 57 57 SER H H 57 8.470 8.470 8.141 0.329 17919 67315 1 164 . 1 1 58 58 ASP N N 58 124.190 124.190 123.677 0.513 17919 67316 1 164 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.322 -0.026 17919 67317 1 164 . 1 1 58 58 ASP C C 58 177.400 177.400 177.349 0.051 17919 67318 1 164 . 1 1 58 58 ASP CA C 58 57.180 57.180 57.005 0.175 17919 67319 1 164 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.529 -0.430 17919 67320 1 164 . 1 1 58 58 ASP H H 58 7.930 7.930 7.837 0.093 17919 67321 1 164 . 1 1 59 59 TYR N N 59 115.510 115.510 115.606 -0.096 17919 67322 1 164 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.526 0.144 17919 67323 1 164 . 1 1 59 59 TYR C C 59 174.700 174.700 174.773 -0.073 17919 67324 1 164 . 1 1 59 59 TYR CA C 59 58.250 58.250 58.055 0.195 17919 67325 1 164 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.544 1.526 17919 67326 1 164 . 1 1 59 59 TYR H H 59 7.250 7.250 7.498 -0.248 17919 67327 1 164 . 1 1 60 60 ASN N N 60 115.900 115.900 117.112 -1.212 17919 67328 1 164 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.355 -0.000 17919 67329 1 164 . 1 1 60 60 ASN C C 60 174.340 174.340 174.637 -0.297 17919 67330 1 164 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.004 0.116 17919 67331 1 164 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.083 0.327 17919 67332 1 164 . 1 1 60 60 ASN H H 60 8.150 8.150 7.844 0.306 17919 67333 1 164 . 1 1 61 61 ILE N N 61 118.600 118.600 119.075 -0.475 17919 67334 1 164 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.592 -0.199 17919 67335 1 164 . 1 1 61 61 ILE C C 61 174.610 174.610 175.240 -0.630 17919 67336 1 164 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.437 0.983 17919 67337 1 164 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.931 -1.191 17919 67338 1 164 . 1 1 61 61 ILE H H 61 7.250 7.250 8.027 -0.777 17919 67339 1 164 . 1 1 62 62 GLN N N 62 124.740 124.740 125.238 -0.498 17919 67340 1 164 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.807 -0.301 17919 67341 1 164 . 1 1 62 62 GLN C C 62 175.970 175.970 175.529 0.441 17919 67342 1 164 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.377 0.283 17919 67343 1 164 . 1 1 62 62 GLN CB C 62 31.650 31.650 32.098 -0.448 17919 67344 1 164 . 1 1 62 62 GLN H H 62 7.610 7.610 7.865 -0.255 17919 67345 1 164 . 1 1 63 63 LYS N N 63 120.300 120.300 121.806 -1.506 17919 67346 1 164 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.085 -0.084 17919 67347 1 164 . 1 1 63 63 LYS C C 63 175.810 175.810 176.684 -0.874 17919 67348 1 164 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.489 0.301 17919 67349 1 164 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.247 0.403 17919 67350 1 164 . 1 1 63 63 LYS H H 63 8.490 8.490 8.695 -0.205 17919 67351 1 164 . 1 1 64 64 GLU N N 64 113.950 113.950 116.301 -2.351 17919 67352 1 164 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.877 -0.412 17919 67353 1 164 . 1 1 64 64 GLU C C 64 175.250 175.250 175.869 -0.619 17919 67354 1 164 . 1 1 64 64 GLU CA C 64 57.890 57.890 58.299 -0.409 17919 67355 1 164 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.744 -2.844 17919 67356 1 164 . 1 1 64 64 GLU H H 64 9.280 9.280 9.117 0.163 17919 67357 1 164 . 1 1 65 65 SER N N 65 114.730 114.730 116.544 -1.814 17919 67358 1 164 . 1 1 65 65 SER HA H 65 4.640 4.640 4.470 0.170 17919 67359 1 164 . 1 1 65 65 SER C C 65 172.160 172.160 173.962 -1.802 17919 67360 1 164 . 1 1 65 65 SER CA C 65 60.890 60.890 60.903 -0.013 17919 67361 1 164 . 1 1 65 65 SER CB C 65 64.910 64.910 63.963 0.947 17919 67362 1 164 . 1 1 65 65 SER H H 65 7.670 7.670 7.679 -0.009 17919 67363 1 164 . 1 1 66 66 THR N N 66 117.110 117.110 120.292 -3.182 17919 67364 1 164 . 1 1 66 66 THR HA H 66 5.270 5.270 5.169 0.101 17919 67365 1 164 . 1 1 66 66 THR C C 66 173.950 173.950 174.214 -0.264 17919 67366 1 164 . 1 1 66 66 THR CA C 66 62.340 62.340 62.254 0.086 17919 67367 1 164 . 1 1 66 66 THR CB C 66 70.080 70.080 69.863 0.217 17919 67368 1 164 . 1 1 66 66 THR H H 66 8.730 8.730 8.248 0.482 17919 67369 1 164 . 1 1 67 67 LEU N N 67 127.110 127.110 126.908 0.202 17919 67370 1 164 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.915 0.145 17919 67371 1 164 . 1 1 67 67 LEU C C 67 175.770 175.770 175.192 0.578 17919 67372 1 164 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.011 -0.111 17919 67373 1 164 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.316 -0.056 17919 67374 1 164 . 1 1 67 67 LEU H H 67 9.410 9.410 8.698 0.712 17919 67375 1 164 . 1 1 68 68 HIS N N 68 118.380 118.380 122.631 -4.251 17919 67376 1 164 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.370 -0.130 17919 67377 1 164 . 1 1 68 68 HIS C C 68 173.150 173.150 173.514 -0.364 17919 67378 1 164 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.597 0.403 17919 67379 1 164 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.910 -2.380 17919 67380 1 164 . 1 1 68 68 HIS H H 68 9.230 9.230 8.970 0.260 17919 67381 1 164 . 1 1 69 69 LEU N N 69 124.460 124.460 128.332 -3.872 17919 67382 1 164 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.219 -0.029 17919 67383 1 164 . 1 1 69 69 LEU C C 69 175.270 175.270 174.160 1.110 17919 67384 1 164 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.240 0.650 17919 67385 1 164 . 1 1 69 69 LEU CB C 69 44.380 44.380 45.159 -0.779 17919 67386 1 164 . 1 1 69 69 LEU H H 69 8.340 8.340 8.228 0.112 17919 67387 1 164 . 1 1 70 70 VAL N N 70 126.940 126.940 123.800 3.140 17919 67388 1 164 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.368 -0.018 17919 67389 1 164 . 1 1 70 70 VAL C C 70 174.000 174.000 174.422 -0.422 17919 67390 1 164 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.437 0.363 17919 67391 1 164 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.966 -1.056 17919 67392 1 164 . 1 1 70 70 VAL H H 70 9.200 9.200 8.993 0.207 17919 67393 1 164 . 1 1 71 71 LEU N N 71 123.130 123.130 123.254 -0.124 17919 67394 1 164 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.076 -0.016 17919 67395 1 164 . 1 1 71 71 LEU C C 71 177.830 177.830 177.090 0.740 17919 67396 1 164 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.148 0.792 17919 67397 1 164 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.098 -0.248 17919 67398 1 164 . 1 1 71 71 LEU H H 71 8.120 8.120 8.310 -0.190 17919 67399 1 164 . 1 1 72 72 ARG N N 72 123.490 123.490 123.502 -0.012 17919 67400 1 164 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.255 0.046 17919 67401 1 164 . 1 1 72 72 ARG C C 72 175.350 175.350 175.234 0.116 17919 67402 1 164 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.399 -0.789 17919 67403 1 164 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.233 1.117 17919 67404 1 164 . 1 1 72 72 ARG H H 72 8.580 8.580 8.135 0.445 17919 67405 1 165 . 1 1 2 2 GLN N N 2 123.220 123.220 120.116 3.104 17919 67406 1 165 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.408 -0.159 17919 67407 1 165 . 1 1 2 2 GLN C C 2 175.920 175.920 176.189 -0.269 17919 67408 1 165 . 1 1 2 2 GLN CA C 2 55.080 55.080 55.257 -0.177 17919 67409 1 165 . 1 1 2 2 GLN CB C 2 30.760 30.760 29.864 0.896 17919 67410 1 165 . 1 1 2 2 GLN H H 2 8.900 8.900 8.395 0.505 17919 67411 1 165 . 1 1 3 3 ILE N N 3 115.340 115.340 117.256 -1.916 17919 67412 1 165 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.316 -0.103 17919 67413 1 165 . 1 1 3 3 ILE C C 3 172.450 172.450 173.614 -1.164 17919 67414 1 165 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.194 0.376 17919 67415 1 165 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.767 0.444 17919 67416 1 165 . 1 1 3 3 ILE H H 3 8.320 8.320 8.516 -0.196 17919 67417 1 165 . 1 1 4 4 PHE N N 4 118.110 118.110 119.932 -1.822 17919 67418 1 165 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.403 0.227 17919 67419 1 165 . 1 1 4 4 PHE C C 4 175.320 175.320 175.190 0.130 17919 67420 1 165 . 1 1 4 4 PHE CA C 4 55.210 55.210 54.687 0.523 17919 67421 1 165 . 1 1 4 4 PHE CB C 4 41.480 41.480 40.760 0.720 17919 67422 1 165 . 1 1 4 4 PHE H H 4 8.610 8.610 8.419 0.191 17919 67423 1 165 . 1 1 5 5 VAL N N 5 121.000 121.000 123.685 -2.685 17919 67424 1 165 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.948 -0.223 17919 67425 1 165 . 1 1 5 5 VAL C C 5 174.870 174.870 174.821 0.049 17919 67426 1 165 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.290 -0.670 17919 67427 1 165 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.758 0.471 17919 67428 1 165 . 1 1 5 5 VAL H H 5 9.300 9.300 8.633 0.667 17919 67429 1 165 . 1 1 6 6 LYS N N 6 127.520 127.520 129.221 -1.701 17919 67430 1 165 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.154 0.213 17919 67431 1 165 . 1 1 6 6 LYS C C 6 177.140 177.140 176.068 1.072 17919 67432 1 165 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.054 0.466 17919 67433 1 165 . 1 1 6 6 LYS CB C 6 35.050 35.050 36.186 -1.136 17919 67434 1 165 . 1 1 6 6 LYS H H 6 8.820 8.820 9.305 -0.485 17919 67435 1 165 . 1 1 7 7 THR N N 7 115.400 115.400 117.669 -2.269 17919 67436 1 165 . 1 1 7 7 THR HA H 7 4.970 4.970 4.655 0.315 17919 67437 1 165 . 1 1 7 7 THR C C 7 176.910 176.910 176.341 0.569 17919 67438 1 165 . 1 1 7 7 THR CA C 7 60.470 60.470 61.131 -0.661 17919 67439 1 165 . 1 1 7 7 THR CB C 7 70.630 70.630 70.323 0.307 17919 67440 1 165 . 1 1 7 7 THR H H 7 8.730 8.730 8.606 0.124 17919 67441 1 165 . 1 1 8 8 LEU N N 8 121.330 121.330 125.339 -4.009 17919 67442 1 165 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.368 -0.058 17919 67443 1 165 . 1 1 8 8 LEU C C 8 178.800 178.800 177.848 0.952 17919 67444 1 165 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.706 -0.126 17919 67445 1 165 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.043 -0.073 17919 67446 1 165 . 1 1 8 8 LEU H H 8 9.100 9.100 8.608 0.492 17919 67447 1 165 . 1 1 9 9 THR N N 9 105.590 105.590 108.824 -3.234 17919 67448 1 165 . 1 1 9 9 THR HA H 9 4.428 4.428 4.267 0.161 17919 67449 1 165 . 1 1 9 9 THR C C 9 175.520 175.520 175.646 -0.126 17919 67450 1 165 . 1 1 9 9 THR CA C 9 61.400 61.400 62.189 -0.789 17919 67451 1 165 . 1 1 9 9 THR CB C 9 69.140 69.140 69.130 0.010 17919 67452 1 165 . 1 1 9 9 THR H H 9 7.630 7.630 7.504 0.126 17919 67453 1 165 . 1 1 10 10 GLY N N 10 108.890 108.890 111.242 -2.352 17919 67454 1 165 . 1 1 10 10 GLY C C 10 174.070 174.070 173.553 0.517 17919 67455 1 165 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.984 0.476 17919 67456 1 165 . 1 1 10 10 GLY H H 10 7.810 7.810 8.102 -0.292 17919 67457 1 165 . 1 1 11 11 LYS N N 11 121.600 121.600 123.451 -1.851 17919 67458 1 165 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.333 0.028 17919 67459 1 165 . 1 1 11 11 LYS C C 11 175.940 175.940 176.135 -0.195 17919 67460 1 165 . 1 1 11 11 LYS CA C 11 56.280 56.280 55.853 0.427 17919 67461 1 165 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.025 0.175 17919 67462 1 165 . 1 1 11 11 LYS H H 11 7.280 7.280 8.003 -0.723 17919 67463 1 165 . 1 1 12 12 THR N N 12 120.440 120.440 122.502 -2.062 17919 67464 1 165 . 1 1 12 12 THR HA H 12 5.046 5.046 4.765 0.281 17919 67465 1 165 . 1 1 12 12 THR C C 12 174.320 174.320 174.549 -0.229 17919 67466 1 165 . 1 1 12 12 THR CA C 12 62.390 62.390 62.622 -0.232 17919 67467 1 165 . 1 1 12 12 THR CB C 12 69.910 69.910 69.650 0.261 17919 67468 1 165 . 1 1 12 12 THR H H 12 8.650 8.650 8.377 0.273 17919 67469 1 165 . 1 1 13 13 ILE N N 13 127.110 127.110 122.077 5.033 17919 67470 1 165 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.712 -0.168 17919 67471 1 165 . 1 1 13 13 ILE C C 13 175.220 175.220 174.775 0.445 17919 67472 1 165 . 1 1 13 13 ILE CA C 13 59.980 59.980 58.865 1.115 17919 67473 1 165 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.743 0.207 17919 67474 1 165 . 1 1 13 13 ILE H H 13 9.450 9.450 8.618 0.832 17919 67475 1 165 . 1 1 14 14 THR N N 14 121.520 121.520 119.897 1.623 17919 67476 1 165 . 1 1 14 14 THR HA H 14 4.964 4.964 4.868 0.096 17919 67477 1 165 . 1 1 14 14 THR C C 14 173.790 173.790 174.221 -0.431 17919 67478 1 165 . 1 1 14 14 THR CA C 14 61.940 61.940 62.306 -0.366 17919 67479 1 165 . 1 1 14 14 THR CB C 14 69.650 69.650 69.565 0.085 17919 67480 1 165 . 1 1 14 14 THR H H 14 8.710 8.710 8.321 0.389 17919 67481 1 165 . 1 1 15 15 LEU N N 15 124.800 124.800 126.366 -1.566 17919 67482 1 165 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.735 0.045 17919 67483 1 165 . 1 1 15 15 LEU C C 15 174.670 174.670 175.508 -0.838 17919 67484 1 165 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.622 -0.792 17919 67485 1 165 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.216 1.854 17919 67486 1 165 . 1 1 15 15 LEU H H 15 8.710 8.710 8.672 0.038 17919 67487 1 165 . 1 1 16 16 GLU N N 16 122.160 122.160 123.098 -0.938 17919 67488 1 165 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.370 -0.453 17919 67489 1 165 . 1 1 16 16 GLU C C 16 175.860 175.860 176.515 -0.655 17919 67490 1 165 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.724 -0.904 17919 67491 1 165 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.445 -0.995 17919 67492 1 165 . 1 1 16 16 GLU H H 16 8.140 8.140 8.686 -0.546 17919 67493 1 165 . 1 1 17 17 VAL N N 17 117.210 117.210 118.707 -1.497 17919 67494 1 165 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.898 -0.184 17919 67495 1 165 . 1 1 17 17 VAL C C 17 174.160 174.160 175.016 -0.856 17919 67496 1 165 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.707 -0.277 17919 67497 1 165 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.598 0.802 17919 67498 1 165 . 1 1 17 17 VAL H H 17 8.900 8.900 8.887 0.013 17919 67499 1 165 . 1 1 18 18 GLU N N 18 118.990 118.990 120.330 -1.340 17919 67500 1 165 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.771 0.308 17919 67501 1 165 . 1 1 18 18 GLU C C 18 176.160 176.160 174.950 1.210 17919 67502 1 165 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.616 0.104 17919 67503 1 165 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.775 -0.465 17919 67504 1 165 . 1 1 18 18 GLU H H 18 8.640 8.640 8.409 0.231 17919 67505 1 165 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.181 -0.040 17919 67506 1 165 . 1 1 19 19 PRO C C 19 175.310 175.310 177.438 -2.128 17919 67507 1 165 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.536 -0.066 17919 67508 1 165 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.010 -0.060 17919 67509 1 165 . 1 1 20 20 SER N N 20 103.400 103.400 110.669 -7.269 17919 67510 1 165 . 1 1 20 20 SER HA H 20 4.370 4.370 4.295 0.075 17919 67511 1 165 . 1 1 20 20 SER C C 20 174.660 174.660 174.017 0.643 17919 67512 1 165 . 1 1 20 20 SER CA C 20 57.400 57.400 58.378 -0.978 17919 67513 1 165 . 1 1 20 20 SER CB C 20 63.370 63.370 62.908 0.462 17919 67514 1 165 . 1 1 20 20 SER H H 20 7.040 7.040 8.026 -0.986 17919 67515 1 165 . 1 1 21 21 ASP N N 21 123.480 123.480 123.815 -0.335 17919 67516 1 165 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.786 -0.091 17919 67517 1 165 . 1 1 21 21 ASP C C 21 176.360 176.360 175.209 1.151 17919 67518 1 165 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.966 0.734 17919 67519 1 165 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.608 -0.808 17919 67520 1 165 . 1 1 21 21 ASP H H 21 8.030 8.030 7.615 0.415 17919 67521 1 165 . 1 1 22 22 THR N N 22 108.800 108.800 112.224 -3.424 17919 67522 1 165 . 1 1 22 22 THR HA H 22 4.920 4.920 4.896 0.024 17919 67523 1 165 . 1 1 22 22 THR C C 22 176.750 176.750 175.965 0.785 17919 67524 1 165 . 1 1 22 22 THR CA C 22 59.690 59.690 60.678 -0.988 17919 67525 1 165 . 1 1 22 22 THR CB C 22 71.200 71.200 70.693 0.507 17919 67526 1 165 . 1 1 22 22 THR H H 22 7.900 7.900 8.235 -0.335 17919 67527 1 165 . 1 1 23 23 ILE N N 23 121.190 121.190 122.350 -1.160 17919 67528 1 165 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.825 -0.168 17919 67529 1 165 . 1 1 23 23 ILE C C 23 179.040 179.040 178.031 1.009 17919 67530 1 165 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.087 -0.827 17919 67531 1 165 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.452 -2.102 17919 67532 1 165 . 1 1 23 23 ILE H H 23 8.560 8.560 9.099 -0.539 17919 67533 1 165 . 1 1 24 24 GLU N N 24 120.830 120.830 119.691 1.139 17919 67534 1 165 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.944 -0.027 17919 67535 1 165 . 1 1 24 24 GLU C C 24 178.640 178.640 178.859 -0.219 17919 67536 1 165 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.097 0.123 17919 67537 1 165 . 1 1 24 24 GLU CB C 24 28.280 28.280 28.975 -0.695 17919 67538 1 165 . 1 1 24 24 GLU H H 24 9.760 9.760 8.598 1.162 17919 67539 1 165 . 1 1 25 25 ASN N N 25 120.570 120.570 118.345 2.225 17919 67540 1 165 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.534 -0.009 17919 67541 1 165 . 1 1 25 25 ASN C C 25 178.380 178.380 177.926 0.454 17919 67542 1 165 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.162 -0.102 17919 67543 1 165 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.635 -0.185 17919 67544 1 165 . 1 1 25 25 ASN H H 25 7.920 7.920 7.551 0.369 17919 67545 1 165 . 1 1 26 26 VAL N N 26 121.710 121.710 120.565 1.145 17919 67546 1 165 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.695 -0.298 17919 67547 1 165 . 1 1 26 26 VAL C C 26 177.950 177.950 177.749 0.201 17919 67548 1 165 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.549 1.111 17919 67549 1 165 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.454 -0.614 17919 67550 1 165 . 1 1 26 26 VAL H H 26 8.070 8.070 8.543 -0.473 17919 67551 1 165 . 1 1 27 27 LYS N N 27 118.860 118.860 120.481 -1.621 17919 67552 1 165 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.252 0.328 17919 67553 1 165 . 1 1 27 27 LYS C C 27 180.550 180.550 178.759 1.791 17919 67554 1 165 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.568 -0.318 17919 67555 1 165 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.399 1.331 17919 67556 1 165 . 1 1 27 27 LYS H H 27 8.560 8.560 8.396 0.164 17919 67557 1 165 . 1 1 28 28 ALA N N 28 123.440 123.440 122.207 1.233 17919 67558 1 165 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.191 -0.031 17919 67559 1 165 . 1 1 28 28 ALA C C 28 180.300 180.300 179.224 1.076 17919 67560 1 165 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.904 0.466 17919 67561 1 165 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.462 -0.752 17919 67562 1 165 . 1 1 28 28 ALA H H 28 8.060 8.060 8.458 -0.398 17919 67563 1 165 . 1 1 29 29 LYS N N 29 119.940 119.940 119.822 0.118 17919 67564 1 165 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.042 0.165 17919 67565 1 165 . 1 1 29 29 LYS C C 29 180.320 180.320 179.338 0.982 17919 67566 1 165 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.350 0.300 17919 67567 1 165 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.438 0.852 17919 67568 1 165 . 1 1 29 29 LYS H H 29 7.850 7.850 7.731 0.119 17919 67569 1 165 . 1 1 30 30 ILE N N 30 121.080 121.080 120.961 0.119 17919 67570 1 165 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.583 -0.076 17919 67571 1 165 . 1 1 30 30 ILE C C 30 178.310 178.310 177.668 0.642 17919 67572 1 165 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.111 1.039 17919 67573 1 165 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.601 -0.801 17919 67574 1 165 . 1 1 30 30 ILE H H 30 8.280 8.280 8.182 0.098 17919 67575 1 165 . 1 1 31 31 GLN N N 31 123.490 123.490 120.304 3.186 17919 67576 1 165 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.094 -0.265 17919 67577 1 165 . 1 1 31 31 GLN C C 31 178.890 178.890 178.751 0.139 17919 67578 1 165 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.155 0.845 17919 67579 1 165 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.545 -0.825 17919 67580 1 165 . 1 1 31 31 GLN H H 31 8.580 8.580 8.455 0.125 17919 67581 1 165 . 1 1 32 32 ASP N N 32 119.360 119.360 118.396 0.964 17919 67582 1 165 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.511 -0.157 17919 67583 1 165 . 1 1 32 32 ASP C C 32 177.250 177.250 177.731 -0.481 17919 67584 1 165 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.341 0.849 17919 67585 1 165 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.878 -0.298 17919 67586 1 165 . 1 1 32 32 ASP H H 32 8.010 8.010 8.135 -0.125 17919 67587 1 165 . 1 1 33 33 LYS N N 33 115.130 115.130 118.865 -3.735 17919 67588 1 165 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.251 0.086 17919 67589 1 165 . 1 1 33 33 LYS C C 33 177.870 177.870 177.802 0.068 17919 67590 1 165 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.562 -0.512 17919 67591 1 165 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.458 0.712 17919 67592 1 165 . 1 1 33 33 LYS H H 33 7.430 7.430 7.550 -0.119 17919 67593 1 165 . 1 1 34 34 GLU N N 34 113.870 113.870 114.069 -0.199 17919 67594 1 165 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.506 0.119 17919 67595 1 165 . 1 1 34 34 GLU C C 34 177.840 177.840 176.255 1.585 17919 67596 1 165 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.699 -0.529 17919 67597 1 165 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.806 0.854 17919 67598 1 165 . 1 1 34 34 GLU H H 34 8.740 8.740 8.186 0.554 17919 67599 1 165 . 1 1 35 35 GLY N N 35 108.650 108.650 108.712 -0.062 17919 67600 1 165 . 1 1 35 35 GLY C C 35 173.960 173.960 174.500 -0.540 17919 67601 1 165 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.920 0.160 17919 67602 1 165 . 1 1 35 35 GLY H H 35 8.530 8.530 8.196 0.334 17919 67603 1 165 . 1 1 36 36 ILE N N 36 119.880 119.880 121.659 -1.779 17919 67604 1 165 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.332 0.113 17919 67605 1 165 . 1 1 36 36 ILE C C 36 173.590 173.590 173.931 -0.341 17919 67606 1 165 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.013 -0.263 17919 67607 1 165 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.609 1.971 17919 67608 1 165 . 1 1 36 36 ILE H H 36 6.150 6.150 7.442 -1.292 17919 67609 1 165 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.567 0.067 17919 67610 1 165 . 1 1 37 37 PRO C C 37 176.940 176.940 175.920 1.020 17919 67611 1 165 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.885 -0.225 17919 67612 1 165 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.231 0.619 17919 67613 1 165 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.144 -0.027 17919 67614 1 165 . 1 1 38 38 PRO C C 38 178.320 178.320 178.575 -0.255 17919 67615 1 165 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.737 0.523 17919 67616 1 165 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.858 1.032 17919 67617 1 165 . 1 1 39 39 ASP N N 39 113.380 113.380 116.400 -3.020 17919 67618 1 165 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.347 0.083 17919 67619 1 165 . 1 1 39 39 ASP C C 39 177.090 177.090 177.617 -0.527 17919 67620 1 165 . 1 1 39 39 ASP CA C 39 55.640 55.640 57.222 -1.582 17919 67621 1 165 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.377 -0.837 17919 67622 1 165 . 1 1 39 39 ASP H H 39 8.550 8.550 8.770 -0.220 17919 67623 1 165 . 1 1 40 40 GLN N N 40 116.780 116.780 115.952 0.828 17919 67624 1 165 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.446 0.018 17919 67625 1 165 . 1 1 40 40 GLN C C 40 175.380 175.380 175.641 -0.261 17919 67626 1 165 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.258 0.382 17919 67627 1 165 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.262 0.878 17919 67628 1 165 . 1 1 40 40 GLN H H 40 7.820 7.820 7.870 -0.050 17919 67629 1 165 . 1 1 41 41 GLN N N 41 117.720 117.720 119.247 -1.527 17919 67630 1 165 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.722 -0.478 17919 67631 1 165 . 1 1 41 41 GLN C C 41 176.300 176.300 175.561 0.739 17919 67632 1 165 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.769 0.701 17919 67633 1 165 . 1 1 41 41 GLN CB C 41 31.650 31.650 30.168 1.482 17919 67634 1 165 . 1 1 41 41 GLN H H 41 7.480 7.480 7.251 0.229 17919 67635 1 165 . 1 1 42 42 ARG N N 42 122.680 122.680 125.283 -2.603 17919 67636 1 165 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.624 -0.124 17919 67637 1 165 . 1 1 42 42 ARG C C 42 174.050 174.050 173.964 0.086 17919 67638 1 165 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.364 0.686 17919 67639 1 165 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.139 -1.389 17919 67640 1 165 . 1 1 42 42 ARG H H 42 8.530 8.530 8.874 -0.344 17919 67641 1 165 . 1 1 43 43 LEU N N 43 124.040 124.040 126.787 -2.747 17919 67642 1 165 . 1 1 43 43 LEU C C 43 175.290 175.290 176.017 -0.727 17919 67643 1 165 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.719 -0.740 17919 67644 1 165 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.124 2.666 17919 67645 1 165 . 1 1 43 43 LEU H H 43 8.820 8.820 8.788 0.032 17919 67646 1 165 . 1 1 44 44 ILE N N 44 121.920 121.920 122.327 -0.407 17919 67647 1 165 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.152 -0.160 17919 67648 1 165 . 1 1 44 44 ILE C C 44 176.060 176.060 174.685 1.375 17919 67649 1 165 . 1 1 44 44 ILE CA C 44 58.980 58.980 58.930 0.050 17919 67650 1 165 . 1 1 44 44 ILE CB C 44 41.420 41.420 39.113 2.307 17919 67651 1 165 . 1 1 44 44 ILE H H 44 9.030 9.030 8.892 0.138 17919 67652 1 165 . 1 1 45 45 PHE N N 45 125.390 125.390 127.696 -2.306 17919 67653 1 165 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.971 0.074 17919 67654 1 165 . 1 1 45 45 PHE C C 45 174.470 174.470 174.304 0.166 17919 67655 1 165 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.159 0.861 17919 67656 1 165 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.353 0.407 17919 67657 1 165 . 1 1 45 45 PHE H H 45 8.830 8.830 8.490 0.340 17919 67658 1 165 . 1 1 46 46 ALA N N 46 132.200 132.200 128.019 4.181 17919 67659 1 165 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.588 0.102 17919 67660 1 165 . 1 1 46 46 ALA C C 46 177.290 177.290 177.813 -0.523 17919 67661 1 165 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.705 -0.165 17919 67662 1 165 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.408 0.162 17919 67663 1 165 . 1 1 46 46 ALA H H 46 8.810 8.810 8.601 0.209 17919 67664 1 165 . 1 1 47 47 GLY N N 47 102.340 102.340 105.438 -3.098 17919 67665 1 165 . 1 1 47 47 GLY C C 47 173.810 173.810 174.230 -0.420 17919 67666 1 165 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.874 0.476 17919 67667 1 165 . 1 1 47 47 GLY H H 47 8.130 8.130 8.383 -0.253 17919 67668 1 165 . 1 1 48 48 LYS N N 48 121.570 121.570 122.091 -0.521 17919 67669 1 165 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.657 -0.035 17919 67670 1 165 . 1 1 48 48 LYS C C 48 174.700 174.700 175.138 -0.438 17919 67671 1 165 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.761 -0.211 17919 67672 1 165 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.517 0.013 17919 67673 1 165 . 1 1 48 48 LYS H H 48 7.980 7.980 7.974 0.006 17919 67674 1 165 . 1 1 49 49 GLN N N 49 122.410 122.410 123.001 -0.591 17919 67675 1 165 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.687 -0.127 17919 67676 1 165 . 1 1 49 49 GLN C C 49 175.670 175.670 175.403 0.267 17919 67677 1 165 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.466 0.274 17919 67678 1 165 . 1 1 49 49 GLN CB C 49 29.000 29.000 28.781 0.219 17919 67679 1 165 . 1 1 49 49 GLN H H 49 8.600 8.600 8.444 0.156 17919 67680 1 165 . 1 1 50 50 LEU N N 50 125.520 125.520 124.961 0.559 17919 67681 1 165 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.125 -0.035 17919 67682 1 165 . 1 1 50 50 LEU C C 50 176.660 176.660 176.308 0.352 17919 67683 1 165 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.981 0.259 17919 67684 1 165 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.988 -0.418 17919 67685 1 165 . 1 1 50 50 LEU H H 50 8.530 8.530 8.112 0.418 17919 67686 1 165 . 1 1 51 51 GLU N N 51 122.940 122.940 123.500 -0.560 17919 67687 1 165 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.461 0.027 17919 67688 1 165 . 1 1 51 51 GLU C C 51 175.870 175.870 177.179 -1.309 17919 67689 1 165 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.242 0.718 17919 67690 1 165 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.838 -0.268 17919 67691 1 165 . 1 1 51 51 GLU H H 51 8.400 8.400 8.109 0.291 17919 67692 1 165 . 1 1 52 52 ASP N N 52 120.030 120.030 125.801 -5.771 17919 67693 1 165 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.429 -0.070 17919 67694 1 165 . 1 1 52 52 ASP C C 52 177.330 177.330 177.236 0.094 17919 67695 1 165 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.077 -0.117 17919 67696 1 165 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.696 0.154 17919 67697 1 165 . 1 1 52 52 ASP H H 52 8.160 8.160 8.809 -0.649 17919 67698 1 165 . 1 1 53 53 GLY N N 53 106.660 106.660 104.940 1.720 17919 67699 1 165 . 1 1 53 53 GLY C C 53 174.870 174.870 174.259 0.611 17919 67700 1 165 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.933 0.237 17919 67701 1 165 . 1 1 53 53 GLY H H 53 9.390 9.390 8.534 0.856 17919 67702 1 165 . 1 1 54 54 ARG N N 54 119.050 119.050 119.734 -0.684 17919 67703 1 165 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.769 -0.074 17919 67704 1 165 . 1 1 54 54 ARG C C 54 175.350 175.350 174.787 0.563 17919 67705 1 165 . 1 1 54 54 ARG CA C 54 54.390 54.390 52.617 1.773 17919 67706 1 165 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.459 -0.809 17919 67707 1 165 . 1 1 54 54 ARG H H 54 7.460 7.460 7.486 -0.026 17919 67708 1 165 . 1 1 55 55 THR N N 55 108.400 108.400 110.935 -2.535 17919 67709 1 165 . 1 1 55 55 THR HA H 55 5.240 5.240 5.122 0.118 17919 67710 1 165 . 1 1 55 55 THR C C 55 176.560 176.560 176.231 0.329 17919 67711 1 165 . 1 1 55 55 THR CA C 55 59.690 59.690 59.622 0.068 17919 67712 1 165 . 1 1 55 55 THR CB C 55 72.260 72.260 71.484 0.776 17919 67713 1 165 . 1 1 55 55 THR H H 55 8.730 8.730 8.864 -0.134 17919 67714 1 165 . 1 1 56 56 LEU N N 56 117.920 117.920 121.553 -3.633 17919 67715 1 165 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.913 0.147 17919 67716 1 165 . 1 1 56 56 LEU C C 56 180.810 180.810 178.748 2.062 17919 67717 1 165 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.662 0.048 17919 67718 1 165 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.261 -0.892 17919 67719 1 165 . 1 1 56 56 LEU H H 56 8.140 8.140 8.918 -0.778 17919 67720 1 165 . 1 1 57 57 SER N N 57 113.330 113.330 114.111 -0.781 17919 67721 1 165 . 1 1 57 57 SER HA H 57 4.370 4.370 4.121 0.249 17919 67722 1 165 . 1 1 57 57 SER C C 57 178.310 178.310 177.132 1.178 17919 67723 1 165 . 1 1 57 57 SER CA C 57 61.080 61.080 61.635 -0.555 17919 67724 1 165 . 1 1 57 57 SER CB C 57 62.530 62.530 62.489 0.041 17919 67725 1 165 . 1 1 57 57 SER H H 57 8.470 8.470 7.990 0.480 17919 67726 1 165 . 1 1 58 58 ASP N N 58 124.190 124.190 122.281 1.909 17919 67727 1 165 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.283 0.013 17919 67728 1 165 . 1 1 58 58 ASP C C 58 177.400 177.400 177.301 0.099 17919 67729 1 165 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.449 0.731 17919 67730 1 165 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.419 -0.319 17919 67731 1 165 . 1 1 58 58 ASP H H 58 7.930 7.930 7.601 0.329 17919 67732 1 165 . 1 1 59 59 TYR N N 59 115.510 115.510 115.571 -0.061 17919 67733 1 165 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.635 0.035 17919 67734 1 165 . 1 1 59 59 TYR C C 59 174.700 174.700 175.057 -0.357 17919 67735 1 165 . 1 1 59 59 TYR CA C 59 58.250 58.250 56.181 2.069 17919 67736 1 165 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.402 1.668 17919 67737 1 165 . 1 1 59 59 TYR H H 59 7.250 7.250 7.321 -0.071 17919 67738 1 165 . 1 1 60 60 ASN N N 60 115.900 115.900 116.792 -0.892 17919 67739 1 165 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.332 0.023 17919 67740 1 165 . 1 1 60 60 ASN C C 60 174.340 174.340 174.577 -0.237 17919 67741 1 165 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.255 -0.135 17919 67742 1 165 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.599 -0.189 17919 67743 1 165 . 1 1 60 60 ASN H H 60 8.150 8.150 7.695 0.455 17919 67744 1 165 . 1 1 61 61 ILE N N 61 118.600 118.600 119.527 -0.927 17919 67745 1 165 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.608 -0.215 17919 67746 1 165 . 1 1 61 61 ILE C C 61 174.610 174.610 175.698 -1.088 17919 67747 1 165 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.446 0.974 17919 67748 1 165 . 1 1 61 61 ILE CB C 61 36.740 36.740 36.836 -0.096 17919 67749 1 165 . 1 1 61 61 ILE H H 61 7.250 7.250 8.266 -1.016 17919 67750 1 165 . 1 1 62 62 GLN N N 62 124.740 124.740 125.765 -1.025 17919 67751 1 165 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.580 -0.074 17919 67752 1 165 . 1 1 62 62 GLN C C 62 175.970 175.970 176.087 -0.117 17919 67753 1 165 . 1 1 62 62 GLN CA C 62 53.660 53.660 52.980 0.680 17919 67754 1 165 . 1 1 62 62 GLN CB C 62 31.650 31.650 30.954 0.696 17919 67755 1 165 . 1 1 62 62 GLN H H 62 7.610 7.610 8.122 -0.512 17919 67756 1 165 . 1 1 63 63 LYS N N 63 120.300 120.300 121.775 -1.475 17919 67757 1 165 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.998 0.003 17919 67758 1 165 . 1 1 63 63 LYS C C 63 175.810 175.810 177.450 -1.640 17919 67759 1 165 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.032 -0.242 17919 67760 1 165 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.691 -0.041 17919 67761 1 165 . 1 1 63 63 LYS H H 63 8.490 8.490 8.660 -0.170 17919 67762 1 165 . 1 1 64 64 GLU N N 64 113.950 113.950 119.709 -5.759 17919 67763 1 165 . 1 1 64 64 GLU HA H 64 3.465 3.465 2.993 0.472 17919 67764 1 165 . 1 1 64 64 GLU C C 64 175.250 175.250 175.599 -0.349 17919 67765 1 165 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.515 0.375 17919 67766 1 165 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.664 -2.764 17919 67767 1 165 . 1 1 64 64 GLU H H 64 9.280 9.280 8.443 0.837 17919 67768 1 165 . 1 1 65 65 SER N N 65 114.730 114.730 115.363 -0.633 17919 67769 1 165 . 1 1 65 65 SER HA H 65 4.640 4.640 4.499 0.141 17919 67770 1 165 . 1 1 65 65 SER C C 65 172.160 172.160 173.448 -1.288 17919 67771 1 165 . 1 1 65 65 SER CA C 65 60.890 60.890 60.154 0.736 17919 67772 1 165 . 1 1 65 65 SER CB C 65 64.910 64.910 64.058 0.852 17919 67773 1 165 . 1 1 65 65 SER H H 65 7.670 7.670 7.506 0.164 17919 67774 1 165 . 1 1 66 66 THR N N 66 117.110 117.110 118.842 -1.732 17919 67775 1 165 . 1 1 66 66 THR HA H 66 5.270 5.270 5.202 0.068 17919 67776 1 165 . 1 1 66 66 THR C C 66 173.950 173.950 174.066 -0.116 17919 67777 1 165 . 1 1 66 66 THR CA C 66 62.340 62.340 62.065 0.275 17919 67778 1 165 . 1 1 66 66 THR CB C 66 70.080 70.080 70.284 -0.204 17919 67779 1 165 . 1 1 66 66 THR H H 66 8.730 8.730 8.464 0.266 17919 67780 1 165 . 1 1 67 67 LEU N N 67 127.110 127.110 126.943 0.167 17919 67781 1 165 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.966 0.094 17919 67782 1 165 . 1 1 67 67 LEU C C 67 175.770 175.770 175.228 0.542 17919 67783 1 165 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.806 0.094 17919 67784 1 165 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.444 -0.184 17919 67785 1 165 . 1 1 67 67 LEU H H 67 9.410 9.410 9.174 0.236 17919 67786 1 165 . 1 1 68 68 HIS N N 68 118.380 118.380 122.171 -3.791 17919 67787 1 165 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.484 -0.244 17919 67788 1 165 . 1 1 68 68 HIS C C 68 173.150 173.150 173.614 -0.464 17919 67789 1 165 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.569 0.431 17919 67790 1 165 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.709 -2.179 17919 67791 1 165 . 1 1 68 68 HIS H H 68 9.230 9.230 8.903 0.327 17919 67792 1 165 . 1 1 69 69 LEU N N 69 124.460 124.460 129.914 -5.454 17919 67793 1 165 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.874 0.316 17919 67794 1 165 . 1 1 69 69 LEU C C 69 175.270 175.270 174.050 1.220 17919 67795 1 165 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.496 0.394 17919 67796 1 165 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.109 0.271 17919 67797 1 165 . 1 1 69 69 LEU H H 69 8.340 8.340 8.521 -0.181 17919 67798 1 165 . 1 1 70 70 VAL N N 70 126.940 126.940 126.667 0.273 17919 67799 1 165 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.405 -0.055 17919 67800 1 165 . 1 1 70 70 VAL C C 70 174.000 174.000 174.579 -0.579 17919 67801 1 165 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.342 0.458 17919 67802 1 165 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.051 -0.141 17919 67803 1 165 . 1 1 70 70 VAL H H 70 9.200 9.200 8.973 0.227 17919 67804 1 165 . 1 1 71 71 LEU N N 71 123.130 123.130 125.018 -1.888 17919 67805 1 165 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.187 -0.127 17919 67806 1 165 . 1 1 71 71 LEU C C 71 177.830 177.830 178.334 -0.504 17919 67807 1 165 . 1 1 71 71 LEU CA C 71 53.940 53.940 54.001 -0.061 17919 67808 1 165 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.252 -0.402 17919 67809 1 165 . 1 1 71 71 LEU H H 71 8.120 8.120 8.587 -0.467 17919 67810 1 165 . 1 1 72 72 ARG N N 72 123.490 123.490 124.595 -1.105 17919 67811 1 165 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.242 0.059 17919 67812 1 165 . 1 1 72 72 ARG C C 72 175.350 175.350 175.986 -0.636 17919 67813 1 165 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.808 -0.198 17919 67814 1 165 . 1 1 72 72 ARG CB C 72 31.350 31.350 27.712 3.639 17919 67815 1 165 . 1 1 72 72 ARG H H 72 8.580 8.580 8.472 0.108 17919 67816 1 166 . 1 1 2 2 GLN N N 2 123.220 123.220 121.138 2.082 17919 67817 1 166 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.203 0.046 17919 67818 1 166 . 1 1 2 2 GLN C C 2 175.920 175.920 174.692 1.228 17919 67819 1 166 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.496 0.584 17919 67820 1 166 . 1 1 2 2 GLN CB C 2 30.760 30.760 31.083 -0.323 17919 67821 1 166 . 1 1 2 2 GLN H H 2 8.900 8.900 8.373 0.527 17919 67822 1 166 . 1 1 3 3 ILE N N 3 115.340 115.340 119.023 -3.683 17919 67823 1 166 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.471 -0.258 17919 67824 1 166 . 1 1 3 3 ILE C C 3 172.450 172.450 173.564 -1.114 17919 67825 1 166 . 1 1 3 3 ILE CA C 3 59.570 59.570 58.645 0.924 17919 67826 1 166 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.602 0.608 17919 67827 1 166 . 1 1 3 3 ILE H H 3 8.320 8.320 8.803 -0.483 17919 67828 1 166 . 1 1 4 4 PHE N N 4 118.110 118.110 119.705 -1.595 17919 67829 1 166 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.231 0.399 17919 67830 1 166 . 1 1 4 4 PHE C C 4 175.320 175.320 175.182 0.138 17919 67831 1 166 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.774 -0.564 17919 67832 1 166 . 1 1 4 4 PHE CB C 4 41.480 41.480 40.807 0.673 17919 67833 1 166 . 1 1 4 4 PHE H H 4 8.610 8.610 8.182 0.428 17919 67834 1 166 . 1 1 5 5 VAL N N 5 121.000 121.000 122.523 -1.523 17919 67835 1 166 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.772 -0.047 17919 67836 1 166 . 1 1 5 5 VAL C C 5 174.870 174.870 174.664 0.206 17919 67837 1 166 . 1 1 5 5 VAL CA C 5 60.620 60.620 60.893 -0.273 17919 67838 1 166 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.532 0.698 17919 67839 1 166 . 1 1 5 5 VAL H H 5 9.300 9.300 9.324 -0.024 17919 67840 1 166 . 1 1 6 6 LYS N N 6 127.520 127.520 129.338 -1.818 17919 67841 1 166 . 1 1 6 6 LYS HA H 6 5.367 5.367 4.949 0.418 17919 67842 1 166 . 1 1 6 6 LYS C C 6 177.140 177.140 176.527 0.613 17919 67843 1 166 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.793 -0.273 17919 67844 1 166 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.130 -0.080 17919 67845 1 166 . 1 1 6 6 LYS H H 6 8.820 8.820 9.157 -0.337 17919 67846 1 166 . 1 1 7 7 THR N N 7 115.400 115.400 119.476 -4.076 17919 67847 1 166 . 1 1 7 7 THR HA H 7 4.970 4.970 4.646 0.324 17919 67848 1 166 . 1 1 7 7 THR C C 7 176.910 176.910 176.460 0.450 17919 67849 1 166 . 1 1 7 7 THR CA C 7 60.470 60.470 61.778 -1.308 17919 67850 1 166 . 1 1 7 7 THR CB C 7 70.630 70.630 69.958 0.672 17919 67851 1 166 . 1 1 7 7 THR H H 7 8.730 8.730 8.981 -0.251 17919 67852 1 166 . 1 1 8 8 LEU N N 8 121.330 121.330 123.958 -2.628 17919 67853 1 166 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.029 0.281 17919 67854 1 166 . 1 1 8 8 LEU C C 8 178.800 178.800 177.765 1.035 17919 67855 1 166 . 1 1 8 8 LEU CA C 8 57.580 57.580 58.543 -0.963 17919 67856 1 166 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.843 0.127 17919 67857 1 166 . 1 1 8 8 LEU H H 8 9.100 9.100 8.491 0.609 17919 67858 1 166 . 1 1 9 9 THR N N 9 105.590 105.590 107.124 -1.534 17919 67859 1 166 . 1 1 9 9 THR HA H 9 4.428 4.428 4.210 0.218 17919 67860 1 166 . 1 1 9 9 THR C C 9 175.520 175.520 176.097 -0.577 17919 67861 1 166 . 1 1 9 9 THR CA C 9 61.400 61.400 61.943 -0.543 17919 67862 1 166 . 1 1 9 9 THR CB C 9 69.140 69.140 68.247 0.893 17919 67863 1 166 . 1 1 9 9 THR H H 9 7.630 7.630 7.858 -0.228 17919 67864 1 166 . 1 1 10 10 GLY N N 10 108.890 108.890 111.036 -2.146 17919 67865 1 166 . 1 1 10 10 GLY C C 10 174.070 174.070 174.335 -0.265 17919 67866 1 166 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.522 -0.062 17919 67867 1 166 . 1 1 10 10 GLY H H 10 7.810 7.810 8.300 -0.490 17919 67868 1 166 . 1 1 11 11 LYS N N 11 121.600 121.600 120.927 0.673 17919 67869 1 166 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.535 -0.174 17919 67870 1 166 . 1 1 11 11 LYS C C 11 175.940 175.940 175.355 0.585 17919 67871 1 166 . 1 1 11 11 LYS CA C 11 56.280 56.280 55.556 0.724 17919 67872 1 166 . 1 1 11 11 LYS CB C 11 33.200 33.200 34.168 -0.968 17919 67873 1 166 . 1 1 11 11 LYS H H 11 7.280 7.280 7.663 -0.383 17919 67874 1 166 . 1 1 12 12 THR N N 12 120.440 120.440 119.047 1.393 17919 67875 1 166 . 1 1 12 12 THR HA H 12 5.046 5.046 4.973 0.073 17919 67876 1 166 . 1 1 12 12 THR C C 12 174.320 174.320 174.771 -0.451 17919 67877 1 166 . 1 1 12 12 THR CA C 12 62.390 62.390 62.213 0.177 17919 67878 1 166 . 1 1 12 12 THR CB C 12 69.910 69.910 69.211 0.699 17919 67879 1 166 . 1 1 12 12 THR H H 12 8.650 8.650 8.326 0.324 17919 67880 1 166 . 1 1 13 13 ILE N N 13 127.110 127.110 124.216 2.894 17919 67881 1 166 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.678 -0.134 17919 67882 1 166 . 1 1 13 13 ILE C C 13 175.220 175.220 175.003 0.217 17919 67883 1 166 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.230 0.750 17919 67884 1 166 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.922 0.028 17919 67885 1 166 . 1 1 13 13 ILE H H 13 9.450 9.450 9.162 0.288 17919 67886 1 166 . 1 1 14 14 THR N N 14 121.520 121.520 121.015 0.505 17919 67887 1 166 . 1 1 14 14 THR HA H 14 4.964 4.964 4.990 -0.026 17919 67888 1 166 . 1 1 14 14 THR C C 14 173.790 173.790 173.576 0.214 17919 67889 1 166 . 1 1 14 14 THR CA C 14 61.940 61.940 62.105 -0.165 17919 67890 1 166 . 1 1 14 14 THR CB C 14 69.650 69.650 70.102 -0.452 17919 67891 1 166 . 1 1 14 14 THR H H 14 8.710 8.710 8.595 0.115 17919 67892 1 166 . 1 1 15 15 LEU N N 15 124.800 124.800 124.515 0.285 17919 67893 1 166 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.790 -0.010 17919 67894 1 166 . 1 1 15 15 LEU C C 15 174.670 174.670 174.686 -0.016 17919 67895 1 166 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.714 -0.884 17919 67896 1 166 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.593 1.477 17919 67897 1 166 . 1 1 15 15 LEU H H 15 8.710 8.710 8.873 -0.163 17919 67898 1 166 . 1 1 16 16 GLU N N 16 122.160 122.160 121.574 0.586 17919 67899 1 166 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.447 -0.530 17919 67900 1 166 . 1 1 16 16 GLU C C 16 175.860 175.860 176.279 -0.419 17919 67901 1 166 . 1 1 16 16 GLU CA C 16 54.820 54.820 54.971 -0.151 17919 67902 1 166 . 1 1 16 16 GLU CB C 16 29.450 29.450 31.113 -1.663 17919 67903 1 166 . 1 1 16 16 GLU H H 16 8.140 8.140 8.624 -0.484 17919 67904 1 166 . 1 1 17 17 VAL N N 17 117.210 117.210 120.024 -2.814 17919 67905 1 166 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.832 -0.118 17919 67906 1 166 . 1 1 17 17 VAL C C 17 174.160 174.160 174.373 -0.213 17919 67907 1 166 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.405 -0.975 17919 67908 1 166 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.768 0.632 17919 67909 1 166 . 1 1 17 17 VAL H H 17 8.900 8.900 8.303 0.597 17919 67910 1 166 . 1 1 18 18 GLU N N 18 118.990 118.990 120.782 -1.792 17919 67911 1 166 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.798 0.281 17919 67912 1 166 . 1 1 18 18 GLU C C 18 176.160 176.160 175.589 0.571 17919 67913 1 166 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.160 -0.440 17919 67914 1 166 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.486 -0.176 17919 67915 1 166 . 1 1 18 18 GLU H H 18 8.640 8.640 7.869 0.771 17919 67916 1 166 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.279 -0.138 17919 67917 1 166 . 1 1 19 19 PRO C C 19 175.310 175.310 177.774 -2.464 17919 67918 1 166 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.550 -0.080 17919 67919 1 166 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.010 -0.059 17919 67920 1 166 . 1 1 20 20 SER N N 20 103.400 103.400 108.601 -5.201 17919 67921 1 166 . 1 1 20 20 SER HA H 20 4.370 4.370 4.266 0.104 17919 67922 1 166 . 1 1 20 20 SER C C 20 174.660 174.660 174.294 0.366 17919 67923 1 166 . 1 1 20 20 SER CA C 20 57.400 57.400 58.975 -1.575 17919 67924 1 166 . 1 1 20 20 SER CB C 20 63.370 63.370 62.937 0.433 17919 67925 1 166 . 1 1 20 20 SER H H 20 7.040 7.040 8.043 -1.003 17919 67926 1 166 . 1 1 21 21 ASP N N 21 123.480 123.480 123.907 -0.427 17919 67927 1 166 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.649 0.046 17919 67928 1 166 . 1 1 21 21 ASP C C 21 176.360 176.360 176.342 0.018 17919 67929 1 166 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.820 0.880 17919 67930 1 166 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.534 -0.734 17919 67931 1 166 . 1 1 21 21 ASP H H 21 8.030 8.030 7.578 0.452 17919 67932 1 166 . 1 1 22 22 THR N N 22 108.800 108.800 113.519 -4.719 17919 67933 1 166 . 1 1 22 22 THR HA H 22 4.920 4.920 4.589 0.331 17919 67934 1 166 . 1 1 22 22 THR C C 22 176.750 176.750 176.019 0.731 17919 67935 1 166 . 1 1 22 22 THR CA C 22 59.690 59.690 61.730 -2.040 17919 67936 1 166 . 1 1 22 22 THR CB C 22 71.200 71.200 70.736 0.464 17919 67937 1 166 . 1 1 22 22 THR H H 22 7.900 7.900 8.195 -0.295 17919 67938 1 166 . 1 1 23 23 ILE N N 23 121.190 121.190 123.135 -1.945 17919 67939 1 166 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.779 -0.122 17919 67940 1 166 . 1 1 23 23 ILE C C 23 179.040 179.040 177.879 1.161 17919 67941 1 166 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.815 -0.555 17919 67942 1 166 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.389 -2.038 17919 67943 1 166 . 1 1 23 23 ILE H H 23 8.560 8.560 8.424 0.136 17919 67944 1 166 . 1 1 24 24 GLU N N 24 120.830 120.830 120.904 -0.074 17919 67945 1 166 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.806 0.111 17919 67946 1 166 . 1 1 24 24 GLU C C 24 178.640 178.640 178.738 -0.098 17919 67947 1 166 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.065 0.156 17919 67948 1 166 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.366 -1.085 17919 67949 1 166 . 1 1 24 24 GLU H H 24 9.760 9.760 8.057 1.703 17919 67950 1 166 . 1 1 25 25 ASN N N 25 120.570 120.570 117.580 2.990 17919 67951 1 166 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.470 0.055 17919 67952 1 166 . 1 1 25 25 ASN C C 25 178.380 178.380 178.003 0.377 17919 67953 1 166 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.045 0.015 17919 67954 1 166 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.740 -0.290 17919 67955 1 166 . 1 1 25 25 ASN H H 25 7.920 7.920 7.701 0.219 17919 67956 1 166 . 1 1 26 26 VAL N N 26 121.710 121.710 120.845 0.865 17919 67957 1 166 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.522 -0.125 17919 67958 1 166 . 1 1 26 26 VAL C C 26 177.950 177.950 177.774 0.176 17919 67959 1 166 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.812 0.848 17919 67960 1 166 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.706 -0.866 17919 67961 1 166 . 1 1 26 26 VAL H H 26 8.070 8.070 8.221 -0.151 17919 67962 1 166 . 1 1 27 27 LYS N N 27 118.860 118.860 119.672 -0.812 17919 67963 1 166 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.102 0.478 17919 67964 1 166 . 1 1 27 27 LYS C C 27 180.550 180.550 179.041 1.509 17919 67965 1 166 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.739 -0.489 17919 67966 1 166 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.214 1.516 17919 67967 1 166 . 1 1 27 27 LYS H H 27 8.560 8.560 8.287 0.273 17919 67968 1 166 . 1 1 28 28 ALA N N 28 123.440 123.440 121.479 1.961 17919 67969 1 166 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.341 -0.181 17919 67970 1 166 . 1 1 28 28 ALA C C 28 180.300 180.300 179.417 0.883 17919 67971 1 166 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.880 0.490 17919 67972 1 166 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.439 -0.729 17919 67973 1 166 . 1 1 28 28 ALA H H 28 8.060 8.060 7.916 0.144 17919 67974 1 166 . 1 1 29 29 LYS N N 29 119.940 119.940 119.440 0.500 17919 67975 1 166 . 1 1 29 29 LYS HA H 29 4.207 4.207 3.984 0.223 17919 67976 1 166 . 1 1 29 29 LYS C C 29 180.320 180.320 179.319 1.001 17919 67977 1 166 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.328 0.322 17919 67978 1 166 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.265 1.025 17919 67979 1 166 . 1 1 29 29 LYS H H 29 7.850 7.850 7.572 0.278 17919 67980 1 166 . 1 1 30 30 ILE N N 30 121.080 121.080 120.324 0.756 17919 67981 1 166 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.576 -0.069 17919 67982 1 166 . 1 1 30 30 ILE C C 30 178.310 178.310 177.539 0.771 17919 67983 1 166 . 1 1 30 30 ILE CA C 30 66.150 66.150 64.846 1.304 17919 67984 1 166 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.386 -0.586 17919 67985 1 166 . 1 1 30 30 ILE H H 30 8.280 8.280 7.959 0.321 17919 67986 1 166 . 1 1 31 31 GLN N N 31 123.490 123.490 120.782 2.708 17919 67987 1 166 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.030 -0.201 17919 67988 1 166 . 1 1 31 31 GLN C C 31 178.890 178.890 178.286 0.604 17919 67989 1 166 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.073 0.927 17919 67990 1 166 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.581 -0.861 17919 67991 1 166 . 1 1 31 31 GLN H H 31 8.580 8.580 8.331 0.249 17919 67992 1 166 . 1 1 32 32 ASP N N 32 119.360 119.360 118.438 0.922 17919 67993 1 166 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.439 -0.085 17919 67994 1 166 . 1 1 32 32 ASP C C 32 177.250 177.250 177.987 -0.737 17919 67995 1 166 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.639 0.551 17919 67996 1 166 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.866 -0.286 17919 67997 1 166 . 1 1 32 32 ASP H H 32 8.010 8.010 8.197 -0.187 17919 67998 1 166 . 1 1 33 33 LYS N N 33 115.130 115.130 118.530 -3.400 17919 67999 1 166 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.194 0.143 17919 68000 1 166 . 1 1 33 33 LYS C C 33 177.870 177.870 178.420 -0.550 17919 68001 1 166 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.461 -0.411 17919 68002 1 166 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.361 0.809 17919 68003 1 166 . 1 1 33 33 LYS H H 33 7.430 7.430 7.402 0.028 17919 68004 1 166 . 1 1 34 34 GLU N N 34 113.870 113.870 114.339 -0.469 17919 68005 1 166 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.454 0.171 17919 68006 1 166 . 1 1 34 34 GLU C C 34 177.840 177.840 176.963 0.877 17919 68007 1 166 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.953 -0.783 17919 68008 1 166 . 1 1 34 34 GLU CB C 34 32.660 32.660 30.935 1.725 17919 68009 1 166 . 1 1 34 34 GLU H H 34 8.740 8.740 7.847 0.893 17919 68010 1 166 . 1 1 35 35 GLY N N 35 108.650 108.650 109.392 -0.742 17919 68011 1 166 . 1 1 35 35 GLY C C 35 173.960 173.960 174.355 -0.395 17919 68012 1 166 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.811 0.269 17919 68013 1 166 . 1 1 35 35 GLY H H 35 8.530 8.530 8.073 0.457 17919 68014 1 166 . 1 1 36 36 ILE N N 36 119.880 119.880 121.554 -1.674 17919 68015 1 166 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.225 0.220 17919 68016 1 166 . 1 1 36 36 ILE C C 36 173.590 173.590 174.091 -0.501 17919 68017 1 166 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.190 -0.440 17919 68018 1 166 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.556 2.024 17919 68019 1 166 . 1 1 36 36 ILE H H 36 6.150 6.150 7.547 -1.397 17919 68020 1 166 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.525 0.109 17919 68021 1 166 . 1 1 37 37 PRO C C 37 176.940 176.940 175.992 0.948 17919 68022 1 166 . 1 1 37 37 PRO CA C 37 61.660 61.660 62.056 -0.396 17919 68023 1 166 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.126 0.724 17919 68024 1 166 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.198 -0.081 17919 68025 1 166 . 1 1 38 38 PRO C C 38 178.320 178.320 178.062 0.258 17919 68026 1 166 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.376 0.884 17919 68027 1 166 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.891 0.999 17919 68028 1 166 . 1 1 39 39 ASP N N 39 113.380 113.380 116.091 -2.711 17919 68029 1 166 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.443 -0.013 17919 68030 1 166 . 1 1 39 39 ASP C C 39 177.090 177.090 177.483 -0.393 17919 68031 1 166 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.583 -0.943 17919 68032 1 166 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.501 -0.960 17919 68033 1 166 . 1 1 39 39 ASP H H 39 8.550 8.550 8.563 -0.013 17919 68034 1 166 . 1 1 40 40 GLN N N 40 116.780 116.780 117.375 -0.595 17919 68035 1 166 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.209 0.255 17919 68036 1 166 . 1 1 40 40 GLN C C 40 175.380 175.380 175.088 0.292 17919 68037 1 166 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.928 -1.288 17919 68038 1 166 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.391 0.749 17919 68039 1 166 . 1 1 40 40 GLN H H 40 7.820 7.820 7.819 0.001 17919 68040 1 166 . 1 1 41 41 GLN N N 41 117.720 117.720 118.404 -0.684 17919 68041 1 166 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.439 -0.195 17919 68042 1 166 . 1 1 41 41 GLN C C 41 176.300 176.300 175.160 1.140 17919 68043 1 166 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.934 0.535 17919 68044 1 166 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.752 1.898 17919 68045 1 166 . 1 1 41 41 GLN H H 41 7.480 7.480 7.156 0.324 17919 68046 1 166 . 1 1 42 42 ARG N N 42 122.680 122.680 125.909 -3.229 17919 68047 1 166 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.628 -0.128 17919 68048 1 166 . 1 1 42 42 ARG C C 42 174.050 174.050 174.124 -0.074 17919 68049 1 166 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.648 0.402 17919 68050 1 166 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.571 -0.821 17919 68051 1 166 . 1 1 42 42 ARG H H 42 8.530 8.530 8.833 -0.303 17919 68052 1 166 . 1 1 43 43 LEU N N 43 124.040 124.040 128.467 -4.427 17919 68053 1 166 . 1 1 43 43 LEU C C 43 175.290 175.290 175.831 -0.541 17919 68054 1 166 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.309 -0.329 17919 68055 1 166 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.005 1.785 17919 68056 1 166 . 1 1 43 43 LEU H H 43 8.820 8.820 8.864 -0.044 17919 68057 1 166 . 1 1 44 44 ILE N N 44 121.920 121.920 120.701 1.219 17919 68058 1 166 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.992 -0.000 17919 68059 1 166 . 1 1 44 44 ILE C C 44 176.060 176.060 173.585 2.475 17919 68060 1 166 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.384 -0.404 17919 68061 1 166 . 1 1 44 44 ILE CB C 44 41.420 41.420 40.729 0.691 17919 68062 1 166 . 1 1 44 44 ILE H H 44 9.030 9.030 8.810 0.220 17919 68063 1 166 . 1 1 45 45 PHE N N 45 125.390 125.390 128.420 -3.030 17919 68064 1 166 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.023 0.022 17919 68065 1 166 . 1 1 45 45 PHE C C 45 174.470 174.470 174.417 0.053 17919 68066 1 166 . 1 1 45 45 PHE CA C 45 57.020 57.020 57.391 -0.371 17919 68067 1 166 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.075 0.685 17919 68068 1 166 . 1 1 45 45 PHE H H 45 8.830 8.830 9.049 -0.219 17919 68069 1 166 . 1 1 46 46 ALA N N 46 132.200 132.200 131.266 0.934 17919 68070 1 166 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.741 -0.051 17919 68071 1 166 . 1 1 46 46 ALA C C 46 177.290 177.290 177.893 -0.603 17919 68072 1 166 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.835 -0.295 17919 68073 1 166 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.570 0.000 17919 68074 1 166 . 1 1 46 46 ALA H H 46 8.810 8.810 8.805 0.005 17919 68075 1 166 . 1 1 47 47 GLY N N 47 102.340 102.340 104.965 -2.625 17919 68076 1 166 . 1 1 47 47 GLY C C 47 173.810 173.810 174.656 -0.846 17919 68077 1 166 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.484 -0.134 17919 68078 1 166 . 1 1 47 47 GLY H H 47 8.130 8.130 8.492 -0.362 17919 68079 1 166 . 1 1 48 48 LYS N N 48 121.570 121.570 122.673 -1.103 17919 68080 1 166 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.522 0.100 17919 68081 1 166 . 1 1 48 48 LYS C C 48 174.700 174.700 175.592 -0.892 17919 68082 1 166 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.132 -0.582 17919 68083 1 166 . 1 1 48 48 LYS CB C 48 34.530 34.530 33.465 1.065 17919 68084 1 166 . 1 1 48 48 LYS H H 48 7.980 7.980 7.764 0.216 17919 68085 1 166 . 1 1 49 49 GLN N N 49 122.410 122.410 125.040 -2.630 17919 68086 1 166 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.321 0.239 17919 68087 1 166 . 1 1 49 49 GLN C C 49 175.670 175.670 175.713 -0.043 17919 68088 1 166 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.505 -0.765 17919 68089 1 166 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.421 -0.421 17919 68090 1 166 . 1 1 49 49 GLN H H 49 8.600 8.600 8.625 -0.025 17919 68091 1 166 . 1 1 50 50 LEU N N 50 125.520 125.520 127.143 -1.623 17919 68092 1 166 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.202 -0.112 17919 68093 1 166 . 1 1 50 50 LEU C C 50 176.660 176.660 175.650 1.010 17919 68094 1 166 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.934 0.306 17919 68095 1 166 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.511 -0.941 17919 68096 1 166 . 1 1 50 50 LEU H H 50 8.530 8.530 8.105 0.425 17919 68097 1 166 . 1 1 51 51 GLU N N 51 122.940 122.940 122.923 0.017 17919 68098 1 166 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.565 -0.077 17919 68099 1 166 . 1 1 51 51 GLU C C 51 175.870 175.870 176.956 -1.086 17919 68100 1 166 . 1 1 51 51 GLU CA C 51 55.960 55.960 54.827 1.133 17919 68101 1 166 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.515 -0.945 17919 68102 1 166 . 1 1 51 51 GLU H H 51 8.400 8.400 8.171 0.229 17919 68103 1 166 . 1 1 52 52 ASP N N 52 120.030 120.030 126.730 -6.700 17919 68104 1 166 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.361 -0.002 17919 68105 1 166 . 1 1 52 52 ASP C C 52 177.330 177.330 177.855 -0.525 17919 68106 1 166 . 1 1 52 52 ASP CA C 52 56.960 56.960 58.149 -1.189 17919 68107 1 166 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.644 0.206 17919 68108 1 166 . 1 1 52 52 ASP H H 52 8.160 8.160 8.833 -0.673 17919 68109 1 166 . 1 1 53 53 GLY N N 53 106.660 106.660 104.964 1.696 17919 68110 1 166 . 1 1 53 53 GLY C C 53 174.870 174.870 174.099 0.771 17919 68111 1 166 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.801 0.369 17919 68112 1 166 . 1 1 53 53 GLY H H 53 9.390 9.390 8.434 0.956 17919 68113 1 166 . 1 1 54 54 ARG N N 54 119.050 119.050 121.091 -2.041 17919 68114 1 166 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.716 -0.021 17919 68115 1 166 . 1 1 54 54 ARG C C 54 175.350 175.350 175.743 -0.393 17919 68116 1 166 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.331 0.059 17919 68117 1 166 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.907 -0.257 17919 68118 1 166 . 1 1 54 54 ARG H H 54 7.460 7.460 7.438 0.022 17919 68119 1 166 . 1 1 55 55 THR N N 55 108.400 108.400 112.486 -4.086 17919 68120 1 166 . 1 1 55 55 THR HA H 55 5.240 5.240 4.740 0.500 17919 68121 1 166 . 1 1 55 55 THR C C 55 176.560 176.560 176.200 0.360 17919 68122 1 166 . 1 1 55 55 THR CA C 55 59.690 59.690 60.766 -1.076 17919 68123 1 166 . 1 1 55 55 THR CB C 55 72.260 72.260 70.762 1.498 17919 68124 1 166 . 1 1 55 55 THR H H 55 8.730 8.730 9.096 -0.366 17919 68125 1 166 . 1 1 56 56 LEU N N 56 117.920 117.920 120.654 -2.734 17919 68126 1 166 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.137 -0.077 17919 68127 1 166 . 1 1 56 56 LEU C C 56 180.810 180.810 178.992 1.818 17919 68128 1 166 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.002 0.708 17919 68129 1 166 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.346 -0.976 17919 68130 1 166 . 1 1 56 56 LEU H H 56 8.140 8.140 8.830 -0.690 17919 68131 1 166 . 1 1 57 57 SER N N 57 113.330 113.330 114.773 -1.443 17919 68132 1 166 . 1 1 57 57 SER HA H 57 4.370 4.370 4.273 0.097 17919 68133 1 166 . 1 1 57 57 SER C C 57 178.310 178.310 176.985 1.325 17919 68134 1 166 . 1 1 57 57 SER CA C 57 61.080 61.080 61.245 -0.165 17919 68135 1 166 . 1 1 57 57 SER CB C 57 62.530 62.530 62.267 0.263 17919 68136 1 166 . 1 1 57 57 SER H H 57 8.470 8.470 8.273 0.197 17919 68137 1 166 . 1 1 58 58 ASP N N 58 124.190 124.190 124.282 -0.092 17919 68138 1 166 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.303 -0.007 17919 68139 1 166 . 1 1 58 58 ASP C C 58 177.400 177.400 177.143 0.257 17919 68140 1 166 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.732 0.448 17919 68141 1 166 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.183 -0.083 17919 68142 1 166 . 1 1 58 58 ASP H H 58 7.930 7.930 7.865 0.065 17919 68143 1 166 . 1 1 59 59 TYR N N 59 115.510 115.510 115.810 -0.300 17919 68144 1 166 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.503 0.167 17919 68145 1 166 . 1 1 59 59 TYR C C 59 174.700 174.700 175.296 -0.596 17919 68146 1 166 . 1 1 59 59 TYR CA C 59 58.250 58.250 58.250 0.000 17919 68147 1 166 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.466 1.604 17919 68148 1 166 . 1 1 59 59 TYR H H 59 7.250 7.250 7.205 0.045 17919 68149 1 166 . 1 1 60 60 ASN N N 60 115.900 115.900 114.756 1.144 17919 68150 1 166 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.401 -0.046 17919 68151 1 166 . 1 1 60 60 ASN C C 60 174.340 174.340 174.527 -0.187 17919 68152 1 166 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.466 -0.346 17919 68153 1 166 . 1 1 60 60 ASN CB C 60 37.410 37.410 36.691 0.719 17919 68154 1 166 . 1 1 60 60 ASN H H 60 8.150 8.150 7.975 0.175 17919 68155 1 166 . 1 1 61 61 ILE N N 61 118.600 118.600 119.564 -0.964 17919 68156 1 166 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.994 -0.601 17919 68157 1 166 . 1 1 61 61 ILE C C 61 174.610 174.610 175.409 -0.799 17919 68158 1 166 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.859 0.561 17919 68159 1 166 . 1 1 61 61 ILE CB C 61 36.740 36.740 38.486 -1.746 17919 68160 1 166 . 1 1 61 61 ILE H H 61 7.250 7.250 8.081 -0.831 17919 68161 1 166 . 1 1 62 62 GLN N N 62 124.740 124.740 125.604 -0.864 17919 68162 1 166 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.837 -0.331 17919 68163 1 166 . 1 1 62 62 GLN C C 62 175.970 175.970 175.625 0.345 17919 68164 1 166 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.428 0.232 17919 68165 1 166 . 1 1 62 62 GLN CB C 62 31.650 31.650 32.058 -0.408 17919 68166 1 166 . 1 1 62 62 GLN H H 62 7.610 7.610 8.113 -0.503 17919 68167 1 166 . 1 1 63 63 LYS N N 63 120.300 120.300 121.827 -1.527 17919 68168 1 166 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.975 0.026 17919 68169 1 166 . 1 1 63 63 LYS C C 63 175.810 175.810 176.593 -0.783 17919 68170 1 166 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.126 -0.336 17919 68171 1 166 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.991 0.659 17919 68172 1 166 . 1 1 63 63 LYS H H 63 8.490 8.490 8.586 -0.096 17919 68173 1 166 . 1 1 64 64 GLU N N 64 113.950 113.950 117.555 -3.605 17919 68174 1 166 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.925 -0.460 17919 68175 1 166 . 1 1 64 64 GLU C C 64 175.250 175.250 176.079 -0.829 17919 68176 1 166 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.615 0.275 17919 68177 1 166 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.747 -2.847 17919 68178 1 166 . 1 1 64 64 GLU H H 64 9.280 9.280 9.081 0.199 17919 68179 1 166 . 1 1 65 65 SER N N 65 114.730 114.730 115.251 -0.521 17919 68180 1 166 . 1 1 65 65 SER HA H 65 4.640 4.640 4.488 0.152 17919 68181 1 166 . 1 1 65 65 SER C C 65 172.160 172.160 173.709 -1.549 17919 68182 1 166 . 1 1 65 65 SER CA C 65 60.890 60.890 60.816 0.074 17919 68183 1 166 . 1 1 65 65 SER CB C 65 64.910 64.910 64.069 0.841 17919 68184 1 166 . 1 1 65 65 SER H H 65 7.670 7.670 7.587 0.083 17919 68185 1 166 . 1 1 66 66 THR N N 66 117.110 117.110 121.177 -4.067 17919 68186 1 166 . 1 1 66 66 THR HA H 66 5.270 5.270 5.193 0.077 17919 68187 1 166 . 1 1 66 66 THR C C 66 173.950 173.950 174.120 -0.170 17919 68188 1 166 . 1 1 66 66 THR CA C 66 62.340 62.340 61.728 0.612 17919 68189 1 166 . 1 1 66 66 THR CB C 66 70.080 70.080 70.466 -0.386 17919 68190 1 166 . 1 1 66 66 THR H H 66 8.730 8.730 8.516 0.214 17919 68191 1 166 . 1 1 67 67 LEU N N 67 127.110 127.110 127.360 -0.250 17919 68192 1 166 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.751 0.309 17919 68193 1 166 . 1 1 67 67 LEU C C 67 175.770 175.770 175.302 0.468 17919 68194 1 166 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.796 0.104 17919 68195 1 166 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.749 0.511 17919 68196 1 166 . 1 1 67 67 LEU H H 67 9.410 9.410 9.118 0.292 17919 68197 1 166 . 1 1 68 68 HIS N N 68 118.380 118.380 119.083 -0.703 17919 68198 1 166 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.144 0.096 17919 68199 1 166 . 1 1 68 68 HIS C C 68 173.150 173.150 173.951 -0.801 17919 68200 1 166 . 1 1 68 68 HIS CA C 68 55.000 55.000 55.223 -0.223 17919 68201 1 166 . 1 1 68 68 HIS CB C 68 30.530 30.530 31.934 -1.405 17919 68202 1 166 . 1 1 68 68 HIS H H 68 9.230 9.230 8.430 0.800 17919 68203 1 166 . 1 1 69 69 LEU N N 69 124.460 124.460 127.200 -2.740 17919 68204 1 166 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.896 0.294 17919 68205 1 166 . 1 1 69 69 LEU C C 69 175.270 175.270 174.269 1.001 17919 68206 1 166 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.744 0.146 17919 68207 1 166 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.345 0.035 17919 68208 1 166 . 1 1 69 69 LEU H H 69 8.340 8.340 8.860 -0.520 17919 68209 1 166 . 1 1 70 70 VAL N N 70 126.940 126.940 120.817 6.123 17919 68210 1 166 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.651 -0.301 17919 68211 1 166 . 1 1 70 70 VAL C C 70 174.000 174.000 173.833 0.167 17919 68212 1 166 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.634 1.166 17919 68213 1 166 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.645 -0.735 17919 68214 1 166 . 1 1 70 70 VAL H H 70 9.200 9.200 9.104 0.096 17919 68215 1 166 . 1 1 71 71 LEU N N 71 123.130 123.130 124.691 -1.561 17919 68216 1 166 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.901 0.159 17919 68217 1 166 . 1 1 71 71 LEU C C 71 177.830 177.830 177.534 0.296 17919 68218 1 166 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.785 0.155 17919 68219 1 166 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.246 -0.396 17919 68220 1 166 . 1 1 71 71 LEU H H 71 8.120 8.120 8.620 -0.500 17919 68221 1 166 . 1 1 72 72 ARG N N 72 123.490 123.490 124.790 -1.300 17919 68222 1 166 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.328 -0.027 17919 68223 1 166 . 1 1 72 72 ARG C C 72 175.350 175.350 175.906 -0.556 17919 68224 1 166 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.650 -1.040 17919 68225 1 166 . 1 1 72 72 ARG CB C 72 31.350 31.350 28.372 2.978 17919 68226 1 166 . 1 1 72 72 ARG H H 72 8.580 8.580 8.726 -0.146 17919 68227 1 167 . 1 1 2 2 GLN N N 2 123.220 123.220 121.008 2.212 17919 68228 1 167 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.381 -0.132 17919 68229 1 167 . 1 1 2 2 GLN C C 2 175.920 175.920 175.734 0.186 17919 68230 1 167 . 1 1 2 2 GLN CA C 2 55.080 55.080 55.230 -0.150 17919 68231 1 167 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.318 0.442 17919 68232 1 167 . 1 1 2 2 GLN H H 2 8.900 8.900 8.485 0.415 17919 68233 1 167 . 1 1 3 3 ILE N N 3 115.340 115.340 115.278 0.062 17919 68234 1 167 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.665 -0.452 17919 68235 1 167 . 1 1 3 3 ILE C C 3 172.450 172.450 173.485 -1.035 17919 68236 1 167 . 1 1 3 3 ILE CA C 3 59.570 59.570 60.204 -0.634 17919 68237 1 167 . 1 1 3 3 ILE CB C 3 42.210 42.210 42.459 -0.249 17919 68238 1 167 . 1 1 3 3 ILE H H 3 8.320 8.320 8.670 -0.350 17919 68239 1 167 . 1 1 4 4 PHE N N 4 118.110 118.110 119.263 -1.153 17919 68240 1 167 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.565 0.065 17919 68241 1 167 . 1 1 4 4 PHE C C 4 175.320 175.320 174.844 0.476 17919 68242 1 167 . 1 1 4 4 PHE CA C 4 55.210 55.210 56.217 -1.007 17919 68243 1 167 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.602 -1.123 17919 68244 1 167 . 1 1 4 4 PHE H H 4 8.610 8.610 8.651 -0.041 17919 68245 1 167 . 1 1 5 5 VAL N N 5 121.000 121.000 123.214 -2.214 17919 68246 1 167 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.815 -0.090 17919 68247 1 167 . 1 1 5 5 VAL C C 5 174.870 174.870 175.313 -0.443 17919 68248 1 167 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.113 -0.493 17919 68249 1 167 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.990 0.240 17919 68250 1 167 . 1 1 5 5 VAL H H 5 9.300 9.300 9.311 -0.011 17919 68251 1 167 . 1 1 6 6 LYS N N 6 127.520 127.520 128.112 -0.592 17919 68252 1 167 . 1 1 6 6 LYS HA H 6 5.367 5.367 4.961 0.406 17919 68253 1 167 . 1 1 6 6 LYS C C 6 177.140 177.140 176.749 0.391 17919 68254 1 167 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.946 -0.426 17919 68255 1 167 . 1 1 6 6 LYS CB C 6 35.050 35.050 33.903 1.147 17919 68256 1 167 . 1 1 6 6 LYS H H 6 8.820 8.820 9.263 -0.443 17919 68257 1 167 . 1 1 7 7 THR N N 7 115.400 115.400 114.982 0.418 17919 68258 1 167 . 1 1 7 7 THR HA H 7 4.970 4.970 4.520 0.450 17919 68259 1 167 . 1 1 7 7 THR C C 7 176.910 176.910 176.605 0.305 17919 68260 1 167 . 1 1 7 7 THR CA C 7 60.470 60.470 60.764 -0.294 17919 68261 1 167 . 1 1 7 7 THR CB C 7 70.630 70.630 70.481 0.149 17919 68262 1 167 . 1 1 7 7 THR H H 7 8.730 8.730 8.483 0.247 17919 68263 1 167 . 1 1 8 8 LEU N N 8 121.330 121.330 121.685 -0.355 17919 68264 1 167 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.150 0.160 17919 68265 1 167 . 1 1 8 8 LEU C C 8 178.800 178.800 178.583 0.217 17919 68266 1 167 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.930 -0.350 17919 68267 1 167 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.500 0.470 17919 68268 1 167 . 1 1 8 8 LEU H H 8 9.100 9.100 9.000 0.100 17919 68269 1 167 . 1 1 9 9 THR N N 9 105.590 105.590 107.661 -2.071 17919 68270 1 167 . 1 1 9 9 THR HA H 9 4.428 4.428 4.264 0.164 17919 68271 1 167 . 1 1 9 9 THR C C 9 175.520 175.520 175.921 -0.401 17919 68272 1 167 . 1 1 9 9 THR CA C 9 61.400 61.400 62.120 -0.720 17919 68273 1 167 . 1 1 9 9 THR CB C 9 69.140 69.140 68.379 0.761 17919 68274 1 167 . 1 1 9 9 THR H H 9 7.630 7.630 7.589 0.041 17919 68275 1 167 . 1 1 10 10 GLY N N 10 108.890 108.890 111.699 -2.809 17919 68276 1 167 . 1 1 10 10 GLY C C 10 174.070 174.070 173.793 0.277 17919 68277 1 167 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.475 -0.015 17919 68278 1 167 . 1 1 10 10 GLY H H 10 7.810 7.810 8.217 -0.407 17919 68279 1 167 . 1 1 11 11 LYS N N 11 121.600 121.600 120.497 1.103 17919 68280 1 167 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.610 -0.249 17919 68281 1 167 . 1 1 11 11 LYS C C 11 175.940 175.940 175.487 0.453 17919 68282 1 167 . 1 1 11 11 LYS CA C 11 56.280 56.280 55.298 0.982 17919 68283 1 167 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.442 -0.242 17919 68284 1 167 . 1 1 11 11 LYS H H 11 7.280 7.280 7.841 -0.561 17919 68285 1 167 . 1 1 12 12 THR N N 12 120.440 120.440 113.003 7.437 17919 68286 1 167 . 1 1 12 12 THR HA H 12 5.046 5.046 5.418 -0.372 17919 68287 1 167 . 1 1 12 12 THR C C 12 174.320 174.320 174.215 0.105 17919 68288 1 167 . 1 1 12 12 THR CA C 12 62.390 62.390 60.212 2.178 17919 68289 1 167 . 1 1 12 12 THR CB C 12 69.910 69.910 71.230 -1.320 17919 68290 1 167 . 1 1 12 12 THR H H 12 8.650 8.650 8.208 0.442 17919 68291 1 167 . 1 1 13 13 ILE N N 13 127.110 127.110 126.333 0.777 17919 68292 1 167 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.561 -0.017 17919 68293 1 167 . 1 1 13 13 ILE C C 13 175.220 175.220 175.519 -0.299 17919 68294 1 167 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.187 -0.207 17919 68295 1 167 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.656 0.294 17919 68296 1 167 . 1 1 13 13 ILE H H 13 9.450 9.450 9.122 0.328 17919 68297 1 167 . 1 1 14 14 THR N N 14 121.520 121.520 123.312 -1.792 17919 68298 1 167 . 1 1 14 14 THR HA H 14 4.964 4.964 4.416 0.548 17919 68299 1 167 . 1 1 14 14 THR C C 14 173.790 173.790 173.796 -0.006 17919 68300 1 167 . 1 1 14 14 THR CA C 14 61.940 61.940 61.725 0.215 17919 68301 1 167 . 1 1 14 14 THR CB C 14 69.650 69.650 69.570 0.080 17919 68302 1 167 . 1 1 14 14 THR H H 14 8.710 8.710 8.454 0.256 17919 68303 1 167 . 1 1 15 15 LEU N N 15 124.800 124.800 125.882 -1.082 17919 68304 1 167 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.648 0.132 17919 68305 1 167 . 1 1 15 15 LEU C C 15 174.670 174.670 174.569 0.101 17919 68306 1 167 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.686 -0.856 17919 68307 1 167 . 1 1 15 15 LEU CB C 15 47.070 47.070 46.838 0.232 17919 68308 1 167 . 1 1 15 15 LEU H H 15 8.710 8.710 8.706 0.004 17919 68309 1 167 . 1 1 16 16 GLU N N 16 122.160 122.160 123.985 -1.825 17919 68310 1 167 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.327 -0.410 17919 68311 1 167 . 1 1 16 16 GLU C C 16 175.860 175.860 175.698 0.162 17919 68312 1 167 . 1 1 16 16 GLU CA C 16 54.820 54.820 54.471 0.349 17919 68313 1 167 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.350 -0.900 17919 68314 1 167 . 1 1 16 16 GLU H H 16 8.140 8.140 8.461 -0.321 17919 68315 1 167 . 1 1 17 17 VAL N N 17 117.210 117.210 118.828 -1.618 17919 68316 1 167 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.583 0.131 17919 68317 1 167 . 1 1 17 17 VAL C C 17 174.160 174.160 175.033 -0.873 17919 68318 1 167 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.926 -0.496 17919 68319 1 167 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.515 0.885 17919 68320 1 167 . 1 1 17 17 VAL H H 17 8.900 8.900 8.725 0.175 17919 68321 1 167 . 1 1 18 18 GLU N N 18 118.990 118.990 121.300 -2.310 17919 68322 1 167 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.800 0.279 17919 68323 1 167 . 1 1 18 18 GLU C C 18 176.160 176.160 175.935 0.225 17919 68324 1 167 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.387 0.333 17919 68325 1 167 . 1 1 18 18 GLU CB C 18 30.310 30.310 29.868 0.442 17919 68326 1 167 . 1 1 18 18 GLU H H 18 8.640 8.640 8.240 0.400 17919 68327 1 167 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.311 -0.170 17919 68328 1 167 . 1 1 19 19 PRO C C 19 175.310 175.310 177.372 -2.062 17919 68329 1 167 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.214 0.256 17919 68330 1 167 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.036 -0.086 17919 68331 1 167 . 1 1 20 20 SER N N 20 103.400 103.400 110.110 -6.710 17919 68332 1 167 . 1 1 20 20 SER HA H 20 4.370 4.370 4.364 0.006 17919 68333 1 167 . 1 1 20 20 SER C C 20 174.660 174.660 174.396 0.264 17919 68334 1 167 . 1 1 20 20 SER CA C 20 57.400 57.400 58.638 -1.238 17919 68335 1 167 . 1 1 20 20 SER CB C 20 63.370 63.370 63.114 0.256 17919 68336 1 167 . 1 1 20 20 SER H H 20 7.040 7.040 8.254 -1.214 17919 68337 1 167 . 1 1 21 21 ASP N N 21 123.480 123.480 123.899 -0.419 17919 68338 1 167 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.714 -0.019 17919 68339 1 167 . 1 1 21 21 ASP C C 21 176.360 176.360 175.602 0.758 17919 68340 1 167 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.584 1.116 17919 68341 1 167 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.968 -1.168 17919 68342 1 167 . 1 1 21 21 ASP H H 21 8.030 8.030 7.523 0.507 17919 68343 1 167 . 1 1 22 22 THR N N 22 108.800 108.800 110.690 -1.890 17919 68344 1 167 . 1 1 22 22 THR HA H 22 4.920 4.920 5.150 -0.230 17919 68345 1 167 . 1 1 22 22 THR C C 22 176.750 176.750 176.434 0.316 17919 68346 1 167 . 1 1 22 22 THR CA C 22 59.690 59.690 60.267 -0.577 17919 68347 1 167 . 1 1 22 22 THR CB C 22 71.200 71.200 71.121 0.079 17919 68348 1 167 . 1 1 22 22 THR H H 22 7.900 7.900 8.725 -0.825 17919 68349 1 167 . 1 1 23 23 ILE N N 23 121.190 121.190 121.029 0.161 17919 68350 1 167 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.963 -0.306 17919 68351 1 167 . 1 1 23 23 ILE C C 23 179.040 179.040 177.627 1.413 17919 68352 1 167 . 1 1 23 23 ILE CA C 23 62.260 62.260 61.877 0.383 17919 68353 1 167 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.165 -1.815 17919 68354 1 167 . 1 1 23 23 ILE H H 23 8.560 8.560 8.589 -0.029 17919 68355 1 167 . 1 1 24 24 GLU N N 24 120.830 120.830 122.313 -1.483 17919 68356 1 167 . 1 1 24 24 GLU HA H 24 3.917 3.917 4.004 -0.087 17919 68357 1 167 . 1 1 24 24 GLU C C 24 178.640 178.640 178.391 0.249 17919 68358 1 167 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.079 0.141 17919 68359 1 167 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.559 -1.279 17919 68360 1 167 . 1 1 24 24 GLU H H 24 9.760 9.760 8.058 1.702 17919 68361 1 167 . 1 1 25 25 ASN N N 25 120.570 120.570 118.907 1.663 17919 68362 1 167 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.454 0.071 17919 68363 1 167 . 1 1 25 25 ASN C C 25 178.380 178.380 177.930 0.450 17919 68364 1 167 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.190 -0.130 17919 68365 1 167 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.421 0.029 17919 68366 1 167 . 1 1 25 25 ASN H H 25 7.920 7.920 7.699 0.221 17919 68367 1 167 . 1 1 26 26 VAL N N 26 121.710 121.710 120.580 1.130 17919 68368 1 167 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.647 -0.250 17919 68369 1 167 . 1 1 26 26 VAL C C 26 177.950 177.950 177.491 0.459 17919 68370 1 167 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.131 1.529 17919 68371 1 167 . 1 1 26 26 VAL CB C 26 30.840 30.840 30.947 -0.107 17919 68372 1 167 . 1 1 26 26 VAL H H 26 8.070 8.070 8.278 -0.208 17919 68373 1 167 . 1 1 27 27 LYS N N 27 118.860 118.860 120.346 -1.486 17919 68374 1 167 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.196 0.384 17919 68375 1 167 . 1 1 27 27 LYS C C 27 180.550 180.550 179.069 1.481 17919 68376 1 167 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.860 -0.610 17919 68377 1 167 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.141 1.589 17919 68378 1 167 . 1 1 27 27 LYS H H 27 8.560 8.560 8.403 0.157 17919 68379 1 167 . 1 1 28 28 ALA N N 28 123.440 123.440 121.961 1.479 17919 68380 1 167 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.214 -0.054 17919 68381 1 167 . 1 1 28 28 ALA C C 28 180.300 180.300 179.239 1.061 17919 68382 1 167 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.669 0.701 17919 68383 1 167 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.531 -0.821 17919 68384 1 167 . 1 1 28 28 ALA H H 28 8.060 8.060 7.842 0.218 17919 68385 1 167 . 1 1 29 29 LYS N N 29 119.940 119.940 119.825 0.115 17919 68386 1 167 . 1 1 29 29 LYS HA H 29 4.207 4.207 3.981 0.226 17919 68387 1 167 . 1 1 29 29 LYS C C 29 180.320 180.320 179.193 1.127 17919 68388 1 167 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.397 0.254 17919 68389 1 167 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.421 0.869 17919 68390 1 167 . 1 1 29 29 LYS H H 29 7.850 7.850 7.643 0.207 17919 68391 1 167 . 1 1 30 30 ILE N N 30 121.080 121.080 120.314 0.766 17919 68392 1 167 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.545 -0.038 17919 68393 1 167 . 1 1 30 30 ILE C C 30 178.310 178.310 177.265 1.045 17919 68394 1 167 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.461 0.689 17919 68395 1 167 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.845 -1.045 17919 68396 1 167 . 1 1 30 30 ILE H H 30 8.280 8.280 8.367 -0.087 17919 68397 1 167 . 1 1 31 31 GLN N N 31 123.490 123.490 120.418 3.072 17919 68398 1 167 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.915 -0.086 17919 68399 1 167 . 1 1 31 31 GLN C C 31 178.890 178.890 178.506 0.384 17919 68400 1 167 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.083 0.917 17919 68401 1 167 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.463 -0.743 17919 68402 1 167 . 1 1 31 31 GLN H H 31 8.580 8.580 8.288 0.292 17919 68403 1 167 . 1 1 32 32 ASP N N 32 119.360 119.360 118.610 0.750 17919 68404 1 167 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.424 -0.070 17919 68405 1 167 . 1 1 32 32 ASP C C 32 177.250 177.250 177.572 -0.322 17919 68406 1 167 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.487 0.702 17919 68407 1 167 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.751 -0.171 17919 68408 1 167 . 1 1 32 32 ASP H H 32 8.010 8.010 7.914 0.096 17919 68409 1 167 . 1 1 33 33 LYS N N 33 115.130 115.130 117.900 -2.770 17919 68410 1 167 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.450 -0.113 17919 68411 1 167 . 1 1 33 33 LYS C C 33 177.870 177.870 178.142 -0.272 17919 68412 1 167 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.275 0.775 17919 68413 1 167 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.499 0.671 17919 68414 1 167 . 1 1 33 33 LYS H H 33 7.430 7.430 7.696 -0.266 17919 68415 1 167 . 1 1 34 34 GLU N N 34 113.870 113.870 115.876 -2.006 17919 68416 1 167 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.452 0.173 17919 68417 1 167 . 1 1 34 34 GLU C C 34 177.840 177.840 177.553 0.287 17919 68418 1 167 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.403 -1.233 17919 68419 1 167 . 1 1 34 34 GLU CB C 34 32.660 32.660 32.037 0.623 17919 68420 1 167 . 1 1 34 34 GLU H H 34 8.740 8.740 8.094 0.646 17919 68421 1 167 . 1 1 35 35 GLY N N 35 108.650 108.650 108.626 0.024 17919 68422 1 167 . 1 1 35 35 GLY C C 35 173.960 173.960 174.175 -0.215 17919 68423 1 167 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.681 0.399 17919 68424 1 167 . 1 1 35 35 GLY H H 35 8.530 8.530 7.937 0.593 17919 68425 1 167 . 1 1 36 36 ILE N N 36 119.880 119.880 122.125 -2.245 17919 68426 1 167 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.260 0.185 17919 68427 1 167 . 1 1 36 36 ILE C C 36 173.590 173.590 174.015 -0.425 17919 68428 1 167 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.011 -0.261 17919 68429 1 167 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.302 2.278 17919 68430 1 167 . 1 1 36 36 ILE H H 36 6.150 6.150 7.679 -1.529 17919 68431 1 167 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.507 0.127 17919 68432 1 167 . 1 1 37 37 PRO C C 37 176.940 176.940 176.031 0.909 17919 68433 1 167 . 1 1 37 37 PRO CA C 37 61.660 61.660 62.075 -0.415 17919 68434 1 167 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.084 0.766 17919 68435 1 167 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.168 -0.051 17919 68436 1 167 . 1 1 38 38 PRO C C 38 178.320 178.320 178.562 -0.242 17919 68437 1 167 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.908 0.352 17919 68438 1 167 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.851 1.039 17919 68439 1 167 . 1 1 39 39 ASP N N 39 113.380 113.380 114.156 -0.776 17919 68440 1 167 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.425 0.005 17919 68441 1 167 . 1 1 39 39 ASP C C 39 177.090 177.090 177.076 0.014 17919 68442 1 167 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.131 -0.491 17919 68443 1 167 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.277 -0.737 17919 68444 1 167 . 1 1 39 39 ASP H H 39 8.550 8.550 8.766 -0.216 17919 68445 1 167 . 1 1 40 40 GLN N N 40 116.780 116.780 117.079 -0.299 17919 68446 1 167 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.250 0.214 17919 68447 1 167 . 1 1 40 40 GLN C C 40 175.380 175.380 176.655 -1.275 17919 68448 1 167 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.048 -0.408 17919 68449 1 167 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.763 0.377 17919 68450 1 167 . 1 1 40 40 GLN H H 40 7.820 7.820 7.773 0.047 17919 68451 1 167 . 1 1 41 41 GLN N N 41 117.720 117.720 118.922 -1.202 17919 68452 1 167 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.428 -0.184 17919 68453 1 167 . 1 1 41 41 GLN C C 41 176.300 176.300 175.425 0.875 17919 68454 1 167 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.698 -0.228 17919 68455 1 167 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.745 1.905 17919 68456 1 167 . 1 1 41 41 GLN H H 41 7.480 7.480 7.394 0.086 17919 68457 1 167 . 1 1 42 42 ARG N N 42 122.680 122.680 120.552 2.128 17919 68458 1 167 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.674 -0.174 17919 68459 1 167 . 1 1 42 42 ARG C C 42 174.050 174.050 174.098 -0.048 17919 68460 1 167 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.117 0.933 17919 68461 1 167 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.790 -1.040 17919 68462 1 167 . 1 1 42 42 ARG H H 42 8.530 8.530 8.688 -0.158 17919 68463 1 167 . 1 1 43 43 LEU N N 43 124.040 124.040 124.216 -0.176 17919 68464 1 167 . 1 1 43 43 LEU C C 43 175.290 175.290 175.632 -0.342 17919 68465 1 167 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.389 -1.409 17919 68466 1 167 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.707 2.083 17919 68467 1 167 . 1 1 43 43 LEU H H 43 8.820 8.820 8.911 -0.091 17919 68468 1 167 . 1 1 44 44 ILE N N 44 121.920 121.920 122.809 -0.889 17919 68469 1 167 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.928 0.064 17919 68470 1 167 . 1 1 44 44 ILE C C 44 176.060 176.060 174.244 1.816 17919 68471 1 167 . 1 1 44 44 ILE CA C 44 58.980 58.980 58.929 0.051 17919 68472 1 167 . 1 1 44 44 ILE CB C 44 41.420 41.420 39.464 1.956 17919 68473 1 167 . 1 1 44 44 ILE H H 44 9.030 9.030 8.993 0.037 17919 68474 1 167 . 1 1 45 45 PHE N N 45 125.390 125.390 127.919 -2.529 17919 68475 1 167 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.993 0.052 17919 68476 1 167 . 1 1 45 45 PHE C C 45 174.470 174.470 174.503 -0.033 17919 68477 1 167 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.308 0.712 17919 68478 1 167 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.709 1.051 17919 68479 1 167 . 1 1 45 45 PHE H H 45 8.830 8.830 9.042 -0.212 17919 68480 1 167 . 1 1 46 46 ALA N N 46 132.200 132.200 130.796 1.404 17919 68481 1 167 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.645 0.045 17919 68482 1 167 . 1 1 46 46 ALA C C 46 177.290 177.290 177.579 -0.289 17919 68483 1 167 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.455 0.085 17919 68484 1 167 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.179 0.391 17919 68485 1 167 . 1 1 46 46 ALA H H 46 8.810 8.810 9.052 -0.242 17919 68486 1 167 . 1 1 47 47 GLY N N 47 102.340 102.340 103.940 -1.600 17919 68487 1 167 . 1 1 47 47 GLY C C 47 173.810 173.810 174.176 -0.366 17919 68488 1 167 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.940 0.410 17919 68489 1 167 . 1 1 47 47 GLY H H 47 8.130 8.130 8.514 -0.384 17919 68490 1 167 . 1 1 48 48 LYS N N 48 121.570 121.570 121.843 -0.273 17919 68491 1 167 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.577 0.045 17919 68492 1 167 . 1 1 48 48 LYS C C 48 174.700 174.700 175.128 -0.428 17919 68493 1 167 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.169 -0.619 17919 68494 1 167 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.445 0.085 17919 68495 1 167 . 1 1 48 48 LYS H H 48 7.980 7.980 7.856 0.124 17919 68496 1 167 . 1 1 49 49 GLN N N 49 122.410 122.410 125.785 -3.375 17919 68497 1 167 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.709 -0.149 17919 68498 1 167 . 1 1 49 49 GLN C C 49 175.670 175.670 175.570 0.100 17919 68499 1 167 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.718 0.022 17919 68500 1 167 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.760 -0.760 17919 68501 1 167 . 1 1 49 49 GLN H H 49 8.600 8.600 8.641 -0.041 17919 68502 1 167 . 1 1 50 50 LEU N N 50 125.520 125.520 127.833 -2.313 17919 68503 1 167 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.399 -0.309 17919 68504 1 167 . 1 1 50 50 LEU C C 50 176.660 176.660 176.303 0.357 17919 68505 1 167 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.352 -0.112 17919 68506 1 167 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.224 -0.654 17919 68507 1 167 . 1 1 50 50 LEU H H 50 8.530 8.530 8.804 -0.274 17919 68508 1 167 . 1 1 51 51 GLU N N 51 122.940 122.940 121.432 1.508 17919 68509 1 167 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.592 -0.104 17919 68510 1 167 . 1 1 51 51 GLU C C 51 175.870 175.870 176.493 -0.623 17919 68511 1 167 . 1 1 51 51 GLU CA C 51 55.960 55.960 54.694 1.266 17919 68512 1 167 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.183 0.387 17919 68513 1 167 . 1 1 51 51 GLU H H 51 8.400 8.400 9.031 -0.631 17919 68514 1 167 . 1 1 52 52 ASP N N 52 120.030 120.030 125.259 -5.229 17919 68515 1 167 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.371 -0.012 17919 68516 1 167 . 1 1 52 52 ASP C C 52 177.330 177.330 177.641 -0.311 17919 68517 1 167 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.705 -0.745 17919 68518 1 167 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.715 0.135 17919 68519 1 167 . 1 1 52 52 ASP H H 52 8.160 8.160 8.856 -0.696 17919 68520 1 167 . 1 1 53 53 GLY N N 53 106.660 106.660 104.518 2.142 17919 68521 1 167 . 1 1 53 53 GLY C C 53 174.870 174.870 174.589 0.281 17919 68522 1 167 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.961 0.209 17919 68523 1 167 . 1 1 53 53 GLY H H 53 9.390 9.390 8.481 0.909 17919 68524 1 167 . 1 1 54 54 ARG N N 54 119.050 119.050 120.141 -1.091 17919 68525 1 167 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.769 -0.074 17919 68526 1 167 . 1 1 54 54 ARG C C 54 175.350 175.350 175.553 -0.203 17919 68527 1 167 . 1 1 54 54 ARG CA C 54 54.390 54.390 53.346 1.044 17919 68528 1 167 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.014 -0.364 17919 68529 1 167 . 1 1 54 54 ARG H H 54 7.460 7.460 7.797 -0.337 17919 68530 1 167 . 1 1 55 55 THR N N 55 108.400 108.400 111.906 -3.506 17919 68531 1 167 . 1 1 55 55 THR HA H 55 5.240 5.240 5.168 0.072 17919 68532 1 167 . 1 1 55 55 THR C C 55 176.560 176.560 176.393 0.167 17919 68533 1 167 . 1 1 55 55 THR CA C 55 59.690 59.690 59.997 -0.307 17919 68534 1 167 . 1 1 55 55 THR CB C 55 72.260 72.260 71.355 0.905 17919 68535 1 167 . 1 1 55 55 THR H H 55 8.730 8.730 8.954 -0.224 17919 68536 1 167 . 1 1 56 56 LEU N N 56 117.920 117.920 121.871 -3.951 17919 68537 1 167 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.996 0.064 17919 68538 1 167 . 1 1 56 56 LEU C C 56 180.810 180.810 179.017 1.793 17919 68539 1 167 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.320 0.390 17919 68540 1 167 . 1 1 56 56 LEU CB C 56 40.370 40.370 40.273 0.097 17919 68541 1 167 . 1 1 56 56 LEU H H 56 8.140 8.140 8.590 -0.450 17919 68542 1 167 . 1 1 57 57 SER N N 57 113.330 113.330 114.022 -0.692 17919 68543 1 167 . 1 1 57 57 SER HA H 57 4.370 4.370 4.163 0.207 17919 68544 1 167 . 1 1 57 57 SER C C 57 178.310 178.310 177.078 1.232 17919 68545 1 167 . 1 1 57 57 SER CA C 57 61.080 61.080 61.602 -0.522 17919 68546 1 167 . 1 1 57 57 SER CB C 57 62.530 62.530 62.356 0.174 17919 68547 1 167 . 1 1 57 57 SER H H 57 8.470 8.470 8.293 0.177 17919 68548 1 167 . 1 1 58 58 ASP N N 58 124.190 124.190 122.893 1.297 17919 68549 1 167 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.359 -0.063 17919 68550 1 167 . 1 1 58 58 ASP C C 58 177.400 177.400 177.236 0.164 17919 68551 1 167 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.726 0.454 17919 68552 1 167 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.396 -0.296 17919 68553 1 167 . 1 1 58 58 ASP H H 58 7.930 7.930 7.686 0.244 17919 68554 1 167 . 1 1 59 59 TYR N N 59 115.510 115.510 116.008 -0.498 17919 68555 1 167 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.622 0.048 17919 68556 1 167 . 1 1 59 59 TYR C C 59 174.700 174.700 175.076 -0.376 17919 68557 1 167 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.427 0.823 17919 68558 1 167 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.212 1.858 17919 68559 1 167 . 1 1 59 59 TYR H H 59 7.250 7.250 7.475 -0.225 17919 68560 1 167 . 1 1 60 60 ASN N N 60 115.900 115.900 117.498 -1.598 17919 68561 1 167 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.329 0.026 17919 68562 1 167 . 1 1 60 60 ASN C C 60 174.340 174.340 174.401 -0.061 17919 68563 1 167 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.364 -0.244 17919 68564 1 167 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.508 -0.098 17919 68565 1 167 . 1 1 60 60 ASN H H 60 8.150 8.150 7.747 0.403 17919 68566 1 167 . 1 1 61 61 ILE N N 61 118.600 118.600 119.814 -1.214 17919 68567 1 167 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.584 -0.191 17919 68568 1 167 . 1 1 61 61 ILE C C 61 174.610 174.610 174.990 -0.380 17919 68569 1 167 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.199 0.221 17919 68570 1 167 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.867 -1.127 17919 68571 1 167 . 1 1 61 61 ILE H H 61 7.250 7.250 7.968 -0.718 17919 68572 1 167 . 1 1 62 62 GLN N N 62 124.740 124.740 125.204 -0.464 17919 68573 1 167 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.807 -0.301 17919 68574 1 167 . 1 1 62 62 GLN C C 62 175.970 175.970 175.645 0.325 17919 68575 1 167 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.504 0.156 17919 68576 1 167 . 1 1 62 62 GLN CB C 62 31.650 31.650 32.732 -1.082 17919 68577 1 167 . 1 1 62 62 GLN H H 62 7.610 7.610 7.900 -0.290 17919 68578 1 167 . 1 1 63 63 LYS N N 63 120.300 120.300 121.562 -1.262 17919 68579 1 167 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.144 -0.143 17919 68580 1 167 . 1 1 63 63 LYS C C 63 175.810 175.810 176.940 -1.130 17919 68581 1 167 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.619 0.171 17919 68582 1 167 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.554 1.096 17919 68583 1 167 . 1 1 63 63 LYS H H 63 8.490 8.490 8.748 -0.258 17919 68584 1 167 . 1 1 64 64 GLU N N 64 113.950 113.950 120.303 -6.353 17919 68585 1 167 . 1 1 64 64 GLU HA H 64 3.465 3.465 4.038 -0.573 17919 68586 1 167 . 1 1 64 64 GLU C C 64 175.250 175.250 176.654 -1.404 17919 68587 1 167 . 1 1 64 64 GLU CA C 64 57.890 57.890 58.088 -0.198 17919 68588 1 167 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.406 -2.506 17919 68589 1 167 . 1 1 64 64 GLU H H 64 9.280 9.280 9.185 0.095 17919 68590 1 167 . 1 1 65 65 SER N N 65 114.730 114.730 115.040 -0.310 17919 68591 1 167 . 1 1 65 65 SER HA H 65 4.640 4.640 4.456 0.184 17919 68592 1 167 . 1 1 65 65 SER C C 65 172.160 172.160 173.910 -1.750 17919 68593 1 167 . 1 1 65 65 SER CA C 65 60.890 60.890 60.779 0.111 17919 68594 1 167 . 1 1 65 65 SER CB C 65 64.910 64.910 64.000 0.910 17919 68595 1 167 . 1 1 65 65 SER H H 65 7.670 7.670 7.779 -0.109 17919 68596 1 167 . 1 1 66 66 THR N N 66 117.110 117.110 118.978 -1.868 17919 68597 1 167 . 1 1 66 66 THR HA H 66 5.270 5.270 5.250 0.020 17919 68598 1 167 . 1 1 66 66 THR C C 66 173.950 173.950 174.020 -0.070 17919 68599 1 167 . 1 1 66 66 THR CA C 66 62.340 62.340 61.740 0.600 17919 68600 1 167 . 1 1 66 66 THR CB C 66 70.080 70.080 70.062 0.018 17919 68601 1 167 . 1 1 66 66 THR H H 66 8.730 8.730 8.198 0.532 17919 68602 1 167 . 1 1 67 67 LEU N N 67 127.110 127.110 127.204 -0.094 17919 68603 1 167 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.873 0.187 17919 68604 1 167 . 1 1 67 67 LEU C C 67 175.770 175.770 175.122 0.648 17919 68605 1 167 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.025 -0.125 17919 68606 1 167 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.305 -0.045 17919 68607 1 167 . 1 1 67 67 LEU H H 67 9.410 9.410 9.284 0.126 17919 68608 1 167 . 1 1 68 68 HIS N N 68 118.380 118.380 122.373 -3.993 17919 68609 1 167 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.217 0.023 17919 68610 1 167 . 1 1 68 68 HIS C C 68 173.150 173.150 173.508 -0.358 17919 68611 1 167 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.594 0.406 17919 68612 1 167 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.797 -2.267 17919 68613 1 167 . 1 1 68 68 HIS H H 68 9.230 9.230 9.047 0.183 17919 68614 1 167 . 1 1 69 69 LEU N N 69 124.460 124.460 129.807 -5.347 17919 68615 1 167 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.893 0.297 17919 68616 1 167 . 1 1 69 69 LEU C C 69 175.270 175.270 174.152 1.118 17919 68617 1 167 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.621 0.269 17919 68618 1 167 . 1 1 69 69 LEU CB C 69 44.380 44.380 43.859 0.521 17919 68619 1 167 . 1 1 69 69 LEU H H 69 8.340 8.340 7.718 0.622 17919 68620 1 167 . 1 1 70 70 VAL N N 70 126.940 126.940 125.346 1.594 17919 68621 1 167 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.429 -0.079 17919 68622 1 167 . 1 1 70 70 VAL C C 70 174.000 174.000 174.532 -0.532 17919 68623 1 167 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.266 0.534 17919 68624 1 167 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.388 -0.478 17919 68625 1 167 . 1 1 70 70 VAL H H 70 9.200 9.200 8.675 0.525 17919 68626 1 167 . 1 1 71 71 LEU N N 71 123.130 123.130 124.269 -1.139 17919 68627 1 167 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.933 0.127 17919 68628 1 167 . 1 1 71 71 LEU C C 71 177.830 177.830 176.277 1.553 17919 68629 1 167 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.137 0.803 17919 68630 1 167 . 1 1 71 71 LEU CB C 71 42.850 42.850 44.186 -1.336 17919 68631 1 167 . 1 1 71 71 LEU H H 71 8.120 8.120 8.383 -0.263 17919 68632 1 167 . 1 1 72 72 ARG N N 72 123.490 123.490 126.540 -3.050 17919 68633 1 167 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.207 0.094 17919 68634 1 167 . 1 1 72 72 ARG C C 72 175.350 175.350 175.005 0.345 17919 68635 1 167 . 1 1 72 72 ARG CA C 72 55.610 55.610 57.236 -1.627 17919 68636 1 167 . 1 1 72 72 ARG CB C 72 31.350 31.350 29.794 1.556 17919 68637 1 167 . 1 1 72 72 ARG H H 72 8.580 8.580 8.642 -0.062 17919 68638 1 168 . 1 1 2 2 GLN N N 2 123.220 123.220 121.415 1.805 17919 68639 1 168 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.175 0.074 17919 68640 1 168 . 1 1 2 2 GLN C C 2 175.920 175.920 174.421 1.499 17919 68641 1 168 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.304 0.776 17919 68642 1 168 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.851 -0.091 17919 68643 1 168 . 1 1 2 2 GLN H H 2 8.900 8.900 8.353 0.547 17919 68644 1 168 . 1 1 3 3 ILE N N 3 115.340 115.340 118.737 -3.397 17919 68645 1 168 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.374 -0.161 17919 68646 1 168 . 1 1 3 3 ILE C C 3 172.450 172.450 173.262 -0.812 17919 68647 1 168 . 1 1 3 3 ILE CA C 3 59.570 59.570 58.881 0.689 17919 68648 1 168 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.892 0.318 17919 68649 1 168 . 1 1 3 3 ILE H H 3 8.320 8.320 8.890 -0.570 17919 68650 1 168 . 1 1 4 4 PHE N N 4 118.110 118.110 118.910 -0.800 17919 68651 1 168 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.556 0.074 17919 68652 1 168 . 1 1 4 4 PHE C C 4 175.320 175.320 175.330 -0.010 17919 68653 1 168 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.497 -0.287 17919 68654 1 168 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.933 -0.453 17919 68655 1 168 . 1 1 4 4 PHE H H 4 8.610 8.610 7.933 0.677 17919 68656 1 168 . 1 1 5 5 VAL N N 5 121.000 121.000 121.963 -0.963 17919 68657 1 168 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.604 0.121 17919 68658 1 168 . 1 1 5 5 VAL C C 5 174.870 174.870 174.855 0.015 17919 68659 1 168 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.253 -0.633 17919 68660 1 168 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.850 -0.620 17919 68661 1 168 . 1 1 5 5 VAL H H 5 9.300 9.300 9.242 0.058 17919 68662 1 168 . 1 1 6 6 LYS N N 6 127.520 127.520 127.571 -0.051 17919 68663 1 168 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.412 -0.045 17919 68664 1 168 . 1 1 6 6 LYS C C 6 177.140 177.140 176.771 0.369 17919 68665 1 168 . 1 1 6 6 LYS CA C 6 54.520 54.520 55.043 -0.523 17919 68666 1 168 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.046 0.004 17919 68667 1 168 . 1 1 6 6 LYS H H 6 8.820 8.820 9.234 -0.414 17919 68668 1 168 . 1 1 7 7 THR N N 7 115.400 115.400 115.532 -0.132 17919 68669 1 168 . 1 1 7 7 THR HA H 7 4.970 4.970 4.722 0.248 17919 68670 1 168 . 1 1 7 7 THR C C 7 176.910 176.910 177.125 -0.215 17919 68671 1 168 . 1 1 7 7 THR CA C 7 60.470 60.470 60.596 -0.126 17919 68672 1 168 . 1 1 7 7 THR CB C 7 70.630 70.630 70.465 0.165 17919 68673 1 168 . 1 1 7 7 THR H H 7 8.730 8.730 9.011 -0.281 17919 68674 1 168 . 1 1 8 8 LEU N N 8 121.330 121.330 118.672 2.658 17919 68675 1 168 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.245 0.065 17919 68676 1 168 . 1 1 8 8 LEU C C 8 178.800 178.800 177.119 1.681 17919 68677 1 168 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.877 -0.297 17919 68678 1 168 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.308 0.662 17919 68679 1 168 . 1 1 8 8 LEU H H 8 9.100 9.100 8.535 0.565 17919 68680 1 168 . 1 1 9 9 THR N N 9 105.590 105.590 107.783 -2.193 17919 68681 1 168 . 1 1 9 9 THR HA H 9 4.428 4.428 4.340 0.088 17919 68682 1 168 . 1 1 9 9 THR C C 9 175.520 175.520 175.540 -0.020 17919 68683 1 168 . 1 1 9 9 THR CA C 9 61.400 61.400 61.551 -0.151 17919 68684 1 168 . 1 1 9 9 THR CB C 9 69.140 69.140 68.325 0.815 17919 68685 1 168 . 1 1 9 9 THR H H 9 7.630 7.630 7.493 0.137 17919 68686 1 168 . 1 1 10 10 GLY N N 10 108.890 108.890 111.900 -3.010 17919 68687 1 168 . 1 1 10 10 GLY C C 10 174.070 174.070 173.154 0.916 17919 68688 1 168 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.420 0.040 17919 68689 1 168 . 1 1 10 10 GLY H H 10 7.810 7.810 8.030 -0.220 17919 68690 1 168 . 1 1 11 11 LYS N N 11 121.600 121.600 118.300 3.300 17919 68691 1 168 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.771 -0.410 17919 68692 1 168 . 1 1 11 11 LYS C C 11 175.940 175.940 175.057 0.883 17919 68693 1 168 . 1 1 11 11 LYS CA C 11 56.280 56.280 54.419 1.861 17919 68694 1 168 . 1 1 11 11 LYS CB C 11 33.200 33.200 35.266 -2.066 17919 68695 1 168 . 1 1 11 11 LYS H H 11 7.280 7.280 7.643 -0.363 17919 68696 1 168 . 1 1 12 12 THR N N 12 120.440 120.440 117.748 2.692 17919 68697 1 168 . 1 1 12 12 THR HA H 12 5.046 5.046 5.304 -0.258 17919 68698 1 168 . 1 1 12 12 THR C C 12 174.320 174.320 174.377 -0.057 17919 68699 1 168 . 1 1 12 12 THR CA C 12 62.390 62.390 61.844 0.546 17919 68700 1 168 . 1 1 12 12 THR CB C 12 69.910 69.910 70.091 -0.181 17919 68701 1 168 . 1 1 12 12 THR H H 12 8.650 8.650 8.395 0.255 17919 68702 1 168 . 1 1 13 13 ILE N N 13 127.110 127.110 127.288 -0.178 17919 68703 1 168 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.373 0.171 17919 68704 1 168 . 1 1 13 13 ILE C C 13 175.220 175.220 175.249 -0.029 17919 68705 1 168 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.759 -0.779 17919 68706 1 168 . 1 1 13 13 ILE CB C 13 40.950 40.950 39.674 1.276 17919 68707 1 168 . 1 1 13 13 ILE H H 13 9.450 9.450 9.267 0.183 17919 68708 1 168 . 1 1 14 14 THR N N 14 121.520 121.520 122.189 -0.669 17919 68709 1 168 . 1 1 14 14 THR HA H 14 4.964 4.964 5.046 -0.082 17919 68710 1 168 . 1 1 14 14 THR C C 14 173.790 173.790 173.399 0.391 17919 68711 1 168 . 1 1 14 14 THR CA C 14 61.940 61.940 61.825 0.115 17919 68712 1 168 . 1 1 14 14 THR CB C 14 69.650 69.650 70.052 -0.402 17919 68713 1 168 . 1 1 14 14 THR H H 14 8.710 8.710 8.508 0.202 17919 68714 1 168 . 1 1 15 15 LEU N N 15 124.800 124.800 128.130 -3.330 17919 68715 1 168 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.749 0.031 17919 68716 1 168 . 1 1 15 15 LEU C C 15 174.670 174.670 174.282 0.388 17919 68717 1 168 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.479 -0.649 17919 68718 1 168 . 1 1 15 15 LEU CB C 15 47.070 47.070 46.593 0.477 17919 68719 1 168 . 1 1 15 15 LEU H H 15 8.710 8.710 9.076 -0.366 17919 68720 1 168 . 1 1 16 16 GLU N N 16 122.160 122.160 125.657 -3.497 17919 68721 1 168 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.420 -0.503 17919 68722 1 168 . 1 1 16 16 GLU C C 16 175.860 175.860 175.424 0.436 17919 68723 1 168 . 1 1 16 16 GLU CA C 16 54.820 54.820 54.879 -0.059 17919 68724 1 168 . 1 1 16 16 GLU CB C 16 29.450 29.450 31.597 -2.147 17919 68725 1 168 . 1 1 16 16 GLU H H 16 8.140 8.140 8.543 -0.403 17919 68726 1 168 . 1 1 17 17 VAL N N 17 117.210 117.210 122.091 -4.881 17919 68727 1 168 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.701 0.013 17919 68728 1 168 . 1 1 17 17 VAL C C 17 174.160 174.160 174.519 -0.359 17919 68729 1 168 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.642 -1.212 17919 68730 1 168 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.697 0.703 17919 68731 1 168 . 1 1 17 17 VAL H H 17 8.900 8.900 8.432 0.468 17919 68732 1 168 . 1 1 18 18 GLU N N 18 118.990 118.990 120.425 -1.435 17919 68733 1 168 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.873 0.206 17919 68734 1 168 . 1 1 18 18 GLU C C 18 176.160 176.160 175.614 0.546 17919 68735 1 168 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.843 -0.123 17919 68736 1 168 . 1 1 18 18 GLU CB C 18 30.310 30.310 31.122 -0.812 17919 68737 1 168 . 1 1 18 18 GLU H H 18 8.640 8.640 8.474 0.166 17919 68738 1 168 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.300 -0.159 17919 68739 1 168 . 1 1 19 19 PRO C C 19 175.310 175.310 177.385 -2.075 17919 68740 1 168 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.457 0.013 17919 68741 1 168 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.078 -0.128 17919 68742 1 168 . 1 1 20 20 SER N N 20 103.400 103.400 109.322 -5.922 17919 68743 1 168 . 1 1 20 20 SER HA H 20 4.370 4.370 4.461 -0.091 17919 68744 1 168 . 1 1 20 20 SER C C 20 174.660 174.660 174.672 -0.012 17919 68745 1 168 . 1 1 20 20 SER CA C 20 57.400 57.400 58.939 -1.539 17919 68746 1 168 . 1 1 20 20 SER CB C 20 63.370 63.370 62.994 0.376 17919 68747 1 168 . 1 1 20 20 SER H H 20 7.040 7.040 8.020 -0.980 17919 68748 1 168 . 1 1 21 21 ASP N N 21 123.480 123.480 123.763 -0.283 17919 68749 1 168 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.715 -0.020 17919 68750 1 168 . 1 1 21 21 ASP C C 21 176.360 176.360 175.602 0.758 17919 68751 1 168 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.371 0.329 17919 68752 1 168 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.518 -0.718 17919 68753 1 168 . 1 1 21 21 ASP H H 21 8.030 8.030 7.886 0.144 17919 68754 1 168 . 1 1 22 22 THR N N 22 108.800 108.800 110.298 -1.498 17919 68755 1 168 . 1 1 22 22 THR HA H 22 4.920 4.920 4.575 0.345 17919 68756 1 168 . 1 1 22 22 THR C C 22 176.750 176.750 176.066 0.684 17919 68757 1 168 . 1 1 22 22 THR CA C 22 59.690 59.690 60.828 -1.138 17919 68758 1 168 . 1 1 22 22 THR CB C 22 71.200 71.200 70.798 0.402 17919 68759 1 168 . 1 1 22 22 THR H H 22 7.900 7.900 8.165 -0.265 17919 68760 1 168 . 1 1 23 23 ILE N N 23 121.190 121.190 121.825 -0.635 17919 68761 1 168 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.781 -0.124 17919 68762 1 168 . 1 1 23 23 ILE C C 23 179.040 179.040 177.545 1.495 17919 68763 1 168 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.919 -0.659 17919 68764 1 168 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.570 -2.220 17919 68765 1 168 . 1 1 23 23 ILE H H 23 8.560 8.560 8.546 0.014 17919 68766 1 168 . 1 1 24 24 GLU N N 24 120.830 120.830 120.948 -0.118 17919 68767 1 168 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.836 0.081 17919 68768 1 168 . 1 1 24 24 GLU C C 24 178.640 178.640 178.627 0.013 17919 68769 1 168 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.031 0.189 17919 68770 1 168 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.310 -1.030 17919 68771 1 168 . 1 1 24 24 GLU H H 24 9.760 9.760 7.845 1.915 17919 68772 1 168 . 1 1 25 25 ASN N N 25 120.570 120.570 117.344 3.226 17919 68773 1 168 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.550 -0.025 17919 68774 1 168 . 1 1 25 25 ASN C C 25 178.380 178.380 177.765 0.615 17919 68775 1 168 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.930 0.130 17919 68776 1 168 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.576 -0.126 17919 68777 1 168 . 1 1 25 25 ASN H H 25 7.920 7.920 7.528 0.392 17919 68778 1 168 . 1 1 26 26 VAL N N 26 121.710 121.710 119.488 2.222 17919 68779 1 168 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.684 -0.287 17919 68780 1 168 . 1 1 26 26 VAL C C 26 177.950 177.950 178.018 -0.068 17919 68781 1 168 . 1 1 26 26 VAL CA C 26 67.660 67.660 65.958 1.702 17919 68782 1 168 . 1 1 26 26 VAL CB C 26 30.840 30.840 30.804 0.036 17919 68783 1 168 . 1 1 26 26 VAL H H 26 8.070 8.070 7.711 0.359 17919 68784 1 168 . 1 1 27 27 LYS N N 27 118.860 118.860 119.988 -1.128 17919 68785 1 168 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.242 0.338 17919 68786 1 168 . 1 1 27 27 LYS C C 27 180.550 180.550 179.043 1.507 17919 68787 1 168 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.357 -0.107 17919 68788 1 168 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.211 1.519 17919 68789 1 168 . 1 1 27 27 LYS H H 27 8.560 8.560 7.942 0.618 17919 68790 1 168 . 1 1 28 28 ALA N N 28 123.440 123.440 122.906 0.534 17919 68791 1 168 . 1 1 28 28 ALA HA H 28 4.160 4.160 3.979 0.181 17919 68792 1 168 . 1 1 28 28 ALA C C 28 180.300 180.300 179.159 1.141 17919 68793 1 168 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.184 0.186 17919 68794 1 168 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.317 -0.607 17919 68795 1 168 . 1 1 28 28 ALA H H 28 8.060 8.060 8.364 -0.304 17919 68796 1 168 . 1 1 29 29 LYS N N 29 119.940 119.940 118.923 1.017 17919 68797 1 168 . 1 1 29 29 LYS HA H 29 4.207 4.207 3.993 0.214 17919 68798 1 168 . 1 1 29 29 LYS C C 29 180.320 180.320 179.268 1.052 17919 68799 1 168 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.505 0.145 17919 68800 1 168 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.363 0.927 17919 68801 1 168 . 1 1 29 29 LYS H H 29 7.850 7.850 8.161 -0.311 17919 68802 1 168 . 1 1 30 30 ILE N N 30 121.080 121.080 119.702 1.378 17919 68803 1 168 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.702 -0.195 17919 68804 1 168 . 1 1 30 30 ILE C C 30 178.310 178.310 177.569 0.741 17919 68805 1 168 . 1 1 30 30 ILE CA C 30 66.150 66.150 64.217 1.933 17919 68806 1 168 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.742 -0.942 17919 68807 1 168 . 1 1 30 30 ILE H H 30 8.280 8.280 7.548 0.732 17919 68808 1 168 . 1 1 31 31 GLN N N 31 123.490 123.490 120.708 2.782 17919 68809 1 168 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.878 -0.049 17919 68810 1 168 . 1 1 31 31 GLN C C 31 178.890 178.890 178.174 0.716 17919 68811 1 168 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.510 0.490 17919 68812 1 168 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.376 -0.656 17919 68813 1 168 . 1 1 31 31 GLN H H 31 8.580 8.580 7.925 0.655 17919 68814 1 168 . 1 1 32 32 ASP N N 32 119.360 119.360 119.082 0.278 17919 68815 1 168 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.389 -0.035 17919 68816 1 168 . 1 1 32 32 ASP C C 32 177.250 177.250 177.857 -0.607 17919 68817 1 168 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.864 0.326 17919 68818 1 168 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.849 -0.269 17919 68819 1 168 . 1 1 32 32 ASP H H 32 8.010 8.010 7.815 0.195 17919 68820 1 168 . 1 1 33 33 LYS N N 33 115.130 115.130 117.054 -1.924 17919 68821 1 168 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.362 -0.025 17919 68822 1 168 . 1 1 33 33 LYS C C 33 177.870 177.870 177.991 -0.121 17919 68823 1 168 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.739 0.311 17919 68824 1 168 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.873 0.297 17919 68825 1 168 . 1 1 33 33 LYS H H 33 7.430 7.430 7.769 -0.339 17919 68826 1 168 . 1 1 34 34 GLU N N 34 113.870 113.870 116.505 -2.635 17919 68827 1 168 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.432 0.193 17919 68828 1 168 . 1 1 34 34 GLU C C 34 177.840 177.840 177.223 0.617 17919 68829 1 168 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.436 -1.266 17919 68830 1 168 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.268 1.392 17919 68831 1 168 . 1 1 34 34 GLU H H 34 8.740 8.740 7.954 0.786 17919 68832 1 168 . 1 1 35 35 GLY N N 35 108.650 108.650 109.352 -0.702 17919 68833 1 168 . 1 1 35 35 GLY C C 35 173.960 173.960 174.338 -0.378 17919 68834 1 168 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.891 0.189 17919 68835 1 168 . 1 1 35 35 GLY H H 35 8.530 8.530 8.188 0.342 17919 68836 1 168 . 1 1 36 36 ILE N N 36 119.880 119.880 121.547 -1.667 17919 68837 1 168 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.283 0.162 17919 68838 1 168 . 1 1 36 36 ILE C C 36 173.590 173.590 173.787 -0.197 17919 68839 1 168 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.155 -0.405 17919 68840 1 168 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.081 2.499 17919 68841 1 168 . 1 1 36 36 ILE H H 36 6.150 6.150 7.718 -1.568 17919 68842 1 168 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.850 -0.216 17919 68843 1 168 . 1 1 37 37 PRO C C 37 176.940 176.940 176.752 0.188 17919 68844 1 168 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.431 0.230 17919 68845 1 168 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.627 0.223 17919 68846 1 168 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.224 -0.107 17919 68847 1 168 . 1 1 38 38 PRO C C 38 178.320 178.320 177.958 0.362 17919 68848 1 168 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.394 0.866 17919 68849 1 168 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.715 1.175 17919 68850 1 168 . 1 1 39 39 ASP N N 39 113.380 113.380 117.471 -4.091 17919 68851 1 168 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.407 0.023 17919 68852 1 168 . 1 1 39 39 ASP C C 39 177.090 177.090 177.274 -0.184 17919 68853 1 168 . 1 1 39 39 ASP CA C 39 55.640 55.640 57.291 -1.651 17919 68854 1 168 . 1 1 39 39 ASP CB C 39 39.540 39.540 39.629 -0.089 17919 68855 1 168 . 1 1 39 39 ASP H H 39 8.550 8.550 8.751 -0.201 17919 68856 1 168 . 1 1 40 40 GLN N N 40 116.780 116.780 116.086 0.694 17919 68857 1 168 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.642 -0.178 17919 68858 1 168 . 1 1 40 40 GLN C C 40 175.380 175.380 175.934 -0.554 17919 68859 1 168 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.888 -0.248 17919 68860 1 168 . 1 1 40 40 GLN CB C 40 30.140 30.140 30.479 -0.339 17919 68861 1 168 . 1 1 40 40 GLN H H 40 7.820 7.820 7.921 -0.101 17919 68862 1 168 . 1 1 41 41 GLN N N 41 117.720 117.720 119.060 -1.340 17919 68863 1 168 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.617 -0.373 17919 68864 1 168 . 1 1 41 41 GLN C C 41 176.300 176.300 175.547 0.753 17919 68865 1 168 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.793 0.677 17919 68866 1 168 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.858 1.792 17919 68867 1 168 . 1 1 41 41 GLN H H 41 7.480 7.480 7.190 0.290 17919 68868 1 168 . 1 1 42 42 ARG N N 42 122.680 122.680 125.815 -3.135 17919 68869 1 168 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.595 -0.095 17919 68870 1 168 . 1 1 42 42 ARG C C 42 174.050 174.050 174.246 -0.196 17919 68871 1 168 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.828 0.222 17919 68872 1 168 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.674 -0.924 17919 68873 1 168 . 1 1 42 42 ARG H H 42 8.530 8.530 9.079 -0.549 17919 68874 1 168 . 1 1 43 43 LEU N N 43 124.040 124.040 127.945 -3.905 17919 68875 1 168 . 1 1 43 43 LEU C C 43 175.290 175.290 175.649 -0.359 17919 68876 1 168 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.143 -1.163 17919 68877 1 168 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.196 2.594 17919 68878 1 168 . 1 1 43 43 LEU H H 43 8.820 8.820 8.853 -0.033 17919 68879 1 168 . 1 1 44 44 ILE N N 44 121.920 121.920 121.862 0.058 17919 68880 1 168 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.764 0.228 17919 68881 1 168 . 1 1 44 44 ILE C C 44 176.060 176.060 175.470 0.590 17919 68882 1 168 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.641 -1.661 17919 68883 1 168 . 1 1 44 44 ILE CB C 44 41.420 41.420 40.700 0.720 17919 68884 1 168 . 1 1 44 44 ILE H H 44 9.030 9.030 8.977 0.053 17919 68885 1 168 . 1 1 45 45 PHE N N 45 125.390 125.390 128.821 -3.431 17919 68886 1 168 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.396 0.649 17919 68887 1 168 . 1 1 45 45 PHE C C 45 174.470 174.470 176.238 -1.768 17919 68888 1 168 . 1 1 45 45 PHE CA C 45 57.020 57.020 59.923 -2.903 17919 68889 1 168 . 1 1 45 45 PHE CB C 45 43.760 43.760 39.966 3.794 17919 68890 1 168 . 1 1 45 45 PHE H H 45 8.830 8.830 8.666 0.164 17919 68891 1 168 . 1 1 46 46 ALA N N 46 132.200 132.200 118.089 14.111 17919 68892 1 168 . 1 1 46 46 ALA HA H 46 3.690 3.690 4.531 -0.841 17919 68893 1 168 . 1 1 46 46 ALA C C 46 177.290 177.290 178.035 -0.745 17919 68894 1 168 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.599 -0.059 17919 68895 1 168 . 1 1 46 46 ALA CB C 46 16.570 16.570 19.520 -2.950 17919 68896 1 168 . 1 1 46 46 ALA H H 46 8.810 8.810 8.343 0.467 17919 68897 1 168 . 1 1 47 47 GLY N N 47 102.340 102.340 106.654 -4.314 17919 68898 1 168 . 1 1 47 47 GLY C C 47 173.810 173.810 173.523 0.287 17919 68899 1 168 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.307 0.042 17919 68900 1 168 . 1 1 47 47 GLY H H 47 8.130 8.130 7.934 0.196 17919 68901 1 168 . 1 1 48 48 LYS N N 48 121.570 121.570 120.962 0.608 17919 68902 1 168 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.662 -0.040 17919 68903 1 168 . 1 1 48 48 LYS C C 48 174.700 174.700 175.035 -0.335 17919 68904 1 168 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.426 -0.876 17919 68905 1 168 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.552 -0.022 17919 68906 1 168 . 1 1 48 48 LYS H H 48 7.980 7.980 7.665 0.315 17919 68907 1 168 . 1 1 49 49 GLN N N 49 122.410 122.410 123.580 -1.170 17919 68908 1 168 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.663 -0.103 17919 68909 1 168 . 1 1 49 49 GLN C C 49 175.670 175.670 175.326 0.344 17919 68910 1 168 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.596 0.145 17919 68911 1 168 . 1 1 49 49 GLN CB C 49 29.000 29.000 28.849 0.152 17919 68912 1 168 . 1 1 49 49 GLN H H 49 8.600 8.600 8.540 0.060 17919 68913 1 168 . 1 1 50 50 LEU N N 50 125.520 125.520 127.163 -1.643 17919 68914 1 168 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.381 -0.291 17919 68915 1 168 . 1 1 50 50 LEU C C 50 176.660 176.660 176.457 0.203 17919 68916 1 168 . 1 1 50 50 LEU CA C 50 54.240 54.240 55.284 -1.044 17919 68917 1 168 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.104 -0.534 17919 68918 1 168 . 1 1 50 50 LEU H H 50 8.530 8.530 8.868 -0.338 17919 68919 1 168 . 1 1 51 51 GLU N N 51 122.940 122.940 122.645 0.295 17919 68920 1 168 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.703 -0.215 17919 68921 1 168 . 1 1 51 51 GLU C C 51 175.870 175.870 177.151 -1.281 17919 68922 1 168 . 1 1 51 51 GLU CA C 51 55.960 55.960 54.568 1.392 17919 68923 1 168 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.791 -1.221 17919 68924 1 168 . 1 1 51 51 GLU H H 51 8.400 8.400 9.161 -0.761 17919 68925 1 168 . 1 1 52 52 ASP N N 52 120.030 120.030 122.137 -2.107 17919 68926 1 168 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.520 -0.161 17919 68927 1 168 . 1 1 52 52 ASP C C 52 177.330 177.330 177.300 0.030 17919 68928 1 168 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.073 -0.113 17919 68929 1 168 . 1 1 52 52 ASP CB C 52 40.850 40.850 41.300 -0.450 17919 68930 1 168 . 1 1 52 52 ASP H H 52 8.160 8.160 8.832 -0.672 17919 68931 1 168 . 1 1 53 53 GLY N N 53 106.660 106.660 105.616 1.044 17919 68932 1 168 . 1 1 53 53 GLY C C 53 174.870 174.870 174.139 0.731 17919 68933 1 168 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.569 0.601 17919 68934 1 168 . 1 1 53 53 GLY H H 53 9.390 9.390 8.395 0.995 17919 68935 1 168 . 1 1 54 54 ARG N N 54 119.050 119.050 121.612 -2.562 17919 68936 1 168 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.627 0.068 17919 68937 1 168 . 1 1 54 54 ARG C C 54 175.350 175.350 175.982 -0.632 17919 68938 1 168 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.938 -0.548 17919 68939 1 168 . 1 1 54 54 ARG CB C 54 32.650 32.650 31.796 0.854 17919 68940 1 168 . 1 1 54 54 ARG H H 54 7.460 7.460 7.437 0.023 17919 68941 1 168 . 1 1 55 55 THR N N 55 108.400 108.400 113.901 -5.501 17919 68942 1 168 . 1 1 55 55 THR HA H 55 5.240 5.240 4.660 0.580 17919 68943 1 168 . 1 1 55 55 THR C C 55 176.560 176.560 175.930 0.630 17919 68944 1 168 . 1 1 55 55 THR CA C 55 59.690 59.690 62.020 -2.330 17919 68945 1 168 . 1 1 55 55 THR CB C 55 72.260 72.260 70.002 2.258 17919 68946 1 168 . 1 1 55 55 THR H H 55 8.730 8.730 8.972 -0.242 17919 68947 1 168 . 1 1 56 56 LEU N N 56 117.920 117.920 122.585 -4.665 17919 68948 1 168 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.148 -0.088 17919 68949 1 168 . 1 1 56 56 LEU C C 56 180.810 180.810 179.012 1.798 17919 68950 1 168 . 1 1 56 56 LEU CA C 56 58.710 58.710 59.280 -0.570 17919 68951 1 168 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.557 -1.187 17919 68952 1 168 . 1 1 56 56 LEU H H 56 8.140 8.140 8.371 -0.231 17919 68953 1 168 . 1 1 57 57 SER N N 57 113.330 113.330 115.563 -2.233 17919 68954 1 168 . 1 1 57 57 SER HA H 57 4.370 4.370 4.148 0.222 17919 68955 1 168 . 1 1 57 57 SER C C 57 178.310 178.310 176.888 1.422 17919 68956 1 168 . 1 1 57 57 SER CA C 57 61.080 61.080 62.104 -1.024 17919 68957 1 168 . 1 1 57 57 SER CB C 57 62.530 62.530 62.640 -0.110 17919 68958 1 168 . 1 1 57 57 SER H H 57 8.470 8.470 8.630 -0.160 17919 68959 1 168 . 1 1 58 58 ASP N N 58 124.190 124.190 121.827 2.363 17919 68960 1 168 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.411 -0.115 17919 68961 1 168 . 1 1 58 58 ASP C C 58 177.400 177.400 177.770 -0.370 17919 68962 1 168 . 1 1 58 58 ASP CA C 58 57.180 57.180 57.034 0.146 17919 68963 1 168 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.379 -0.279 17919 68964 1 168 . 1 1 58 58 ASP H H 58 7.930 7.930 7.925 0.005 17919 68965 1 168 . 1 1 59 59 TYR N N 59 115.510 115.510 116.929 -1.419 17919 68966 1 168 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.522 0.148 17919 68967 1 168 . 1 1 59 59 TYR C C 59 174.700 174.700 174.816 -0.116 17919 68968 1 168 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.715 0.535 17919 68969 1 168 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.471 1.599 17919 68970 1 168 . 1 1 59 59 TYR H H 59 7.250 7.250 7.561 -0.311 17919 68971 1 168 . 1 1 60 60 ASN N N 60 115.900 115.900 115.765 0.135 17919 68972 1 168 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.459 -0.104 17919 68973 1 168 . 1 1 60 60 ASN C C 60 174.340 174.340 174.732 -0.392 17919 68974 1 168 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.452 -0.332 17919 68975 1 168 . 1 1 60 60 ASN CB C 60 37.410 37.410 36.576 0.834 17919 68976 1 168 . 1 1 60 60 ASN H H 60 8.150 8.150 8.053 0.097 17919 68977 1 168 . 1 1 61 61 ILE N N 61 118.600 118.600 119.300 -0.700 17919 68978 1 168 . 1 1 61 61 ILE HA H 61 3.393 3.393 4.042 -0.649 17919 68979 1 168 . 1 1 61 61 ILE C C 61 174.610 174.610 175.400 -0.790 17919 68980 1 168 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.114 0.305 17919 68981 1 168 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.960 -1.220 17919 68982 1 168 . 1 1 61 61 ILE H H 61 7.250 7.250 7.795 -0.545 17919 68983 1 168 . 1 1 62 62 GLN N N 62 124.740 124.740 125.502 -0.762 17919 68984 1 168 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.821 -0.315 17919 68985 1 168 . 1 1 62 62 GLN C C 62 175.970 175.970 175.075 0.895 17919 68986 1 168 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.334 0.326 17919 68987 1 168 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.492 0.158 17919 68988 1 168 . 1 1 62 62 GLN H H 62 7.610 7.610 8.023 -0.413 17919 68989 1 168 . 1 1 63 63 LYS N N 63 120.300 120.300 121.608 -1.308 17919 68990 1 168 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.827 0.174 17919 68991 1 168 . 1 1 63 63 LYS C C 63 175.810 175.810 176.932 -1.122 17919 68992 1 168 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.445 -0.655 17919 68993 1 168 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.355 0.295 17919 68994 1 168 . 1 1 63 63 LYS H H 63 8.490 8.490 8.491 -0.001 17919 68995 1 168 . 1 1 64 64 GLU N N 64 113.950 113.950 118.941 -4.991 17919 68996 1 168 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.560 -0.095 17919 68997 1 168 . 1 1 64 64 GLU C C 64 175.250 175.250 175.558 -0.308 17919 68998 1 168 . 1 1 64 64 GLU CA C 64 57.890 57.890 58.169 -0.279 17919 68999 1 168 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.354 -2.454 17919 69000 1 168 . 1 1 64 64 GLU H H 64 9.280 9.280 8.823 0.457 17919 69001 1 168 . 1 1 65 65 SER N N 65 114.730 114.730 115.972 -1.242 17919 69002 1 168 . 1 1 65 65 SER HA H 65 4.640 4.640 4.363 0.277 17919 69003 1 168 . 1 1 65 65 SER C C 65 172.160 172.160 173.670 -1.510 17919 69004 1 168 . 1 1 65 65 SER CA C 65 60.890 60.890 60.837 0.053 17919 69005 1 168 . 1 1 65 65 SER CB C 65 64.910 64.910 63.791 1.119 17919 69006 1 168 . 1 1 65 65 SER H H 65 7.670 7.670 7.509 0.161 17919 69007 1 168 . 1 1 66 66 THR N N 66 117.110 117.110 119.415 -2.305 17919 69008 1 168 . 1 1 66 66 THR HA H 66 5.270 5.270 5.241 0.029 17919 69009 1 168 . 1 1 66 66 THR C C 66 173.950 173.950 174.300 -0.350 17919 69010 1 168 . 1 1 66 66 THR CA C 66 62.340 62.340 61.792 0.548 17919 69011 1 168 . 1 1 66 66 THR CB C 66 70.080 70.080 70.193 -0.113 17919 69012 1 168 . 1 1 66 66 THR H H 66 8.730 8.730 8.387 0.343 17919 69013 1 168 . 1 1 67 67 LEU N N 67 127.110 127.110 126.121 0.989 17919 69014 1 168 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.707 0.353 17919 69015 1 168 . 1 1 67 67 LEU C C 67 175.770 175.770 175.273 0.497 17919 69016 1 168 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.540 0.360 17919 69017 1 168 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.808 -0.548 17919 69018 1 168 . 1 1 67 67 LEU H H 67 9.410 9.410 8.912 0.498 17919 69019 1 168 . 1 1 68 68 HIS N N 68 118.380 118.380 120.319 -1.939 17919 69020 1 168 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.509 -0.269 17919 69021 1 168 . 1 1 68 68 HIS C C 68 173.150 173.150 173.350 -0.200 17919 69022 1 168 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.676 0.324 17919 69023 1 168 . 1 1 68 68 HIS CB C 68 30.530 30.530 33.166 -2.636 17919 69024 1 168 . 1 1 68 68 HIS H H 68 9.230 9.230 9.149 0.081 17919 69025 1 168 . 1 1 69 69 LEU N N 69 124.460 124.460 128.946 -4.486 17919 69026 1 168 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.132 0.058 17919 69027 1 168 . 1 1 69 69 LEU C C 69 175.270 175.270 173.815 1.455 17919 69028 1 168 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.064 0.826 17919 69029 1 168 . 1 1 69 69 LEU CB C 69 44.380 44.380 45.714 -1.334 17919 69030 1 168 . 1 1 69 69 LEU H H 69 8.340 8.340 8.632 -0.292 17919 69031 1 168 . 1 1 70 70 VAL N N 70 126.940 126.940 121.859 5.081 17919 69032 1 168 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.564 -0.214 17919 69033 1 168 . 1 1 70 70 VAL C C 70 174.000 174.000 173.237 0.763 17919 69034 1 168 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.722 1.078 17919 69035 1 168 . 1 1 70 70 VAL CB C 70 34.910 34.910 36.096 -1.186 17919 69036 1 168 . 1 1 70 70 VAL H H 70 9.200 9.200 8.901 0.299 17919 69037 1 168 . 1 1 71 71 LEU N N 71 123.130 123.130 124.436 -1.306 17919 69038 1 168 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.127 -0.067 17919 69039 1 168 . 1 1 71 71 LEU C C 71 177.830 177.830 176.356 1.474 17919 69040 1 168 . 1 1 71 71 LEU CA C 71 53.940 53.940 54.273 -0.333 17919 69041 1 168 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.056 0.794 17919 69042 1 168 . 1 1 71 71 LEU H H 71 8.120 8.120 8.414 -0.294 17919 69043 1 168 . 1 1 72 72 ARG N N 72 123.490 123.490 129.070 -5.580 17919 69044 1 168 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.669 -0.368 17919 69045 1 168 . 1 1 72 72 ARG C C 72 175.350 175.350 174.340 1.010 17919 69046 1 168 . 1 1 72 72 ARG CA C 72 55.610 55.610 54.489 1.121 17919 69047 1 168 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.530 0.820 17919 69048 1 168 . 1 1 72 72 ARG H H 72 8.580 8.580 9.074 -0.494 17919 69049 1 169 . 1 1 2 2 GLN N N 2 123.220 123.220 119.153 4.067 17919 69050 1 169 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.076 0.173 17919 69051 1 169 . 1 1 2 2 GLN C C 2 175.920 175.920 175.640 0.280 17919 69052 1 169 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.838 0.242 17919 69053 1 169 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.212 0.548 17919 69054 1 169 . 1 1 2 2 GLN H H 2 8.900 8.900 8.230 0.670 17919 69055 1 169 . 1 1 3 3 ILE N N 3 115.340 115.340 116.940 -1.600 17919 69056 1 169 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.517 -0.304 17919 69057 1 169 . 1 1 3 3 ILE C C 3 172.450 172.450 173.741 -1.291 17919 69058 1 169 . 1 1 3 3 ILE CA C 3 59.570 59.570 58.818 0.752 17919 69059 1 169 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.808 0.402 17919 69060 1 169 . 1 1 3 3 ILE H H 3 8.320 8.320 8.860 -0.540 17919 69061 1 169 . 1 1 4 4 PHE N N 4 118.110 118.110 119.427 -1.317 17919 69062 1 169 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.590 0.040 17919 69063 1 169 . 1 1 4 4 PHE C C 4 175.320 175.320 175.070 0.250 17919 69064 1 169 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.033 0.177 17919 69065 1 169 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.587 -0.107 17919 69066 1 169 . 1 1 4 4 PHE H H 4 8.610 8.610 8.771 -0.161 17919 69067 1 169 . 1 1 5 5 VAL N N 5 121.000 121.000 123.636 -2.636 17919 69068 1 169 . 1 1 5 5 VAL HA H 5 4.725 4.725 5.208 -0.483 17919 69069 1 169 . 1 1 5 5 VAL C C 5 174.870 174.870 174.804 0.066 17919 69070 1 169 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.053 -0.434 17919 69071 1 169 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.504 -0.274 17919 69072 1 169 . 1 1 5 5 VAL H H 5 9.300 9.300 9.507 -0.207 17919 69073 1 169 . 1 1 6 6 LYS N N 6 127.520 127.520 127.349 0.171 17919 69074 1 169 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.302 0.065 17919 69075 1 169 . 1 1 6 6 LYS C C 6 177.140 177.140 175.994 1.146 17919 69076 1 169 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.310 0.210 17919 69077 1 169 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.539 -0.490 17919 69078 1 169 . 1 1 6 6 LYS H H 6 8.820 8.820 9.519 -0.699 17919 69079 1 169 . 1 1 7 7 THR N N 7 115.400 115.400 114.617 0.783 17919 69080 1 169 . 1 1 7 7 THR HA H 7 4.970 4.970 4.910 0.060 17919 69081 1 169 . 1 1 7 7 THR C C 7 176.910 176.910 175.889 1.021 17919 69082 1 169 . 1 1 7 7 THR CA C 7 60.470 60.470 59.943 0.527 17919 69083 1 169 . 1 1 7 7 THR CB C 7 70.630 70.630 71.921 -1.291 17919 69084 1 169 . 1 1 7 7 THR H H 7 8.730 8.730 8.988 -0.258 17919 69085 1 169 . 1 1 8 8 LEU N N 8 121.330 121.330 122.381 -1.051 17919 69086 1 169 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.535 -0.225 17919 69087 1 169 . 1 1 8 8 LEU C C 8 178.800 178.800 177.184 1.616 17919 69088 1 169 . 1 1 8 8 LEU CA C 8 57.580 57.580 55.805 1.775 17919 69089 1 169 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.026 -0.056 17919 69090 1 169 . 1 1 8 8 LEU H H 8 9.100 9.100 8.721 0.379 17919 69091 1 169 . 1 1 9 9 THR N N 9 105.590 105.590 110.701 -5.111 17919 69092 1 169 . 1 1 9 9 THR HA H 9 4.428 4.428 4.391 0.037 17919 69093 1 169 . 1 1 9 9 THR C C 9 175.520 175.520 175.315 0.205 17919 69094 1 169 . 1 1 9 9 THR CA C 9 61.400 61.400 61.393 0.007 17919 69095 1 169 . 1 1 9 9 THR CB C 9 69.140 69.140 68.944 0.196 17919 69096 1 169 . 1 1 9 9 THR H H 9 7.630 7.630 7.741 -0.111 17919 69097 1 169 . 1 1 10 10 GLY N N 10 108.890 108.890 111.798 -2.908 17919 69098 1 169 . 1 1 10 10 GLY C C 10 174.070 174.070 173.543 0.527 17919 69099 1 169 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.383 0.077 17919 69100 1 169 . 1 1 10 10 GLY H H 10 7.810 7.810 7.892 -0.082 17919 69101 1 169 . 1 1 11 11 LYS N N 11 121.600 121.600 118.343 3.257 17919 69102 1 169 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.874 -0.513 17919 69103 1 169 . 1 1 11 11 LYS C C 11 175.940 175.940 174.575 1.365 17919 69104 1 169 . 1 1 11 11 LYS CA C 11 56.280 56.280 54.326 1.954 17919 69105 1 169 . 1 1 11 11 LYS CB C 11 33.200 33.200 35.279 -2.079 17919 69106 1 169 . 1 1 11 11 LYS H H 11 7.280 7.280 7.788 -0.508 17919 69107 1 169 . 1 1 12 12 THR N N 12 120.440 120.440 116.184 4.256 17919 69108 1 169 . 1 1 12 12 THR HA H 12 5.046 5.046 5.433 -0.387 17919 69109 1 169 . 1 1 12 12 THR C C 12 174.320 174.320 174.092 0.228 17919 69110 1 169 . 1 1 12 12 THR CA C 12 62.390 62.390 61.449 0.941 17919 69111 1 169 . 1 1 12 12 THR CB C 12 69.910 69.910 71.171 -1.261 17919 69112 1 169 . 1 1 12 12 THR H H 12 8.650 8.650 8.256 0.394 17919 69113 1 169 . 1 1 13 13 ILE N N 13 127.110 127.110 120.306 6.804 17919 69114 1 169 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.687 -0.143 17919 69115 1 169 . 1 1 13 13 ILE C C 13 175.220 175.220 174.713 0.507 17919 69116 1 169 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.614 0.366 17919 69117 1 169 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.450 -0.500 17919 69118 1 169 . 1 1 13 13 ILE H H 13 9.450 9.450 9.285 0.165 17919 69119 1 169 . 1 1 14 14 THR N N 14 121.520 121.520 120.755 0.765 17919 69120 1 169 . 1 1 14 14 THR HA H 14 4.964 4.964 5.213 -0.249 17919 69121 1 169 . 1 1 14 14 THR C C 14 173.790 173.790 173.814 -0.024 17919 69122 1 169 . 1 1 14 14 THR CA C 14 61.940 61.940 62.045 -0.105 17919 69123 1 169 . 1 1 14 14 THR CB C 14 69.650 69.650 69.903 -0.254 17919 69124 1 169 . 1 1 14 14 THR H H 14 8.710 8.710 8.453 0.257 17919 69125 1 169 . 1 1 15 15 LEU N N 15 124.800 124.800 125.004 -0.204 17919 69126 1 169 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.798 -0.018 17919 69127 1 169 . 1 1 15 15 LEU C C 15 174.670 174.670 175.461 -0.791 17919 69128 1 169 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.233 -0.403 17919 69129 1 169 . 1 1 15 15 LEU CB C 15 47.070 47.070 46.398 0.672 17919 69130 1 169 . 1 1 15 15 LEU H H 15 8.710 8.710 8.773 -0.063 17919 69131 1 169 . 1 1 16 16 GLU N N 16 122.160 122.160 122.273 -0.113 17919 69132 1 169 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.276 -0.359 17919 69133 1 169 . 1 1 16 16 GLU C C 16 175.860 175.860 175.756 0.104 17919 69134 1 169 . 1 1 16 16 GLU CA C 16 54.820 54.820 54.290 0.530 17919 69135 1 169 . 1 1 16 16 GLU CB C 16 29.450 29.450 29.681 -0.231 17919 69136 1 169 . 1 1 16 16 GLU H H 16 8.140 8.140 8.592 -0.452 17919 69137 1 169 . 1 1 17 17 VAL N N 17 117.210 117.210 117.987 -0.777 17919 69138 1 169 . 1 1 17 17 VAL HA H 17 4.714 4.714 5.108 -0.394 17919 69139 1 169 . 1 1 17 17 VAL C C 17 174.160 174.160 175.271 -1.111 17919 69140 1 169 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.832 -0.402 17919 69141 1 169 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.940 0.460 17919 69142 1 169 . 1 1 17 17 VAL H H 17 8.900 8.900 8.534 0.366 17919 69143 1 169 . 1 1 18 18 GLU N N 18 118.990 118.990 119.546 -0.556 17919 69144 1 169 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.924 0.155 17919 69145 1 169 . 1 1 18 18 GLU C C 18 176.160 176.160 175.364 0.796 17919 69146 1 169 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.036 0.684 17919 69147 1 169 . 1 1 18 18 GLU CB C 18 30.310 30.310 31.718 -1.408 17919 69148 1 169 . 1 1 18 18 GLU H H 18 8.640 8.640 8.387 0.253 17919 69149 1 169 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.287 -0.146 17919 69150 1 169 . 1 1 19 19 PRO C C 19 175.310 175.310 178.000 -2.690 17919 69151 1 169 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.520 -0.050 17919 69152 1 169 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.854 0.096 17919 69153 1 169 . 1 1 20 20 SER N N 20 103.400 103.400 110.694 -7.294 17919 69154 1 169 . 1 1 20 20 SER HA H 20 4.370 4.370 4.243 0.127 17919 69155 1 169 . 1 1 20 20 SER C C 20 174.660 174.660 175.066 -0.406 17919 69156 1 169 . 1 1 20 20 SER CA C 20 57.400 57.400 59.890 -2.490 17919 69157 1 169 . 1 1 20 20 SER CB C 20 63.370 63.370 62.790 0.580 17919 69158 1 169 . 1 1 20 20 SER H H 20 7.040 7.040 8.076 -1.036 17919 69159 1 169 . 1 1 21 21 ASP N N 21 123.480 123.480 123.772 -0.292 17919 69160 1 169 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.815 -0.120 17919 69161 1 169 . 1 1 21 21 ASP C C 21 176.360 176.360 176.001 0.359 17919 69162 1 169 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.486 1.214 17919 69163 1 169 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.762 -0.962 17919 69164 1 169 . 1 1 21 21 ASP H H 21 8.030 8.030 8.354 -0.324 17919 69165 1 169 . 1 1 22 22 THR N N 22 108.800 108.800 111.666 -2.866 17919 69166 1 169 . 1 1 22 22 THR HA H 22 4.920 4.920 4.826 0.094 17919 69167 1 169 . 1 1 22 22 THR C C 22 176.750 176.750 176.300 0.450 17919 69168 1 169 . 1 1 22 22 THR CA C 22 59.690 59.690 61.431 -1.741 17919 69169 1 169 . 1 1 22 22 THR CB C 22 71.200 71.200 71.198 0.002 17919 69170 1 169 . 1 1 22 22 THR H H 22 7.900 7.900 8.162 -0.262 17919 69171 1 169 . 1 1 23 23 ILE N N 23 121.190 121.190 122.246 -1.056 17919 69172 1 169 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.731 -0.074 17919 69173 1 169 . 1 1 23 23 ILE C C 23 179.040 179.040 177.835 1.205 17919 69174 1 169 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.173 -0.913 17919 69175 1 169 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.519 -2.169 17919 69176 1 169 . 1 1 23 23 ILE H H 23 8.560 8.560 8.475 0.085 17919 69177 1 169 . 1 1 24 24 GLU N N 24 120.830 120.830 120.057 0.773 17919 69178 1 169 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.866 0.051 17919 69179 1 169 . 1 1 24 24 GLU C C 24 178.640 178.640 178.608 0.032 17919 69180 1 169 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.899 0.321 17919 69181 1 169 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.403 -1.123 17919 69182 1 169 . 1 1 24 24 GLU H H 24 9.760 9.760 8.290 1.470 17919 69183 1 169 . 1 1 25 25 ASN N N 25 120.570 120.570 118.141 2.429 17919 69184 1 169 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.492 0.033 17919 69185 1 169 . 1 1 25 25 ASN C C 25 178.380 178.380 177.785 0.595 17919 69186 1 169 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.312 -0.252 17919 69187 1 169 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.568 -0.118 17919 69188 1 169 . 1 1 25 25 ASN H H 25 7.920 7.920 7.643 0.277 17919 69189 1 169 . 1 1 26 26 VAL N N 26 121.710 121.710 119.783 1.927 17919 69190 1 169 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.578 -0.181 17919 69191 1 169 . 1 1 26 26 VAL C C 26 177.950 177.950 178.033 -0.083 17919 69192 1 169 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.379 1.281 17919 69193 1 169 . 1 1 26 26 VAL CB C 26 30.840 30.840 30.696 0.144 17919 69194 1 169 . 1 1 26 26 VAL H H 26 8.070 8.070 7.771 0.299 17919 69195 1 169 . 1 1 27 27 LYS N N 27 118.860 118.860 119.522 -0.662 17919 69196 1 169 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.263 0.317 17919 69197 1 169 . 1 1 27 27 LYS C C 27 180.550 180.550 179.198 1.352 17919 69198 1 169 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.514 -0.265 17919 69199 1 169 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.257 1.473 17919 69200 1 169 . 1 1 27 27 LYS H H 27 8.560 8.560 8.061 0.499 17919 69201 1 169 . 1 1 28 28 ALA N N 28 123.440 123.440 122.443 0.997 17919 69202 1 169 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.245 -0.085 17919 69203 1 169 . 1 1 28 28 ALA C C 28 180.300 180.300 178.978 1.322 17919 69204 1 169 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.613 0.757 17919 69205 1 169 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.515 -0.805 17919 69206 1 169 . 1 1 28 28 ALA H H 28 8.060 8.060 8.314 -0.254 17919 69207 1 169 . 1 1 29 29 LYS N N 29 119.940 119.940 119.421 0.519 17919 69208 1 169 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.051 0.156 17919 69209 1 169 . 1 1 29 29 LYS C C 29 180.320 180.320 179.260 1.060 17919 69210 1 169 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.408 0.242 17919 69211 1 169 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.421 0.869 17919 69212 1 169 . 1 1 29 29 LYS H H 29 7.850 7.850 7.946 -0.096 17919 69213 1 169 . 1 1 30 30 ILE N N 30 121.080 121.080 120.749 0.331 17919 69214 1 169 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.603 -0.096 17919 69215 1 169 . 1 1 30 30 ILE C C 30 178.310 178.310 177.426 0.884 17919 69216 1 169 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.049 1.101 17919 69217 1 169 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.709 -0.909 17919 69218 1 169 . 1 1 30 30 ILE H H 30 8.280 8.280 8.080 0.200 17919 69219 1 169 . 1 1 31 31 GLN N N 31 123.490 123.490 120.382 3.108 17919 69220 1 169 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.029 -0.200 17919 69221 1 169 . 1 1 31 31 GLN C C 31 178.890 178.890 177.962 0.928 17919 69222 1 169 . 1 1 31 31 GLN CA C 31 60.000 60.000 58.867 1.133 17919 69223 1 169 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.611 -0.891 17919 69224 1 169 . 1 1 31 31 GLN H H 31 8.580 8.580 8.058 0.522 17919 69225 1 169 . 1 1 32 32 ASP N N 32 119.360 119.360 117.283 2.077 17919 69226 1 169 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.469 -0.115 17919 69227 1 169 . 1 1 32 32 ASP C C 32 177.250 177.250 177.948 -0.698 17919 69228 1 169 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.365 0.825 17919 69229 1 169 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.953 -0.373 17919 69230 1 169 . 1 1 32 32 ASP H H 32 8.010 8.010 7.791 0.219 17919 69231 1 169 . 1 1 33 33 LYS N N 33 115.130 115.130 118.634 -3.504 17919 69232 1 169 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.346 -0.009 17919 69233 1 169 . 1 1 33 33 LYS C C 33 177.870 177.870 177.966 -0.096 17919 69234 1 169 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.064 -0.014 17919 69235 1 169 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.529 0.641 17919 69236 1 169 . 1 1 33 33 LYS H H 33 7.430 7.430 7.635 -0.205 17919 69237 1 169 . 1 1 34 34 GLU N N 34 113.870 113.870 114.902 -1.032 17919 69238 1 169 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.492 0.133 17919 69239 1 169 . 1 1 34 34 GLU C C 34 177.840 177.840 176.750 1.090 17919 69240 1 169 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.239 -1.069 17919 69241 1 169 . 1 1 34 34 GLU CB C 34 32.660 32.660 32.168 0.492 17919 69242 1 169 . 1 1 34 34 GLU H H 34 8.740 8.740 7.824 0.916 17919 69243 1 169 . 1 1 35 35 GLY N N 35 108.650 108.650 108.448 0.202 17919 69244 1 169 . 1 1 35 35 GLY C C 35 173.960 173.960 174.415 -0.455 17919 69245 1 169 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.537 0.543 17919 69246 1 169 . 1 1 35 35 GLY H H 35 8.530 8.530 7.905 0.625 17919 69247 1 169 . 1 1 36 36 ILE N N 36 119.880 119.880 123.490 -3.610 17919 69248 1 169 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.334 0.111 17919 69249 1 169 . 1 1 36 36 ILE C C 36 173.590 173.590 174.439 -0.849 17919 69250 1 169 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.160 -0.410 17919 69251 1 169 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.208 2.373 17919 69252 1 169 . 1 1 36 36 ILE H H 36 6.150 6.150 7.860 -1.710 17919 69253 1 169 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.727 -0.093 17919 69254 1 169 . 1 1 37 37 PRO C C 37 176.940 176.940 175.875 1.065 17919 69255 1 169 . 1 1 37 37 PRO CA C 37 61.660 61.660 60.957 0.703 17919 69256 1 169 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.097 0.753 17919 69257 1 169 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.230 -0.113 17919 69258 1 169 . 1 1 38 38 PRO C C 38 178.320 178.320 177.000 1.320 17919 69259 1 169 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.208 1.052 17919 69260 1 169 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.895 0.995 17919 69261 1 169 . 1 1 39 39 ASP N N 39 113.380 113.380 114.911 -1.531 17919 69262 1 169 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.391 0.039 17919 69263 1 169 . 1 1 39 39 ASP C C 39 177.090 177.090 177.124 -0.034 17919 69264 1 169 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.153 -0.513 17919 69265 1 169 . 1 1 39 39 ASP CB C 39 39.540 39.540 41.059 -1.520 17919 69266 1 169 . 1 1 39 39 ASP H H 39 8.550 8.550 8.326 0.224 17919 69267 1 169 . 1 1 40 40 GLN N N 40 116.780 116.780 116.953 -0.173 17919 69268 1 169 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.442 0.022 17919 69269 1 169 . 1 1 40 40 GLN C C 40 175.380 175.380 176.028 -0.648 17919 69270 1 169 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.090 0.550 17919 69271 1 169 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.477 0.663 17919 69272 1 169 . 1 1 40 40 GLN H H 40 7.820 7.820 7.854 -0.034 17919 69273 1 169 . 1 1 41 41 GLN N N 41 117.720 117.720 119.709 -1.989 17919 69274 1 169 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.665 -0.421 17919 69275 1 169 . 1 1 41 41 GLN C C 41 176.300 176.300 175.538 0.762 17919 69276 1 169 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.239 0.231 17919 69277 1 169 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.845 1.805 17919 69278 1 169 . 1 1 41 41 GLN H H 41 7.480 7.480 7.311 0.169 17919 69279 1 169 . 1 1 42 42 ARG N N 42 122.680 122.680 122.735 -0.055 17919 69280 1 169 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.664 -0.164 17919 69281 1 169 . 1 1 42 42 ARG C C 42 174.050 174.050 174.432 -0.382 17919 69282 1 169 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.916 0.134 17919 69283 1 169 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.874 -1.124 17919 69284 1 169 . 1 1 42 42 ARG H H 42 8.530 8.530 8.903 -0.373 17919 69285 1 169 . 1 1 43 43 LEU N N 43 124.040 124.040 125.817 -1.777 17919 69286 1 169 . 1 1 43 43 LEU C C 43 175.290 175.290 175.428 -0.138 17919 69287 1 169 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.891 -0.911 17919 69288 1 169 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.725 2.065 17919 69289 1 169 . 1 1 43 43 LEU H H 43 8.820 8.820 8.828 -0.008 17919 69290 1 169 . 1 1 44 44 ILE N N 44 121.920 121.920 123.068 -1.148 17919 69291 1 169 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.174 -0.182 17919 69292 1 169 . 1 1 44 44 ILE C C 44 176.060 176.060 174.577 1.483 17919 69293 1 169 . 1 1 44 44 ILE CA C 44 58.980 58.980 58.531 0.449 17919 69294 1 169 . 1 1 44 44 ILE CB C 44 41.420 41.420 39.607 1.813 17919 69295 1 169 . 1 1 44 44 ILE H H 44 9.030 9.030 9.199 -0.169 17919 69296 1 169 . 1 1 45 45 PHE N N 45 125.390 125.390 127.194 -1.804 17919 69297 1 169 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.937 0.108 17919 69298 1 169 . 1 1 45 45 PHE C C 45 174.470 174.470 174.449 0.021 17919 69299 1 169 . 1 1 45 45 PHE CA C 45 57.020 57.020 55.760 1.260 17919 69300 1 169 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.848 0.912 17919 69301 1 169 . 1 1 45 45 PHE H H 45 8.830 8.830 8.789 0.041 17919 69302 1 169 . 1 1 46 46 ALA N N 46 132.200 132.200 129.945 2.255 17919 69303 1 169 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.694 -0.004 17919 69304 1 169 . 1 1 46 46 ALA C C 46 177.290 177.290 177.820 -0.530 17919 69305 1 169 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.165 0.375 17919 69306 1 169 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.335 0.235 17919 69307 1 169 . 1 1 46 46 ALA H H 46 8.810 8.810 8.821 -0.011 17919 69308 1 169 . 1 1 47 47 GLY N N 47 102.340 102.340 104.869 -2.529 17919 69309 1 169 . 1 1 47 47 GLY C C 47 173.810 173.810 174.316 -0.506 17919 69310 1 169 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.085 0.265 17919 69311 1 169 . 1 1 47 47 GLY H H 47 8.130 8.130 8.582 -0.452 17919 69312 1 169 . 1 1 48 48 LYS N N 48 121.570 121.570 120.722 0.848 17919 69313 1 169 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.593 0.029 17919 69314 1 169 . 1 1 48 48 LYS C C 48 174.700 174.700 175.295 -0.595 17919 69315 1 169 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.991 -0.441 17919 69316 1 169 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.624 -0.094 17919 69317 1 169 . 1 1 48 48 LYS H H 48 7.980 7.980 7.922 0.058 17919 69318 1 169 . 1 1 49 49 GLN N N 49 122.410 122.410 123.731 -1.321 17919 69319 1 169 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.567 -0.007 17919 69320 1 169 . 1 1 49 49 GLN C C 49 175.670 175.670 176.012 -0.342 17919 69321 1 169 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.098 -0.358 17919 69322 1 169 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.150 -0.150 17919 69323 1 169 . 1 1 49 49 GLN H H 49 8.600 8.600 8.596 0.004 17919 69324 1 169 . 1 1 50 50 LEU N N 50 125.520 125.520 129.183 -3.663 17919 69325 1 169 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.412 -0.322 17919 69326 1 169 . 1 1 50 50 LEU C C 50 176.660 176.660 175.966 0.694 17919 69327 1 169 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.761 -0.521 17919 69328 1 169 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.281 -0.710 17919 69329 1 169 . 1 1 50 50 LEU H H 50 8.530 8.530 8.643 -0.113 17919 69330 1 169 . 1 1 51 51 GLU N N 51 122.940 122.940 122.506 0.434 17919 69331 1 169 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.560 -0.072 17919 69332 1 169 . 1 1 51 51 GLU C C 51 175.870 175.870 176.244 -0.374 17919 69333 1 169 . 1 1 51 51 GLU CA C 51 55.960 55.960 54.902 1.058 17919 69334 1 169 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.654 -1.084 17919 69335 1 169 . 1 1 51 51 GLU H H 51 8.400 8.400 8.790 -0.390 17919 69336 1 169 . 1 1 52 52 ASP N N 52 120.030 120.030 126.739 -6.709 17919 69337 1 169 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.564 -0.205 17919 69338 1 169 . 1 1 52 52 ASP C C 52 177.330 177.330 177.008 0.322 17919 69339 1 169 . 1 1 52 52 ASP CA C 52 56.960 56.960 56.597 0.363 17919 69340 1 169 . 1 1 52 52 ASP CB C 52 40.850 40.850 41.244 -0.394 17919 69341 1 169 . 1 1 52 52 ASP H H 52 8.160 8.160 8.852 -0.692 17919 69342 1 169 . 1 1 53 53 GLY N N 53 106.660 106.660 105.617 1.043 17919 69343 1 169 . 1 1 53 53 GLY C C 53 174.870 174.870 174.149 0.721 17919 69344 1 169 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.414 0.756 17919 69345 1 169 . 1 1 53 53 GLY H H 53 9.390 9.390 8.241 1.149 17919 69346 1 169 . 1 1 54 54 ARG N N 54 119.050 119.050 120.977 -1.927 17919 69347 1 169 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.586 0.109 17919 69348 1 169 . 1 1 54 54 ARG C C 54 175.350 175.350 176.063 -0.713 17919 69349 1 169 . 1 1 54 54 ARG CA C 54 54.390 54.390 55.282 -0.892 17919 69350 1 169 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.020 0.631 17919 69351 1 169 . 1 1 54 54 ARG H H 54 7.460 7.460 7.394 0.066 17919 69352 1 169 . 1 1 55 55 THR N N 55 108.400 108.400 114.433 -6.033 17919 69353 1 169 . 1 1 55 55 THR HA H 55 5.240 5.240 4.651 0.589 17919 69354 1 169 . 1 1 55 55 THR C C 55 176.560 176.560 176.071 0.489 17919 69355 1 169 . 1 1 55 55 THR CA C 55 59.690 59.690 62.042 -2.352 17919 69356 1 169 . 1 1 55 55 THR CB C 55 72.260 72.260 70.208 2.052 17919 69357 1 169 . 1 1 55 55 THR H H 55 8.730 8.730 8.808 -0.078 17919 69358 1 169 . 1 1 56 56 LEU N N 56 117.920 117.920 122.419 -4.499 17919 69359 1 169 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.129 -0.069 17919 69360 1 169 . 1 1 56 56 LEU C C 56 180.810 180.810 179.094 1.716 17919 69361 1 169 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.054 0.656 17919 69362 1 169 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.288 -0.918 17919 69363 1 169 . 1 1 56 56 LEU H H 56 8.140 8.140 8.834 -0.694 17919 69364 1 169 . 1 1 57 57 SER N N 57 113.330 113.330 114.214 -0.884 17919 69365 1 169 . 1 1 57 57 SER HA H 57 4.370 4.370 4.141 0.229 17919 69366 1 169 . 1 1 57 57 SER C C 57 178.310 178.310 176.864 1.446 17919 69367 1 169 . 1 1 57 57 SER CA C 57 61.080 61.080 61.790 -0.710 17919 69368 1 169 . 1 1 57 57 SER CB C 57 62.530 62.530 62.756 -0.226 17919 69369 1 169 . 1 1 57 57 SER H H 57 8.470 8.470 8.416 0.054 17919 69370 1 169 . 1 1 58 58 ASP N N 58 124.190 124.190 121.234 2.956 17919 69371 1 169 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.365 -0.069 17919 69372 1 169 . 1 1 58 58 ASP C C 58 177.400 177.400 177.078 0.322 17919 69373 1 169 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.202 0.978 17919 69374 1 169 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.481 -0.381 17919 69375 1 169 . 1 1 58 58 ASP H H 58 7.930 7.930 7.854 0.076 17919 69376 1 169 . 1 1 59 59 TYR N N 59 115.510 115.510 116.680 -1.170 17919 69377 1 169 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.575 0.095 17919 69378 1 169 . 1 1 59 59 TYR C C 59 174.700 174.700 175.103 -0.403 17919 69379 1 169 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.272 0.979 17919 69380 1 169 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.389 1.681 17919 69381 1 169 . 1 1 59 59 TYR H H 59 7.250 7.250 7.405 -0.155 17919 69382 1 169 . 1 1 60 60 ASN N N 60 115.900 115.900 118.415 -2.515 17919 69383 1 169 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.342 0.013 17919 69384 1 169 . 1 1 60 60 ASN C C 60 174.340 174.340 174.523 -0.183 17919 69385 1 169 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.314 -0.194 17919 69386 1 169 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.397 0.013 17919 69387 1 169 . 1 1 60 60 ASN H H 60 8.150 8.150 7.703 0.447 17919 69388 1 169 . 1 1 61 61 ILE N N 61 118.600 118.600 120.047 -1.447 17919 69389 1 169 . 1 1 61 61 ILE HA H 61 3.393 3.393 4.028 -0.635 17919 69390 1 169 . 1 1 61 61 ILE C C 61 174.610 174.610 175.404 -0.794 17919 69391 1 169 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.141 1.279 17919 69392 1 169 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.715 -0.975 17919 69393 1 169 . 1 1 61 61 ILE H H 61 7.250 7.250 7.555 -0.305 17919 69394 1 169 . 1 1 62 62 GLN N N 62 124.740 124.740 127.608 -2.868 17919 69395 1 169 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.607 -0.101 17919 69396 1 169 . 1 1 62 62 GLN C C 62 175.970 175.970 175.161 0.809 17919 69397 1 169 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.860 -0.200 17919 69398 1 169 . 1 1 62 62 GLN CB C 62 31.650 31.650 30.480 1.170 17919 69399 1 169 . 1 1 62 62 GLN H H 62 7.610 7.610 7.999 -0.389 17919 69400 1 169 . 1 1 63 63 LYS N N 63 120.300 120.300 118.327 1.973 17919 69401 1 169 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.075 -0.074 17919 69402 1 169 . 1 1 63 63 LYS C C 63 175.810 175.810 177.360 -1.550 17919 69403 1 169 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.850 -0.060 17919 69404 1 169 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.196 0.455 17919 69405 1 169 . 1 1 63 63 LYS H H 63 8.490 8.490 8.388 0.102 17919 69406 1 169 . 1 1 64 64 GLU N N 64 113.950 113.950 120.192 -6.242 17919 69407 1 169 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.223 0.242 17919 69408 1 169 . 1 1 64 64 GLU C C 64 175.250 175.250 176.381 -1.131 17919 69409 1 169 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.624 0.266 17919 69410 1 169 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.802 -2.902 17919 69411 1 169 . 1 1 64 64 GLU H H 64 9.280 9.280 8.744 0.536 17919 69412 1 169 . 1 1 65 65 SER N N 65 114.730 114.730 116.001 -1.271 17919 69413 1 169 . 1 1 65 65 SER HA H 65 4.640 4.640 4.399 0.241 17919 69414 1 169 . 1 1 65 65 SER C C 65 172.160 172.160 173.805 -1.645 17919 69415 1 169 . 1 1 65 65 SER CA C 65 60.890 60.890 60.724 0.166 17919 69416 1 169 . 1 1 65 65 SER CB C 65 64.910 64.910 63.886 1.024 17919 69417 1 169 . 1 1 65 65 SER H H 65 7.670 7.670 7.274 0.396 17919 69418 1 169 . 1 1 66 66 THR N N 66 117.110 117.110 120.657 -3.547 17919 69419 1 169 . 1 1 66 66 THR HA H 66 5.270 5.270 5.305 -0.035 17919 69420 1 169 . 1 1 66 66 THR C C 66 173.950 173.950 174.287 -0.337 17919 69421 1 169 . 1 1 66 66 THR CA C 66 62.340 62.340 62.124 0.216 17919 69422 1 169 . 1 1 66 66 THR CB C 66 70.080 70.080 70.375 -0.295 17919 69423 1 169 . 1 1 66 66 THR H H 66 8.730 8.730 8.626 0.104 17919 69424 1 169 . 1 1 67 67 LEU N N 67 127.110 127.110 126.663 0.447 17919 69425 1 169 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.948 0.112 17919 69426 1 169 . 1 1 67 67 LEU C C 67 175.770 175.770 175.269 0.501 17919 69427 1 169 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.891 0.009 17919 69428 1 169 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.286 -0.026 17919 69429 1 169 . 1 1 67 67 LEU H H 67 9.410 9.410 9.184 0.226 17919 69430 1 169 . 1 1 68 68 HIS N N 68 118.380 118.380 121.384 -3.004 17919 69431 1 169 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.436 -0.196 17919 69432 1 169 . 1 1 68 68 HIS C C 68 173.150 173.150 173.916 -0.766 17919 69433 1 169 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.181 0.819 17919 69434 1 169 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.493 -1.963 17919 69435 1 169 . 1 1 68 68 HIS H H 68 9.230 9.230 9.425 -0.195 17919 69436 1 169 . 1 1 69 69 LEU N N 69 124.460 124.460 128.850 -4.390 17919 69437 1 169 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.936 0.254 17919 69438 1 169 . 1 1 69 69 LEU C C 69 175.270 175.270 174.125 1.145 17919 69439 1 169 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.415 0.475 17919 69440 1 169 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.701 -0.321 17919 69441 1 169 . 1 1 69 69 LEU H H 69 8.340 8.340 8.627 -0.287 17919 69442 1 169 . 1 1 70 70 VAL N N 70 126.940 126.940 123.103 3.837 17919 69443 1 169 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.485 -0.135 17919 69444 1 169 . 1 1 70 70 VAL C C 70 174.000 174.000 173.490 0.510 17919 69445 1 169 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.540 1.260 17919 69446 1 169 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.383 -0.473 17919 69447 1 169 . 1 1 70 70 VAL H H 70 9.200 9.200 8.866 0.334 17919 69448 1 169 . 1 1 71 71 LEU N N 71 123.130 123.130 123.762 -0.632 17919 69449 1 169 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.132 -0.072 17919 69450 1 169 . 1 1 71 71 LEU C C 71 177.830 177.830 178.151 -0.321 17919 69451 1 169 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.385 0.555 17919 69452 1 169 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.494 -0.644 17919 69453 1 169 . 1 1 71 71 LEU H H 71 8.120 8.120 8.414 -0.294 17919 69454 1 169 . 1 1 72 72 ARG N N 72 123.490 123.490 123.644 -0.154 17919 69455 1 169 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.261 0.040 17919 69456 1 169 . 1 1 72 72 ARG C C 72 175.350 175.350 175.835 -0.485 17919 69457 1 169 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.645 -0.035 17919 69458 1 169 . 1 1 72 72 ARG CB C 72 31.350 31.350 28.956 2.394 17919 69459 1 169 . 1 1 72 72 ARG H H 72 8.580 8.580 8.702 -0.122 17919 69460 1 170 . 1 1 2 2 GLN N N 2 123.220 123.220 120.492 2.728 17919 69461 1 170 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.383 -0.134 17919 69462 1 170 . 1 1 2 2 GLN C C 2 175.920 175.920 175.496 0.424 17919 69463 1 170 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.465 0.615 17919 69464 1 170 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.664 0.096 17919 69465 1 170 . 1 1 2 2 GLN H H 2 8.900 8.900 8.371 0.529 17919 69466 1 170 . 1 1 3 3 ILE N N 3 115.340 115.340 117.128 -1.788 17919 69467 1 170 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.659 -0.446 17919 69468 1 170 . 1 1 3 3 ILE C C 3 172.450 172.450 173.696 -1.246 17919 69469 1 170 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.244 0.326 17919 69470 1 170 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.957 0.253 17919 69471 1 170 . 1 1 3 3 ILE H H 3 8.320 8.320 8.342 -0.022 17919 69472 1 170 . 1 1 4 4 PHE N N 4 118.110 118.110 119.857 -1.747 17919 69473 1 170 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.464 0.166 17919 69474 1 170 . 1 1 4 4 PHE C C 4 175.320 175.320 175.472 -0.152 17919 69475 1 170 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.883 -0.673 17919 69476 1 170 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.835 -0.355 17919 69477 1 170 . 1 1 4 4 PHE H H 4 8.610 8.610 8.974 -0.364 17919 69478 1 170 . 1 1 5 5 VAL N N 5 121.000 121.000 121.671 -0.671 17919 69479 1 170 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.682 0.043 17919 69480 1 170 . 1 1 5 5 VAL C C 5 174.870 174.870 174.264 0.606 17919 69481 1 170 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.258 -0.638 17919 69482 1 170 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.666 -0.436 17919 69483 1 170 . 1 1 5 5 VAL H H 5 9.300 9.300 9.326 -0.026 17919 69484 1 170 . 1 1 6 6 LYS N N 6 127.520 127.520 128.985 -1.465 17919 69485 1 170 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.341 0.026 17919 69486 1 170 . 1 1 6 6 LYS C C 6 177.140 177.140 176.421 0.719 17919 69487 1 170 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.123 0.397 17919 69488 1 170 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.629 -0.579 17919 69489 1 170 . 1 1 6 6 LYS H H 6 8.820 8.820 9.035 -0.215 17919 69490 1 170 . 1 1 7 7 THR N N 7 115.400 115.400 118.844 -3.444 17919 69491 1 170 . 1 1 7 7 THR HA H 7 4.970 4.970 4.543 0.427 17919 69492 1 170 . 1 1 7 7 THR C C 7 176.910 176.910 176.566 0.344 17919 69493 1 170 . 1 1 7 7 THR CA C 7 60.470 60.470 61.684 -1.214 17919 69494 1 170 . 1 1 7 7 THR CB C 7 70.630 70.630 69.897 0.733 17919 69495 1 170 . 1 1 7 7 THR H H 7 8.730 8.730 8.873 -0.143 17919 69496 1 170 . 1 1 8 8 LEU N N 8 121.330 121.330 122.871 -1.541 17919 69497 1 170 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.491 -0.181 17919 69498 1 170 . 1 1 8 8 LEU C C 8 178.800 178.800 177.738 1.062 17919 69499 1 170 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.726 -0.146 17919 69500 1 170 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.194 -0.224 17919 69501 1 170 . 1 1 8 8 LEU H H 8 9.100 9.100 8.590 0.510 17919 69502 1 170 . 1 1 9 9 THR N N 9 105.590 105.590 108.762 -3.172 17919 69503 1 170 . 1 1 9 9 THR HA H 9 4.428 4.428 4.334 0.094 17919 69504 1 170 . 1 1 9 9 THR C C 9 175.520 175.520 175.534 -0.014 17919 69505 1 170 . 1 1 9 9 THR CA C 9 61.400 61.400 61.767 -0.367 17919 69506 1 170 . 1 1 9 9 THR CB C 9 69.140 69.140 69.090 0.050 17919 69507 1 170 . 1 1 9 9 THR H H 9 7.630 7.630 7.572 0.058 17919 69508 1 170 . 1 1 10 10 GLY N N 10 108.890 108.890 110.788 -1.898 17919 69509 1 170 . 1 1 10 10 GLY C C 10 174.070 174.070 174.206 -0.136 17919 69510 1 170 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.356 0.103 17919 69511 1 170 . 1 1 10 10 GLY H H 10 7.810 7.810 7.795 0.015 17919 69512 1 170 . 1 1 11 11 LYS N N 11 121.600 121.600 122.151 -0.551 17919 69513 1 170 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.268 0.093 17919 69514 1 170 . 1 1 11 11 LYS C C 11 175.940 175.940 175.547 0.393 17919 69515 1 170 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.733 -0.453 17919 69516 1 170 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.352 -0.152 17919 69517 1 170 . 1 1 11 11 LYS H H 11 7.280 7.280 7.615 -0.335 17919 69518 1 170 . 1 1 12 12 THR N N 12 120.440 120.440 120.035 0.405 17919 69519 1 170 . 1 1 12 12 THR HA H 12 5.046 5.046 5.134 -0.088 17919 69520 1 170 . 1 1 12 12 THR C C 12 174.320 174.320 174.577 -0.257 17919 69521 1 170 . 1 1 12 12 THR CA C 12 62.390 62.390 61.652 0.738 17919 69522 1 170 . 1 1 12 12 THR CB C 12 69.910 69.910 69.726 0.184 17919 69523 1 170 . 1 1 12 12 THR H H 12 8.650 8.650 8.206 0.444 17919 69524 1 170 . 1 1 13 13 ILE N N 13 127.110 127.110 120.864 6.246 17919 69525 1 170 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.748 -0.204 17919 69526 1 170 . 1 1 13 13 ILE C C 13 175.220 175.220 174.639 0.581 17919 69527 1 170 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.511 0.469 17919 69528 1 170 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.530 -0.580 17919 69529 1 170 . 1 1 13 13 ILE H H 13 9.450 9.450 9.221 0.229 17919 69530 1 170 . 1 1 14 14 THR N N 14 121.520 121.520 117.693 3.827 17919 69531 1 170 . 1 1 14 14 THR HA H 14 4.964 4.964 5.070 -0.106 17919 69532 1 170 . 1 1 14 14 THR C C 14 173.790 173.790 174.087 -0.297 17919 69533 1 170 . 1 1 14 14 THR CA C 14 61.940 61.940 60.465 1.475 17919 69534 1 170 . 1 1 14 14 THR CB C 14 69.650 69.650 70.208 -0.558 17919 69535 1 170 . 1 1 14 14 THR H H 14 8.710 8.710 8.414 0.296 17919 69536 1 170 . 1 1 15 15 LEU N N 15 124.800 124.800 127.004 -2.204 17919 69537 1 170 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.726 0.054 17919 69538 1 170 . 1 1 15 15 LEU C C 15 174.670 174.670 175.918 -1.248 17919 69539 1 170 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.818 -0.988 17919 69540 1 170 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.235 1.835 17919 69541 1 170 . 1 1 15 15 LEU H H 15 8.710 8.710 9.066 -0.356 17919 69542 1 170 . 1 1 16 16 GLU N N 16 122.160 122.160 121.102 1.058 17919 69543 1 170 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.322 -0.405 17919 69544 1 170 . 1 1 16 16 GLU C C 16 175.860 175.860 176.014 -0.154 17919 69545 1 170 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.471 -0.651 17919 69546 1 170 . 1 1 16 16 GLU CB C 16 29.450 29.450 31.216 -1.766 17919 69547 1 170 . 1 1 16 16 GLU H H 16 8.140 8.140 8.626 -0.486 17919 69548 1 170 . 1 1 17 17 VAL N N 17 117.210 117.210 119.582 -2.372 17919 69549 1 170 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.996 -0.282 17919 69550 1 170 . 1 1 17 17 VAL C C 17 174.160 174.160 175.138 -0.978 17919 69551 1 170 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.013 -0.583 17919 69552 1 170 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.536 0.864 17919 69553 1 170 . 1 1 17 17 VAL H H 17 8.900 8.900 8.125 0.775 17919 69554 1 170 . 1 1 18 18 GLU N N 18 118.990 118.990 122.071 -3.081 17919 69555 1 170 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.796 0.283 17919 69556 1 170 . 1 1 18 18 GLU C C 18 176.160 176.160 175.153 1.007 17919 69557 1 170 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.953 -0.233 17919 69558 1 170 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.357 -0.047 17919 69559 1 170 . 1 1 18 18 GLU H H 18 8.640 8.640 8.602 0.038 17919 69560 1 170 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.300 -0.159 17919 69561 1 170 . 1 1 19 19 PRO C C 19 175.310 175.310 177.797 -2.487 17919 69562 1 170 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.308 0.162 17919 69563 1 170 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.788 0.162 17919 69564 1 170 . 1 1 20 20 SER N N 20 103.400 103.400 109.839 -6.439 17919 69565 1 170 . 1 1 20 20 SER HA H 20 4.370 4.370 4.297 0.073 17919 69566 1 170 . 1 1 20 20 SER C C 20 174.660 174.660 174.232 0.428 17919 69567 1 170 . 1 1 20 20 SER CA C 20 57.400 57.400 58.971 -1.571 17919 69568 1 170 . 1 1 20 20 SER CB C 20 63.370 63.370 62.441 0.929 17919 69569 1 170 . 1 1 20 20 SER H H 20 7.040 7.040 8.042 -1.002 17919 69570 1 170 . 1 1 21 21 ASP N N 21 123.480 123.480 124.548 -1.068 17919 69571 1 170 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.759 -0.064 17919 69572 1 170 . 1 1 21 21 ASP C C 21 176.360 176.360 176.094 0.266 17919 69573 1 170 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.809 0.891 17919 69574 1 170 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.478 -0.678 17919 69575 1 170 . 1 1 21 21 ASP H H 21 8.030 8.030 8.088 -0.058 17919 69576 1 170 . 1 1 22 22 THR N N 22 108.800 108.800 114.337 -5.537 17919 69577 1 170 . 1 1 22 22 THR HA H 22 4.920 4.920 4.746 0.174 17919 69578 1 170 . 1 1 22 22 THR C C 22 176.750 176.750 176.170 0.580 17919 69579 1 170 . 1 1 22 22 THR CA C 22 59.690 59.690 61.319 -1.629 17919 69580 1 170 . 1 1 22 22 THR CB C 22 71.200 71.200 70.111 1.089 17919 69581 1 170 . 1 1 22 22 THR H H 22 7.900 7.900 8.419 -0.519 17919 69582 1 170 . 1 1 23 23 ILE N N 23 121.190 121.190 122.018 -0.828 17919 69583 1 170 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.838 -0.181 17919 69584 1 170 . 1 1 23 23 ILE C C 23 179.040 179.040 177.668 1.372 17919 69585 1 170 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.304 -0.044 17919 69586 1 170 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.160 -1.810 17919 69587 1 170 . 1 1 23 23 ILE H H 23 8.560 8.560 8.696 -0.136 17919 69588 1 170 . 1 1 24 24 GLU N N 24 120.830 120.830 121.470 -0.640 17919 69589 1 170 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.851 0.066 17919 69590 1 170 . 1 1 24 24 GLU C C 24 178.640 178.640 178.442 0.198 17919 69591 1 170 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.409 -0.189 17919 69592 1 170 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.382 -1.102 17919 69593 1 170 . 1 1 24 24 GLU H H 24 9.760 9.760 8.532 1.228 17919 69594 1 170 . 1 1 25 25 ASN N N 25 120.570 120.570 117.768 2.802 17919 69595 1 170 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.509 0.016 17919 69596 1 170 . 1 1 25 25 ASN C C 25 178.380 178.380 177.892 0.488 17919 69597 1 170 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.116 -0.056 17919 69598 1 170 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.738 -0.288 17919 69599 1 170 . 1 1 25 25 ASN H H 25 7.920 7.920 7.746 0.174 17919 69600 1 170 . 1 1 26 26 VAL N N 26 121.710 121.710 120.750 0.960 17919 69601 1 170 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.653 -0.256 17919 69602 1 170 . 1 1 26 26 VAL C C 26 177.950 177.950 177.957 -0.007 17919 69603 1 170 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.345 1.315 17919 69604 1 170 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.081 -0.241 17919 69605 1 170 . 1 1 26 26 VAL H H 26 8.070 8.070 8.334 -0.264 17919 69606 1 170 . 1 1 27 27 LYS N N 27 118.860 118.860 120.223 -1.363 17919 69607 1 170 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.155 0.425 17919 69608 1 170 . 1 1 27 27 LYS C C 27 180.550 180.550 179.338 1.212 17919 69609 1 170 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.729 -0.479 17919 69610 1 170 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.238 1.492 17919 69611 1 170 . 1 1 27 27 LYS H H 27 8.560 8.560 8.453 0.107 17919 69612 1 170 . 1 1 28 28 ALA N N 28 123.440 123.440 120.909 2.531 17919 69613 1 170 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.230 -0.070 17919 69614 1 170 . 1 1 28 28 ALA C C 28 180.300 180.300 179.099 1.201 17919 69615 1 170 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.503 0.867 17919 69616 1 170 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.629 -0.919 17919 69617 1 170 . 1 1 28 28 ALA H H 28 8.060 8.060 8.332 -0.272 17919 69618 1 170 . 1 1 29 29 LYS N N 29 119.940 119.940 119.747 0.193 17919 69619 1 170 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.080 0.127 17919 69620 1 170 . 1 1 29 29 LYS C C 29 180.320 180.320 179.097 1.223 17919 69621 1 170 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.372 0.278 17919 69622 1 170 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.462 0.828 17919 69623 1 170 . 1 1 29 29 LYS H H 29 7.850 7.850 7.874 -0.024 17919 69624 1 170 . 1 1 30 30 ILE N N 30 121.080 121.080 120.338 0.742 17919 69625 1 170 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.648 -0.141 17919 69626 1 170 . 1 1 30 30 ILE C C 30 178.310 178.310 177.285 1.025 17919 69627 1 170 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.141 1.009 17919 69628 1 170 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.767 -0.968 17919 69629 1 170 . 1 1 30 30 ILE H H 30 8.280 8.280 8.334 -0.054 17919 69630 1 170 . 1 1 31 31 GLN N N 31 123.490 123.490 121.002 2.488 17919 69631 1 170 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.918 -0.089 17919 69632 1 170 . 1 1 31 31 GLN C C 31 178.890 178.890 178.350 0.540 17919 69633 1 170 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.127 0.873 17919 69634 1 170 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.483 -0.763 17919 69635 1 170 . 1 1 31 31 GLN H H 31 8.580 8.580 7.770 0.810 17919 69636 1 170 . 1 1 32 32 ASP N N 32 119.360 119.360 119.230 0.130 17919 69637 1 170 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.370 -0.016 17919 69638 1 170 . 1 1 32 32 ASP C C 32 177.250 177.250 178.034 -0.784 17919 69639 1 170 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.715 0.475 17919 69640 1 170 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.872 -0.292 17919 69641 1 170 . 1 1 32 32 ASP H H 32 8.010 8.010 8.044 -0.034 17919 69642 1 170 . 1 1 33 33 LYS N N 33 115.130 115.130 117.972 -2.842 17919 69643 1 170 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.182 0.155 17919 69644 1 170 . 1 1 33 33 LYS C C 33 177.870 177.870 177.953 -0.083 17919 69645 1 170 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.492 -0.443 17919 69646 1 170 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.045 1.125 17919 69647 1 170 . 1 1 33 33 LYS H H 33 7.430 7.430 7.554 -0.124 17919 69648 1 170 . 1 1 34 34 GLU N N 34 113.870 113.870 114.404 -0.534 17919 69649 1 170 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.509 0.116 17919 69650 1 170 . 1 1 34 34 GLU C C 34 177.840 177.840 176.428 1.412 17919 69651 1 170 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.656 -0.486 17919 69652 1 170 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.383 1.278 17919 69653 1 170 . 1 1 34 34 GLU H H 34 8.740 8.740 8.096 0.644 17919 69654 1 170 . 1 1 35 35 GLY N N 35 108.650 108.650 109.011 -0.361 17919 69655 1 170 . 1 1 35 35 GLY C C 35 173.960 173.960 174.639 -0.679 17919 69656 1 170 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.827 0.253 17919 69657 1 170 . 1 1 35 35 GLY H H 35 8.530 8.530 8.040 0.490 17919 69658 1 170 . 1 1 36 36 ILE N N 36 119.880 119.880 117.476 2.404 17919 69659 1 170 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.564 -0.119 17919 69660 1 170 . 1 1 36 36 ILE C C 36 173.590 173.590 173.495 0.095 17919 69661 1 170 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.644 0.106 17919 69662 1 170 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.527 2.053 17919 69663 1 170 . 1 1 36 36 ILE H H 36 6.150 6.150 7.364 -1.214 17919 69664 1 170 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.615 0.019 17919 69665 1 170 . 1 1 37 37 PRO C C 37 176.940 176.940 175.887 1.053 17919 69666 1 170 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.707 -0.047 17919 69667 1 170 . 1 1 37 37 PRO CB C 37 31.850 31.850 30.861 0.989 17919 69668 1 170 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.141 -0.024 17919 69669 1 170 . 1 1 38 38 PRO C C 38 178.320 178.320 178.504 -0.184 17919 69670 1 170 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.867 0.393 17919 69671 1 170 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.938 0.952 17919 69672 1 170 . 1 1 39 39 ASP N N 39 113.380 113.380 114.600 -1.220 17919 69673 1 170 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.422 0.008 17919 69674 1 170 . 1 1 39 39 ASP C C 39 177.090 177.090 177.338 -0.248 17919 69675 1 170 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.469 -0.829 17919 69676 1 170 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.346 -0.806 17919 69677 1 170 . 1 1 39 39 ASP H H 39 8.550 8.550 8.540 0.010 17919 69678 1 170 . 1 1 40 40 GLN N N 40 116.780 116.780 116.207 0.573 17919 69679 1 170 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.362 0.102 17919 69680 1 170 . 1 1 40 40 GLN C C 40 175.380 175.380 175.844 -0.464 17919 69681 1 170 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.695 -0.055 17919 69682 1 170 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.304 0.836 17919 69683 1 170 . 1 1 40 40 GLN H H 40 7.820 7.820 7.885 -0.065 17919 69684 1 170 . 1 1 41 41 GLN N N 41 117.720 117.720 119.006 -1.286 17919 69685 1 170 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.516 -0.272 17919 69686 1 170 . 1 1 41 41 GLN C C 41 176.300 176.300 175.598 0.702 17919 69687 1 170 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.264 0.206 17919 69688 1 170 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.636 2.014 17919 69689 1 170 . 1 1 41 41 GLN H H 41 7.480 7.480 7.129 0.351 17919 69690 1 170 . 1 1 42 42 ARG N N 42 122.680 122.680 125.221 -2.541 17919 69691 1 170 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.634 -0.134 17919 69692 1 170 . 1 1 42 42 ARG C C 42 174.050 174.050 173.562 0.488 17919 69693 1 170 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.871 0.179 17919 69694 1 170 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.070 -1.320 17919 69695 1 170 . 1 1 42 42 ARG H H 42 8.530 8.530 8.763 -0.233 17919 69696 1 170 . 1 1 43 43 LEU N N 43 124.040 124.040 127.806 -3.766 17919 69697 1 170 . 1 1 43 43 LEU C C 43 175.290 175.290 175.737 -0.447 17919 69698 1 170 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.327 -1.347 17919 69699 1 170 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.153 1.637 17919 69700 1 170 . 1 1 43 43 LEU H H 43 8.820 8.820 8.795 0.025 17919 69701 1 170 . 1 1 44 44 ILE N N 44 121.920 121.920 121.660 0.260 17919 69702 1 170 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.043 -0.051 17919 69703 1 170 . 1 1 44 44 ILE C C 44 176.060 176.060 174.116 1.944 17919 69704 1 170 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.988 -1.008 17919 69705 1 170 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.432 -0.012 17919 69706 1 170 . 1 1 44 44 ILE H H 44 9.030 9.030 9.233 -0.203 17919 69707 1 170 . 1 1 45 45 PHE N N 45 125.390 125.390 125.724 -0.334 17919 69708 1 170 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.981 0.064 17919 69709 1 170 . 1 1 45 45 PHE C C 45 174.470 174.470 174.412 0.058 17919 69710 1 170 . 1 1 45 45 PHE CA C 45 57.020 57.020 57.291 -0.271 17919 69711 1 170 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.821 0.939 17919 69712 1 170 . 1 1 45 45 PHE H H 45 8.830 8.830 9.028 -0.198 17919 69713 1 170 . 1 1 46 46 ALA N N 46 132.200 132.200 129.579 2.621 17919 69714 1 170 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.614 0.076 17919 69715 1 170 . 1 1 46 46 ALA C C 46 177.290 177.290 177.796 -0.506 17919 69716 1 170 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.766 -0.226 17919 69717 1 170 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.779 -0.209 17919 69718 1 170 . 1 1 46 46 ALA H H 46 8.810 8.810 8.677 0.133 17919 69719 1 170 . 1 1 47 47 GLY N N 47 102.340 102.340 103.627 -1.287 17919 69720 1 170 . 1 1 47 47 GLY C C 47 173.810 173.810 174.169 -0.359 17919 69721 1 170 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.692 0.658 17919 69722 1 170 . 1 1 47 47 GLY H H 47 8.130 8.130 8.362 -0.232 17919 69723 1 170 . 1 1 48 48 LYS N N 48 121.570 121.570 122.226 -0.656 17919 69724 1 170 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.549 0.073 17919 69725 1 170 . 1 1 48 48 LYS C C 48 174.700 174.700 175.035 -0.335 17919 69726 1 170 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.025 -0.475 17919 69727 1 170 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.271 0.259 17919 69728 1 170 . 1 1 48 48 LYS H H 48 7.980 7.980 7.625 0.355 17919 69729 1 170 . 1 1 49 49 GLN N N 49 122.410 122.410 125.832 -3.422 17919 69730 1 170 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.470 0.090 17919 69731 1 170 . 1 1 49 49 GLN C C 49 175.670 175.670 175.609 0.061 17919 69732 1 170 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.916 -0.176 17919 69733 1 170 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.390 -0.390 17919 69734 1 170 . 1 1 49 49 GLN H H 49 8.600 8.600 8.667 -0.067 17919 69735 1 170 . 1 1 50 50 LEU N N 50 125.520 125.520 128.578 -3.058 17919 69736 1 170 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.145 -0.055 17919 69737 1 170 . 1 1 50 50 LEU C C 50 176.660 176.660 176.883 -0.223 17919 69738 1 170 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.763 -0.523 17919 69739 1 170 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.197 -0.626 17919 69740 1 170 . 1 1 50 50 LEU H H 50 8.530 8.530 8.277 0.253 17919 69741 1 170 . 1 1 51 51 GLU N N 51 122.940 122.940 122.987 -0.047 17919 69742 1 170 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.531 -0.043 17919 69743 1 170 . 1 1 51 51 GLU C C 51 175.870 175.870 177.155 -1.285 17919 69744 1 170 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.583 0.377 17919 69745 1 170 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.095 0.475 17919 69746 1 170 . 1 1 51 51 GLU H H 51 8.400 8.400 8.279 0.121 17919 69747 1 170 . 1 1 52 52 ASP N N 52 120.030 120.030 124.987 -4.957 17919 69748 1 170 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.363 -0.004 17919 69749 1 170 . 1 1 52 52 ASP C C 52 177.330 177.330 177.581 -0.251 17919 69750 1 170 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.273 -0.313 17919 69751 1 170 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.714 0.136 17919 69752 1 170 . 1 1 52 52 ASP H H 52 8.160 8.160 8.897 -0.737 17919 69753 1 170 . 1 1 53 53 GLY N N 53 106.660 106.660 104.986 1.674 17919 69754 1 170 . 1 1 53 53 GLY C C 53 174.870 174.870 173.804 1.066 17919 69755 1 170 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.511 0.659 17919 69756 1 170 . 1 1 53 53 GLY H H 53 9.390 9.390 8.403 0.987 17919 69757 1 170 . 1 1 54 54 ARG N N 54 119.050 119.050 120.520 -1.470 17919 69758 1 170 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.886 -0.191 17919 69759 1 170 . 1 1 54 54 ARG C C 54 175.350 175.350 175.143 0.207 17919 69760 1 170 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.187 0.203 17919 69761 1 170 . 1 1 54 54 ARG CB C 54 32.650 32.650 34.013 -1.363 17919 69762 1 170 . 1 1 54 54 ARG H H 54 7.460 7.460 7.487 -0.027 17919 69763 1 170 . 1 1 55 55 THR N N 55 108.400 108.400 111.776 -3.376 17919 69764 1 170 . 1 1 55 55 THR HA H 55 5.240 5.240 5.146 0.094 17919 69765 1 170 . 1 1 55 55 THR C C 55 176.560 176.560 176.231 0.329 17919 69766 1 170 . 1 1 55 55 THR CA C 55 59.690 59.690 59.471 0.219 17919 69767 1 170 . 1 1 55 55 THR CB C 55 72.260 72.260 71.249 1.011 17919 69768 1 170 . 1 1 55 55 THR H H 55 8.730 8.730 9.229 -0.499 17919 69769 1 170 . 1 1 56 56 LEU N N 56 117.920 117.920 122.378 -4.458 17919 69770 1 170 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.868 0.192 17919 69771 1 170 . 1 1 56 56 LEU C C 56 180.810 180.810 178.786 2.024 17919 69772 1 170 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.773 -0.063 17919 69773 1 170 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.432 -1.062 17919 69774 1 170 . 1 1 56 56 LEU H H 56 8.140 8.140 8.405 -0.265 17919 69775 1 170 . 1 1 57 57 SER N N 57 113.330 113.330 115.217 -1.887 17919 69776 1 170 . 1 1 57 57 SER HA H 57 4.370 4.370 4.085 0.285 17919 69777 1 170 . 1 1 57 57 SER C C 57 178.310 178.310 176.893 1.417 17919 69778 1 170 . 1 1 57 57 SER CA C 57 61.080 61.080 62.248 -1.168 17919 69779 1 170 . 1 1 57 57 SER CB C 57 62.530 62.530 62.674 -0.144 17919 69780 1 170 . 1 1 57 57 SER H H 57 8.470 8.470 8.159 0.311 17919 69781 1 170 . 1 1 58 58 ASP N N 58 124.190 124.190 122.230 1.960 17919 69782 1 170 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.301 -0.005 17919 69783 1 170 . 1 1 58 58 ASP C C 58 177.400 177.400 177.373 0.027 17919 69784 1 170 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.683 0.497 17919 69785 1 170 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.352 -0.252 17919 69786 1 170 . 1 1 58 58 ASP H H 58 7.930 7.930 7.798 0.132 17919 69787 1 170 . 1 1 59 59 TYR N N 59 115.510 115.510 115.564 -0.054 17919 69788 1 170 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.534 0.136 17919 69789 1 170 . 1 1 59 59 TYR C C 59 174.700 174.700 175.157 -0.457 17919 69790 1 170 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.215 1.035 17919 69791 1 170 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.384 1.686 17919 69792 1 170 . 1 1 59 59 TYR H H 59 7.250 7.250 7.353 -0.103 17919 69793 1 170 . 1 1 60 60 ASN N N 60 115.900 115.900 117.259 -1.359 17919 69794 1 170 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.436 -0.081 17919 69795 1 170 . 1 1 60 60 ASN C C 60 174.340 174.340 174.696 -0.356 17919 69796 1 170 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.354 -0.234 17919 69797 1 170 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.167 0.243 17919 69798 1 170 . 1 1 60 60 ASN H H 60 8.150 8.150 8.157 -0.007 17919 69799 1 170 . 1 1 61 61 ILE N N 61 118.600 118.600 118.768 -0.168 17919 69800 1 170 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.922 -0.529 17919 69801 1 170 . 1 1 61 61 ILE C C 61 174.610 174.610 175.621 -1.011 17919 69802 1 170 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.142 1.278 17919 69803 1 170 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.362 -0.622 17919 69804 1 170 . 1 1 61 61 ILE H H 61 7.250 7.250 7.886 -0.636 17919 69805 1 170 . 1 1 62 62 GLN N N 62 124.740 124.740 124.280 0.460 17919 69806 1 170 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.803 -0.296 17919 69807 1 170 . 1 1 62 62 GLN C C 62 175.970 175.970 175.565 0.405 17919 69808 1 170 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.424 0.236 17919 69809 1 170 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.727 -0.077 17919 69810 1 170 . 1 1 62 62 GLN H H 62 7.610 7.610 8.000 -0.390 17919 69811 1 170 . 1 1 63 63 LYS N N 63 120.300 120.300 122.333 -2.033 17919 69812 1 170 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.047 -0.046 17919 69813 1 170 . 1 1 63 63 LYS C C 63 175.810 175.810 177.320 -1.510 17919 69814 1 170 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.167 -0.377 17919 69815 1 170 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.484 0.166 17919 69816 1 170 . 1 1 63 63 LYS H H 63 8.490 8.490 8.678 -0.188 17919 69817 1 170 . 1 1 64 64 GLU N N 64 113.950 113.950 121.030 -7.080 17919 69818 1 170 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.648 -0.183 17919 69819 1 170 . 1 1 64 64 GLU C C 64 175.250 175.250 175.946 -0.696 17919 69820 1 170 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.926 -0.036 17919 69821 1 170 . 1 1 64 64 GLU CB C 64 25.900 25.900 29.185 -3.285 17919 69822 1 170 . 1 1 64 64 GLU H H 64 9.280 9.280 8.817 0.463 17919 69823 1 170 . 1 1 65 65 SER N N 65 114.730 114.730 115.457 -0.727 17919 69824 1 170 . 1 1 65 65 SER HA H 65 4.640 4.640 4.545 0.095 17919 69825 1 170 . 1 1 65 65 SER C C 65 172.160 172.160 174.148 -1.988 17919 69826 1 170 . 1 1 65 65 SER CA C 65 60.890 60.890 60.515 0.375 17919 69827 1 170 . 1 1 65 65 SER CB C 65 64.910 64.910 63.820 1.090 17919 69828 1 170 . 1 1 65 65 SER H H 65 7.670 7.670 7.695 -0.025 17919 69829 1 170 . 1 1 66 66 THR N N 66 117.110 117.110 119.049 -1.939 17919 69830 1 170 . 1 1 66 66 THR HA H 66 5.270 5.270 5.068 0.202 17919 69831 1 170 . 1 1 66 66 THR C C 66 173.950 173.950 174.126 -0.176 17919 69832 1 170 . 1 1 66 66 THR CA C 66 62.340 62.340 62.124 0.215 17919 69833 1 170 . 1 1 66 66 THR CB C 66 70.080 70.080 69.882 0.198 17919 69834 1 170 . 1 1 66 66 THR H H 66 8.730 8.730 8.335 0.395 17919 69835 1 170 . 1 1 67 67 LEU N N 67 127.110 127.110 126.357 0.753 17919 69836 1 170 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.879 0.181 17919 69837 1 170 . 1 1 67 67 LEU C C 67 175.770 175.770 175.265 0.505 17919 69838 1 170 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.888 0.012 17919 69839 1 170 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.478 -0.218 17919 69840 1 170 . 1 1 67 67 LEU H H 67 9.410 9.410 9.025 0.385 17919 69841 1 170 . 1 1 68 68 HIS N N 68 118.380 118.380 122.124 -3.744 17919 69842 1 170 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.402 -0.162 17919 69843 1 170 . 1 1 68 68 HIS C C 68 173.150 173.150 173.403 -0.253 17919 69844 1 170 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.363 0.637 17919 69845 1 170 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.699 -2.169 17919 69846 1 170 . 1 1 68 68 HIS H H 68 9.230 9.230 9.105 0.125 17919 69847 1 170 . 1 1 69 69 LEU N N 69 124.460 124.460 129.919 -5.459 17919 69848 1 170 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.969 0.221 17919 69849 1 170 . 1 1 69 69 LEU C C 69 175.270 175.270 173.884 1.386 17919 69850 1 170 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.326 0.564 17919 69851 1 170 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.412 -0.032 17919 69852 1 170 . 1 1 69 69 LEU H H 69 8.340 8.340 8.315 0.025 17919 69853 1 170 . 1 1 70 70 VAL N N 70 126.940 126.940 127.025 -0.085 17919 69854 1 170 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.390 -0.040 17919 69855 1 170 . 1 1 70 70 VAL C C 70 174.000 174.000 174.489 -0.489 17919 69856 1 170 . 1 1 70 70 VAL CA C 70 60.800 60.800 61.028 -0.228 17919 69857 1 170 . 1 1 70 70 VAL CB C 70 34.910 34.910 34.295 0.615 17919 69858 1 170 . 1 1 70 70 VAL H H 70 9.200 9.200 9.152 0.048 17919 69859 1 170 . 1 1 71 71 LEU N N 71 123.130 123.130 127.122 -3.992 17919 69860 1 170 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.839 0.221 17919 69861 1 170 . 1 1 71 71 LEU C C 71 177.830 177.830 176.798 1.032 17919 69862 1 170 . 1 1 71 71 LEU CA C 71 53.940 53.940 54.123 -0.184 17919 69863 1 170 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.316 -0.466 17919 69864 1 170 . 1 1 71 71 LEU H H 71 8.120 8.120 8.527 -0.407 17919 69865 1 170 . 1 1 72 72 ARG N N 72 123.490 123.490 124.345 -0.855 17919 69866 1 170 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.349 -0.048 17919 69867 1 170 . 1 1 72 72 ARG C C 72 175.350 175.350 175.915 -0.565 17919 69868 1 170 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.988 -0.378 17919 69869 1 170 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.647 0.703 17919 69870 1 170 . 1 1 72 72 ARG H H 72 8.580 8.580 8.173 0.407 17919 69871 1 171 . 1 1 2 2 GLN N N 2 123.220 123.220 125.060 -1.840 17919 69872 1 171 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.289 -0.040 17919 69873 1 171 . 1 1 2 2 GLN C C 2 175.920 175.920 174.734 1.186 17919 69874 1 171 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.684 0.396 17919 69875 1 171 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.475 0.285 17919 69876 1 171 . 1 1 2 2 GLN H H 2 8.900 8.900 8.387 0.513 17919 69877 1 171 . 1 1 3 3 ILE N N 3 115.340 115.340 118.025 -2.685 17919 69878 1 171 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.848 -0.635 17919 69879 1 171 . 1 1 3 3 ILE C C 3 172.450 172.450 173.663 -1.213 17919 69880 1 171 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.220 0.350 17919 69881 1 171 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.847 0.363 17919 69882 1 171 . 1 1 3 3 ILE H H 3 8.320 8.320 8.575 -0.255 17919 69883 1 171 . 1 1 4 4 PHE N N 4 118.110 118.110 119.608 -1.498 17919 69884 1 171 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.309 0.321 17919 69885 1 171 . 1 1 4 4 PHE C C 4 175.320 175.320 174.707 0.613 17919 69886 1 171 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.857 -0.647 17919 69887 1 171 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.236 -0.756 17919 69888 1 171 . 1 1 4 4 PHE H H 4 8.610 8.610 8.723 -0.113 17919 69889 1 171 . 1 1 5 5 VAL N N 5 121.000 121.000 122.586 -1.586 17919 69890 1 171 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.914 -0.189 17919 69891 1 171 . 1 1 5 5 VAL C C 5 174.870 174.870 175.400 -0.530 17919 69892 1 171 . 1 1 5 5 VAL CA C 5 60.620 60.620 60.862 -0.242 17919 69893 1 171 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.381 0.849 17919 69894 1 171 . 1 1 5 5 VAL H H 5 9.300 9.300 9.128 0.172 17919 69895 1 171 . 1 1 6 6 LYS N N 6 127.520 127.520 128.557 -1.037 17919 69896 1 171 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.507 -0.140 17919 69897 1 171 . 1 1 6 6 LYS C C 6 177.140 177.140 176.789 0.351 17919 69898 1 171 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.972 -0.452 17919 69899 1 171 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.594 -0.544 17919 69900 1 171 . 1 1 6 6 LYS H H 6 8.820 8.820 8.825 -0.005 17919 69901 1 171 . 1 1 7 7 THR N N 7 115.400 115.400 115.966 -0.566 17919 69902 1 171 . 1 1 7 7 THR HA H 7 4.970 4.970 5.107 -0.137 17919 69903 1 171 . 1 1 7 7 THR C C 7 176.910 176.910 176.077 0.833 17919 69904 1 171 . 1 1 7 7 THR CA C 7 60.470 60.470 59.902 0.568 17919 69905 1 171 . 1 1 7 7 THR CB C 7 70.630 70.630 70.967 -0.337 17919 69906 1 171 . 1 1 7 7 THR H H 7 8.730 8.730 8.552 0.178 17919 69907 1 171 . 1 1 8 8 LEU N N 8 121.330 121.330 120.119 1.211 17919 69908 1 171 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.291 0.019 17919 69909 1 171 . 1 1 8 8 LEU C C 8 178.800 178.800 178.527 0.273 17919 69910 1 171 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.503 0.077 17919 69911 1 171 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.765 0.205 17919 69912 1 171 . 1 1 8 8 LEU H H 8 9.100 9.100 8.837 0.263 17919 69913 1 171 . 1 1 9 9 THR N N 9 105.590 105.590 109.514 -3.924 17919 69914 1 171 . 1 1 9 9 THR HA H 9 4.428 4.428 4.293 0.135 17919 69915 1 171 . 1 1 9 9 THR C C 9 175.520 175.520 175.636 -0.116 17919 69916 1 171 . 1 1 9 9 THR CA C 9 61.400 61.400 62.370 -0.970 17919 69917 1 171 . 1 1 9 9 THR CB C 9 69.140 69.140 69.201 -0.061 17919 69918 1 171 . 1 1 9 9 THR H H 9 7.630 7.630 8.009 -0.379 17919 69919 1 171 . 1 1 10 10 GLY N N 10 108.890 108.890 110.180 -1.290 17919 69920 1 171 . 1 1 10 10 GLY C C 10 174.070 174.070 173.671 0.399 17919 69921 1 171 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.771 0.689 17919 69922 1 171 . 1 1 10 10 GLY H H 10 7.810 7.810 7.512 0.298 17919 69923 1 171 . 1 1 11 11 LYS N N 11 121.600 121.600 121.056 0.544 17919 69924 1 171 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.298 0.063 17919 69925 1 171 . 1 1 11 11 LYS C C 11 175.940 175.940 175.409 0.531 17919 69926 1 171 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.551 -0.272 17919 69927 1 171 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.389 -0.189 17919 69928 1 171 . 1 1 11 11 LYS H H 11 7.280 7.280 7.639 -0.359 17919 69929 1 171 . 1 1 12 12 THR N N 12 120.440 120.440 120.149 0.291 17919 69930 1 171 . 1 1 12 12 THR HA H 12 5.046 5.046 5.409 -0.363 17919 69931 1 171 . 1 1 12 12 THR C C 12 174.320 174.320 174.270 0.050 17919 69932 1 171 . 1 1 12 12 THR CA C 12 62.390 62.390 61.062 1.328 17919 69933 1 171 . 1 1 12 12 THR CB C 12 69.910 69.910 70.161 -0.251 17919 69934 1 171 . 1 1 12 12 THR H H 12 8.650 8.650 8.187 0.463 17919 69935 1 171 . 1 1 13 13 ILE N N 13 127.110 127.110 123.573 3.537 17919 69936 1 171 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.744 -0.200 17919 69937 1 171 . 1 1 13 13 ILE C C 13 175.220 175.220 174.722 0.498 17919 69938 1 171 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.638 0.342 17919 69939 1 171 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.370 0.580 17919 69940 1 171 . 1 1 13 13 ILE H H 13 9.450 9.450 9.003 0.447 17919 69941 1 171 . 1 1 14 14 THR N N 14 121.520 121.520 124.211 -2.691 17919 69942 1 171 . 1 1 14 14 THR HA H 14 4.964 4.964 4.793 0.171 17919 69943 1 171 . 1 1 14 14 THR C C 14 173.790 173.790 173.704 0.086 17919 69944 1 171 . 1 1 14 14 THR CA C 14 61.940 61.940 62.033 -0.093 17919 69945 1 171 . 1 1 14 14 THR CB C 14 69.650 69.650 69.848 -0.198 17919 69946 1 171 . 1 1 14 14 THR H H 14 8.710 8.710 8.405 0.305 17919 69947 1 171 . 1 1 15 15 LEU N N 15 124.800 124.800 124.848 -0.048 17919 69948 1 171 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.759 0.021 17919 69949 1 171 . 1 1 15 15 LEU C C 15 174.670 174.670 175.144 -0.474 17919 69950 1 171 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.406 -0.576 17919 69951 1 171 . 1 1 15 15 LEU CB C 15 47.070 47.070 46.607 0.463 17919 69952 1 171 . 1 1 15 15 LEU H H 15 8.710 8.710 8.390 0.320 17919 69953 1 171 . 1 1 16 16 GLU N N 16 122.160 122.160 121.409 0.751 17919 69954 1 171 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.351 -0.434 17919 69955 1 171 . 1 1 16 16 GLU C C 16 175.860 175.860 175.935 -0.075 17919 69956 1 171 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.017 -0.197 17919 69957 1 171 . 1 1 16 16 GLU CB C 16 29.450 29.450 31.417 -1.967 17919 69958 1 171 . 1 1 16 16 GLU H H 16 8.140 8.140 8.574 -0.434 17919 69959 1 171 . 1 1 17 17 VAL N N 17 117.210 117.210 119.048 -1.838 17919 69960 1 171 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.585 0.129 17919 69961 1 171 . 1 1 17 17 VAL C C 17 174.160 174.160 174.808 -0.648 17919 69962 1 171 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.669 -0.239 17919 69963 1 171 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.280 1.120 17919 69964 1 171 . 1 1 17 17 VAL H H 17 8.900 8.900 8.810 0.090 17919 69965 1 171 . 1 1 18 18 GLU N N 18 118.990 118.990 119.946 -0.956 17919 69966 1 171 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.718 0.361 17919 69967 1 171 . 1 1 18 18 GLU C C 18 176.160 176.160 175.564 0.596 17919 69968 1 171 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.186 -0.466 17919 69969 1 171 . 1 1 18 18 GLU CB C 18 30.310 30.310 29.405 0.904 17919 69970 1 171 . 1 1 18 18 GLU H H 18 8.640 8.640 8.948 -0.308 17919 69971 1 171 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.380 -0.239 17919 69972 1 171 . 1 1 19 19 PRO C C 19 175.310 175.310 177.366 -2.056 17919 69973 1 171 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.117 0.353 17919 69974 1 171 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.043 -0.093 17919 69975 1 171 . 1 1 20 20 SER N N 20 103.400 103.400 109.542 -6.142 17919 69976 1 171 . 1 1 20 20 SER HA H 20 4.370 4.370 4.373 -0.003 17919 69977 1 171 . 1 1 20 20 SER C C 20 174.660 174.660 174.775 -0.115 17919 69978 1 171 . 1 1 20 20 SER CA C 20 57.400 57.400 58.517 -1.117 17919 69979 1 171 . 1 1 20 20 SER CB C 20 63.370 63.370 63.043 0.327 17919 69980 1 171 . 1 1 20 20 SER H H 20 7.040 7.040 7.967 -0.927 17919 69981 1 171 . 1 1 21 21 ASP N N 21 123.480 123.480 124.148 -0.668 17919 69982 1 171 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.687 0.008 17919 69983 1 171 . 1 1 21 21 ASP C C 21 176.360 176.360 176.014 0.346 17919 69984 1 171 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.216 0.484 17919 69985 1 171 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.330 -0.530 17919 69986 1 171 . 1 1 21 21 ASP H H 21 8.030 8.030 8.137 -0.107 17919 69987 1 171 . 1 1 22 22 THR N N 22 108.800 108.800 109.445 -0.645 17919 69988 1 171 . 1 1 22 22 THR HA H 22 4.920 4.920 4.863 0.057 17919 69989 1 171 . 1 1 22 22 THR C C 22 176.750 176.750 176.149 0.601 17919 69990 1 171 . 1 1 22 22 THR CA C 22 59.690 59.690 61.385 -1.695 17919 69991 1 171 . 1 1 22 22 THR CB C 22 71.200 71.200 70.121 1.079 17919 69992 1 171 . 1 1 22 22 THR H H 22 7.900 7.900 8.234 -0.334 17919 69993 1 171 . 1 1 23 23 ILE N N 23 121.190 121.190 122.486 -1.296 17919 69994 1 171 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.837 -0.180 17919 69995 1 171 . 1 1 23 23 ILE C C 23 179.040 179.040 177.667 1.373 17919 69996 1 171 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.218 0.042 17919 69997 1 171 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.375 -2.025 17919 69998 1 171 . 1 1 23 23 ILE H H 23 8.560 8.560 9.149 -0.589 17919 69999 1 171 . 1 1 24 24 GLU N N 24 120.830 120.830 121.918 -1.088 17919 70000 1 171 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.880 0.037 17919 70001 1 171 . 1 1 24 24 GLU C C 24 178.640 178.640 178.382 0.258 17919 70002 1 171 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.141 0.079 17919 70003 1 171 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.554 -1.274 17919 70004 1 171 . 1 1 24 24 GLU H H 24 9.760 9.760 8.586 1.174 17919 70005 1 171 . 1 1 25 25 ASN N N 25 120.570 120.570 117.984 2.586 17919 70006 1 171 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.467 0.058 17919 70007 1 171 . 1 1 25 25 ASN C C 25 178.380 178.380 177.928 0.452 17919 70008 1 171 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.996 0.064 17919 70009 1 171 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.142 0.308 17919 70010 1 171 . 1 1 25 25 ASN H H 25 7.920 7.920 7.844 0.076 17919 70011 1 171 . 1 1 26 26 VAL N N 26 121.710 121.710 120.430 1.280 17919 70012 1 171 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.517 -0.120 17919 70013 1 171 . 1 1 26 26 VAL C C 26 177.950 177.950 177.812 0.138 17919 70014 1 171 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.980 0.681 17919 70015 1 171 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.372 -0.532 17919 70016 1 171 . 1 1 26 26 VAL H H 26 8.070 8.070 8.014 0.056 17919 70017 1 171 . 1 1 27 27 LYS N N 27 118.860 118.860 120.343 -1.483 17919 70018 1 171 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.107 0.473 17919 70019 1 171 . 1 1 27 27 LYS C C 27 180.550 180.550 179.277 1.273 17919 70020 1 171 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.688 -0.438 17919 70021 1 171 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.260 1.470 17919 70022 1 171 . 1 1 27 27 LYS H H 27 8.560 8.560 8.097 0.463 17919 70023 1 171 . 1 1 28 28 ALA N N 28 123.440 123.440 121.673 1.767 17919 70024 1 171 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.007 0.153 17919 70025 1 171 . 1 1 28 28 ALA C C 28 180.300 180.300 179.201 1.099 17919 70026 1 171 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.136 0.234 17919 70027 1 171 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.332 -0.622 17919 70028 1 171 . 1 1 28 28 ALA H H 28 8.060 8.060 8.670 -0.610 17919 70029 1 171 . 1 1 29 29 LYS N N 29 119.940 119.940 119.045 0.895 17919 70030 1 171 . 1 1 29 29 LYS HA H 29 4.207 4.207 3.988 0.219 17919 70031 1 171 . 1 1 29 29 LYS C C 29 180.320 180.320 179.111 1.209 17919 70032 1 171 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.488 0.162 17919 70033 1 171 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.302 0.988 17919 70034 1 171 . 1 1 29 29 LYS H H 29 7.850 7.850 7.877 -0.027 17919 70035 1 171 . 1 1 30 30 ILE N N 30 121.080 121.080 120.818 0.262 17919 70036 1 171 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.615 -0.108 17919 70037 1 171 . 1 1 30 30 ILE C C 30 178.310 178.310 177.533 0.777 17919 70038 1 171 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.311 0.839 17919 70039 1 171 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.569 -0.769 17919 70040 1 171 . 1 1 30 30 ILE H H 30 8.280 8.280 8.323 -0.043 17919 70041 1 171 . 1 1 31 31 GLN N N 31 123.490 123.490 121.034 2.456 17919 70042 1 171 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.142 -0.313 17919 70043 1 171 . 1 1 31 31 GLN C C 31 178.890 178.890 178.151 0.739 17919 70044 1 171 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.163 0.836 17919 70045 1 171 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.363 -0.643 17919 70046 1 171 . 1 1 31 31 GLN H H 31 8.580 8.580 7.985 0.595 17919 70047 1 171 . 1 1 32 32 ASP N N 32 119.360 119.360 118.443 0.917 17919 70048 1 171 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.410 -0.056 17919 70049 1 171 . 1 1 32 32 ASP C C 32 177.250 177.250 178.311 -1.061 17919 70050 1 171 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.722 0.467 17919 70051 1 171 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.959 -0.379 17919 70052 1 171 . 1 1 32 32 ASP H H 32 8.010 8.010 7.938 0.072 17919 70053 1 171 . 1 1 33 33 LYS N N 33 115.130 115.130 118.466 -3.336 17919 70054 1 171 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.212 0.125 17919 70055 1 171 . 1 1 33 33 LYS C C 33 177.870 177.870 177.934 -0.064 17919 70056 1 171 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.006 0.044 17919 70057 1 171 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.264 0.905 17919 70058 1 171 . 1 1 33 33 LYS H H 33 7.430 7.430 7.551 -0.121 17919 70059 1 171 . 1 1 34 34 GLU N N 34 113.870 113.870 114.699 -0.829 17919 70060 1 171 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.446 0.179 17919 70061 1 171 . 1 1 34 34 GLU C C 34 177.840 177.840 176.822 1.018 17919 70062 1 171 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.641 -0.471 17919 70063 1 171 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.535 1.125 17919 70064 1 171 . 1 1 34 34 GLU H H 34 8.740 8.740 8.415 0.325 17919 70065 1 171 . 1 1 35 35 GLY N N 35 108.650 108.650 107.639 1.011 17919 70066 1 171 . 1 1 35 35 GLY C C 35 173.960 173.960 174.705 -0.745 17919 70067 1 171 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.451 0.629 17919 70068 1 171 . 1 1 35 35 GLY H H 35 8.530 8.530 7.831 0.699 17919 70069 1 171 . 1 1 36 36 ILE N N 36 119.880 119.880 122.678 -2.798 17919 70070 1 171 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.367 0.078 17919 70071 1 171 . 1 1 36 36 ILE C C 36 173.590 173.590 174.432 -0.842 17919 70072 1 171 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.922 -0.172 17919 70073 1 171 . 1 1 36 36 ILE CB C 36 40.580 40.580 39.159 1.421 17919 70074 1 171 . 1 1 36 36 ILE H H 36 6.150 6.150 7.576 -1.426 17919 70075 1 171 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.634 0.000 17919 70076 1 171 . 1 1 37 37 PRO C C 37 176.940 176.940 176.137 0.803 17919 70077 1 171 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.417 0.243 17919 70078 1 171 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.024 0.826 17919 70079 1 171 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.155 -0.038 17919 70080 1 171 . 1 1 38 38 PRO C C 38 178.320 178.320 178.034 0.286 17919 70081 1 171 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.597 0.663 17919 70082 1 171 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.800 1.090 17919 70083 1 171 . 1 1 39 39 ASP N N 39 113.380 113.380 114.398 -1.018 17919 70084 1 171 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.453 -0.023 17919 70085 1 171 . 1 1 39 39 ASP C C 39 177.090 177.090 176.579 0.511 17919 70086 1 171 . 1 1 39 39 ASP CA C 39 55.640 55.640 55.987 -0.347 17919 70087 1 171 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.534 -0.994 17919 70088 1 171 . 1 1 39 39 ASP H H 39 8.550 8.550 8.472 0.078 17919 70089 1 171 . 1 1 40 40 GLN N N 40 116.780 116.780 116.573 0.207 17919 70090 1 171 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.270 0.194 17919 70091 1 171 . 1 1 40 40 GLN C C 40 175.380 175.380 175.297 0.083 17919 70092 1 171 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.131 -0.491 17919 70093 1 171 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.322 0.818 17919 70094 1 171 . 1 1 40 40 GLN H H 40 7.820 7.820 7.803 0.017 17919 70095 1 171 . 1 1 41 41 GLN N N 41 117.720 117.720 118.752 -1.032 17919 70096 1 171 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.525 -0.281 17919 70097 1 171 . 1 1 41 41 GLN C C 41 176.300 176.300 175.463 0.837 17919 70098 1 171 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.854 0.616 17919 70099 1 171 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.890 1.760 17919 70100 1 171 . 1 1 41 41 GLN H H 41 7.480 7.480 7.143 0.337 17919 70101 1 171 . 1 1 42 42 ARG N N 42 122.680 122.680 125.336 -2.656 17919 70102 1 171 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.634 -0.134 17919 70103 1 171 . 1 1 42 42 ARG C C 42 174.050 174.050 173.678 0.372 17919 70104 1 171 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.828 0.222 17919 70105 1 171 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.952 -1.202 17919 70106 1 171 . 1 1 42 42 ARG H H 42 8.530 8.530 8.772 -0.242 17919 70107 1 171 . 1 1 43 43 LEU N N 43 124.040 124.040 128.496 -4.456 17919 70108 1 171 . 1 1 43 43 LEU C C 43 175.290 175.290 174.955 0.335 17919 70109 1 171 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.001 -1.021 17919 70110 1 171 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.732 1.058 17919 70111 1 171 . 1 1 43 43 LEU H H 43 8.820 8.820 8.792 0.028 17919 70112 1 171 . 1 1 44 44 ILE N N 44 121.920 121.920 120.341 1.579 17919 70113 1 171 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.034 -0.042 17919 70114 1 171 . 1 1 44 44 ILE C C 44 176.060 176.060 173.341 2.719 17919 70115 1 171 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.233 -0.253 17919 70116 1 171 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.745 -0.325 17919 70117 1 171 . 1 1 44 44 ILE H H 44 9.030 9.030 8.800 0.230 17919 70118 1 171 . 1 1 45 45 PHE N N 45 125.390 125.390 126.224 -0.834 17919 70119 1 171 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.107 -0.062 17919 70120 1 171 . 1 1 45 45 PHE C C 45 174.470 174.470 175.037 -0.567 17919 70121 1 171 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.067 0.953 17919 70122 1 171 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.507 1.253 17919 70123 1 171 . 1 1 45 45 PHE H H 45 8.830 8.830 8.112 0.718 17919 70124 1 171 . 1 1 46 46 ALA N N 46 132.200 132.200 130.575 1.625 17919 70125 1 171 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.711 -0.021 17919 70126 1 171 . 1 1 46 46 ALA C C 46 177.290 177.290 177.806 -0.516 17919 70127 1 171 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.354 0.186 17919 70128 1 171 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.223 0.347 17919 70129 1 171 . 1 1 46 46 ALA H H 46 8.810 8.810 9.083 -0.273 17919 70130 1 171 . 1 1 47 47 GLY N N 47 102.340 102.340 103.503 -1.163 17919 70131 1 171 . 1 1 47 47 GLY C C 47 173.810 173.810 174.493 -0.683 17919 70132 1 171 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.752 -0.402 17919 70133 1 171 . 1 1 47 47 GLY H H 47 8.130 8.130 8.749 -0.619 17919 70134 1 171 . 1 1 48 48 LYS N N 48 121.570 121.570 121.388 0.182 17919 70135 1 171 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.566 0.056 17919 70136 1 171 . 1 1 48 48 LYS C C 48 174.700 174.700 175.289 -0.589 17919 70137 1 171 . 1 1 48 48 LYS CA C 48 54.550 54.550 53.887 0.663 17919 70138 1 171 . 1 1 48 48 LYS CB C 48 34.530 34.530 33.433 1.097 17919 70139 1 171 . 1 1 48 48 LYS H H 48 7.980 7.980 8.015 -0.035 17919 70140 1 171 . 1 1 49 49 GLN N N 49 122.410 122.410 125.527 -3.117 17919 70141 1 171 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.117 0.443 17919 70142 1 171 . 1 1 49 49 GLN C C 49 175.670 175.670 175.192 0.478 17919 70143 1 171 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.825 -0.085 17919 70144 1 171 . 1 1 49 49 GLN CB C 49 29.000 29.000 28.400 0.600 17919 70145 1 171 . 1 1 49 49 GLN H H 49 8.600 8.600 8.497 0.103 17919 70146 1 171 . 1 1 50 50 LEU N N 50 125.520 125.520 127.324 -1.804 17919 70147 1 171 . 1 1 50 50 LEU HA H 50 4.090 4.090 3.334 0.756 17919 70148 1 171 . 1 1 50 50 LEU C C 50 176.660 176.660 176.915 -0.255 17919 70149 1 171 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.047 0.193 17919 70150 1 171 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.660 -0.090 17919 70151 1 171 . 1 1 50 50 LEU H H 50 8.530 8.530 8.099 0.431 17919 70152 1 171 . 1 1 51 51 GLU N N 51 122.940 122.940 123.724 -0.784 17919 70153 1 171 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.358 0.130 17919 70154 1 171 . 1 1 51 51 GLU C C 51 175.870 175.870 176.724 -0.854 17919 70155 1 171 . 1 1 51 51 GLU CA C 51 55.960 55.960 56.049 -0.089 17919 70156 1 171 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.055 0.515 17919 70157 1 171 . 1 1 51 51 GLU H H 51 8.400 8.400 8.115 0.285 17919 70158 1 171 . 1 1 52 52 ASP N N 52 120.030 120.030 124.129 -4.099 17919 70159 1 171 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.418 -0.059 17919 70160 1 171 . 1 1 52 52 ASP C C 52 177.330 177.330 177.878 -0.548 17919 70161 1 171 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.954 -0.994 17919 70162 1 171 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.734 0.116 17919 70163 1 171 . 1 1 52 52 ASP H H 52 8.160 8.160 8.866 -0.706 17919 70164 1 171 . 1 1 53 53 GLY N N 53 106.660 106.660 104.946 1.714 17919 70165 1 171 . 1 1 53 53 GLY C C 53 174.870 174.870 174.019 0.851 17919 70166 1 171 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.911 0.259 17919 70167 1 171 . 1 1 53 53 GLY H H 53 9.390 9.390 8.472 0.918 17919 70168 1 171 . 1 1 54 54 ARG N N 54 119.050 119.050 119.543 -0.493 17919 70169 1 171 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.746 -0.051 17919 70170 1 171 . 1 1 54 54 ARG C C 54 175.350 175.350 175.265 0.085 17919 70171 1 171 . 1 1 54 54 ARG CA C 54 54.390 54.390 53.629 0.761 17919 70172 1 171 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.903 -1.252 17919 70173 1 171 . 1 1 54 54 ARG H H 54 7.460 7.460 7.456 0.004 17919 70174 1 171 . 1 1 55 55 THR N N 55 108.400 108.400 113.124 -4.724 17919 70175 1 171 . 1 1 55 55 THR HA H 55 5.240 5.240 4.911 0.329 17919 70176 1 171 . 1 1 55 55 THR C C 55 176.560 176.560 176.358 0.202 17919 70177 1 171 . 1 1 55 55 THR CA C 55 59.690 59.690 61.113 -1.423 17919 70178 1 171 . 1 1 55 55 THR CB C 55 72.260 72.260 70.377 1.883 17919 70179 1 171 . 1 1 55 55 THR H H 55 8.730 8.730 9.164 -0.434 17919 70180 1 171 . 1 1 56 56 LEU N N 56 117.920 117.920 122.670 -4.750 17919 70181 1 171 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.826 0.234 17919 70182 1 171 . 1 1 56 56 LEU C C 56 180.810 180.810 178.642 2.168 17919 70183 1 171 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.531 0.179 17919 70184 1 171 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.316 -0.945 17919 70185 1 171 . 1 1 56 56 LEU H H 56 8.140 8.140 8.845 -0.705 17919 70186 1 171 . 1 1 57 57 SER N N 57 113.330 113.330 112.841 0.489 17919 70187 1 171 . 1 1 57 57 SER HA H 57 4.370 4.370 4.247 0.123 17919 70188 1 171 . 1 1 57 57 SER C C 57 178.310 178.310 176.602 1.708 17919 70189 1 171 . 1 1 57 57 SER CA C 57 61.080 61.080 61.650 -0.570 17919 70190 1 171 . 1 1 57 57 SER CB C 57 62.530 62.530 62.483 0.047 17919 70191 1 171 . 1 1 57 57 SER H H 57 8.470 8.470 8.505 -0.035 17919 70192 1 171 . 1 1 58 58 ASP N N 58 124.190 124.190 122.414 1.776 17919 70193 1 171 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.316 -0.020 17919 70194 1 171 . 1 1 58 58 ASP C C 58 177.400 177.400 176.891 0.509 17919 70195 1 171 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.871 0.309 17919 70196 1 171 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.623 -0.523 17919 70197 1 171 . 1 1 58 58 ASP H H 58 7.930 7.930 7.903 0.027 17919 70198 1 171 . 1 1 59 59 TYR N N 59 115.510 115.510 115.448 0.062 17919 70199 1 171 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.728 -0.058 17919 70200 1 171 . 1 1 59 59 TYR C C 59 174.700 174.700 174.874 -0.174 17919 70201 1 171 . 1 1 59 59 TYR CA C 59 58.250 58.250 56.611 1.639 17919 70202 1 171 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.068 2.002 17919 70203 1 171 . 1 1 59 59 TYR H H 59 7.250 7.250 7.427 -0.177 17919 70204 1 171 . 1 1 60 60 ASN N N 60 115.900 115.900 117.903 -2.003 17919 70205 1 171 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.294 0.061 17919 70206 1 171 . 1 1 60 60 ASN C C 60 174.340 174.340 174.754 -0.414 17919 70207 1 171 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.215 -0.096 17919 70208 1 171 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.643 -0.233 17919 70209 1 171 . 1 1 60 60 ASN H H 60 8.150 8.150 7.708 0.442 17919 70210 1 171 . 1 1 61 61 ILE N N 61 118.600 118.600 119.637 -1.037 17919 70211 1 171 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.480 -0.087 17919 70212 1 171 . 1 1 61 61 ILE C C 61 174.610 174.610 174.669 -0.059 17919 70213 1 171 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.811 0.609 17919 70214 1 171 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.232 -0.492 17919 70215 1 171 . 1 1 61 61 ILE H H 61 7.250 7.250 8.019 -0.769 17919 70216 1 171 . 1 1 62 62 GLN N N 62 124.740 124.740 124.614 0.126 17919 70217 1 171 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.771 -0.265 17919 70218 1 171 . 1 1 62 62 GLN C C 62 175.970 175.970 175.645 0.325 17919 70219 1 171 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.226 0.434 17919 70220 1 171 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.823 -0.173 17919 70221 1 171 . 1 1 62 62 GLN H H 62 7.610 7.610 7.927 -0.317 17919 70222 1 171 . 1 1 63 63 LYS N N 63 120.300 120.300 121.886 -1.586 17919 70223 1 171 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.933 0.068 17919 70224 1 171 . 1 1 63 63 LYS C C 63 175.810 175.810 176.767 -0.957 17919 70225 1 171 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.987 -0.197 17919 70226 1 171 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.563 1.087 17919 70227 1 171 . 1 1 63 63 LYS H H 63 8.490 8.490 8.685 -0.195 17919 70228 1 171 . 1 1 64 64 GLU N N 64 113.950 113.950 119.053 -5.103 17919 70229 1 171 . 1 1 64 64 GLU HA H 64 3.465 3.465 4.129 -0.664 17919 70230 1 171 . 1 1 64 64 GLU C C 64 175.250 175.250 175.817 -0.567 17919 70231 1 171 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.577 0.313 17919 70232 1 171 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.166 -2.266 17919 70233 1 171 . 1 1 64 64 GLU H H 64 9.280 9.280 9.012 0.268 17919 70234 1 171 . 1 1 65 65 SER N N 65 114.730 114.730 115.041 -0.311 17919 70235 1 171 . 1 1 65 65 SER HA H 65 4.640 4.640 4.529 0.111 17919 70236 1 171 . 1 1 65 65 SER C C 65 172.160 172.160 174.272 -2.112 17919 70237 1 171 . 1 1 65 65 SER CA C 65 60.890 60.890 60.355 0.535 17919 70238 1 171 . 1 1 65 65 SER CB C 65 64.910 64.910 64.366 0.544 17919 70239 1 171 . 1 1 65 65 SER H H 65 7.670 7.670 7.597 0.073 17919 70240 1 171 . 1 1 66 66 THR N N 66 117.110 117.110 119.240 -2.130 17919 70241 1 171 . 1 1 66 66 THR HA H 66 5.270 5.270 5.123 0.147 17919 70242 1 171 . 1 1 66 66 THR C C 66 173.950 173.950 174.207 -0.257 17919 70243 1 171 . 1 1 66 66 THR CA C 66 62.340 62.340 61.671 0.669 17919 70244 1 171 . 1 1 66 66 THR CB C 66 70.080 70.080 70.687 -0.607 17919 70245 1 171 . 1 1 66 66 THR H H 66 8.730 8.730 8.377 0.353 17919 70246 1 171 . 1 1 67 67 LEU N N 67 127.110 127.110 126.899 0.211 17919 70247 1 171 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.900 0.160 17919 70248 1 171 . 1 1 67 67 LEU C C 67 175.770 175.770 175.594 0.176 17919 70249 1 171 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.974 -0.074 17919 70250 1 171 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.347 -0.088 17919 70251 1 171 . 1 1 67 67 LEU H H 67 9.410 9.410 9.242 0.168 17919 70252 1 171 . 1 1 68 68 HIS N N 68 118.380 118.380 118.533 -0.153 17919 70253 1 171 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.119 0.121 17919 70254 1 171 . 1 1 68 68 HIS C C 68 173.150 173.150 174.305 -1.155 17919 70255 1 171 . 1 1 68 68 HIS CA C 68 55.000 55.000 55.315 -0.315 17919 70256 1 171 . 1 1 68 68 HIS CB C 68 30.530 30.530 31.288 -0.758 17919 70257 1 171 . 1 1 68 68 HIS H H 68 9.230 9.230 9.216 0.014 17919 70258 1 171 . 1 1 69 69 LEU N N 69 124.460 124.460 126.878 -2.418 17919 70259 1 171 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.039 0.151 17919 70260 1 171 . 1 1 69 69 LEU C C 69 175.270 175.270 174.890 0.380 17919 70261 1 171 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.053 -0.163 17919 70262 1 171 . 1 1 69 69 LEU CB C 69 44.380 44.380 43.590 0.790 17919 70263 1 171 . 1 1 69 69 LEU H H 69 8.340 8.340 8.650 -0.310 17919 70264 1 171 . 1 1 70 70 VAL N N 70 126.940 126.940 126.394 0.546 17919 70265 1 171 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.336 0.014 17919 70266 1 171 . 1 1 70 70 VAL C C 70 174.000 174.000 174.585 -0.585 17919 70267 1 171 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.992 -0.192 17919 70268 1 171 . 1 1 70 70 VAL CB C 70 34.910 34.910 34.384 0.526 17919 70269 1 171 . 1 1 70 70 VAL H H 70 9.200 9.200 9.155 0.045 17919 70270 1 171 . 1 1 71 71 LEU N N 71 123.130 123.130 124.642 -1.512 17919 70271 1 171 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.060 0.000 17919 70272 1 171 . 1 1 71 71 LEU C C 71 177.830 177.830 177.038 0.792 17919 70273 1 171 . 1 1 71 71 LEU CA C 71 53.940 53.940 52.837 1.103 17919 70274 1 171 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.602 0.248 17919 70275 1 171 . 1 1 71 71 LEU H H 71 8.120 8.120 8.285 -0.165 17919 70276 1 171 . 1 1 72 72 ARG N N 72 123.490 123.490 125.189 -1.699 17919 70277 1 171 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.382 -0.081 17919 70278 1 171 . 1 1 72 72 ARG C C 72 175.350 175.350 175.800 -0.450 17919 70279 1 171 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.005 -0.395 17919 70280 1 171 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.416 0.934 17919 70281 1 171 . 1 1 72 72 ARG H H 72 8.580 8.580 8.236 0.344 17919 70282 1 172 . 1 1 2 2 GLN N N 2 123.220 123.220 121.751 1.469 17919 70283 1 172 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.308 -0.059 17919 70284 1 172 . 1 1 2 2 GLN C C 2 175.920 175.920 175.124 0.796 17919 70285 1 172 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.858 0.223 17919 70286 1 172 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.595 0.165 17919 70287 1 172 . 1 1 2 2 GLN H H 2 8.900 8.900 8.313 0.587 17919 70288 1 172 . 1 1 3 3 ILE N N 3 115.340 115.340 117.635 -2.295 17919 70289 1 172 . 1 1 3 3 ILE HA H 3 4.213 4.213 5.024 -0.811 17919 70290 1 172 . 1 1 3 3 ILE C C 3 172.450 172.450 173.711 -1.261 17919 70291 1 172 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.187 0.383 17919 70292 1 172 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.962 0.248 17919 70293 1 172 . 1 1 3 3 ILE H H 3 8.320 8.320 8.280 0.040 17919 70294 1 172 . 1 1 4 4 PHE N N 4 118.110 118.110 120.102 -1.992 17919 70295 1 172 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.429 0.201 17919 70296 1 172 . 1 1 4 4 PHE C C 4 175.320 175.320 175.551 -0.231 17919 70297 1 172 . 1 1 4 4 PHE CA C 4 55.210 55.210 56.347 -1.137 17919 70298 1 172 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.264 0.216 17919 70299 1 172 . 1 1 4 4 PHE H H 4 8.610 8.610 8.841 -0.231 17919 70300 1 172 . 1 1 5 5 VAL N N 5 121.000 121.000 123.715 -2.715 17919 70301 1 172 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.515 0.210 17919 70302 1 172 . 1 1 5 5 VAL C C 5 174.870 174.870 174.667 0.203 17919 70303 1 172 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.687 -1.067 17919 70304 1 172 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.076 1.154 17919 70305 1 172 . 1 1 5 5 VAL H H 5 9.300 9.300 9.168 0.132 17919 70306 1 172 . 1 1 6 6 LYS N N 6 127.520 127.520 127.055 0.465 17919 70307 1 172 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.452 -0.085 17919 70308 1 172 . 1 1 6 6 LYS C C 6 177.140 177.140 176.927 0.213 17919 70309 1 172 . 1 1 6 6 LYS CA C 6 54.520 54.520 53.843 0.677 17919 70310 1 172 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.281 0.769 17919 70311 1 172 . 1 1 6 6 LYS H H 6 8.820 8.820 9.170 -0.350 17919 70312 1 172 . 1 1 7 7 THR N N 7 115.400 115.400 115.992 -0.592 17919 70313 1 172 . 1 1 7 7 THR HA H 7 4.970 4.970 4.629 0.341 17919 70314 1 172 . 1 1 7 7 THR C C 7 176.910 176.910 177.173 -0.263 17919 70315 1 172 . 1 1 7 7 THR CA C 7 60.470 60.470 61.052 -0.582 17919 70316 1 172 . 1 1 7 7 THR CB C 7 70.630 70.630 70.250 0.380 17919 70317 1 172 . 1 1 7 7 THR H H 7 8.730 8.730 8.644 0.086 17919 70318 1 172 . 1 1 8 8 LEU N N 8 121.330 121.330 119.267 2.063 17919 70319 1 172 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.462 -0.152 17919 70320 1 172 . 1 1 8 8 LEU C C 8 178.800 178.800 177.092 1.708 17919 70321 1 172 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.437 0.143 17919 70322 1 172 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.102 0.868 17919 70323 1 172 . 1 1 8 8 LEU H H 8 9.100 9.100 8.413 0.687 17919 70324 1 172 . 1 1 9 9 THR N N 9 105.590 105.590 109.426 -3.836 17919 70325 1 172 . 1 1 9 9 THR HA H 9 4.428 4.428 4.393 0.035 17919 70326 1 172 . 1 1 9 9 THR C C 9 175.520 175.520 176.038 -0.518 17919 70327 1 172 . 1 1 9 9 THR CA C 9 61.400 61.400 61.597 -0.197 17919 70328 1 172 . 1 1 9 9 THR CB C 9 69.140 69.140 69.796 -0.656 17919 70329 1 172 . 1 1 9 9 THR H H 9 7.630 7.630 7.511 0.119 17919 70330 1 172 . 1 1 10 10 GLY N N 10 108.890 108.890 111.001 -2.111 17919 70331 1 172 . 1 1 10 10 GLY C C 10 174.070 174.070 173.903 0.167 17919 70332 1 172 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.210 0.250 17919 70333 1 172 . 1 1 10 10 GLY H H 10 7.810 7.810 8.073 -0.263 17919 70334 1 172 . 1 1 11 11 LYS N N 11 121.600 121.600 122.839 -1.239 17919 70335 1 172 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.402 -0.041 17919 70336 1 172 . 1 1 11 11 LYS C C 11 175.940 175.940 175.757 0.183 17919 70337 1 172 . 1 1 11 11 LYS CA C 11 56.280 56.280 55.771 0.509 17919 70338 1 172 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.135 0.065 17919 70339 1 172 . 1 1 11 11 LYS H H 11 7.280 7.280 7.573 -0.293 17919 70340 1 172 . 1 1 12 12 THR N N 12 120.440 120.440 123.342 -2.902 17919 70341 1 172 . 1 1 12 12 THR HA H 12 5.046 5.046 4.997 0.049 17919 70342 1 172 . 1 1 12 12 THR C C 12 174.320 174.320 174.527 -0.207 17919 70343 1 172 . 1 1 12 12 THR CA C 12 62.390 62.390 62.277 0.113 17919 70344 1 172 . 1 1 12 12 THR CB C 12 69.910 69.910 69.656 0.255 17919 70345 1 172 . 1 1 12 12 THR H H 12 8.650 8.650 8.572 0.078 17919 70346 1 172 . 1 1 13 13 ILE N N 13 127.110 127.110 128.040 -0.930 17919 70347 1 172 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.564 -0.020 17919 70348 1 172 . 1 1 13 13 ILE C C 13 175.220 175.220 174.985 0.235 17919 70349 1 172 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.585 -0.605 17919 70350 1 172 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.056 -0.106 17919 70351 1 172 . 1 1 13 13 ILE H H 13 9.450 9.450 9.053 0.397 17919 70352 1 172 . 1 1 14 14 THR N N 14 121.520 121.520 122.103 -0.583 17919 70353 1 172 . 1 1 14 14 THR HA H 14 4.964 4.964 4.721 0.242 17919 70354 1 172 . 1 1 14 14 THR C C 14 173.790 173.790 173.917 -0.127 17919 70355 1 172 . 1 1 14 14 THR CA C 14 61.940 61.940 61.801 0.139 17919 70356 1 172 . 1 1 14 14 THR CB C 14 69.650 69.650 69.491 0.159 17919 70357 1 172 . 1 1 14 14 THR H H 14 8.710 8.710 8.246 0.464 17919 70358 1 172 . 1 1 15 15 LEU N N 15 124.800 124.800 127.181 -2.381 17919 70359 1 172 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.668 0.112 17919 70360 1 172 . 1 1 15 15 LEU C C 15 174.670 174.670 174.530 0.140 17919 70361 1 172 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.988 -1.158 17919 70362 1 172 . 1 1 15 15 LEU CB C 15 47.070 47.070 46.691 0.379 17919 70363 1 172 . 1 1 15 15 LEU H H 15 8.710 8.710 8.315 0.395 17919 70364 1 172 . 1 1 16 16 GLU N N 16 122.160 122.160 123.277 -1.117 17919 70365 1 172 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.137 -0.220 17919 70366 1 172 . 1 1 16 16 GLU C C 16 175.860 175.860 176.501 -0.641 17919 70367 1 172 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.133 -0.313 17919 70368 1 172 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.157 -0.707 17919 70369 1 172 . 1 1 16 16 GLU H H 16 8.140 8.140 8.534 -0.394 17919 70370 1 172 . 1 1 17 17 VAL N N 17 117.210 117.210 119.340 -2.130 17919 70371 1 172 . 1 1 17 17 VAL HA H 17 4.714 4.714 5.053 -0.339 17919 70372 1 172 . 1 1 17 17 VAL C C 17 174.160 174.160 175.388 -1.228 17919 70373 1 172 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.526 -0.096 17919 70374 1 172 . 1 1 17 17 VAL CB C 17 36.400 36.400 34.982 1.418 17919 70375 1 172 . 1 1 17 17 VAL H H 17 8.900 8.900 8.953 -0.053 17919 70376 1 172 . 1 1 18 18 GLU N N 18 118.990 118.990 120.670 -1.680 17919 70377 1 172 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.874 0.205 17919 70378 1 172 . 1 1 18 18 GLU C C 18 176.160 176.160 175.594 0.566 17919 70379 1 172 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.206 0.514 17919 70380 1 172 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.237 0.073 17919 70381 1 172 . 1 1 18 18 GLU H H 18 8.640 8.640 8.656 -0.016 17919 70382 1 172 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.277 -0.136 17919 70383 1 172 . 1 1 19 19 PRO C C 19 175.310 175.310 177.685 -2.375 17919 70384 1 172 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.625 -0.155 17919 70385 1 172 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.109 -0.159 17919 70386 1 172 . 1 1 20 20 SER N N 20 103.400 103.400 110.224 -6.824 17919 70387 1 172 . 1 1 20 20 SER HA H 20 4.370 4.370 4.274 0.096 17919 70388 1 172 . 1 1 20 20 SER C C 20 174.660 174.660 174.636 0.024 17919 70389 1 172 . 1 1 20 20 SER CA C 20 57.400 57.400 58.980 -1.581 17919 70390 1 172 . 1 1 20 20 SER CB C 20 63.370 63.370 62.694 0.676 17919 70391 1 172 . 1 1 20 20 SER H H 20 7.040 7.040 8.017 -0.977 17919 70392 1 172 . 1 1 21 21 ASP N N 21 123.480 123.480 124.709 -1.229 17919 70393 1 172 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.703 -0.008 17919 70394 1 172 . 1 1 21 21 ASP C C 21 176.360 176.360 175.921 0.439 17919 70395 1 172 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.388 0.312 17919 70396 1 172 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.582 -0.782 17919 70397 1 172 . 1 1 21 21 ASP H H 21 8.030 8.030 8.163 -0.133 17919 70398 1 172 . 1 1 22 22 THR N N 22 108.800 108.800 112.978 -4.178 17919 70399 1 172 . 1 1 22 22 THR HA H 22 4.920 4.920 4.926 -0.006 17919 70400 1 172 . 1 1 22 22 THR C C 22 176.750 176.750 176.083 0.667 17919 70401 1 172 . 1 1 22 22 THR CA C 22 59.690 59.690 60.545 -0.855 17919 70402 1 172 . 1 1 22 22 THR CB C 22 71.200 71.200 70.684 0.516 17919 70403 1 172 . 1 1 22 22 THR H H 22 7.900 7.900 8.252 -0.352 17919 70404 1 172 . 1 1 23 23 ILE N N 23 121.190 121.190 122.057 -0.867 17919 70405 1 172 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.798 -0.141 17919 70406 1 172 . 1 1 23 23 ILE C C 23 179.040 179.040 177.823 1.217 17919 70407 1 172 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.757 -0.497 17919 70408 1 172 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.241 -1.891 17919 70409 1 172 . 1 1 23 23 ILE H H 23 8.560 8.560 8.694 -0.134 17919 70410 1 172 . 1 1 24 24 GLU N N 24 120.830 120.830 121.064 -0.234 17919 70411 1 172 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.888 0.029 17919 70412 1 172 . 1 1 24 24 GLU C C 24 178.640 178.640 178.650 -0.010 17919 70413 1 172 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.081 0.139 17919 70414 1 172 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.470 -1.190 17919 70415 1 172 . 1 1 24 24 GLU H H 24 9.760 9.760 8.140 1.620 17919 70416 1 172 . 1 1 25 25 ASN N N 25 120.570 120.570 117.691 2.879 17919 70417 1 172 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.590 -0.065 17919 70418 1 172 . 1 1 25 25 ASN C C 25 178.380 178.380 177.997 0.383 17919 70419 1 172 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.526 0.534 17919 70420 1 172 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.480 -0.030 17919 70421 1 172 . 1 1 25 25 ASN H H 25 7.920 7.920 7.537 0.383 17919 70422 1 172 . 1 1 26 26 VAL N N 26 121.710 121.710 121.423 0.287 17919 70423 1 172 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.504 -0.107 17919 70424 1 172 . 1 1 26 26 VAL C C 26 177.950 177.950 177.690 0.260 17919 70425 1 172 . 1 1 26 26 VAL CA C 26 67.660 67.660 67.288 0.372 17919 70426 1 172 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.435 -0.595 17919 70427 1 172 . 1 1 26 26 VAL H H 26 8.070 8.070 8.590 -0.520 17919 70428 1 172 . 1 1 27 27 LYS N N 27 118.860 118.860 119.155 -0.295 17919 70429 1 172 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.282 0.298 17919 70430 1 172 . 1 1 27 27 LYS C C 27 180.550 180.550 179.010 1.540 17919 70431 1 172 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.437 -0.187 17919 70432 1 172 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.258 1.472 17919 70433 1 172 . 1 1 27 27 LYS H H 27 8.560 8.560 8.103 0.457 17919 70434 1 172 . 1 1 28 28 ALA N N 28 123.440 123.440 122.388 1.052 17919 70435 1 172 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.168 -0.008 17919 70436 1 172 . 1 1 28 28 ALA C C 28 180.300 180.300 179.329 0.971 17919 70437 1 172 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.858 0.512 17919 70438 1 172 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.477 -0.767 17919 70439 1 172 . 1 1 28 28 ALA H H 28 8.060 8.060 7.938 0.122 17919 70440 1 172 . 1 1 29 29 LYS N N 29 119.940 119.940 119.304 0.636 17919 70441 1 172 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.007 0.200 17919 70442 1 172 . 1 1 29 29 LYS C C 29 180.320 180.320 179.118 1.202 17919 70443 1 172 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.277 0.373 17919 70444 1 172 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.375 0.915 17919 70445 1 172 . 1 1 29 29 LYS H H 29 7.850 7.850 7.838 0.012 17919 70446 1 172 . 1 1 30 30 ILE N N 30 121.080 121.080 120.323 0.757 17919 70447 1 172 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.648 -0.141 17919 70448 1 172 . 1 1 30 30 ILE C C 30 178.310 178.310 177.098 1.212 17919 70449 1 172 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.422 0.728 17919 70450 1 172 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.951 -1.151 17919 70451 1 172 . 1 1 30 30 ILE H H 30 8.280 8.280 8.341 -0.061 17919 70452 1 172 . 1 1 31 31 GLN N N 31 123.490 123.490 121.534 1.956 17919 70453 1 172 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.018 -0.189 17919 70454 1 172 . 1 1 31 31 GLN C C 31 178.890 178.890 178.087 0.803 17919 70455 1 172 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.322 0.678 17919 70456 1 172 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.483 -0.763 17919 70457 1 172 . 1 1 31 31 GLN H H 31 8.580 8.580 8.022 0.558 17919 70458 1 172 . 1 1 32 32 ASP N N 32 119.360 119.360 118.191 1.169 17919 70459 1 172 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.397 -0.043 17919 70460 1 172 . 1 1 32 32 ASP C C 32 177.250 177.250 177.320 -0.070 17919 70461 1 172 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.517 0.673 17919 70462 1 172 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.592 -0.012 17919 70463 1 172 . 1 1 32 32 ASP H H 32 8.010 8.010 7.983 0.027 17919 70464 1 172 . 1 1 33 33 LYS N N 33 115.130 115.130 118.439 -3.309 17919 70465 1 172 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.381 -0.044 17919 70466 1 172 . 1 1 33 33 LYS C C 33 177.870 177.870 178.315 -0.445 17919 70467 1 172 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.551 0.499 17919 70468 1 172 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.373 0.797 17919 70469 1 172 . 1 1 33 33 LYS H H 33 7.430 7.430 7.495 -0.065 17919 70470 1 172 . 1 1 34 34 GLU N N 34 113.870 113.870 115.653 -1.783 17919 70471 1 172 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.409 0.216 17919 70472 1 172 . 1 1 34 34 GLU C C 34 177.840 177.840 177.704 0.136 17919 70473 1 172 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.179 -1.009 17919 70474 1 172 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.493 1.167 17919 70475 1 172 . 1 1 34 34 GLU H H 34 8.740 8.740 8.112 0.628 17919 70476 1 172 . 1 1 35 35 GLY N N 35 108.650 108.650 108.980 -0.330 17919 70477 1 172 . 1 1 35 35 GLY C C 35 173.960 173.960 174.211 -0.251 17919 70478 1 172 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.355 0.725 17919 70479 1 172 . 1 1 35 35 GLY H H 35 8.530 8.530 8.539 -0.009 17919 70480 1 172 . 1 1 36 36 ILE N N 36 119.880 119.880 118.053 1.827 17919 70481 1 172 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.572 -0.127 17919 70482 1 172 . 1 1 36 36 ILE C C 36 173.590 173.590 173.691 -0.101 17919 70483 1 172 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.594 0.156 17919 70484 1 172 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.556 2.024 17919 70485 1 172 . 1 1 36 36 ILE H H 36 6.150 6.150 7.525 -1.375 17919 70486 1 172 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.576 0.058 17919 70487 1 172 . 1 1 37 37 PRO C C 37 176.940 176.940 176.128 0.812 17919 70488 1 172 . 1 1 37 37 PRO CA C 37 61.660 61.660 62.005 -0.345 17919 70489 1 172 . 1 1 37 37 PRO CB C 37 31.850 31.850 30.794 1.056 17919 70490 1 172 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.156 -0.039 17919 70491 1 172 . 1 1 38 38 PRO C C 38 178.320 178.320 178.720 -0.400 17919 70492 1 172 . 1 1 38 38 PRO CA C 38 66.260 66.260 66.020 0.240 17919 70493 1 172 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.877 1.013 17919 70494 1 172 . 1 1 39 39 ASP N N 39 113.380 113.380 115.582 -2.202 17919 70495 1 172 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.370 0.060 17919 70496 1 172 . 1 1 39 39 ASP C C 39 177.090 177.090 178.158 -1.068 17919 70497 1 172 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.618 -0.979 17919 70498 1 172 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.385 -0.845 17919 70499 1 172 . 1 1 39 39 ASP H H 39 8.550 8.550 8.632 -0.082 17919 70500 1 172 . 1 1 40 40 GLN N N 40 116.780 116.780 117.456 -0.676 17919 70501 1 172 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.083 0.381 17919 70502 1 172 . 1 1 40 40 GLN C C 40 175.380 175.380 176.661 -1.281 17919 70503 1 172 . 1 1 40 40 GLN CA C 40 55.640 55.640 57.160 -1.520 17919 70504 1 172 . 1 1 40 40 GLN CB C 40 30.140 30.140 28.720 1.420 17919 70505 1 172 . 1 1 40 40 GLN H H 40 7.820 7.820 7.816 0.004 17919 70506 1 172 . 1 1 41 41 GLN N N 41 117.720 117.720 118.596 -0.876 17919 70507 1 172 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.782 -0.538 17919 70508 1 172 . 1 1 41 41 GLN C C 41 176.300 176.300 175.203 1.097 17919 70509 1 172 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.513 0.957 17919 70510 1 172 . 1 1 41 41 GLN CB C 41 31.650 31.650 30.423 1.227 17919 70511 1 172 . 1 1 41 41 GLN H H 41 7.480 7.480 7.996 -0.516 17919 70512 1 172 . 1 1 42 42 ARG N N 42 122.680 122.680 122.531 0.149 17919 70513 1 172 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.692 -0.192 17919 70514 1 172 . 1 1 42 42 ARG C C 42 174.050 174.050 174.380 -0.330 17919 70515 1 172 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.015 0.035 17919 70516 1 172 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.005 -1.255 17919 70517 1 172 . 1 1 42 42 ARG H H 42 8.530 8.530 8.240 0.290 17919 70518 1 172 . 1 1 43 43 LEU N N 43 124.040 124.040 125.995 -1.955 17919 70519 1 172 . 1 1 43 43 LEU C C 43 175.290 175.290 175.723 -0.433 17919 70520 1 172 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.039 -1.059 17919 70521 1 172 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.042 1.748 17919 70522 1 172 . 1 1 43 43 LEU H H 43 8.820 8.820 8.825 -0.005 17919 70523 1 172 . 1 1 44 44 ILE N N 44 121.920 121.920 122.178 -0.258 17919 70524 1 172 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.924 0.068 17919 70525 1 172 . 1 1 44 44 ILE C C 44 176.060 176.060 174.308 1.752 17919 70526 1 172 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.032 -1.052 17919 70527 1 172 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.627 -0.207 17919 70528 1 172 . 1 1 44 44 ILE H H 44 9.030 9.030 9.102 -0.072 17919 70529 1 172 . 1 1 45 45 PHE N N 45 125.390 125.390 127.631 -2.241 17919 70530 1 172 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.032 0.013 17919 70531 1 172 . 1 1 45 45 PHE C C 45 174.470 174.470 174.977 -0.507 17919 70532 1 172 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.220 0.800 17919 70533 1 172 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.667 1.093 17919 70534 1 172 . 1 1 45 45 PHE H H 45 8.830 8.830 8.722 0.108 17919 70535 1 172 . 1 1 46 46 ALA N N 46 132.200 132.200 129.246 2.954 17919 70536 1 172 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.638 0.052 17919 70537 1 172 . 1 1 46 46 ALA C C 46 177.290 177.290 177.618 -0.328 17919 70538 1 172 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.324 0.216 17919 70539 1 172 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.159 0.411 17919 70540 1 172 . 1 1 46 46 ALA H H 46 8.810 8.810 8.729 0.081 17919 70541 1 172 . 1 1 47 47 GLY N N 47 102.340 102.340 104.060 -1.720 17919 70542 1 172 . 1 1 47 47 GLY C C 47 173.810 173.810 174.271 -0.461 17919 70543 1 172 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.920 0.430 17919 70544 1 172 . 1 1 47 47 GLY H H 47 8.130 8.130 8.361 -0.231 17919 70545 1 172 . 1 1 48 48 LYS N N 48 121.570 121.570 120.432 1.138 17919 70546 1 172 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.557 0.065 17919 70547 1 172 . 1 1 48 48 LYS C C 48 174.700 174.700 174.654 0.046 17919 70548 1 172 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.463 0.087 17919 70549 1 172 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.981 -0.451 17919 70550 1 172 . 1 1 48 48 LYS H H 48 7.980 7.980 8.182 -0.202 17919 70551 1 172 . 1 1 49 49 GLN N N 49 122.410 122.410 125.745 -3.335 17919 70552 1 172 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.441 0.119 17919 70553 1 172 . 1 1 49 49 GLN C C 49 175.670 175.670 175.710 -0.040 17919 70554 1 172 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.346 -0.606 17919 70555 1 172 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.370 -0.370 17919 70556 1 172 . 1 1 49 49 GLN H H 49 8.600 8.600 8.610 -0.010 17919 70557 1 172 . 1 1 50 50 LEU N N 50 125.520 125.520 129.369 -3.849 17919 70558 1 172 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.210 -0.120 17919 70559 1 172 . 1 1 50 50 LEU C C 50 176.660 176.660 176.498 0.162 17919 70560 1 172 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.812 -0.572 17919 70561 1 172 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.127 -0.556 17919 70562 1 172 . 1 1 50 50 LEU H H 50 8.530 8.530 8.628 -0.098 17919 70563 1 172 . 1 1 51 51 GLU N N 51 122.940 122.940 121.612 1.328 17919 70564 1 172 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.619 -0.131 17919 70565 1 172 . 1 1 51 51 GLU C C 51 175.870 175.870 177.060 -1.190 17919 70566 1 172 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.203 0.757 17919 70567 1 172 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.867 -0.297 17919 70568 1 172 . 1 1 51 51 GLU H H 51 8.400 8.400 8.315 0.085 17919 70569 1 172 . 1 1 52 52 ASP N N 52 120.030 120.030 122.993 -2.963 17919 70570 1 172 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.424 -0.065 17919 70571 1 172 . 1 1 52 52 ASP C C 52 177.330 177.330 177.807 -0.477 17919 70572 1 172 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.757 -0.797 17919 70573 1 172 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.711 0.139 17919 70574 1 172 . 1 1 52 52 ASP H H 52 8.160 8.160 8.833 -0.673 17919 70575 1 172 . 1 1 53 53 GLY N N 53 106.660 106.660 104.638 2.022 17919 70576 1 172 . 1 1 53 53 GLY C C 53 174.870 174.870 174.026 0.844 17919 70577 1 172 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.624 0.546 17919 70578 1 172 . 1 1 53 53 GLY H H 53 9.390 9.390 8.443 0.947 17919 70579 1 172 . 1 1 54 54 ARG N N 54 119.050 119.050 120.605 -1.555 17919 70580 1 172 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.523 0.172 17919 70581 1 172 . 1 1 54 54 ARG C C 54 175.350 175.350 175.606 -0.256 17919 70582 1 172 . 1 1 54 54 ARG CA C 54 54.390 54.390 55.218 -0.828 17919 70583 1 172 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.479 0.171 17919 70584 1 172 . 1 1 54 54 ARG H H 54 7.460 7.460 7.331 0.129 17919 70585 1 172 . 1 1 55 55 THR N N 55 108.400 108.400 110.623 -2.223 17919 70586 1 172 . 1 1 55 55 THR HA H 55 5.240 5.240 5.126 0.114 17919 70587 1 172 . 1 1 55 55 THR C C 55 176.560 176.560 176.195 0.365 17919 70588 1 172 . 1 1 55 55 THR CA C 55 59.690 59.690 59.570 0.120 17919 70589 1 172 . 1 1 55 55 THR CB C 55 72.260 72.260 71.245 1.015 17919 70590 1 172 . 1 1 55 55 THR H H 55 8.730 8.730 8.943 -0.213 17919 70591 1 172 . 1 1 56 56 LEU N N 56 117.920 117.920 120.677 -2.757 17919 70592 1 172 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.990 0.070 17919 70593 1 172 . 1 1 56 56 LEU C C 56 180.810 180.810 178.898 1.912 17919 70594 1 172 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.311 0.399 17919 70595 1 172 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.403 -1.033 17919 70596 1 172 . 1 1 56 56 LEU H H 56 8.140 8.140 8.404 -0.264 17919 70597 1 172 . 1 1 57 57 SER N N 57 113.330 113.330 114.903 -1.573 17919 70598 1 172 . 1 1 57 57 SER HA H 57 4.370 4.370 4.194 0.176 17919 70599 1 172 . 1 1 57 57 SER C C 57 178.310 178.310 176.789 1.521 17919 70600 1 172 . 1 1 57 57 SER CA C 57 61.080 61.080 61.830 -0.750 17919 70601 1 172 . 1 1 57 57 SER CB C 57 62.530 62.530 62.772 -0.242 17919 70602 1 172 . 1 1 57 57 SER H H 57 8.470 8.470 8.320 0.150 17919 70603 1 172 . 1 1 58 58 ASP N N 58 124.190 124.190 122.385 1.805 17919 70604 1 172 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.334 -0.038 17919 70605 1 172 . 1 1 58 58 ASP C C 58 177.400 177.400 176.943 0.457 17919 70606 1 172 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.330 0.850 17919 70607 1 172 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.325 -0.225 17919 70608 1 172 . 1 1 58 58 ASP H H 58 7.930 7.930 7.649 0.281 17919 70609 1 172 . 1 1 59 59 TYR N N 59 115.510 115.510 115.608 -0.098 17919 70610 1 172 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.466 0.204 17919 70611 1 172 . 1 1 59 59 TYR C C 59 174.700 174.700 175.097 -0.397 17919 70612 1 172 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.166 1.084 17919 70613 1 172 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.174 1.896 17919 70614 1 172 . 1 1 59 59 TYR H H 59 7.250 7.250 7.244 0.006 17919 70615 1 172 . 1 1 60 60 ASN N N 60 115.900 115.900 116.171 -0.271 17919 70616 1 172 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.364 -0.009 17919 70617 1 172 . 1 1 60 60 ASN C C 60 174.340 174.340 174.515 -0.175 17919 70618 1 172 . 1 1 60 60 ASN CA C 60 54.120 54.120 53.947 0.173 17919 70619 1 172 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.377 0.033 17919 70620 1 172 . 1 1 60 60 ASN H H 60 8.150 8.150 7.563 0.587 17919 70621 1 172 . 1 1 61 61 ILE N N 61 118.600 118.600 118.656 -0.056 17919 70622 1 172 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.829 -0.436 17919 70623 1 172 . 1 1 61 61 ILE C C 61 174.610 174.610 175.012 -0.402 17919 70624 1 172 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.927 0.493 17919 70625 1 172 . 1 1 61 61 ILE CB C 61 36.740 36.740 38.205 -1.465 17919 70626 1 172 . 1 1 61 61 ILE H H 61 7.250 7.250 8.043 -0.793 17919 70627 1 172 . 1 1 62 62 GLN N N 62 124.740 124.740 126.034 -1.294 17919 70628 1 172 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.669 -0.163 17919 70629 1 172 . 1 1 62 62 GLN C C 62 175.970 175.970 174.259 1.711 17919 70630 1 172 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.079 0.581 17919 70631 1 172 . 1 1 62 62 GLN CB C 62 31.650 31.650 33.169 -1.519 17919 70632 1 172 . 1 1 62 62 GLN H H 62 7.610 7.610 8.342 -0.732 17919 70633 1 172 . 1 1 63 63 LYS N N 63 120.300 120.300 121.236 -0.936 17919 70634 1 172 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.172 -0.171 17919 70635 1 172 . 1 1 63 63 LYS C C 63 175.810 175.810 176.962 -1.152 17919 70636 1 172 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.836 -0.046 17919 70637 1 172 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.430 0.220 17919 70638 1 172 . 1 1 63 63 LYS H H 63 8.490 8.490 8.504 -0.014 17919 70639 1 172 . 1 1 64 64 GLU N N 64 113.950 113.950 119.515 -5.565 17919 70640 1 172 . 1 1 64 64 GLU HA H 64 3.465 3.465 4.092 -0.627 17919 70641 1 172 . 1 1 64 64 GLU C C 64 175.250 175.250 175.390 -0.140 17919 70642 1 172 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.519 0.371 17919 70643 1 172 . 1 1 64 64 GLU CB C 64 25.900 25.900 29.206 -3.306 17919 70644 1 172 . 1 1 64 64 GLU H H 64 9.280 9.280 8.877 0.403 17919 70645 1 172 . 1 1 65 65 SER N N 65 114.730 114.730 115.409 -0.679 17919 70646 1 172 . 1 1 65 65 SER HA H 65 4.640 4.640 4.571 0.069 17919 70647 1 172 . 1 1 65 65 SER C C 65 172.160 172.160 173.751 -1.591 17919 70648 1 172 . 1 1 65 65 SER CA C 65 60.890 60.890 60.475 0.415 17919 70649 1 172 . 1 1 65 65 SER CB C 65 64.910 64.910 64.064 0.847 17919 70650 1 172 . 1 1 65 65 SER H H 65 7.670 7.670 7.735 -0.065 17919 70651 1 172 . 1 1 66 66 THR N N 66 117.110 117.110 119.711 -2.601 17919 70652 1 172 . 1 1 66 66 THR HA H 66 5.270 5.270 5.236 0.034 17919 70653 1 172 . 1 1 66 66 THR C C 66 173.950 173.950 173.771 0.179 17919 70654 1 172 . 1 1 66 66 THR CA C 66 62.340 62.340 62.122 0.218 17919 70655 1 172 . 1 1 66 66 THR CB C 66 70.080 70.080 70.008 0.072 17919 70656 1 172 . 1 1 66 66 THR H H 66 8.730 8.730 8.245 0.485 17919 70657 1 172 . 1 1 67 67 LEU N N 67 127.110 127.110 126.695 0.415 17919 70658 1 172 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.925 0.135 17919 70659 1 172 . 1 1 67 67 LEU C C 67 175.770 175.770 175.543 0.227 17919 70660 1 172 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.817 0.083 17919 70661 1 172 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.161 0.099 17919 70662 1 172 . 1 1 67 67 LEU H H 67 9.410 9.410 9.329 0.081 17919 70663 1 172 . 1 1 68 68 HIS N N 68 118.380 118.380 122.920 -4.540 17919 70664 1 172 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.372 -0.132 17919 70665 1 172 . 1 1 68 68 HIS C C 68 173.150 173.150 173.587 -0.437 17919 70666 1 172 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.164 0.836 17919 70667 1 172 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.161 -1.631 17919 70668 1 172 . 1 1 68 68 HIS H H 68 9.230 9.230 9.204 0.026 17919 70669 1 172 . 1 1 69 69 LEU N N 69 124.460 124.460 128.906 -4.446 17919 70670 1 172 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.149 0.041 17919 70671 1 172 . 1 1 69 69 LEU C C 69 175.270 175.270 174.010 1.260 17919 70672 1 172 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.101 0.789 17919 70673 1 172 . 1 1 69 69 LEU CB C 69 44.380 44.380 45.670 -1.290 17919 70674 1 172 . 1 1 69 69 LEU H H 69 8.340 8.340 8.297 0.043 17919 70675 1 172 . 1 1 70 70 VAL N N 70 126.940 126.940 125.564 1.376 17919 70676 1 172 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.360 -0.010 17919 70677 1 172 . 1 1 70 70 VAL C C 70 174.000 174.000 174.554 -0.554 17919 70678 1 172 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.756 0.044 17919 70679 1 172 . 1 1 70 70 VAL CB C 70 34.910 34.910 33.745 1.165 17919 70680 1 172 . 1 1 70 70 VAL H H 70 9.200 9.200 8.851 0.349 17919 70681 1 172 . 1 1 71 71 LEU N N 71 123.130 123.130 122.982 0.148 17919 70682 1 172 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.044 0.016 17919 70683 1 172 . 1 1 71 71 LEU C C 71 177.830 177.830 177.583 0.247 17919 70684 1 172 . 1 1 71 71 LEU CA C 71 53.940 53.940 52.352 1.588 17919 70685 1 172 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.393 -0.543 17919 70686 1 172 . 1 1 71 71 LEU H H 71 8.120 8.120 8.338 -0.218 17919 70687 1 172 . 1 1 72 72 ARG N N 72 123.490 123.490 121.375 2.115 17919 70688 1 172 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.107 0.194 17919 70689 1 172 . 1 1 72 72 ARG C C 72 175.350 175.350 176.740 -1.390 17919 70690 1 172 . 1 1 72 72 ARG CA C 72 55.610 55.610 57.087 -1.477 17919 70691 1 172 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.371 0.979 17919 70692 1 172 . 1 1 72 72 ARG H H 72 8.580 8.580 8.103 0.477 17919 70693 1 173 . 1 1 2 2 GLN N N 2 123.220 123.220 120.600 2.620 17919 70694 1 173 . 1 1 2 2 GLN HA H 2 5.249 5.249 4.995 0.254 17919 70695 1 173 . 1 1 2 2 GLN C C 2 175.920 175.920 174.765 1.155 17919 70696 1 173 . 1 1 2 2 GLN CA C 2 55.080 55.080 55.198 -0.118 17919 70697 1 173 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.307 0.453 17919 70698 1 173 . 1 1 2 2 GLN H H 2 8.900 8.900 8.364 0.536 17919 70699 1 173 . 1 1 3 3 ILE N N 3 115.340 115.340 119.681 -4.341 17919 70700 1 173 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.252 -0.039 17919 70701 1 173 . 1 1 3 3 ILE C C 3 172.450 172.450 173.326 -0.876 17919 70702 1 173 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.504 0.066 17919 70703 1 173 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.831 0.379 17919 70704 1 173 . 1 1 3 3 ILE H H 3 8.320 8.320 8.347 -0.027 17919 70705 1 173 . 1 1 4 4 PHE N N 4 118.110 118.110 121.352 -3.242 17919 70706 1 173 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.331 0.299 17919 70707 1 173 . 1 1 4 4 PHE C C 4 175.320 175.320 174.713 0.607 17919 70708 1 173 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.663 -0.453 17919 70709 1 173 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.470 -0.990 17919 70710 1 173 . 1 1 4 4 PHE H H 4 8.610 8.610 8.307 0.303 17919 70711 1 173 . 1 1 5 5 VAL N N 5 121.000 121.000 123.994 -2.994 17919 70712 1 173 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.853 -0.128 17919 70713 1 173 . 1 1 5 5 VAL C C 5 174.870 174.870 174.804 0.066 17919 70714 1 173 . 1 1 5 5 VAL CA C 5 60.620 60.620 60.922 -0.302 17919 70715 1 173 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.566 0.664 17919 70716 1 173 . 1 1 5 5 VAL H H 5 9.300 9.300 9.460 -0.160 17919 70717 1 173 . 1 1 6 6 LYS N N 6 127.520 127.520 130.225 -2.705 17919 70718 1 173 . 1 1 6 6 LYS HA H 6 5.367 5.367 4.917 0.450 17919 70719 1 173 . 1 1 6 6 LYS C C 6 177.140 177.140 176.084 1.056 17919 70720 1 173 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.336 0.184 17919 70721 1 173 . 1 1 6 6 LYS CB C 6 35.050 35.050 33.755 1.295 17919 70722 1 173 . 1 1 6 6 LYS H H 6 8.820 8.820 9.327 -0.507 17919 70723 1 173 . 1 1 7 7 THR N N 7 115.400 115.400 117.921 -2.521 17919 70724 1 173 . 1 1 7 7 THR HA H 7 4.970 4.970 5.166 -0.196 17919 70725 1 173 . 1 1 7 7 THR C C 7 176.910 176.910 175.332 1.578 17919 70726 1 173 . 1 1 7 7 THR CA C 7 60.470 60.470 60.278 0.192 17919 70727 1 173 . 1 1 7 7 THR CB C 7 70.630 70.630 70.771 -0.141 17919 70728 1 173 . 1 1 7 7 THR H H 7 8.730 8.730 9.032 -0.302 17919 70729 1 173 . 1 1 8 8 LEU N N 8 121.330 121.330 120.421 0.909 17919 70730 1 173 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.443 -0.133 17919 70731 1 173 . 1 1 8 8 LEU C C 8 178.800 178.800 177.226 1.574 17919 70732 1 173 . 1 1 8 8 LEU CA C 8 57.580 57.580 56.851 0.729 17919 70733 1 173 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.370 -0.400 17919 70734 1 173 . 1 1 8 8 LEU H H 8 9.100 9.100 8.465 0.635 17919 70735 1 173 . 1 1 9 9 THR N N 9 105.590 105.590 108.588 -2.998 17919 70736 1 173 . 1 1 9 9 THR HA H 9 4.428 4.428 4.338 0.090 17919 70737 1 173 . 1 1 9 9 THR C C 9 175.520 175.520 175.638 -0.118 17919 70738 1 173 . 1 1 9 9 THR CA C 9 61.400 61.400 61.533 -0.133 17919 70739 1 173 . 1 1 9 9 THR CB C 9 69.140 69.140 68.116 1.024 17919 70740 1 173 . 1 1 9 9 THR H H 9 7.630 7.630 7.688 -0.058 17919 70741 1 173 . 1 1 10 10 GLY N N 10 108.890 108.890 111.667 -2.777 17919 70742 1 173 . 1 1 10 10 GLY C C 10 174.070 174.070 174.253 -0.183 17919 70743 1 173 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.883 -0.423 17919 70744 1 173 . 1 1 10 10 GLY H H 10 7.810 7.810 7.967 -0.157 17919 70745 1 173 . 1 1 11 11 LYS N N 11 121.600 121.600 120.814 0.786 17919 70746 1 173 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.552 -0.191 17919 70747 1 173 . 1 1 11 11 LYS C C 11 175.940 175.940 174.953 0.987 17919 70748 1 173 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.083 0.197 17919 70749 1 173 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.257 -0.057 17919 70750 1 173 . 1 1 11 11 LYS H H 11 7.280 7.280 7.645 -0.365 17919 70751 1 173 . 1 1 12 12 THR N N 12 120.440 120.440 115.282 5.158 17919 70752 1 173 . 1 1 12 12 THR HA H 12 5.046 5.046 5.394 -0.348 17919 70753 1 173 . 1 1 12 12 THR C C 12 174.320 174.320 173.999 0.321 17919 70754 1 173 . 1 1 12 12 THR CA C 12 62.390 62.390 61.681 0.709 17919 70755 1 173 . 1 1 12 12 THR CB C 12 69.910 69.910 70.997 -1.087 17919 70756 1 173 . 1 1 12 12 THR H H 12 8.650 8.650 8.245 0.405 17919 70757 1 173 . 1 1 13 13 ILE N N 13 127.110 127.110 122.425 4.685 17919 70758 1 173 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.804 -0.260 17919 70759 1 173 . 1 1 13 13 ILE C C 13 175.220 175.220 173.810 1.410 17919 70760 1 173 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.209 0.770 17919 70761 1 173 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.985 -1.035 17919 70762 1 173 . 1 1 13 13 ILE H H 13 9.450 9.450 9.141 0.309 17919 70763 1 173 . 1 1 14 14 THR N N 14 121.520 121.520 119.212 2.308 17919 70764 1 173 . 1 1 14 14 THR HA H 14 4.964 4.964 5.451 -0.487 17919 70765 1 173 . 1 1 14 14 THR C C 14 173.790 173.790 173.641 0.149 17919 70766 1 173 . 1 1 14 14 THR CA C 14 61.940 61.940 60.079 1.861 17919 70767 1 173 . 1 1 14 14 THR CB C 14 69.650 69.650 69.944 -0.294 17919 70768 1 173 . 1 1 14 14 THR H H 14 8.710 8.710 8.484 0.226 17919 70769 1 173 . 1 1 15 15 LEU N N 15 124.800 124.800 127.516 -2.716 17919 70770 1 173 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.787 -0.007 17919 70771 1 173 . 1 1 15 15 LEU C C 15 174.670 174.670 174.964 -0.294 17919 70772 1 173 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.643 -0.813 17919 70773 1 173 . 1 1 15 15 LEU CB C 15 47.070 47.070 44.992 2.079 17919 70774 1 173 . 1 1 15 15 LEU H H 15 8.710 8.710 8.733 -0.023 17919 70775 1 173 . 1 1 16 16 GLU N N 16 122.160 122.160 122.362 -0.202 17919 70776 1 173 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.959 -0.042 17919 70777 1 173 . 1 1 16 16 GLU C C 16 175.860 175.860 176.018 -0.158 17919 70778 1 173 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.184 -0.364 17919 70779 1 173 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.005 -0.555 17919 70780 1 173 . 1 1 16 16 GLU H H 16 8.140 8.140 8.587 -0.447 17919 70781 1 173 . 1 1 17 17 VAL N N 17 117.210 117.210 120.465 -3.255 17919 70782 1 173 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.586 0.128 17919 70783 1 173 . 1 1 17 17 VAL C C 17 174.160 174.160 174.621 -0.461 17919 70784 1 173 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.196 -0.766 17919 70785 1 173 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.360 1.040 17919 70786 1 173 . 1 1 17 17 VAL H H 17 8.900 8.900 8.839 0.061 17919 70787 1 173 . 1 1 18 18 GLU N N 18 118.990 118.990 121.926 -2.936 17919 70788 1 173 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.796 0.283 17919 70789 1 173 . 1 1 18 18 GLU C C 18 176.160 176.160 175.788 0.372 17919 70790 1 173 . 1 1 18 18 GLU CA C 18 52.720 52.720 51.728 0.992 17919 70791 1 173 . 1 1 18 18 GLU CB C 18 30.310 30.310 32.432 -2.122 17919 70792 1 173 . 1 1 18 18 GLU H H 18 8.640 8.640 8.354 0.286 17919 70793 1 173 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.463 -0.322 17919 70794 1 173 . 1 1 19 19 PRO C C 19 175.310 175.310 177.000 -1.690 17919 70795 1 173 . 1 1 19 19 PRO CA C 19 65.470 65.470 64.596 0.874 17919 70796 1 173 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.313 -0.363 17919 70797 1 173 . 1 1 20 20 SER N N 20 103.400 103.400 111.353 -7.953 17919 70798 1 173 . 1 1 20 20 SER HA H 20 4.370 4.370 4.338 0.032 17919 70799 1 173 . 1 1 20 20 SER C C 20 174.660 174.660 174.540 0.120 17919 70800 1 173 . 1 1 20 20 SER CA C 20 57.400 57.400 58.990 -1.590 17919 70801 1 173 . 1 1 20 20 SER CB C 20 63.370 63.370 62.821 0.549 17919 70802 1 173 . 1 1 20 20 SER H H 20 7.040 7.040 8.073 -1.033 17919 70803 1 173 . 1 1 21 21 ASP N N 21 123.480 123.480 123.063 0.417 17919 70804 1 173 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.814 -0.119 17919 70805 1 173 . 1 1 21 21 ASP C C 21 176.360 176.360 175.441 0.919 17919 70806 1 173 . 1 1 21 21 ASP CA C 21 55.700 55.700 53.561 2.139 17919 70807 1 173 . 1 1 21 21 ASP CB C 21 40.800 40.800 42.626 -1.826 17919 70808 1 173 . 1 1 21 21 ASP H H 21 8.030 8.030 7.706 0.324 17919 70809 1 173 . 1 1 22 22 THR N N 22 108.800 108.800 113.544 -4.744 17919 70810 1 173 . 1 1 22 22 THR HA H 22 4.920 4.920 4.662 0.258 17919 70811 1 173 . 1 1 22 22 THR C C 22 176.750 176.750 175.967 0.783 17919 70812 1 173 . 1 1 22 22 THR CA C 22 59.690 59.690 61.658 -1.968 17919 70813 1 173 . 1 1 22 22 THR CB C 22 71.200 71.200 70.432 0.768 17919 70814 1 173 . 1 1 22 22 THR H H 22 7.900 7.900 8.288 -0.388 17919 70815 1 173 . 1 1 23 23 ILE N N 23 121.190 121.190 122.011 -0.821 17919 70816 1 173 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.876 -0.219 17919 70817 1 173 . 1 1 23 23 ILE C C 23 179.040 179.040 177.586 1.454 17919 70818 1 173 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.240 0.020 17919 70819 1 173 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.536 -2.186 17919 70820 1 173 . 1 1 23 23 ILE H H 23 8.560 8.560 8.437 0.123 17919 70821 1 173 . 1 1 24 24 GLU N N 24 120.830 120.830 121.626 -0.796 17919 70822 1 173 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.895 0.022 17919 70823 1 173 . 1 1 24 24 GLU C C 24 178.640 178.640 178.725 -0.085 17919 70824 1 173 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.334 -0.114 17919 70825 1 173 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.398 -1.117 17919 70826 1 173 . 1 1 24 24 GLU H H 24 9.760 9.760 8.105 1.655 17919 70827 1 173 . 1 1 25 25 ASN N N 25 120.570 120.570 117.865 2.705 17919 70828 1 173 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.500 0.025 17919 70829 1 173 . 1 1 25 25 ASN C C 25 178.380 178.380 178.050 0.330 17919 70830 1 173 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.767 0.293 17919 70831 1 173 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.192 0.258 17919 70832 1 173 . 1 1 25 25 ASN H H 25 7.920 7.920 7.854 0.066 17919 70833 1 173 . 1 1 26 26 VAL N N 26 121.710 121.710 121.522 0.188 17919 70834 1 173 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.509 -0.112 17919 70835 1 173 . 1 1 26 26 VAL C C 26 177.950 177.950 177.499 0.451 17919 70836 1 173 . 1 1 26 26 VAL CA C 26 67.660 67.660 67.221 0.440 17919 70837 1 173 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.681 -0.841 17919 70838 1 173 . 1 1 26 26 VAL H H 26 8.070 8.070 8.227 -0.157 17919 70839 1 173 . 1 1 27 27 LYS N N 27 118.860 118.860 120.048 -1.188 17919 70840 1 173 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.175 0.405 17919 70841 1 173 . 1 1 27 27 LYS C C 27 180.550 180.550 179.149 1.401 17919 70842 1 173 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.739 -0.489 17919 70843 1 173 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.249 1.481 17919 70844 1 173 . 1 1 27 27 LYS H H 27 8.560 8.560 7.970 0.590 17919 70845 1 173 . 1 1 28 28 ALA N N 28 123.440 123.440 122.062 1.378 17919 70846 1 173 . 1 1 28 28 ALA HA H 28 4.160 4.160 3.938 0.222 17919 70847 1 173 . 1 1 28 28 ALA C C 28 180.300 180.300 179.261 1.039 17919 70848 1 173 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.517 -0.147 17919 70849 1 173 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.334 -0.624 17919 70850 1 173 . 1 1 28 28 ALA H H 28 8.060 8.060 8.214 -0.154 17919 70851 1 173 . 1 1 29 29 LYS N N 29 119.940 119.940 119.066 0.874 17919 70852 1 173 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.040 0.167 17919 70853 1 173 . 1 1 29 29 LYS C C 29 180.320 180.320 179.150 1.170 17919 70854 1 173 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.224 0.426 17919 70855 1 173 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.407 0.883 17919 70856 1 173 . 1 1 29 29 LYS H H 29 7.850 7.850 7.622 0.228 17919 70857 1 173 . 1 1 30 30 ILE N N 30 121.080 121.080 120.965 0.115 17919 70858 1 173 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.611 -0.104 17919 70859 1 173 . 1 1 30 30 ILE C C 30 178.310 178.310 177.321 0.989 17919 70860 1 173 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.352 0.798 17919 70861 1 173 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.837 -1.036 17919 70862 1 173 . 1 1 30 30 ILE H H 30 8.280 8.280 8.420 -0.140 17919 70863 1 173 . 1 1 31 31 GLN N N 31 123.490 123.490 121.195 2.295 17919 70864 1 173 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.072 -0.243 17919 70865 1 173 . 1 1 31 31 GLN C C 31 178.890 178.890 178.207 0.683 17919 70866 1 173 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.249 0.751 17919 70867 1 173 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.555 -0.835 17919 70868 1 173 . 1 1 31 31 GLN H H 31 8.580 8.580 8.385 0.195 17919 70869 1 173 . 1 1 32 32 ASP N N 32 119.360 119.360 119.460 -0.100 17919 70870 1 173 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.356 -0.002 17919 70871 1 173 . 1 1 32 32 ASP C C 32 177.250 177.250 178.047 -0.797 17919 70872 1 173 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.981 0.209 17919 70873 1 173 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.846 -0.266 17919 70874 1 173 . 1 1 32 32 ASP H H 32 8.010 8.010 8.107 -0.097 17919 70875 1 173 . 1 1 33 33 LYS N N 33 115.130 115.130 117.444 -2.314 17919 70876 1 173 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.350 -0.013 17919 70877 1 173 . 1 1 33 33 LYS C C 33 177.870 177.870 178.078 -0.208 17919 70878 1 173 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.826 0.224 17919 70879 1 173 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.820 0.350 17919 70880 1 173 . 1 1 33 33 LYS H H 33 7.430 7.430 7.546 -0.116 17919 70881 1 173 . 1 1 34 34 GLU N N 34 113.870 113.870 115.177 -1.307 17919 70882 1 173 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.439 0.186 17919 70883 1 173 . 1 1 34 34 GLU C C 34 177.840 177.840 177.261 0.579 17919 70884 1 173 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.196 -1.026 17919 70885 1 173 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.019 1.641 17919 70886 1 173 . 1 1 34 34 GLU H H 34 8.740 8.740 8.500 0.240 17919 70887 1 173 . 1 1 35 35 GLY N N 35 108.650 108.650 109.838 -1.188 17919 70888 1 173 . 1 1 35 35 GLY C C 35 173.960 173.960 174.267 -0.307 17919 70889 1 173 . 1 1 35 35 GLY CA C 35 46.080 46.080 46.124 -0.044 17919 70890 1 173 . 1 1 35 35 GLY H H 35 8.530 8.530 8.267 0.263 17919 70891 1 173 . 1 1 36 36 ILE N N 36 119.880 119.880 116.067 3.813 17919 70892 1 173 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.532 -0.087 17919 70893 1 173 . 1 1 36 36 ILE C C 36 173.590 173.590 173.853 -0.263 17919 70894 1 173 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.204 0.546 17919 70895 1 173 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.870 1.710 17919 70896 1 173 . 1 1 36 36 ILE H H 36 6.150 6.150 7.296 -1.146 17919 70897 1 173 . 1 1 37 37 PRO HA H 37 4.634 4.634 5.091 -0.457 17919 70898 1 173 . 1 1 37 37 PRO C C 37 176.940 176.940 176.459 0.481 17919 70899 1 173 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.016 0.644 17919 70900 1 173 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.128 0.722 17919 70901 1 173 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.225 -0.108 17919 70902 1 173 . 1 1 38 38 PRO C C 38 178.320 178.320 177.786 0.534 17919 70903 1 173 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.261 0.999 17919 70904 1 173 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.964 0.926 17919 70905 1 173 . 1 1 39 39 ASP N N 39 113.380 113.380 115.418 -2.038 17919 70906 1 173 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.311 0.119 17919 70907 1 173 . 1 1 39 39 ASP C C 39 177.090 177.090 177.092 -0.002 17919 70908 1 173 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.623 -0.983 17919 70909 1 173 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.870 -1.330 17919 70910 1 173 . 1 1 39 39 ASP H H 39 8.550 8.550 8.582 -0.032 17919 70911 1 173 . 1 1 40 40 GLN N N 40 116.780 116.780 114.853 1.927 17919 70912 1 173 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.408 0.056 17919 70913 1 173 . 1 1 40 40 GLN C C 40 175.380 175.380 175.754 -0.374 17919 70914 1 173 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.281 0.359 17919 70915 1 173 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.320 0.820 17919 70916 1 173 . 1 1 40 40 GLN H H 40 7.820 7.820 7.705 0.115 17919 70917 1 173 . 1 1 41 41 GLN N N 41 117.720 117.720 118.493 -0.773 17919 70918 1 173 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.745 -0.501 17919 70919 1 173 . 1 1 41 41 GLN C C 41 176.300 176.300 175.494 0.806 17919 70920 1 173 . 1 1 41 41 GLN CA C 41 56.470 56.470 54.903 1.567 17919 70921 1 173 . 1 1 41 41 GLN CB C 41 31.650 31.650 30.165 1.486 17919 70922 1 173 . 1 1 41 41 GLN H H 41 7.480 7.480 7.378 0.102 17919 70923 1 173 . 1 1 42 42 ARG N N 42 122.680 122.680 125.390 -2.710 17919 70924 1 173 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.675 -0.175 17919 70925 1 173 . 1 1 42 42 ARG C C 42 174.050 174.050 174.206 -0.156 17919 70926 1 173 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.712 0.338 17919 70927 1 173 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.572 -0.822 17919 70928 1 173 . 1 1 42 42 ARG H H 42 8.530 8.530 8.461 0.069 17919 70929 1 173 . 1 1 43 43 LEU N N 43 124.040 124.040 127.723 -3.683 17919 70930 1 173 . 1 1 43 43 LEU C C 43 175.290 175.290 175.883 -0.593 17919 70931 1 173 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.121 -1.141 17919 70932 1 173 . 1 1 43 43 LEU CB C 43 45.790 45.790 42.821 2.969 17919 70933 1 173 . 1 1 43 43 LEU H H 43 8.820 8.820 8.779 0.041 17919 70934 1 173 . 1 1 44 44 ILE N N 44 121.920 121.920 122.599 -0.679 17919 70935 1 173 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.088 -0.096 17919 70936 1 173 . 1 1 44 44 ILE C C 44 176.060 176.060 174.262 1.798 17919 70937 1 173 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.386 -1.406 17919 70938 1 173 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.794 -0.374 17919 70939 1 173 . 1 1 44 44 ILE H H 44 9.030 9.030 9.015 0.015 17919 70940 1 173 . 1 1 45 45 PHE N N 45 125.390 125.390 126.796 -1.406 17919 70941 1 173 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.977 0.068 17919 70942 1 173 . 1 1 45 45 PHE C C 45 174.470 174.470 174.303 0.167 17919 70943 1 173 . 1 1 45 45 PHE CA C 45 57.020 57.020 57.074 -0.054 17919 70944 1 173 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.028 0.732 17919 70945 1 173 . 1 1 45 45 PHE H H 45 8.830 8.830 8.953 -0.123 17919 70946 1 173 . 1 1 46 46 ALA N N 46 132.200 132.200 130.245 1.955 17919 70947 1 173 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.705 -0.015 17919 70948 1 173 . 1 1 46 46 ALA C C 46 177.290 177.290 177.885 -0.595 17919 70949 1 173 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.817 -0.277 17919 70950 1 173 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.579 -0.009 17919 70951 1 173 . 1 1 46 46 ALA H H 46 8.810 8.810 8.809 0.001 17919 70952 1 173 . 1 1 47 47 GLY N N 47 102.340 102.340 105.107 -2.767 17919 70953 1 173 . 1 1 47 47 GLY C C 47 173.810 173.810 174.405 -0.595 17919 70954 1 173 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.869 0.481 17919 70955 1 173 . 1 1 47 47 GLY H H 47 8.130 8.130 8.505 -0.375 17919 70956 1 173 . 1 1 48 48 LYS N N 48 121.570 121.570 121.621 -0.051 17919 70957 1 173 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.569 0.053 17919 70958 1 173 . 1 1 48 48 LYS C C 48 174.700 174.700 175.618 -0.918 17919 70959 1 173 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.111 -0.561 17919 70960 1 173 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.258 0.272 17919 70961 1 173 . 1 1 48 48 LYS H H 48 7.980 7.980 7.685 0.295 17919 70962 1 173 . 1 1 49 49 GLN N N 49 122.410 122.410 121.225 1.185 17919 70963 1 173 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.710 -0.150 17919 70964 1 173 . 1 1 49 49 GLN C C 49 175.670 175.670 176.103 -0.433 17919 70965 1 173 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.039 -0.299 17919 70966 1 173 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.273 -0.273 17919 70967 1 173 . 1 1 49 49 GLN H H 49 8.600 8.600 8.461 0.139 17919 70968 1 173 . 1 1 50 50 LEU N N 50 125.520 125.520 126.286 -0.766 17919 70969 1 173 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.046 0.044 17919 70970 1 173 . 1 1 50 50 LEU C C 50 176.660 176.660 176.664 -0.004 17919 70971 1 173 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.435 -0.195 17919 70972 1 173 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.865 -0.295 17919 70973 1 173 . 1 1 50 50 LEU H H 50 8.530 8.530 7.892 0.638 17919 70974 1 173 . 1 1 51 51 GLU N N 51 122.940 122.940 123.702 -0.762 17919 70975 1 173 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.524 -0.036 17919 70976 1 173 . 1 1 51 51 GLU C C 51 175.870 175.870 176.942 -1.072 17919 70977 1 173 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.535 0.425 17919 70978 1 173 . 1 1 51 51 GLU CB C 51 31.570 31.570 30.950 0.620 17919 70979 1 173 . 1 1 51 51 GLU H H 51 8.400 8.400 8.469 -0.069 17919 70980 1 173 . 1 1 52 52 ASP N N 52 120.030 120.030 125.321 -5.291 17919 70981 1 173 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.375 -0.016 17919 70982 1 173 . 1 1 52 52 ASP C C 52 177.330 177.330 177.608 -0.278 17919 70983 1 173 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.139 -0.179 17919 70984 1 173 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.701 0.149 17919 70985 1 173 . 1 1 52 52 ASP H H 52 8.160 8.160 8.913 -0.753 17919 70986 1 173 . 1 1 53 53 GLY N N 53 106.660 106.660 104.816 1.844 17919 70987 1 173 . 1 1 53 53 GLY C C 53 174.870 174.870 174.010 0.860 17919 70988 1 173 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.954 0.216 17919 70989 1 173 . 1 1 53 53 GLY H H 53 9.390 9.390 8.597 0.793 17919 70990 1 173 . 1 1 54 54 ARG N N 54 119.050 119.050 120.139 -1.089 17919 70991 1 173 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.806 -0.111 17919 70992 1 173 . 1 1 54 54 ARG C C 54 175.350 175.350 175.481 -0.131 17919 70993 1 173 . 1 1 54 54 ARG CA C 54 54.390 54.390 53.622 0.768 17919 70994 1 173 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.369 -0.719 17919 70995 1 173 . 1 1 54 54 ARG H H 54 7.460 7.460 7.420 0.040 17919 70996 1 173 . 1 1 55 55 THR N N 55 108.400 108.400 112.614 -4.214 17919 70997 1 173 . 1 1 55 55 THR HA H 55 5.240 5.240 4.923 0.317 17919 70998 1 173 . 1 1 55 55 THR C C 55 176.560 176.560 175.975 0.585 17919 70999 1 173 . 1 1 55 55 THR CA C 55 59.690 59.690 60.618 -0.929 17919 71000 1 173 . 1 1 55 55 THR CB C 55 72.260 72.260 70.894 1.366 17919 71001 1 173 . 1 1 55 55 THR H H 55 8.730 8.730 9.034 -0.303 17919 71002 1 173 . 1 1 56 56 LEU N N 56 117.920 117.920 122.271 -4.351 17919 71003 1 173 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.026 0.034 17919 71004 1 173 . 1 1 56 56 LEU C C 56 180.810 180.810 178.984 1.826 17919 71005 1 173 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.669 0.041 17919 71006 1 173 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.090 -0.720 17919 71007 1 173 . 1 1 56 56 LEU H H 56 8.140 8.140 9.020 -0.880 17919 71008 1 173 . 1 1 57 57 SER N N 57 113.330 113.330 114.131 -0.801 17919 71009 1 173 . 1 1 57 57 SER HA H 57 4.370 4.370 4.242 0.128 17919 71010 1 173 . 1 1 57 57 SER C C 57 178.310 178.310 176.533 1.777 17919 71011 1 173 . 1 1 57 57 SER CA C 57 61.080 61.080 61.917 -0.837 17919 71012 1 173 . 1 1 57 57 SER CB C 57 62.530 62.530 62.777 -0.247 17919 71013 1 173 . 1 1 57 57 SER H H 57 8.470 8.470 8.045 0.425 17919 71014 1 173 . 1 1 58 58 ASP N N 58 124.190 124.190 122.237 1.953 17919 71015 1 173 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.355 -0.059 17919 71016 1 173 . 1 1 58 58 ASP C C 58 177.400 177.400 177.384 0.016 17919 71017 1 173 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.658 0.522 17919 71018 1 173 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.532 -0.432 17919 71019 1 173 . 1 1 58 58 ASP H H 58 7.930 7.930 7.758 0.172 17919 71020 1 173 . 1 1 59 59 TYR N N 59 115.510 115.510 114.993 0.517 17919 71021 1 173 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.628 0.042 17919 71022 1 173 . 1 1 59 59 TYR C C 59 174.700 174.700 174.977 -0.277 17919 71023 1 173 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.430 0.820 17919 71024 1 173 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.791 1.279 17919 71025 1 173 . 1 1 59 59 TYR H H 59 7.250 7.250 7.480 -0.230 17919 71026 1 173 . 1 1 60 60 ASN N N 60 115.900 115.900 118.991 -3.091 17919 71027 1 173 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.443 -0.088 17919 71028 1 173 . 1 1 60 60 ASN C C 60 174.340 174.340 175.061 -0.721 17919 71029 1 173 . 1 1 60 60 ASN CA C 60 54.120 54.120 53.986 0.134 17919 71030 1 173 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.254 0.156 17919 71031 1 173 . 1 1 60 60 ASN H H 60 8.150 8.150 7.543 0.607 17919 71032 1 173 . 1 1 61 61 ILE N N 61 118.600 118.600 120.965 -2.365 17919 71033 1 173 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.683 -0.290 17919 71034 1 173 . 1 1 61 61 ILE C C 61 174.610 174.610 175.844 -1.234 17919 71035 1 173 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.176 0.244 17919 71036 1 173 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.696 -0.955 17919 71037 1 173 . 1 1 61 61 ILE H H 61 7.250 7.250 8.164 -0.914 17919 71038 1 173 . 1 1 62 62 GLN N N 62 124.740 124.740 125.583 -0.843 17919 71039 1 173 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.615 -0.109 17919 71040 1 173 . 1 1 62 62 GLN C C 62 175.970 175.970 175.525 0.445 17919 71041 1 173 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.664 -0.004 17919 71042 1 173 . 1 1 62 62 GLN CB C 62 31.650 31.650 32.429 -0.779 17919 71043 1 173 . 1 1 62 62 GLN H H 62 7.610 7.610 8.179 -0.569 17919 71044 1 173 . 1 1 63 63 LYS N N 63 120.300 120.300 122.502 -2.202 17919 71045 1 173 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.890 0.111 17919 71046 1 173 . 1 1 63 63 LYS C C 63 175.810 175.810 176.797 -0.987 17919 71047 1 173 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.413 -0.623 17919 71048 1 173 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.150 0.500 17919 71049 1 173 . 1 1 63 63 LYS H H 63 8.490 8.490 8.727 -0.237 17919 71050 1 173 . 1 1 64 64 GLU N N 64 113.950 113.950 120.459 -6.509 17919 71051 1 173 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.818 -0.353 17919 71052 1 173 . 1 1 64 64 GLU C C 64 175.250 175.250 175.939 -0.689 17919 71053 1 173 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.837 0.053 17919 71054 1 173 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.464 -2.564 17919 71055 1 173 . 1 1 64 64 GLU H H 64 9.280 9.280 9.069 0.211 17919 71056 1 173 . 1 1 65 65 SER N N 65 114.730 114.730 114.945 -0.215 17919 71057 1 173 . 1 1 65 65 SER HA H 65 4.640 4.640 4.610 0.030 17919 71058 1 173 . 1 1 65 65 SER C C 65 172.160 172.160 174.051 -1.891 17919 71059 1 173 . 1 1 65 65 SER CA C 65 60.890 60.890 59.220 1.670 17919 71060 1 173 . 1 1 65 65 SER CB C 65 64.910 64.910 64.983 -0.073 17919 71061 1 173 . 1 1 65 65 SER H H 65 7.670 7.670 8.068 -0.398 17919 71062 1 173 . 1 1 66 66 THR N N 66 117.110 117.110 119.613 -2.503 17919 71063 1 173 . 1 1 66 66 THR HA H 66 5.270 5.270 5.321 -0.051 17919 71064 1 173 . 1 1 66 66 THR C C 66 173.950 173.950 174.510 -0.560 17919 71065 1 173 . 1 1 66 66 THR CA C 66 62.340 62.340 62.089 0.251 17919 71066 1 173 . 1 1 66 66 THR CB C 66 70.080 70.080 70.162 -0.082 17919 71067 1 173 . 1 1 66 66 THR H H 66 8.730 8.730 8.483 0.247 17919 71068 1 173 . 1 1 67 67 LEU N N 67 127.110 127.110 128.215 -1.105 17919 71069 1 173 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.774 0.286 17919 71070 1 173 . 1 1 67 67 LEU C C 67 175.770 175.770 175.422 0.348 17919 71071 1 173 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.201 -0.301 17919 71072 1 173 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.918 0.342 17919 71073 1 173 . 1 1 67 67 LEU H H 67 9.410 9.410 9.117 0.293 17919 71074 1 173 . 1 1 68 68 HIS N N 68 118.380 118.380 121.019 -2.639 17919 71075 1 173 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.380 -0.140 17919 71076 1 173 . 1 1 68 68 HIS C C 68 173.150 173.150 173.457 -0.307 17919 71077 1 173 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.179 0.821 17919 71078 1 173 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.590 -2.060 17919 71079 1 173 . 1 1 68 68 HIS H H 68 9.230 9.230 9.335 -0.105 17919 71080 1 173 . 1 1 69 69 LEU N N 69 124.460 124.460 128.706 -4.246 17919 71081 1 173 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.672 0.518 17919 71082 1 173 . 1 1 69 69 LEU C C 69 175.270 175.270 173.779 1.491 17919 71083 1 173 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.633 0.257 17919 71084 1 173 . 1 1 69 69 LEU CB C 69 44.380 44.380 45.090 -0.710 17919 71085 1 173 . 1 1 69 69 LEU H H 69 8.340 8.340 9.079 -0.739 17919 71086 1 173 . 1 1 70 70 VAL N N 70 126.940 126.940 127.149 -0.209 17919 71087 1 173 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.308 0.042 17919 71088 1 173 . 1 1 70 70 VAL C C 70 174.000 174.000 174.266 -0.266 17919 71089 1 173 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.718 0.083 17919 71090 1 173 . 1 1 70 70 VAL CB C 70 34.910 34.910 33.967 0.943 17919 71091 1 173 . 1 1 70 70 VAL H H 70 9.200 9.200 8.563 0.637 17919 71092 1 173 . 1 1 71 71 LEU N N 71 123.130 123.130 127.403 -4.273 17919 71093 1 173 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.728 0.332 17919 71094 1 173 . 1 1 71 71 LEU C C 71 177.830 177.830 176.438 1.392 17919 71095 1 173 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.718 0.222 17919 71096 1 173 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.429 -0.579 17919 71097 1 173 . 1 1 71 71 LEU H H 71 8.120 8.120 8.496 -0.376 17919 71098 1 173 . 1 1 72 72 ARG N N 72 123.490 123.490 125.765 -2.275 17919 71099 1 173 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.499 -0.198 17919 71100 1 173 . 1 1 72 72 ARG C C 72 175.350 175.350 175.339 0.011 17919 71101 1 173 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.549 0.061 17919 71102 1 173 . 1 1 72 72 ARG CB C 72 31.350 31.350 31.138 0.212 17919 71103 1 173 . 1 1 72 72 ARG H H 72 8.580 8.580 8.164 0.416 17919 71104 1 174 . 1 1 2 2 GLN N N 2 123.220 123.220 121.358 1.862 17919 71105 1 174 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.282 -0.033 17919 71106 1 174 . 1 1 2 2 GLN C C 2 175.920 175.920 175.762 0.158 17919 71107 1 174 . 1 1 2 2 GLN CA C 2 55.080 55.080 55.118 -0.038 17919 71108 1 174 . 1 1 2 2 GLN CB C 2 30.760 30.760 29.625 1.135 17919 71109 1 174 . 1 1 2 2 GLN H H 2 8.900 8.900 8.431 0.469 17919 71110 1 174 . 1 1 3 3 ILE N N 3 115.340 115.340 117.062 -1.722 17919 71111 1 174 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.440 -0.227 17919 71112 1 174 . 1 1 3 3 ILE C C 3 172.450 172.450 173.516 -1.066 17919 71113 1 174 . 1 1 3 3 ILE CA C 3 59.570 59.570 58.908 0.662 17919 71114 1 174 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.806 0.404 17919 71115 1 174 . 1 1 3 3 ILE H H 3 8.320 8.320 8.368 -0.048 17919 71116 1 174 . 1 1 4 4 PHE N N 4 118.110 118.110 118.402 -0.292 17919 71117 1 174 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.490 0.140 17919 71118 1 174 . 1 1 4 4 PHE C C 4 175.320 175.320 175.477 -0.157 17919 71119 1 174 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.830 -0.620 17919 71120 1 174 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.920 -0.440 17919 71121 1 174 . 1 1 4 4 PHE H H 4 8.610 8.610 8.257 0.353 17919 71122 1 174 . 1 1 5 5 VAL N N 5 121.000 121.000 123.399 -2.399 17919 71123 1 174 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.304 0.421 17919 71124 1 174 . 1 1 5 5 VAL C C 5 174.870 174.870 174.730 0.140 17919 71125 1 174 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.752 -1.132 17919 71126 1 174 . 1 1 5 5 VAL CB C 5 34.230 34.230 32.625 1.605 17919 71127 1 174 . 1 1 5 5 VAL H H 5 9.300 9.300 8.967 0.333 17919 71128 1 174 . 1 1 6 6 LYS N N 6 127.520 127.520 129.425 -1.905 17919 71129 1 174 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.332 0.035 17919 71130 1 174 . 1 1 6 6 LYS C C 6 177.140 177.140 176.640 0.500 17919 71131 1 174 . 1 1 6 6 LYS CA C 6 54.520 54.520 53.964 0.556 17919 71132 1 174 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.495 0.555 17919 71133 1 174 . 1 1 6 6 LYS H H 6 8.820 8.820 9.024 -0.204 17919 71134 1 174 . 1 1 7 7 THR N N 7 115.400 115.400 118.269 -2.869 17919 71135 1 174 . 1 1 7 7 THR HA H 7 4.970 4.970 4.556 0.414 17919 71136 1 174 . 1 1 7 7 THR C C 7 176.910 176.910 176.906 0.004 17919 71137 1 174 . 1 1 7 7 THR CA C 7 60.470 60.470 61.472 -1.002 17919 71138 1 174 . 1 1 7 7 THR CB C 7 70.630 70.630 69.996 0.634 17919 71139 1 174 . 1 1 7 7 THR H H 7 8.730 8.730 8.681 0.049 17919 71140 1 174 . 1 1 8 8 LEU N N 8 121.330 121.330 118.397 2.933 17919 71141 1 174 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.541 -0.231 17919 71142 1 174 . 1 1 8 8 LEU C C 8 178.800 178.800 177.334 1.466 17919 71143 1 174 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.528 0.052 17919 71144 1 174 . 1 1 8 8 LEU CB C 8 41.970 41.970 40.800 1.170 17919 71145 1 174 . 1 1 8 8 LEU H H 8 9.100 9.100 8.449 0.651 17919 71146 1 174 . 1 1 9 9 THR N N 9 105.590 105.590 110.369 -4.779 17919 71147 1 174 . 1 1 9 9 THR HA H 9 4.428 4.428 4.382 0.046 17919 71148 1 174 . 1 1 9 9 THR C C 9 175.520 175.520 175.704 -0.184 17919 71149 1 174 . 1 1 9 9 THR CA C 9 61.400 61.400 61.591 -0.191 17919 71150 1 174 . 1 1 9 9 THR CB C 9 69.140 69.140 68.966 0.174 17919 71151 1 174 . 1 1 9 9 THR H H 9 7.630 7.630 7.692 -0.062 17919 71152 1 174 . 1 1 10 10 GLY N N 10 108.890 108.890 109.933 -1.043 17919 71153 1 174 . 1 1 10 10 GLY C C 10 174.070 174.070 173.340 0.730 17919 71154 1 174 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.086 0.374 17919 71155 1 174 . 1 1 10 10 GLY H H 10 7.810 7.810 7.859 -0.049 17919 71156 1 174 . 1 1 11 11 LYS N N 11 121.600 121.600 121.393 0.207 17919 71157 1 174 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.264 0.097 17919 71158 1 174 . 1 1 11 11 LYS C C 11 175.940 175.940 175.733 0.207 17919 71159 1 174 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.714 -0.434 17919 71160 1 174 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.178 0.022 17919 71161 1 174 . 1 1 11 11 LYS H H 11 7.280 7.280 7.841 -0.561 17919 71162 1 174 . 1 1 12 12 THR N N 12 120.440 120.440 122.044 -1.604 17919 71163 1 174 . 1 1 12 12 THR HA H 12 5.046 5.046 4.801 0.245 17919 71164 1 174 . 1 1 12 12 THR C C 12 174.320 174.320 174.281 0.039 17919 71165 1 174 . 1 1 12 12 THR CA C 12 62.390 62.390 62.518 -0.128 17919 71166 1 174 . 1 1 12 12 THR CB C 12 69.910 69.910 69.604 0.306 17919 71167 1 174 . 1 1 12 12 THR H H 12 8.650 8.650 8.240 0.410 17919 71168 1 174 . 1 1 13 13 ILE N N 13 127.110 127.110 127.707 -0.597 17919 71169 1 174 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.473 0.071 17919 71170 1 174 . 1 1 13 13 ILE C C 13 175.220 175.220 175.256 -0.036 17919 71171 1 174 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.407 -0.428 17919 71172 1 174 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.272 -0.322 17919 71173 1 174 . 1 1 13 13 ILE H H 13 9.450 9.450 8.978 0.472 17919 71174 1 174 . 1 1 14 14 THR N N 14 121.520 121.520 121.468 0.052 17919 71175 1 174 . 1 1 14 14 THR HA H 14 4.964 4.964 4.947 0.017 17919 71176 1 174 . 1 1 14 14 THR C C 14 173.790 173.790 173.763 0.027 17919 71177 1 174 . 1 1 14 14 THR CA C 14 61.940 61.940 61.593 0.347 17919 71178 1 174 . 1 1 14 14 THR CB C 14 69.650 69.650 70.167 -0.517 17919 71179 1 174 . 1 1 14 14 THR H H 14 8.710 8.710 8.447 0.263 17919 71180 1 174 . 1 1 15 15 LEU N N 15 124.800 124.800 127.509 -2.709 17919 71181 1 174 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.713 0.067 17919 71182 1 174 . 1 1 15 15 LEU C C 15 174.670 174.670 175.429 -0.759 17919 71183 1 174 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.805 -0.975 17919 71184 1 174 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.026 2.045 17919 71185 1 174 . 1 1 15 15 LEU H H 15 8.710 8.710 8.515 0.195 17919 71186 1 174 . 1 1 16 16 GLU N N 16 122.160 122.160 123.502 -1.342 17919 71187 1 174 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.388 -0.471 17919 71188 1 174 . 1 1 16 16 GLU C C 16 175.860 175.860 176.074 -0.214 17919 71189 1 174 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.986 -1.166 17919 71190 1 174 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.579 -1.129 17919 71191 1 174 . 1 1 16 16 GLU H H 16 8.140 8.140 8.660 -0.520 17919 71192 1 174 . 1 1 17 17 VAL N N 17 117.210 117.210 119.614 -2.404 17919 71193 1 174 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.688 0.026 17919 71194 1 174 . 1 1 17 17 VAL C C 17 174.160 174.160 174.232 -0.072 17919 71195 1 174 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.824 -1.394 17919 71196 1 174 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.560 0.840 17919 71197 1 174 . 1 1 17 17 VAL H H 17 8.900 8.900 8.654 0.246 17919 71198 1 174 . 1 1 18 18 GLU N N 18 118.990 118.990 120.151 -1.161 17919 71199 1 174 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.875 0.204 17919 71200 1 174 . 1 1 18 18 GLU C C 18 176.160 176.160 175.471 0.689 17919 71201 1 174 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.960 -0.240 17919 71202 1 174 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.748 -0.438 17919 71203 1 174 . 1 1 18 18 GLU H H 18 8.640 8.640 8.629 0.011 17919 71204 1 174 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.458 -0.317 17919 71205 1 174 . 1 1 19 19 PRO C C 19 175.310 175.310 177.612 -2.302 17919 71206 1 174 . 1 1 19 19 PRO CA C 19 65.470 65.470 64.945 0.525 17919 71207 1 174 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.060 -0.110 17919 71208 1 174 . 1 1 20 20 SER N N 20 103.400 103.400 112.287 -8.887 17919 71209 1 174 . 1 1 20 20 SER HA H 20 4.370 4.370 4.459 -0.089 17919 71210 1 174 . 1 1 20 20 SER C C 20 174.660 174.660 174.286 0.374 17919 71211 1 174 . 1 1 20 20 SER CA C 20 57.400 57.400 59.265 -1.865 17919 71212 1 174 . 1 1 20 20 SER CB C 20 63.370 63.370 62.836 0.534 17919 71213 1 174 . 1 1 20 20 SER H H 20 7.040 7.040 8.300 -1.260 17919 71214 1 174 . 1 1 21 21 ASP N N 21 123.480 123.480 123.139 0.341 17919 71215 1 174 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.793 -0.098 17919 71216 1 174 . 1 1 21 21 ASP C C 21 176.360 176.360 175.381 0.979 17919 71217 1 174 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.757 0.943 17919 71218 1 174 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.696 -0.895 17919 71219 1 174 . 1 1 21 21 ASP H H 21 8.030 8.030 7.724 0.306 17919 71220 1 174 . 1 1 22 22 THR N N 22 108.800 108.800 110.358 -1.558 17919 71221 1 174 . 1 1 22 22 THR HA H 22 4.920 4.920 4.963 -0.043 17919 71222 1 174 . 1 1 22 22 THR C C 22 176.750 176.750 176.162 0.588 17919 71223 1 174 . 1 1 22 22 THR CA C 22 59.690 59.690 60.387 -0.697 17919 71224 1 174 . 1 1 22 22 THR CB C 22 71.200 71.200 71.446 -0.246 17919 71225 1 174 . 1 1 22 22 THR H H 22 7.900 7.900 8.088 -0.188 17919 71226 1 174 . 1 1 23 23 ILE N N 23 121.190 121.190 121.973 -0.783 17919 71227 1 174 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.829 -0.172 17919 71228 1 174 . 1 1 23 23 ILE C C 23 179.040 179.040 177.654 1.386 17919 71229 1 174 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.168 0.092 17919 71230 1 174 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.141 -1.791 17919 71231 1 174 . 1 1 23 23 ILE H H 23 8.560 8.560 8.591 -0.031 17919 71232 1 174 . 1 1 24 24 GLU N N 24 120.830 120.830 121.290 -0.460 17919 71233 1 174 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.831 0.086 17919 71234 1 174 . 1 1 24 24 GLU C C 24 178.640 178.640 178.621 0.019 17919 71235 1 174 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.328 -0.108 17919 71236 1 174 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.425 -1.145 17919 71237 1 174 . 1 1 24 24 GLU H H 24 9.760 9.760 8.776 0.984 17919 71238 1 174 . 1 1 25 25 ASN N N 25 120.570 120.570 117.961 2.609 17919 71239 1 174 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.424 0.101 17919 71240 1 174 . 1 1 25 25 ASN C C 25 178.380 178.380 178.017 0.363 17919 71241 1 174 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.228 -0.168 17919 71242 1 174 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.583 -0.133 17919 71243 1 174 . 1 1 25 25 ASN H H 25 7.920 7.920 7.795 0.125 17919 71244 1 174 . 1 1 26 26 VAL N N 26 121.710 121.710 120.187 1.523 17919 71245 1 174 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.620 -0.223 17919 71246 1 174 . 1 1 26 26 VAL C C 26 177.950 177.950 177.926 0.024 17919 71247 1 174 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.126 1.534 17919 71248 1 174 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.090 -0.249 17919 71249 1 174 . 1 1 26 26 VAL H H 26 8.070 8.070 8.066 0.004 17919 71250 1 174 . 1 1 27 27 LYS N N 27 118.860 118.860 119.791 -0.931 17919 71251 1 174 . 1 1 27 27 LYS HA H 27 4.580 4.580 3.942 0.638 17919 71252 1 174 . 1 1 27 27 LYS C C 27 180.550 180.550 178.998 1.552 17919 71253 1 174 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.937 -0.687 17919 71254 1 174 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.153 1.577 17919 71255 1 174 . 1 1 27 27 LYS H H 27 8.560 8.560 8.541 0.019 17919 71256 1 174 . 1 1 28 28 ALA N N 28 123.440 123.440 119.579 3.861 17919 71257 1 174 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.241 -0.081 17919 71258 1 174 . 1 1 28 28 ALA C C 28 180.300 180.300 178.751 1.549 17919 71259 1 174 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.420 0.950 17919 71260 1 174 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.417 -0.707 17919 71261 1 174 . 1 1 28 28 ALA H H 28 8.060 8.060 8.191 -0.131 17919 71262 1 174 . 1 1 29 29 LYS N N 29 119.940 119.940 120.014 -0.074 17919 71263 1 174 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.078 0.129 17919 71264 1 174 . 1 1 29 29 LYS C C 29 180.320 180.320 179.134 1.186 17919 71265 1 174 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.256 0.394 17919 71266 1 174 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.365 0.925 17919 71267 1 174 . 1 1 29 29 LYS H H 29 7.850 7.850 7.486 0.364 17919 71268 1 174 . 1 1 30 30 ILE N N 30 121.080 121.080 120.707 0.373 17919 71269 1 174 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.588 -0.081 17919 71270 1 174 . 1 1 30 30 ILE C C 30 178.310 178.310 177.510 0.800 17919 71271 1 174 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.127 1.023 17919 71272 1 174 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.482 -0.682 17919 71273 1 174 . 1 1 30 30 ILE H H 30 8.280 8.280 7.981 0.299 17919 71274 1 174 . 1 1 31 31 GLN N N 31 123.490 123.490 120.970 2.520 17919 71275 1 174 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.073 -0.244 17919 71276 1 174 . 1 1 31 31 GLN C C 31 178.890 178.890 178.388 0.502 17919 71277 1 174 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.240 0.760 17919 71278 1 174 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.618 -0.898 17919 71279 1 174 . 1 1 31 31 GLN H H 31 8.580 8.580 8.498 0.082 17919 71280 1 174 . 1 1 32 32 ASP N N 32 119.360 119.360 119.314 0.046 17919 71281 1 174 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.418 -0.064 17919 71282 1 174 . 1 1 32 32 ASP C C 32 177.250 177.250 178.087 -0.837 17919 71283 1 174 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.837 0.352 17919 71284 1 174 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.830 -0.250 17919 71285 1 174 . 1 1 32 32 ASP H H 32 8.010 8.010 8.431 -0.421 17919 71286 1 174 . 1 1 33 33 LYS N N 33 115.130 115.130 117.458 -2.328 17919 71287 1 174 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.272 0.065 17919 71288 1 174 . 1 1 33 33 LYS C C 33 177.870 177.870 178.081 -0.211 17919 71289 1 174 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.576 -0.526 17919 71290 1 174 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.613 0.557 17919 71291 1 174 . 1 1 33 33 LYS H H 33 7.430 7.430 7.637 -0.207 17919 71292 1 174 . 1 1 34 34 GLU N N 34 113.870 113.870 114.584 -0.714 17919 71293 1 174 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.437 0.188 17919 71294 1 174 . 1 1 34 34 GLU C C 34 177.840 177.840 177.630 0.210 17919 71295 1 174 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.074 -0.904 17919 71296 1 174 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.486 1.174 17919 71297 1 174 . 1 1 34 34 GLU H H 34 8.740 8.740 8.268 0.472 17919 71298 1 174 . 1 1 35 35 GLY N N 35 108.650 108.650 109.369 -0.719 17919 71299 1 174 . 1 1 35 35 GLY C C 35 173.960 173.960 174.308 -0.348 17919 71300 1 174 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.733 0.347 17919 71301 1 174 . 1 1 35 35 GLY H H 35 8.530 8.530 8.492 0.038 17919 71302 1 174 . 1 1 36 36 ILE N N 36 119.880 119.880 122.765 -2.885 17919 71303 1 174 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.281 0.164 17919 71304 1 174 . 1 1 36 36 ILE C C 36 173.590 173.590 174.494 -0.904 17919 71305 1 174 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.055 -0.305 17919 71306 1 174 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.204 2.376 17919 71307 1 174 . 1 1 36 36 ILE H H 36 6.150 6.150 7.706 -1.556 17919 71308 1 174 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.902 -0.268 17919 71309 1 174 . 1 1 37 37 PRO C C 37 176.940 176.940 176.288 0.652 17919 71310 1 174 . 1 1 37 37 PRO CA C 37 61.660 61.660 60.858 0.802 17919 71311 1 174 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.371 0.479 17919 71312 1 174 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.159 -0.042 17919 71313 1 174 . 1 1 38 38 PRO C C 38 178.320 178.320 178.615 -0.295 17919 71314 1 174 . 1 1 38 38 PRO CA C 38 66.260 66.260 66.353 -0.093 17919 71315 1 174 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.752 1.138 17919 71316 1 174 . 1 1 39 39 ASP N N 39 113.380 113.380 114.897 -1.517 17919 71317 1 174 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.444 -0.014 17919 71318 1 174 . 1 1 39 39 ASP C C 39 177.090 177.090 177.633 -0.543 17919 71319 1 174 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.573 -0.933 17919 71320 1 174 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.284 -0.744 17919 71321 1 174 . 1 1 39 39 ASP H H 39 8.550 8.550 8.541 0.009 17919 71322 1 174 . 1 1 40 40 GLN N N 40 116.780 116.780 115.495 1.285 17919 71323 1 174 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.315 0.149 17919 71324 1 174 . 1 1 40 40 GLN C C 40 175.380 175.380 175.382 -0.002 17919 71325 1 174 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.733 -0.092 17919 71326 1 174 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.165 0.975 17919 71327 1 174 . 1 1 40 40 GLN H H 40 7.820 7.820 8.036 -0.216 17919 71328 1 174 . 1 1 41 41 GLN N N 41 117.720 117.720 116.409 1.311 17919 71329 1 174 . 1 1 41 41 GLN HA H 41 4.244 4.244 5.153 -0.909 17919 71330 1 174 . 1 1 41 41 GLN C C 41 176.300 176.300 175.139 1.161 17919 71331 1 174 . 1 1 41 41 GLN CA C 41 56.470 56.470 54.227 2.243 17919 71332 1 174 . 1 1 41 41 GLN CB C 41 31.650 31.650 31.826 -0.176 17919 71333 1 174 . 1 1 41 41 GLN H H 41 7.480 7.480 7.348 0.132 17919 71334 1 174 . 1 1 42 42 ARG N N 42 122.680 122.680 121.324 1.356 17919 71335 1 174 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.688 -0.188 17919 71336 1 174 . 1 1 42 42 ARG C C 42 174.050 174.050 174.209 -0.159 17919 71337 1 174 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.032 0.018 17919 71338 1 174 . 1 1 42 42 ARG CB C 42 31.750 31.750 34.175 -2.425 17919 71339 1 174 . 1 1 42 42 ARG H H 42 8.530 8.530 8.503 0.027 17919 71340 1 174 . 1 1 43 43 LEU N N 43 124.040 124.040 123.918 0.122 17919 71341 1 174 . 1 1 43 43 LEU C C 43 175.290 175.290 175.325 -0.035 17919 71342 1 174 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.888 -0.908 17919 71343 1 174 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.623 1.167 17919 71344 1 174 . 1 1 43 43 LEU H H 43 8.820 8.820 8.811 0.009 17919 71345 1 174 . 1 1 44 44 ILE N N 44 121.920 121.920 121.830 0.090 17919 71346 1 174 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.815 0.177 17919 71347 1 174 . 1 1 44 44 ILE C C 44 176.060 176.060 174.197 1.863 17919 71348 1 174 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.411 -1.431 17919 71349 1 174 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.610 -0.190 17919 71350 1 174 . 1 1 44 44 ILE H H 44 9.030 9.030 8.791 0.239 17919 71351 1 174 . 1 1 45 45 PHE N N 45 125.390 125.390 127.060 -1.670 17919 71352 1 174 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.071 -0.026 17919 71353 1 174 . 1 1 45 45 PHE C C 45 174.470 174.470 174.466 0.004 17919 71354 1 174 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.229 0.791 17919 71355 1 174 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.041 0.719 17919 71356 1 174 . 1 1 45 45 PHE H H 45 8.830 8.830 9.052 -0.222 17919 71357 1 174 . 1 1 46 46 ALA N N 46 132.200 132.200 130.251 1.949 17919 71358 1 174 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.665 0.025 17919 71359 1 174 . 1 1 46 46 ALA C C 46 177.290 177.290 177.264 0.026 17919 71360 1 174 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.865 -0.325 17919 71361 1 174 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.399 0.171 17919 71362 1 174 . 1 1 46 46 ALA H H 46 8.810 8.810 9.040 -0.230 17919 71363 1 174 . 1 1 47 47 GLY N N 47 102.340 102.340 104.440 -2.100 17919 71364 1 174 . 1 1 47 47 GLY C C 47 173.810 173.810 174.591 -0.781 17919 71365 1 174 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.406 -0.056 17919 71366 1 174 . 1 1 47 47 GLY H H 47 8.130 8.130 8.595 -0.465 17919 71367 1 174 . 1 1 48 48 LYS N N 48 121.570 121.570 121.579 -0.009 17919 71368 1 174 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.620 0.002 17919 71369 1 174 . 1 1 48 48 LYS C C 48 174.700 174.700 175.055 -0.355 17919 71370 1 174 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.888 -0.338 17919 71371 1 174 . 1 1 48 48 LYS CB C 48 34.530 34.530 33.979 0.551 17919 71372 1 174 . 1 1 48 48 LYS H H 48 7.980 7.980 7.685 0.295 17919 71373 1 174 . 1 1 49 49 GLN N N 49 122.410 122.410 124.213 -1.803 17919 71374 1 174 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.798 -0.238 17919 71375 1 174 . 1 1 49 49 GLN C C 49 175.670 175.670 175.733 -0.063 17919 71376 1 174 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.343 0.398 17919 71377 1 174 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.579 -0.579 17919 71378 1 174 . 1 1 49 49 GLN H H 49 8.600 8.600 8.512 0.088 17919 71379 1 174 . 1 1 50 50 LEU N N 50 125.520 125.520 128.055 -2.535 17919 71380 1 174 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.147 -0.057 17919 71381 1 174 . 1 1 50 50 LEU C C 50 176.660 176.660 176.206 0.454 17919 71382 1 174 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.959 0.281 17919 71383 1 174 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.125 -0.555 17919 71384 1 174 . 1 1 50 50 LEU H H 50 8.530 8.530 8.111 0.419 17919 71385 1 174 . 1 1 51 51 GLU N N 51 122.940 122.940 124.104 -1.164 17919 71386 1 174 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.425 0.063 17919 71387 1 174 . 1 1 51 51 GLU C C 51 175.870 175.870 177.192 -1.322 17919 71388 1 174 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.618 0.342 17919 71389 1 174 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.526 0.044 17919 71390 1 174 . 1 1 51 51 GLU H H 51 8.400 8.400 8.421 -0.021 17919 71391 1 174 . 1 1 52 52 ASP N N 52 120.030 120.030 127.078 -7.048 17919 71392 1 174 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.409 -0.050 17919 71393 1 174 . 1 1 52 52 ASP C C 52 177.330 177.330 178.074 -0.744 17919 71394 1 174 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.503 -0.543 17919 71395 1 174 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.418 0.432 17919 71396 1 174 . 1 1 52 52 ASP H H 52 8.160 8.160 8.832 -0.672 17919 71397 1 174 . 1 1 53 53 GLY N N 53 106.660 106.660 105.261 1.399 17919 71398 1 174 . 1 1 53 53 GLY C C 53 174.870 174.870 174.287 0.583 17919 71399 1 174 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.166 0.004 17919 71400 1 174 . 1 1 53 53 GLY H H 53 9.390 9.390 8.596 0.794 17919 71401 1 174 . 1 1 54 54 ARG N N 54 119.050 119.050 119.815 -0.765 17919 71402 1 174 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.667 0.028 17919 71403 1 174 . 1 1 54 54 ARG C C 54 175.350 175.350 175.055 0.295 17919 71404 1 174 . 1 1 54 54 ARG CA C 54 54.390 54.390 53.899 0.491 17919 71405 1 174 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.679 -0.029 17919 71406 1 174 . 1 1 54 54 ARG H H 54 7.460 7.460 7.428 0.032 17919 71407 1 174 . 1 1 55 55 THR N N 55 108.400 108.400 111.951 -3.551 17919 71408 1 174 . 1 1 55 55 THR HA H 55 5.240 5.240 5.238 0.002 17919 71409 1 174 . 1 1 55 55 THR C C 55 176.560 176.560 176.049 0.511 17919 71410 1 174 . 1 1 55 55 THR CA C 55 59.690 59.690 60.043 -0.353 17919 71411 1 174 . 1 1 55 55 THR CB C 55 72.260 72.260 71.425 0.835 17919 71412 1 174 . 1 1 55 55 THR H H 55 8.730 8.730 9.140 -0.410 17919 71413 1 174 . 1 1 56 56 LEU N N 56 117.920 117.920 122.358 -4.438 17919 71414 1 174 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.035 0.025 17919 71415 1 174 . 1 1 56 56 LEU C C 56 180.810 180.810 178.940 1.870 17919 71416 1 174 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.722 -0.012 17919 71417 1 174 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.467 -1.097 17919 71418 1 174 . 1 1 56 56 LEU H H 56 8.140 8.140 8.607 -0.467 17919 71419 1 174 . 1 1 57 57 SER N N 57 113.330 113.330 115.182 -1.852 17919 71420 1 174 . 1 1 57 57 SER HA H 57 4.370 4.370 4.220 0.150 17919 71421 1 174 . 1 1 57 57 SER C C 57 178.310 178.310 176.856 1.454 17919 71422 1 174 . 1 1 57 57 SER CA C 57 61.080 61.080 62.088 -1.008 17919 71423 1 174 . 1 1 57 57 SER CB C 57 62.530 62.530 62.724 -0.194 17919 71424 1 174 . 1 1 57 57 SER H H 57 8.470 8.470 8.086 0.384 17919 71425 1 174 . 1 1 58 58 ASP N N 58 124.190 124.190 121.844 2.346 17919 71426 1 174 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.369 -0.073 17919 71427 1 174 . 1 1 58 58 ASP C C 58 177.400 177.400 177.041 0.359 17919 71428 1 174 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.501 0.679 17919 71429 1 174 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.301 -0.201 17919 71430 1 174 . 1 1 58 58 ASP H H 58 7.930 7.930 7.794 0.136 17919 71431 1 174 . 1 1 59 59 TYR N N 59 115.510 115.510 115.833 -0.323 17919 71432 1 174 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.583 0.087 17919 71433 1 174 . 1 1 59 59 TYR C C 59 174.700 174.700 175.306 -0.606 17919 71434 1 174 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.214 1.036 17919 71435 1 174 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.448 1.622 17919 71436 1 174 . 1 1 59 59 TYR H H 59 7.250 7.250 7.321 -0.071 17919 71437 1 174 . 1 1 60 60 ASN N N 60 115.900 115.900 117.243 -1.343 17919 71438 1 174 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.381 -0.026 17919 71439 1 174 . 1 1 60 60 ASN C C 60 174.340 174.340 174.607 -0.267 17919 71440 1 174 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.349 -0.229 17919 71441 1 174 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.176 0.234 17919 71442 1 174 . 1 1 60 60 ASN H H 60 8.150 8.150 7.681 0.469 17919 71443 1 174 . 1 1 61 61 ILE N N 61 118.600 118.600 119.722 -1.122 17919 71444 1 174 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.709 -0.316 17919 71445 1 174 . 1 1 61 61 ILE C C 61 174.610 174.610 175.262 -0.652 17919 71446 1 174 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.343 0.077 17919 71447 1 174 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.971 -1.231 17919 71448 1 174 . 1 1 61 61 ILE H H 61 7.250 7.250 7.905 -0.655 17919 71449 1 174 . 1 1 62 62 GLN N N 62 124.740 124.740 123.784 0.956 17919 71450 1 174 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.908 -0.402 17919 71451 1 174 . 1 1 62 62 GLN C C 62 175.970 175.970 175.381 0.589 17919 71452 1 174 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.507 0.153 17919 71453 1 174 . 1 1 62 62 GLN CB C 62 31.650 31.650 33.701 -2.051 17919 71454 1 174 . 1 1 62 62 GLN H H 62 7.610 7.610 7.996 -0.386 17919 71455 1 174 . 1 1 63 63 LYS N N 63 120.300 120.300 121.208 -0.908 17919 71456 1 174 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.034 -0.033 17919 71457 1 174 . 1 1 63 63 LYS C C 63 175.810 175.810 176.923 -1.113 17919 71458 1 174 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.909 -0.119 17919 71459 1 174 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.156 0.494 17919 71460 1 174 . 1 1 63 63 LYS H H 63 8.490 8.490 8.710 -0.220 17919 71461 1 174 . 1 1 64 64 GLU N N 64 113.950 113.950 118.917 -4.967 17919 71462 1 174 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.942 -0.477 17919 71463 1 174 . 1 1 64 64 GLU C C 64 175.250 175.250 176.347 -1.097 17919 71464 1 174 . 1 1 64 64 GLU CA C 64 57.890 57.890 58.056 -0.166 17919 71465 1 174 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.433 -2.533 17919 71466 1 174 . 1 1 64 64 GLU H H 64 9.280 9.280 9.073 0.207 17919 71467 1 174 . 1 1 65 65 SER N N 65 114.730 114.730 116.591 -1.861 17919 71468 1 174 . 1 1 65 65 SER HA H 65 4.640 4.640 4.515 0.125 17919 71469 1 174 . 1 1 65 65 SER C C 65 172.160 172.160 173.654 -1.494 17919 71470 1 174 . 1 1 65 65 SER CA C 65 60.890 60.890 60.630 0.260 17919 71471 1 174 . 1 1 65 65 SER CB C 65 64.910 64.910 64.281 0.630 17919 71472 1 174 . 1 1 65 65 SER H H 65 7.670 7.670 7.365 0.305 17919 71473 1 174 . 1 1 66 66 THR N N 66 117.110 117.110 119.364 -2.254 17919 71474 1 174 . 1 1 66 66 THR HA H 66 5.270 5.270 5.004 0.266 17919 71475 1 174 . 1 1 66 66 THR C C 66 173.950 173.950 174.361 -0.411 17919 71476 1 174 . 1 1 66 66 THR CA C 66 62.340 62.340 61.923 0.417 17919 71477 1 174 . 1 1 66 66 THR CB C 66 70.080 70.080 70.710 -0.630 17919 71478 1 174 . 1 1 66 66 THR H H 66 8.730 8.730 8.510 0.220 17919 71479 1 174 . 1 1 67 67 LEU N N 67 127.110 127.110 127.736 -0.626 17919 71480 1 174 . 1 1 67 67 LEU HA H 67 5.060 5.060 5.003 0.057 17919 71481 1 174 . 1 1 67 67 LEU C C 67 175.770 175.770 175.867 -0.097 17919 71482 1 174 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.260 -0.359 17919 71483 1 174 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.523 0.737 17919 71484 1 174 . 1 1 67 67 LEU H H 67 9.410 9.410 8.924 0.486 17919 71485 1 174 . 1 1 68 68 HIS N N 68 118.380 118.380 121.662 -3.282 17919 71486 1 174 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.175 0.065 17919 71487 1 174 . 1 1 68 68 HIS C C 68 173.150 173.150 173.819 -0.669 17919 71488 1 174 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.090 0.910 17919 71489 1 174 . 1 1 68 68 HIS CB C 68 30.530 30.530 31.333 -0.803 17919 71490 1 174 . 1 1 68 68 HIS H H 68 9.230 9.230 9.137 0.093 17919 71491 1 174 . 1 1 69 69 LEU N N 69 124.460 124.460 130.197 -5.737 17919 71492 1 174 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.351 -0.161 17919 71493 1 174 . 1 1 69 69 LEU C C 69 175.270 175.270 174.096 1.174 17919 71494 1 174 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.291 0.599 17919 71495 1 174 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.940 -0.559 17919 71496 1 174 . 1 1 69 69 LEU H H 69 8.340 8.340 8.633 -0.293 17919 71497 1 174 . 1 1 70 70 VAL N N 70 126.940 126.940 127.100 -0.160 17919 71498 1 174 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.330 0.020 17919 71499 1 174 . 1 1 70 70 VAL C C 70 174.000 174.000 174.106 -0.106 17919 71500 1 174 . 1 1 70 70 VAL CA C 70 60.800 60.800 61.596 -0.797 17919 71501 1 174 . 1 1 70 70 VAL CB C 70 34.910 34.910 33.547 1.363 17919 71502 1 174 . 1 1 70 70 VAL H H 70 9.200 9.200 8.736 0.464 17919 71503 1 174 . 1 1 71 71 LEU N N 71 123.130 123.130 126.765 -3.635 17919 71504 1 174 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.539 -0.479 17919 71505 1 174 . 1 1 71 71 LEU C C 71 177.830 177.830 176.143 1.687 17919 71506 1 174 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.164 0.775 17919 71507 1 174 . 1 1 71 71 LEU CB C 71 42.850 42.850 45.601 -2.751 17919 71508 1 174 . 1 1 71 71 LEU H H 71 8.120 8.120 8.414 -0.294 17919 71509 1 174 . 1 1 72 72 ARG N N 72 123.490 123.490 122.371 1.119 17919 71510 1 174 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.682 -0.381 17919 71511 1 174 . 1 1 72 72 ARG C C 72 175.350 175.350 174.251 1.099 17919 71512 1 174 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.291 0.319 17919 71513 1 174 . 1 1 72 72 ARG CB C 72 31.350 31.350 31.614 -0.264 17919 71514 1 174 . 1 1 72 72 ARG H H 72 8.580 8.580 8.268 0.312 17919 71515 1 175 . 1 1 2 2 GLN N N 2 123.220 123.220 120.129 3.091 17919 71516 1 175 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.420 -0.171 17919 71517 1 175 . 1 1 2 2 GLN C C 2 175.920 175.920 175.565 0.355 17919 71518 1 175 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.452 0.628 17919 71519 1 175 . 1 1 2 2 GLN CB C 2 30.760 30.760 31.249 -0.489 17919 71520 1 175 . 1 1 2 2 GLN H H 2 8.900 8.900 8.353 0.547 17919 71521 1 175 . 1 1 3 3 ILE N N 3 115.340 115.340 115.162 0.178 17919 71522 1 175 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.253 -0.040 17919 71523 1 175 . 1 1 3 3 ILE C C 3 172.450 172.450 173.121 -0.671 17919 71524 1 175 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.327 0.243 17919 71525 1 175 . 1 1 3 3 ILE CB C 3 42.210 42.210 42.068 0.142 17919 71526 1 175 . 1 1 3 3 ILE H H 3 8.320 8.320 8.714 -0.394 17919 71527 1 175 . 1 1 4 4 PHE N N 4 118.110 118.110 118.714 -0.604 17919 71528 1 175 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.446 0.184 17919 71529 1 175 . 1 1 4 4 PHE C C 4 175.320 175.320 175.050 0.270 17919 71530 1 175 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.714 -0.504 17919 71531 1 175 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.681 -0.201 17919 71532 1 175 . 1 1 4 4 PHE H H 4 8.610 8.610 8.458 0.152 17919 71533 1 175 . 1 1 5 5 VAL N N 5 121.000 121.000 122.168 -1.168 17919 71534 1 175 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.711 0.014 17919 71535 1 175 . 1 1 5 5 VAL C C 5 174.870 174.870 175.123 -0.253 17919 71536 1 175 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.243 -0.623 17919 71537 1 175 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.531 -0.301 17919 71538 1 175 . 1 1 5 5 VAL H H 5 9.300 9.300 9.074 0.226 17919 71539 1 175 . 1 1 6 6 LYS N N 6 127.520 127.520 127.057 0.463 17919 71540 1 175 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.524 -0.158 17919 71541 1 175 . 1 1 6 6 LYS C C 6 177.140 177.140 176.838 0.302 17919 71542 1 175 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.492 0.028 17919 71543 1 175 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.401 -0.351 17919 71544 1 175 . 1 1 6 6 LYS H H 6 8.820 8.820 8.826 -0.006 17919 71545 1 175 . 1 1 7 7 THR N N 7 115.400 115.400 114.508 0.892 17919 71546 1 175 . 1 1 7 7 THR HA H 7 4.970 4.970 4.568 0.402 17919 71547 1 175 . 1 1 7 7 THR C C 7 176.910 176.910 176.783 0.127 17919 71548 1 175 . 1 1 7 7 THR CA C 7 60.470 60.470 61.069 -0.599 17919 71549 1 175 . 1 1 7 7 THR CB C 7 70.630 70.630 70.242 0.388 17919 71550 1 175 . 1 1 7 7 THR H H 7 8.730 8.730 8.607 0.123 17919 71551 1 175 . 1 1 8 8 LEU N N 8 121.330 121.330 122.118 -0.788 17919 71552 1 175 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.144 0.166 17919 71553 1 175 . 1 1 8 8 LEU C C 8 178.800 178.800 177.914 0.886 17919 71554 1 175 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.297 0.283 17919 71555 1 175 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.254 0.716 17919 71556 1 175 . 1 1 8 8 LEU H H 8 9.100 9.100 9.023 0.077 17919 71557 1 175 . 1 1 9 9 THR N N 9 105.590 105.590 109.231 -3.641 17919 71558 1 175 . 1 1 9 9 THR HA H 9 4.428 4.428 4.371 0.057 17919 71559 1 175 . 1 1 9 9 THR C C 9 175.520 175.520 175.524 -0.004 17919 71560 1 175 . 1 1 9 9 THR CA C 9 61.400 61.400 61.774 -0.374 17919 71561 1 175 . 1 1 9 9 THR CB C 9 69.140 69.140 69.225 -0.086 17919 71562 1 175 . 1 1 9 9 THR H H 9 7.630 7.630 7.710 -0.080 17919 71563 1 175 . 1 1 10 10 GLY N N 10 108.890 108.890 110.172 -1.282 17919 71564 1 175 . 1 1 10 10 GLY C C 10 174.070 174.070 174.056 0.014 17919 71565 1 175 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.976 0.484 17919 71566 1 175 . 1 1 10 10 GLY H H 10 7.810 7.810 7.676 0.134 17919 71567 1 175 . 1 1 11 11 LYS N N 11 121.600 121.600 121.658 -0.058 17919 71568 1 175 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.374 -0.013 17919 71569 1 175 . 1 1 11 11 LYS C C 11 175.940 175.940 175.849 0.091 17919 71570 1 175 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.499 -0.219 17919 71571 1 175 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.546 -0.346 17919 71572 1 175 . 1 1 11 11 LYS H H 11 7.280 7.280 7.790 -0.510 17919 71573 1 175 . 1 1 12 12 THR N N 12 120.440 120.440 119.970 0.470 17919 71574 1 175 . 1 1 12 12 THR HA H 12 5.046 5.046 5.103 -0.057 17919 71575 1 175 . 1 1 12 12 THR C C 12 174.320 174.320 174.578 -0.258 17919 71576 1 175 . 1 1 12 12 THR CA C 12 62.390 62.390 62.120 0.270 17919 71577 1 175 . 1 1 12 12 THR CB C 12 69.910 69.910 69.676 0.234 17919 71578 1 175 . 1 1 12 12 THR H H 12 8.650 8.650 8.252 0.398 17919 71579 1 175 . 1 1 13 13 ILE N N 13 127.110 127.110 129.352 -2.242 17919 71580 1 175 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.369 0.175 17919 71581 1 175 . 1 1 13 13 ILE C C 13 175.220 175.220 175.239 -0.019 17919 71582 1 175 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.779 -0.799 17919 71583 1 175 . 1 1 13 13 ILE CB C 13 40.950 40.950 39.733 1.217 17919 71584 1 175 . 1 1 13 13 ILE H H 13 9.450 9.450 9.230 0.220 17919 71585 1 175 . 1 1 14 14 THR N N 14 121.520 121.520 124.106 -2.586 17919 71586 1 175 . 1 1 14 14 THR HA H 14 4.964 4.964 4.830 0.134 17919 71587 1 175 . 1 1 14 14 THR C C 14 173.790 173.790 173.630 0.160 17919 71588 1 175 . 1 1 14 14 THR CA C 14 61.940 61.940 62.796 -0.856 17919 71589 1 175 . 1 1 14 14 THR CB C 14 69.650 69.650 69.453 0.197 17919 71590 1 175 . 1 1 14 14 THR H H 14 8.710 8.710 8.714 -0.004 17919 71591 1 175 . 1 1 15 15 LEU N N 15 124.800 124.800 127.129 -2.329 17919 71592 1 175 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.738 0.042 17919 71593 1 175 . 1 1 15 15 LEU C C 15 174.670 174.670 175.097 -0.427 17919 71594 1 175 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.356 -0.526 17919 71595 1 175 . 1 1 15 15 LEU CB C 15 47.070 47.070 44.515 2.555 17919 71596 1 175 . 1 1 15 15 LEU H H 15 8.710 8.710 9.005 -0.295 17919 71597 1 175 . 1 1 16 16 GLU N N 16 122.160 122.160 125.214 -3.054 17919 71598 1 175 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.156 -0.239 17919 71599 1 175 . 1 1 16 16 GLU C C 16 175.860 175.860 175.441 0.419 17919 71600 1 175 . 1 1 16 16 GLU CA C 16 54.820 54.820 54.461 0.359 17919 71601 1 175 . 1 1 16 16 GLU CB C 16 29.450 29.450 29.538 -0.088 17919 71602 1 175 . 1 1 16 16 GLU H H 16 8.140 8.140 8.686 -0.546 17919 71603 1 175 . 1 1 17 17 VAL N N 17 117.210 117.210 118.078 -0.868 17919 71604 1 175 . 1 1 17 17 VAL HA H 17 4.714 4.714 5.177 -0.463 17919 71605 1 175 . 1 1 17 17 VAL C C 17 174.160 174.160 174.551 -0.391 17919 71606 1 175 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.152 -0.722 17919 71607 1 175 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.791 0.609 17919 71608 1 175 . 1 1 17 17 VAL H H 17 8.900 8.900 8.854 0.046 17919 71609 1 175 . 1 1 18 18 GLU N N 18 118.990 118.990 122.876 -3.886 17919 71610 1 175 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.879 0.200 17919 71611 1 175 . 1 1 18 18 GLU C C 18 176.160 176.160 175.166 0.994 17919 71612 1 175 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.590 0.130 17919 71613 1 175 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.569 -0.259 17919 71614 1 175 . 1 1 18 18 GLU H H 18 8.640 8.640 8.753 -0.113 17919 71615 1 175 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.334 -0.193 17919 71616 1 175 . 1 1 19 19 PRO C C 19 175.310 175.310 177.572 -2.262 17919 71617 1 175 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.636 -0.166 17919 71618 1 175 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.991 -0.040 17919 71619 1 175 . 1 1 20 20 SER N N 20 103.400 103.400 109.105 -5.705 17919 71620 1 175 . 1 1 20 20 SER HA H 20 4.370 4.370 4.349 0.021 17919 71621 1 175 . 1 1 20 20 SER C C 20 174.660 174.660 174.503 0.157 17919 71622 1 175 . 1 1 20 20 SER CA C 20 57.400 57.400 58.910 -1.510 17919 71623 1 175 . 1 1 20 20 SER CB C 20 63.370 63.370 62.866 0.504 17919 71624 1 175 . 1 1 20 20 SER H H 20 7.040 7.040 7.998 -0.958 17919 71625 1 175 . 1 1 21 21 ASP N N 21 123.480 123.480 124.979 -1.499 17919 71626 1 175 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.754 -0.059 17919 71627 1 175 . 1 1 21 21 ASP C C 21 176.360 176.360 175.917 0.443 17919 71628 1 175 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.823 0.877 17919 71629 1 175 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.371 -0.571 17919 71630 1 175 . 1 1 21 21 ASP H H 21 8.030 8.030 7.809 0.221 17919 71631 1 175 . 1 1 22 22 THR N N 22 108.800 108.800 112.721 -3.921 17919 71632 1 175 . 1 1 22 22 THR HA H 22 4.920 4.920 4.761 0.159 17919 71633 1 175 . 1 1 22 22 THR C C 22 176.750 176.750 176.264 0.486 17919 71634 1 175 . 1 1 22 22 THR CA C 22 59.690 59.690 60.613 -0.923 17919 71635 1 175 . 1 1 22 22 THR CB C 22 71.200 71.200 70.863 0.337 17919 71636 1 175 . 1 1 22 22 THR H H 22 7.900 7.900 8.204 -0.304 17919 71637 1 175 . 1 1 23 23 ILE N N 23 121.190 121.190 121.765 -0.575 17919 71638 1 175 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.709 -0.052 17919 71639 1 175 . 1 1 23 23 ILE C C 23 179.040 179.040 177.825 1.215 17919 71640 1 175 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.336 -1.076 17919 71641 1 175 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.052 -1.702 17919 71642 1 175 . 1 1 23 23 ILE H H 23 8.560 8.560 9.051 -0.491 17919 71643 1 175 . 1 1 24 24 GLU N N 24 120.830 120.830 120.881 -0.051 17919 71644 1 175 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.814 0.103 17919 71645 1 175 . 1 1 24 24 GLU C C 24 178.640 178.640 178.343 0.297 17919 71646 1 175 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.307 -0.087 17919 71647 1 175 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.437 -1.157 17919 71648 1 175 . 1 1 24 24 GLU H H 24 9.760 9.760 8.709 1.051 17919 71649 1 175 . 1 1 25 25 ASN N N 25 120.570 120.570 117.704 2.866 17919 71650 1 175 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.485 0.040 17919 71651 1 175 . 1 1 25 25 ASN C C 25 178.380 178.380 177.915 0.465 17919 71652 1 175 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.156 -0.096 17919 71653 1 175 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.598 -0.148 17919 71654 1 175 . 1 1 25 25 ASN H H 25 7.920 7.920 7.625 0.295 17919 71655 1 175 . 1 1 26 26 VAL N N 26 121.710 121.710 120.450 1.260 17919 71656 1 175 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.676 -0.279 17919 71657 1 175 . 1 1 26 26 VAL C C 26 177.950 177.950 177.948 0.002 17919 71658 1 175 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.095 1.565 17919 71659 1 175 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.124 -0.284 17919 71660 1 175 . 1 1 26 26 VAL H H 26 8.070 8.070 7.785 0.285 17919 71661 1 175 . 1 1 27 27 LYS N N 27 118.860 118.860 119.951 -1.091 17919 71662 1 175 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.168 0.412 17919 71663 1 175 . 1 1 27 27 LYS C C 27 180.550 180.550 179.317 1.233 17919 71664 1 175 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.643 -0.393 17919 71665 1 175 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.246 1.484 17919 71666 1 175 . 1 1 27 27 LYS H H 27 8.560 8.560 8.406 0.154 17919 71667 1 175 . 1 1 28 28 ALA N N 28 123.440 123.440 122.065 1.375 17919 71668 1 175 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.038 0.122 17919 71669 1 175 . 1 1 28 28 ALA C C 28 180.300 180.300 179.307 0.993 17919 71670 1 175 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.203 0.168 17919 71671 1 175 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.306 -0.596 17919 71672 1 175 . 1 1 28 28 ALA H H 28 8.060 8.060 8.158 -0.098 17919 71673 1 175 . 1 1 29 29 LYS N N 29 119.940 119.940 118.856 1.084 17919 71674 1 175 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.041 0.166 17919 71675 1 175 . 1 1 29 29 LYS C C 29 180.320 180.320 179.092 1.228 17919 71676 1 175 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.439 0.211 17919 71677 1 175 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.395 0.895 17919 71678 1 175 . 1 1 29 29 LYS H H 29 7.850 7.850 7.710 0.140 17919 71679 1 175 . 1 1 30 30 ILE N N 30 121.080 121.080 120.058 1.022 17919 71680 1 175 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.691 -0.184 17919 71681 1 175 . 1 1 30 30 ILE C C 30 178.310 178.310 177.394 0.916 17919 71682 1 175 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.025 1.125 17919 71683 1 175 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.702 -0.902 17919 71684 1 175 . 1 1 30 30 ILE H H 30 8.280 8.280 7.788 0.492 17919 71685 1 175 . 1 1 31 31 GLN N N 31 123.490 123.490 120.872 2.618 17919 71686 1 175 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.169 -0.340 17919 71687 1 175 . 1 1 31 31 GLN C C 31 178.890 178.890 177.995 0.895 17919 71688 1 175 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.145 0.855 17919 71689 1 175 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.676 -0.956 17919 71690 1 175 . 1 1 31 31 GLN H H 31 8.580 8.580 7.919 0.661 17919 71691 1 175 . 1 1 32 32 ASP N N 32 119.360 119.360 119.639 -0.279 17919 71692 1 175 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.411 -0.057 17919 71693 1 175 . 1 1 32 32 ASP C C 32 177.250 177.250 178.310 -1.060 17919 71694 1 175 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.717 0.473 17919 71695 1 175 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.908 -0.328 17919 71696 1 175 . 1 1 32 32 ASP H H 32 8.010 8.010 8.297 -0.287 17919 71697 1 175 . 1 1 33 33 LYS N N 33 115.130 115.130 118.546 -3.416 17919 71698 1 175 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.216 0.121 17919 71699 1 175 . 1 1 33 33 LYS C C 33 177.870 177.870 178.458 -0.588 17919 71700 1 175 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.566 -0.515 17919 71701 1 175 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.430 0.740 17919 71702 1 175 . 1 1 33 33 LYS H H 33 7.430 7.430 7.713 -0.283 17919 71703 1 175 . 1 1 34 34 GLU N N 34 113.870 113.870 114.191 -0.321 17919 71704 1 175 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.524 0.101 17919 71705 1 175 . 1 1 34 34 GLU C C 34 177.840 177.840 176.479 1.361 17919 71706 1 175 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.610 -0.440 17919 71707 1 175 . 1 1 34 34 GLU CB C 34 32.660 32.660 30.452 2.208 17919 71708 1 175 . 1 1 34 34 GLU H H 34 8.740 8.740 8.146 0.594 17919 71709 1 175 . 1 1 35 35 GLY N N 35 108.650 108.650 108.251 0.399 17919 71710 1 175 . 1 1 35 35 GLY C C 35 173.960 173.960 174.469 -0.509 17919 71711 1 175 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.809 0.271 17919 71712 1 175 . 1 1 35 35 GLY H H 35 8.530 8.530 7.876 0.654 17919 71713 1 175 . 1 1 36 36 ILE N N 36 119.880 119.880 121.855 -1.975 17919 71714 1 175 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.322 0.123 17919 71715 1 175 . 1 1 36 36 ILE C C 36 173.590 173.590 173.783 -0.193 17919 71716 1 175 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.964 -0.214 17919 71717 1 175 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.951 1.629 17919 71718 1 175 . 1 1 36 36 ILE H H 36 6.150 6.150 7.384 -1.234 17919 71719 1 175 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.507 0.127 17919 71720 1 175 . 1 1 37 37 PRO C C 37 176.940 176.940 176.008 0.932 17919 71721 1 175 . 1 1 37 37 PRO CA C 37 61.660 61.660 62.040 -0.380 17919 71722 1 175 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.436 0.414 17919 71723 1 175 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.210 -0.093 17919 71724 1 175 . 1 1 38 38 PRO C C 38 178.320 178.320 178.565 -0.245 17919 71725 1 175 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.566 0.694 17919 71726 1 175 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.926 0.964 17919 71727 1 175 . 1 1 39 39 ASP N N 39 113.380 113.380 115.568 -2.188 17919 71728 1 175 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.437 -0.007 17919 71729 1 175 . 1 1 39 39 ASP C C 39 177.090 177.090 177.271 -0.181 17919 71730 1 175 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.327 -0.687 17919 71731 1 175 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.472 -0.932 17919 71732 1 175 . 1 1 39 39 ASP H H 39 8.550 8.550 8.699 -0.149 17919 71733 1 175 . 1 1 40 40 GLN N N 40 116.780 116.780 117.173 -0.393 17919 71734 1 175 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.318 0.146 17919 71735 1 175 . 1 1 40 40 GLN C C 40 175.380 175.380 175.880 -0.500 17919 71736 1 175 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.623 0.017 17919 71737 1 175 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.469 0.671 17919 71738 1 175 . 1 1 40 40 GLN H H 40 7.820 7.820 7.642 0.178 17919 71739 1 175 . 1 1 41 41 GLN N N 41 117.720 117.720 119.859 -2.139 17919 71740 1 175 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.482 -0.238 17919 71741 1 175 . 1 1 41 41 GLN C C 41 176.300 176.300 174.174 2.126 17919 71742 1 175 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.515 0.955 17919 71743 1 175 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.918 1.732 17919 71744 1 175 . 1 1 41 41 GLN H H 41 7.480 7.480 7.757 -0.277 17919 71745 1 175 . 1 1 42 42 ARG N N 42 122.680 122.680 125.728 -3.048 17919 71746 1 175 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.647 -0.147 17919 71747 1 175 . 1 1 42 42 ARG C C 42 174.050 174.050 174.182 -0.132 17919 71748 1 175 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.839 0.211 17919 71749 1 175 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.357 -0.607 17919 71750 1 175 . 1 1 42 42 ARG H H 42 8.530 8.530 8.879 -0.349 17919 71751 1 175 . 1 1 43 43 LEU N N 43 124.040 124.040 127.929 -3.889 17919 71752 1 175 . 1 1 43 43 LEU C C 43 175.290 175.290 175.866 -0.576 17919 71753 1 175 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.133 -1.153 17919 71754 1 175 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.249 2.541 17919 71755 1 175 . 1 1 43 43 LEU H H 43 8.820 8.820 8.869 -0.049 17919 71756 1 175 . 1 1 44 44 ILE N N 44 121.920 121.920 121.814 0.106 17919 71757 1 175 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.989 0.003 17919 71758 1 175 . 1 1 44 44 ILE C C 44 176.060 176.060 174.270 1.790 17919 71759 1 175 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.007 -1.027 17919 71760 1 175 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.370 0.049 17919 71761 1 175 . 1 1 44 44 ILE H H 44 9.030 9.030 8.983 0.047 17919 71762 1 175 . 1 1 45 45 PHE N N 45 125.390 125.390 127.004 -1.614 17919 71763 1 175 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.897 0.148 17919 71764 1 175 . 1 1 45 45 PHE C C 45 174.470 174.470 174.705 -0.235 17919 71765 1 175 . 1 1 45 45 PHE CA C 45 57.020 57.020 55.640 1.380 17919 71766 1 175 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.643 1.117 17919 71767 1 175 . 1 1 45 45 PHE H H 45 8.830 8.830 9.016 -0.186 17919 71768 1 175 . 1 1 46 46 ALA N N 46 132.200 132.200 130.708 1.492 17919 71769 1 175 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.786 -0.096 17919 71770 1 175 . 1 1 46 46 ALA C C 46 177.290 177.290 177.702 -0.412 17919 71771 1 175 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.882 -0.342 17919 71772 1 175 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.556 0.014 17919 71773 1 175 . 1 1 46 46 ALA H H 46 8.810 8.810 9.109 -0.299 17919 71774 1 175 . 1 1 47 47 GLY N N 47 102.340 102.340 102.676 -0.336 17919 71775 1 175 . 1 1 47 47 GLY C C 47 173.810 173.810 174.337 -0.527 17919 71776 1 175 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.235 0.115 17919 71777 1 175 . 1 1 47 47 GLY H H 47 8.130 8.130 8.741 -0.611 17919 71778 1 175 . 1 1 48 48 LYS N N 48 121.570 121.570 120.848 0.722 17919 71779 1 175 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.628 -0.006 17919 71780 1 175 . 1 1 48 48 LYS C C 48 174.700 174.700 175.626 -0.926 17919 71781 1 175 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.876 -0.326 17919 71782 1 175 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.615 -0.085 17919 71783 1 175 . 1 1 48 48 LYS H H 48 7.980 7.980 8.108 -0.128 17919 71784 1 175 . 1 1 49 49 GLN N N 49 122.410 122.410 123.035 -0.625 17919 71785 1 175 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.562 -0.002 17919 71786 1 175 . 1 1 49 49 GLN C C 49 175.670 175.670 176.032 -0.362 17919 71787 1 175 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.938 -0.198 17919 71788 1 175 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.209 -0.209 17919 71789 1 175 . 1 1 49 49 GLN H H 49 8.600 8.600 8.539 0.061 17919 71790 1 175 . 1 1 50 50 LEU N N 50 125.520 125.520 127.153 -1.633 17919 71791 1 175 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.263 -0.173 17919 71792 1 175 . 1 1 50 50 LEU C C 50 176.660 176.660 176.910 -0.250 17919 71793 1 175 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.554 -0.314 17919 71794 1 175 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.938 -0.368 17919 71795 1 175 . 1 1 50 50 LEU H H 50 8.530 8.530 8.283 0.247 17919 71796 1 175 . 1 1 51 51 GLU N N 51 122.940 122.940 123.574 -0.634 17919 71797 1 175 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.454 0.034 17919 71798 1 175 . 1 1 51 51 GLU C C 51 175.870 175.870 177.316 -1.446 17919 71799 1 175 . 1 1 51 51 GLU CA C 51 55.960 55.960 56.187 -0.227 17919 71800 1 175 . 1 1 51 51 GLU CB C 51 31.570 31.570 30.801 0.769 17919 71801 1 175 . 1 1 51 51 GLU H H 51 8.400 8.400 8.745 -0.345 17919 71802 1 175 . 1 1 52 52 ASP N N 52 120.030 120.030 123.337 -3.307 17919 71803 1 175 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.540 -0.181 17919 71804 1 175 . 1 1 52 52 ASP C C 52 177.330 177.330 177.326 0.004 17919 71805 1 175 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.069 -0.110 17919 71806 1 175 . 1 1 52 52 ASP CB C 52 40.850 40.850 41.063 -0.213 17919 71807 1 175 . 1 1 52 52 ASP H H 52 8.160 8.160 8.821 -0.661 17919 71808 1 175 . 1 1 53 53 GLY N N 53 106.660 106.660 104.203 2.457 17919 71809 1 175 . 1 1 53 53 GLY C C 53 174.870 174.870 174.449 0.421 17919 71810 1 175 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.440 0.730 17919 71811 1 175 . 1 1 53 53 GLY H H 53 9.390 9.390 8.476 0.914 17919 71812 1 175 . 1 1 54 54 ARG N N 54 119.050 119.050 120.283 -1.233 17919 71813 1 175 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.547 0.148 17919 71814 1 175 . 1 1 54 54 ARG C C 54 175.350 175.350 175.764 -0.414 17919 71815 1 175 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.969 -0.579 17919 71816 1 175 . 1 1 54 54 ARG CB C 54 32.650 32.650 31.572 1.078 17919 71817 1 175 . 1 1 54 54 ARG H H 54 7.460 7.460 7.342 0.118 17919 71818 1 175 . 1 1 55 55 THR N N 55 108.400 108.400 112.215 -3.815 17919 71819 1 175 . 1 1 55 55 THR HA H 55 5.240 5.240 5.108 0.132 17919 71820 1 175 . 1 1 55 55 THR C C 55 176.560 176.560 176.380 0.180 17919 71821 1 175 . 1 1 55 55 THR CA C 55 59.690 59.690 60.044 -0.354 17919 71822 1 175 . 1 1 55 55 THR CB C 55 72.260 72.260 71.296 0.964 17919 71823 1 175 . 1 1 55 55 THR H H 55 8.730 8.730 8.699 0.031 17919 71824 1 175 . 1 1 56 56 LEU N N 56 117.920 117.920 122.277 -4.357 17919 71825 1 175 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.960 0.100 17919 71826 1 175 . 1 1 56 56 LEU C C 56 180.810 180.810 178.998 1.812 17919 71827 1 175 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.576 0.134 17919 71828 1 175 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.271 -0.901 17919 71829 1 175 . 1 1 56 56 LEU H H 56 8.140 8.140 8.631 -0.491 17919 71830 1 175 . 1 1 57 57 SER N N 57 113.330 113.330 114.378 -1.048 17919 71831 1 175 . 1 1 57 57 SER HA H 57 4.370 4.370 4.148 0.222 17919 71832 1 175 . 1 1 57 57 SER C C 57 178.310 178.310 177.175 1.135 17919 71833 1 175 . 1 1 57 57 SER CA C 57 61.080 61.080 61.681 -0.600 17919 71834 1 175 . 1 1 57 57 SER CB C 57 62.530 62.530 62.693 -0.163 17919 71835 1 175 . 1 1 57 57 SER H H 57 8.470 8.470 8.605 -0.135 17919 71836 1 175 . 1 1 58 58 ASP N N 58 124.190 124.190 122.399 1.791 17919 71837 1 175 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.375 -0.079 17919 71838 1 175 . 1 1 58 58 ASP C C 58 177.400 177.400 177.904 -0.504 17919 71839 1 175 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.896 0.284 17919 71840 1 175 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.394 -0.294 17919 71841 1 175 . 1 1 58 58 ASP H H 58 7.930 7.930 7.918 0.012 17919 71842 1 175 . 1 1 59 59 TYR N N 59 115.510 115.510 116.034 -0.524 17919 71843 1 175 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.589 0.081 17919 71844 1 175 . 1 1 59 59 TYR C C 59 174.700 174.700 174.937 -0.237 17919 71845 1 175 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.321 0.929 17919 71846 1 175 . 1 1 59 59 TYR CB C 59 40.070 40.070 37.783 2.287 17919 71847 1 175 . 1 1 59 59 TYR H H 59 7.250 7.250 7.543 -0.293 17919 71848 1 175 . 1 1 60 60 ASN N N 60 115.900 115.900 117.363 -1.463 17919 71849 1 175 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.387 -0.032 17919 71850 1 175 . 1 1 60 60 ASN C C 60 174.340 174.340 174.738 -0.398 17919 71851 1 175 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.335 -0.215 17919 71852 1 175 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.281 0.129 17919 71853 1 175 . 1 1 60 60 ASN H H 60 8.150 8.150 7.924 0.226 17919 71854 1 175 . 1 1 61 61 ILE N N 61 118.600 118.600 117.594 1.006 17919 71855 1 175 . 1 1 61 61 ILE HA H 61 3.393 3.393 4.056 -0.663 17919 71856 1 175 . 1 1 61 61 ILE C C 61 174.610 174.610 175.289 -0.679 17919 71857 1 175 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.562 0.858 17919 71858 1 175 . 1 1 61 61 ILE CB C 61 36.740 36.740 38.744 -2.004 17919 71859 1 175 . 1 1 61 61 ILE H H 61 7.250 7.250 7.968 -0.718 17919 71860 1 175 . 1 1 62 62 GLN N N 62 124.740 124.740 125.866 -1.126 17919 71861 1 175 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.759 -0.253 17919 71862 1 175 . 1 1 62 62 GLN C C 62 175.970 175.970 175.313 0.657 17919 71863 1 175 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.935 -0.275 17919 71864 1 175 . 1 1 62 62 GLN CB C 62 31.650 31.650 32.206 -0.556 17919 71865 1 175 . 1 1 62 62 GLN H H 62 7.610 7.610 8.325 -0.715 17919 71866 1 175 . 1 1 63 63 LYS N N 63 120.300 120.300 120.742 -0.442 17919 71867 1 175 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.161 -0.160 17919 71868 1 175 . 1 1 63 63 LYS C C 63 175.810 175.810 177.140 -1.330 17919 71869 1 175 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.389 0.401 17919 71870 1 175 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.224 0.426 17919 71871 1 175 . 1 1 63 63 LYS H H 63 8.490 8.490 8.602 -0.112 17919 71872 1 175 . 1 1 64 64 GLU N N 64 113.950 113.950 116.359 -2.409 17919 71873 1 175 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.764 -0.299 17919 71874 1 175 . 1 1 64 64 GLU C C 64 175.250 175.250 175.979 -0.729 17919 71875 1 175 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.716 0.174 17919 71876 1 175 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.501 -2.601 17919 71877 1 175 . 1 1 64 64 GLU H H 64 9.280 9.280 8.797 0.483 17919 71878 1 175 . 1 1 65 65 SER N N 65 114.730 114.730 115.422 -0.692 17919 71879 1 175 . 1 1 65 65 SER HA H 65 4.640 4.640 4.418 0.222 17919 71880 1 175 . 1 1 65 65 SER C C 65 172.160 172.160 174.008 -1.848 17919 71881 1 175 . 1 1 65 65 SER CA C 65 60.890 60.890 60.461 0.429 17919 71882 1 175 . 1 1 65 65 SER CB C 65 64.910 64.910 64.283 0.627 17919 71883 1 175 . 1 1 65 65 SER H H 65 7.670 7.670 7.250 0.420 17919 71884 1 175 . 1 1 66 66 THR N N 66 117.110 117.110 119.490 -2.380 17919 71885 1 175 . 1 1 66 66 THR HA H 66 5.270 5.270 5.134 0.136 17919 71886 1 175 . 1 1 66 66 THR C C 66 173.950 173.950 173.668 0.282 17919 71887 1 175 . 1 1 66 66 THR CA C 66 62.340 62.340 61.226 1.114 17919 71888 1 175 . 1 1 66 66 THR CB C 66 70.080 70.080 70.696 -0.616 17919 71889 1 175 . 1 1 66 66 THR H H 66 8.730 8.730 8.421 0.309 17919 71890 1 175 . 1 1 67 67 LEU N N 67 127.110 127.110 126.495 0.615 17919 71891 1 175 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.446 0.614 17919 71892 1 175 . 1 1 67 67 LEU C C 67 175.770 175.770 175.453 0.317 17919 71893 1 175 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.542 0.358 17919 71894 1 175 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.837 0.423 17919 71895 1 175 . 1 1 67 67 LEU H H 67 9.410 9.410 8.888 0.522 17919 71896 1 175 . 1 1 68 68 HIS N N 68 118.380 118.380 117.654 0.726 17919 71897 1 175 . 1 1 68 68 HIS HA H 68 5.240 5.240 4.874 0.366 17919 71898 1 175 . 1 1 68 68 HIS C C 68 173.150 173.150 174.232 -1.082 17919 71899 1 175 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.274 0.726 17919 71900 1 175 . 1 1 68 68 HIS CB C 68 30.530 30.530 31.476 -0.946 17919 71901 1 175 . 1 1 68 68 HIS H H 68 9.230 9.230 8.482 0.748 17919 71902 1 175 . 1 1 69 69 LEU N N 69 124.460 124.460 127.892 -3.432 17919 71903 1 175 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.718 0.472 17919 71904 1 175 . 1 1 69 69 LEU C C 69 175.270 175.270 174.635 0.635 17919 71905 1 175 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.804 -0.914 17919 71906 1 175 . 1 1 69 69 LEU CB C 69 44.380 44.380 43.113 1.267 17919 71907 1 175 . 1 1 69 69 LEU H H 69 8.340 8.340 8.323 0.017 17919 71908 1 175 . 1 1 70 70 VAL N N 70 126.940 126.940 126.213 0.727 17919 71909 1 175 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.459 -0.109 17919 71910 1 175 . 1 1 70 70 VAL C C 70 174.000 174.000 174.540 -0.540 17919 71911 1 175 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.317 0.483 17919 71912 1 175 . 1 1 70 70 VAL CB C 70 34.910 34.910 34.828 0.082 17919 71913 1 175 . 1 1 70 70 VAL H H 70 9.200 9.200 9.036 0.164 17919 71914 1 175 . 1 1 71 71 LEU N N 71 123.130 123.130 125.486 -2.356 17919 71915 1 175 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.239 -0.179 17919 71916 1 175 . 1 1 71 71 LEU C C 71 177.830 177.830 177.036 0.794 17919 71917 1 175 . 1 1 71 71 LEU CA C 71 53.940 53.940 54.026 -0.086 17919 71918 1 175 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.809 -0.959 17919 71919 1 175 . 1 1 71 71 LEU H H 71 8.120 8.120 8.470 -0.350 17919 71920 1 175 . 1 1 72 72 ARG N N 72 123.490 123.490 123.652 -0.162 17919 71921 1 175 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.767 -0.466 17919 71922 1 175 . 1 1 72 72 ARG C C 72 175.350 175.350 175.598 -0.248 17919 71923 1 175 . 1 1 72 72 ARG CA C 72 55.610 55.610 54.139 1.471 17919 71924 1 175 . 1 1 72 72 ARG CB C 72 31.350 31.350 31.974 -0.624 17919 71925 1 175 . 1 1 72 72 ARG H H 72 8.580 8.580 8.795 -0.215 17919 71926 1 176 . 1 1 2 2 GLN N N 2 123.220 123.220 120.566 2.654 17919 71927 1 176 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.500 -0.251 17919 71928 1 176 . 1 1 2 2 GLN C C 2 175.920 175.920 174.849 1.071 17919 71929 1 176 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.468 0.612 17919 71930 1 176 . 1 1 2 2 GLN CB C 2 30.760 30.760 31.111 -0.351 17919 71931 1 176 . 1 1 2 2 GLN H H 2 8.900 8.900 8.404 0.496 17919 71932 1 176 . 1 1 3 3 ILE N N 3 115.340 115.340 115.734 -0.394 17919 71933 1 176 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.291 -0.078 17919 71934 1 176 . 1 1 3 3 ILE C C 3 172.450 172.450 173.365 -0.915 17919 71935 1 176 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.011 0.559 17919 71936 1 176 . 1 1 3 3 ILE CB C 3 42.210 42.210 42.246 -0.036 17919 71937 1 176 . 1 1 3 3 ILE H H 3 8.320 8.320 8.938 -0.618 17919 71938 1 176 . 1 1 4 4 PHE N N 4 118.110 118.110 118.697 -0.587 17919 71939 1 176 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.688 -0.058 17919 71940 1 176 . 1 1 4 4 PHE C C 4 175.320 175.320 175.298 0.022 17919 71941 1 176 . 1 1 4 4 PHE CA C 4 55.210 55.210 54.813 0.397 17919 71942 1 176 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.834 -0.354 17919 71943 1 176 . 1 1 4 4 PHE H H 4 8.610 8.610 8.559 0.051 17919 71944 1 176 . 1 1 5 5 VAL N N 5 121.000 121.000 120.648 0.352 17919 71945 1 176 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.986 -0.261 17919 71946 1 176 . 1 1 5 5 VAL C C 5 174.870 174.870 174.524 0.346 17919 71947 1 176 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.101 -0.481 17919 71948 1 176 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.867 -0.637 17919 71949 1 176 . 1 1 5 5 VAL H H 5 9.300 9.300 9.244 0.056 17919 71950 1 176 . 1 1 6 6 LYS N N 6 127.520 127.520 128.105 -0.585 17919 71951 1 176 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.544 -0.177 17919 71952 1 176 . 1 1 6 6 LYS C C 6 177.140 177.140 176.265 0.875 17919 71953 1 176 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.116 0.404 17919 71954 1 176 . 1 1 6 6 LYS CB C 6 35.050 35.050 36.162 -1.112 17919 71955 1 176 . 1 1 6 6 LYS H H 6 8.820 8.820 9.295 -0.475 17919 71956 1 176 . 1 1 7 7 THR N N 7 115.400 115.400 117.426 -2.026 17919 71957 1 176 . 1 1 7 7 THR HA H 7 4.970 4.970 4.734 0.236 17919 71958 1 176 . 1 1 7 7 THR C C 7 176.910 176.910 176.407 0.503 17919 71959 1 176 . 1 1 7 7 THR CA C 7 60.470 60.470 60.995 -0.525 17919 71960 1 176 . 1 1 7 7 THR CB C 7 70.630 70.630 70.730 -0.100 17919 71961 1 176 . 1 1 7 7 THR H H 7 8.730 8.730 8.856 -0.126 17919 71962 1 176 . 1 1 8 8 LEU N N 8 121.330 121.330 124.281 -2.951 17919 71963 1 176 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.255 0.055 17919 71964 1 176 . 1 1 8 8 LEU C C 8 178.800 178.800 178.142 0.658 17919 71965 1 176 . 1 1 8 8 LEU CA C 8 57.580 57.580 58.134 -0.554 17919 71966 1 176 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.044 -0.074 17919 71967 1 176 . 1 1 8 8 LEU H H 8 9.100 9.100 9.096 0.004 17919 71968 1 176 . 1 1 9 9 THR N N 9 105.590 105.590 109.083 -3.493 17919 71969 1 176 . 1 1 9 9 THR HA H 9 4.428 4.428 4.272 0.156 17919 71970 1 176 . 1 1 9 9 THR C C 9 175.520 175.520 175.615 -0.095 17919 71971 1 176 . 1 1 9 9 THR CA C 9 61.400 61.400 61.917 -0.517 17919 71972 1 176 . 1 1 9 9 THR CB C 9 69.140 69.140 69.226 -0.086 17919 71973 1 176 . 1 1 9 9 THR H H 9 7.630 7.630 7.730 -0.100 17919 71974 1 176 . 1 1 10 10 GLY N N 10 108.890 108.890 111.059 -2.169 17919 71975 1 176 . 1 1 10 10 GLY C C 10 174.070 174.070 173.870 0.200 17919 71976 1 176 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.089 0.371 17919 71977 1 176 . 1 1 10 10 GLY H H 10 7.810 7.810 8.215 -0.405 17919 71978 1 176 . 1 1 11 11 LYS N N 11 121.600 121.600 120.628 0.972 17919 71979 1 176 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.275 0.086 17919 71980 1 176 . 1 1 11 11 LYS C C 11 175.940 175.940 175.488 0.452 17919 71981 1 176 . 1 1 11 11 LYS CA C 11 56.280 56.280 57.005 -0.726 17919 71982 1 176 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.543 -0.343 17919 71983 1 176 . 1 1 11 11 LYS H H 11 7.280 7.280 7.589 -0.309 17919 71984 1 176 . 1 1 12 12 THR N N 12 120.440 120.440 120.417 0.023 17919 71985 1 176 . 1 1 12 12 THR HA H 12 5.046 5.046 5.575 -0.529 17919 71986 1 176 . 1 1 12 12 THR C C 12 174.320 174.320 174.357 -0.037 17919 71987 1 176 . 1 1 12 12 THR CA C 12 62.390 62.390 60.970 1.420 17919 71988 1 176 . 1 1 12 12 THR CB C 12 69.910 69.910 70.273 -0.363 17919 71989 1 176 . 1 1 12 12 THR H H 12 8.650 8.650 8.179 0.471 17919 71990 1 176 . 1 1 13 13 ILE N N 13 127.110 127.110 122.810 4.300 17919 71991 1 176 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.651 -0.107 17919 71992 1 176 . 1 1 13 13 ILE C C 13 175.220 175.220 174.992 0.228 17919 71993 1 176 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.470 0.510 17919 71994 1 176 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.165 0.785 17919 71995 1 176 . 1 1 13 13 ILE H H 13 9.450 9.450 9.291 0.159 17919 71996 1 176 . 1 1 14 14 THR N N 14 121.520 121.520 121.801 -0.281 17919 71997 1 176 . 1 1 14 14 THR HA H 14 4.964 4.964 5.144 -0.180 17919 71998 1 176 . 1 1 14 14 THR C C 14 173.790 173.790 174.292 -0.502 17919 71999 1 176 . 1 1 14 14 THR CA C 14 61.940 61.940 62.735 -0.795 17919 72000 1 176 . 1 1 14 14 THR CB C 14 69.650 69.650 69.742 -0.092 17919 72001 1 176 . 1 1 14 14 THR H H 14 8.710 8.710 8.451 0.259 17919 72002 1 176 . 1 1 15 15 LEU N N 15 124.800 124.800 126.416 -1.616 17919 72003 1 176 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.775 0.005 17919 72004 1 176 . 1 1 15 15 LEU C C 15 174.670 174.670 175.108 -0.438 17919 72005 1 176 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.907 -1.077 17919 72006 1 176 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.483 1.587 17919 72007 1 176 . 1 1 15 15 LEU H H 15 8.710 8.710 9.347 -0.637 17919 72008 1 176 . 1 1 16 16 GLU N N 16 122.160 122.160 123.791 -1.631 17919 72009 1 176 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.320 -0.403 17919 72010 1 176 . 1 1 16 16 GLU C C 16 175.860 175.860 176.029 -0.169 17919 72011 1 176 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.691 -0.871 17919 72012 1 176 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.759 -1.309 17919 72013 1 176 . 1 1 16 16 GLU H H 16 8.140 8.140 8.835 -0.695 17919 72014 1 176 . 1 1 17 17 VAL N N 17 117.210 117.210 119.536 -2.326 17919 72015 1 176 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.757 -0.043 17919 72016 1 176 . 1 1 17 17 VAL C C 17 174.160 174.160 174.859 -0.699 17919 72017 1 176 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.065 -0.634 17919 72018 1 176 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.648 0.752 17919 72019 1 176 . 1 1 17 17 VAL H H 17 8.900 8.900 8.928 -0.028 17919 72020 1 176 . 1 1 18 18 GLU N N 18 118.990 118.990 121.767 -2.777 17919 72021 1 176 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.775 0.304 17919 72022 1 176 . 1 1 18 18 GLU C C 18 176.160 176.160 175.423 0.737 17919 72023 1 176 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.696 0.024 17919 72024 1 176 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.066 0.244 17919 72025 1 176 . 1 1 18 18 GLU H H 18 8.640 8.640 8.463 0.177 17919 72026 1 176 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.341 -0.200 17919 72027 1 176 . 1 1 19 19 PRO C C 19 175.310 175.310 177.734 -2.424 17919 72028 1 176 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.261 0.209 17919 72029 1 176 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.910 0.040 17919 72030 1 176 . 1 1 20 20 SER N N 20 103.400 103.400 111.524 -8.124 17919 72031 1 176 . 1 1 20 20 SER HA H 20 4.370 4.370 4.190 0.180 17919 72032 1 176 . 1 1 20 20 SER C C 20 174.660 174.660 174.629 0.031 17919 72033 1 176 . 1 1 20 20 SER CA C 20 57.400 57.400 59.028 -1.628 17919 72034 1 176 . 1 1 20 20 SER CB C 20 63.370 63.370 62.669 0.701 17919 72035 1 176 . 1 1 20 20 SER H H 20 7.040 7.040 8.284 -1.244 17919 72036 1 176 . 1 1 21 21 ASP N N 21 123.480 123.480 124.460 -0.980 17919 72037 1 176 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.619 0.076 17919 72038 1 176 . 1 1 21 21 ASP C C 21 176.360 176.360 176.575 -0.215 17919 72039 1 176 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.029 0.671 17919 72040 1 176 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.189 -0.389 17919 72041 1 176 . 1 1 21 21 ASP H H 21 8.030 8.030 7.722 0.308 17919 72042 1 176 . 1 1 22 22 THR N N 22 108.800 108.800 114.397 -5.597 17919 72043 1 176 . 1 1 22 22 THR HA H 22 4.920 4.920 4.901 0.019 17919 72044 1 176 . 1 1 22 22 THR C C 22 176.750 176.750 176.706 0.044 17919 72045 1 176 . 1 1 22 22 THR CA C 22 59.690 59.690 61.093 -1.403 17919 72046 1 176 . 1 1 22 22 THR CB C 22 71.200 71.200 70.537 0.663 17919 72047 1 176 . 1 1 22 22 THR H H 22 7.900 7.900 8.965 -1.065 17919 72048 1 176 . 1 1 23 23 ILE N N 23 121.190 121.190 121.675 -0.485 17919 72049 1 176 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.767 -0.110 17919 72050 1 176 . 1 1 23 23 ILE C C 23 179.040 179.040 177.767 1.273 17919 72051 1 176 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.023 -0.763 17919 72052 1 176 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.036 -1.686 17919 72053 1 176 . 1 1 23 23 ILE H H 23 8.560 8.560 8.606 -0.046 17919 72054 1 176 . 1 1 24 24 GLU N N 24 120.830 120.830 121.232 -0.402 17919 72055 1 176 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.900 0.017 17919 72056 1 176 . 1 1 24 24 GLU C C 24 178.640 178.640 178.535 0.105 17919 72057 1 176 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.418 -0.198 17919 72058 1 176 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.326 -1.046 17919 72059 1 176 . 1 1 24 24 GLU H H 24 9.760 9.760 8.358 1.402 17919 72060 1 176 . 1 1 25 25 ASN N N 25 120.570 120.570 117.780 2.790 17919 72061 1 176 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.496 0.029 17919 72062 1 176 . 1 1 25 25 ASN C C 25 178.380 178.380 178.068 0.312 17919 72063 1 176 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.941 0.119 17919 72064 1 176 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.461 -0.011 17919 72065 1 176 . 1 1 25 25 ASN H H 25 7.920 7.920 7.751 0.169 17919 72066 1 176 . 1 1 26 26 VAL N N 26 121.710 121.710 122.040 -0.330 17919 72067 1 176 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.589 -0.192 17919 72068 1 176 . 1 1 26 26 VAL C C 26 177.950 177.950 177.456 0.494 17919 72069 1 176 . 1 1 26 26 VAL CA C 26 67.660 67.660 67.390 0.270 17919 72070 1 176 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.554 -0.714 17919 72071 1 176 . 1 1 26 26 VAL H H 26 8.070 8.070 8.147 -0.077 17919 72072 1 176 . 1 1 27 27 LYS N N 27 118.860 118.860 120.479 -1.619 17919 72073 1 176 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.231 0.349 17919 72074 1 176 . 1 1 27 27 LYS C C 27 180.550 180.550 179.221 1.329 17919 72075 1 176 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.678 -0.428 17919 72076 1 176 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.317 1.413 17919 72077 1 176 . 1 1 27 27 LYS H H 27 8.560 8.560 8.034 0.526 17919 72078 1 176 . 1 1 28 28 ALA N N 28 123.440 123.440 121.692 1.748 17919 72079 1 176 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.050 0.110 17919 72080 1 176 . 1 1 28 28 ALA C C 28 180.300 180.300 179.421 0.879 17919 72081 1 176 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.229 0.141 17919 72082 1 176 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.384 -0.673 17919 72083 1 176 . 1 1 28 28 ALA H H 28 8.060 8.060 8.431 -0.371 17919 72084 1 176 . 1 1 29 29 LYS N N 29 119.940 119.940 118.494 1.446 17919 72085 1 176 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.104 0.103 17919 72086 1 176 . 1 1 29 29 LYS C C 29 180.320 180.320 179.103 1.217 17919 72087 1 176 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.052 0.598 17919 72088 1 176 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.490 0.800 17919 72089 1 176 . 1 1 29 29 LYS H H 29 7.850 7.850 7.651 0.199 17919 72090 1 176 . 1 1 30 30 ILE N N 30 121.080 121.080 121.106 -0.026 17919 72091 1 176 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.657 -0.150 17919 72092 1 176 . 1 1 30 30 ILE C C 30 178.310 178.310 177.052 1.258 17919 72093 1 176 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.331 0.819 17919 72094 1 176 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.812 -1.012 17919 72095 1 176 . 1 1 30 30 ILE H H 30 8.280 8.280 8.368 -0.088 17919 72096 1 176 . 1 1 31 31 GLN N N 31 123.490 123.490 121.068 2.422 17919 72097 1 176 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.851 -0.022 17919 72098 1 176 . 1 1 31 31 GLN C C 31 178.890 178.890 178.011 0.879 17919 72099 1 176 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.585 0.415 17919 72100 1 176 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.428 -0.708 17919 72101 1 176 . 1 1 31 31 GLN H H 31 8.580 8.580 8.312 0.268 17919 72102 1 176 . 1 1 32 32 ASP N N 32 119.360 119.360 118.831 0.529 17919 72103 1 176 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.399 -0.045 17919 72104 1 176 . 1 1 32 32 ASP C C 32 177.250 177.250 177.960 -0.710 17919 72105 1 176 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.919 0.271 17919 72106 1 176 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.745 -0.165 17919 72107 1 176 . 1 1 32 32 ASP H H 32 8.010 8.010 7.814 0.196 17919 72108 1 176 . 1 1 33 33 LYS N N 33 115.130 115.130 117.854 -2.724 17919 72109 1 176 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.291 0.046 17919 72110 1 176 . 1 1 33 33 LYS C C 33 177.870 177.870 178.230 -0.360 17919 72111 1 176 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.177 -0.127 17919 72112 1 176 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.012 1.158 17919 72113 1 176 . 1 1 33 33 LYS H H 33 7.430 7.430 7.407 0.023 17919 72114 1 176 . 1 1 34 34 GLU N N 34 113.870 113.870 114.537 -0.667 17919 72115 1 176 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.476 0.149 17919 72116 1 176 . 1 1 34 34 GLU C C 34 177.840 177.840 177.275 0.565 17919 72117 1 176 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.745 -0.575 17919 72118 1 176 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.237 1.423 17919 72119 1 176 . 1 1 34 34 GLU H H 34 8.740 8.740 8.463 0.277 17919 72120 1 176 . 1 1 35 35 GLY N N 35 108.650 108.650 109.002 -0.352 17919 72121 1 176 . 1 1 35 35 GLY C C 35 173.960 173.960 174.465 -0.505 17919 72122 1 176 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.524 0.556 17919 72123 1 176 . 1 1 35 35 GLY H H 35 8.530 8.530 7.898 0.632 17919 72124 1 176 . 1 1 36 36 ILE N N 36 119.880 119.880 121.079 -1.199 17919 72125 1 176 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.307 0.138 17919 72126 1 176 . 1 1 36 36 ILE C C 36 173.590 173.590 174.086 -0.496 17919 72127 1 176 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.910 -0.160 17919 72128 1 176 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.470 2.110 17919 72129 1 176 . 1 1 36 36 ILE H H 36 6.150 6.150 7.569 -1.419 17919 72130 1 176 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.596 0.038 17919 72131 1 176 . 1 1 37 37 PRO C C 37 176.940 176.940 175.925 1.015 17919 72132 1 176 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.752 -0.092 17919 72133 1 176 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.423 0.427 17919 72134 1 176 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.135 -0.018 17919 72135 1 176 . 1 1 38 38 PRO C C 38 178.320 178.320 178.621 -0.301 17919 72136 1 176 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.787 0.473 17919 72137 1 176 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.869 1.021 17919 72138 1 176 . 1 1 39 39 ASP N N 39 113.380 113.380 114.945 -1.565 17919 72139 1 176 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.422 0.008 17919 72140 1 176 . 1 1 39 39 ASP C C 39 177.090 177.090 176.626 0.464 17919 72141 1 176 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.267 -0.627 17919 72142 1 176 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.373 -0.833 17919 72143 1 176 . 1 1 39 39 ASP H H 39 8.550 8.550 8.751 -0.201 17919 72144 1 176 . 1 1 40 40 GLN N N 40 116.780 116.780 115.859 0.921 17919 72145 1 176 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.565 -0.101 17919 72146 1 176 . 1 1 40 40 GLN C C 40 175.380 175.380 175.394 -0.014 17919 72147 1 176 . 1 1 40 40 GLN CA C 40 55.640 55.640 54.659 0.981 17919 72148 1 176 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.649 0.491 17919 72149 1 176 . 1 1 40 40 GLN H H 40 7.820 7.820 7.771 0.049 17919 72150 1 176 . 1 1 41 41 GLN N N 41 117.720 117.720 120.242 -2.522 17919 72151 1 176 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.537 -0.293 17919 72152 1 176 . 1 1 41 41 GLN C C 41 176.300 176.300 175.351 0.949 17919 72153 1 176 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.999 0.471 17919 72154 1 176 . 1 1 41 41 GLN CB C 41 31.650 31.650 30.431 1.219 17919 72155 1 176 . 1 1 41 41 GLN H H 41 7.480 7.480 7.876 -0.396 17919 72156 1 176 . 1 1 42 42 ARG N N 42 122.680 122.680 122.814 -0.134 17919 72157 1 176 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.656 -0.156 17919 72158 1 176 . 1 1 42 42 ARG C C 42 174.050 174.050 174.204 -0.154 17919 72159 1 176 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.229 -0.179 17919 72160 1 176 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.508 -1.758 17919 72161 1 176 . 1 1 42 42 ARG H H 42 8.530 8.530 8.450 0.080 17919 72162 1 176 . 1 1 43 43 LEU N N 43 124.040 124.040 124.590 -0.550 17919 72163 1 176 . 1 1 43 43 LEU C C 43 175.290 175.290 175.351 -0.061 17919 72164 1 176 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.556 -0.576 17919 72165 1 176 . 1 1 43 43 LEU CB C 43 45.790 45.790 45.455 0.335 17919 72166 1 176 . 1 1 43 43 LEU H H 43 8.820 8.820 8.779 0.041 17919 72167 1 176 . 1 1 44 44 ILE N N 44 121.920 121.920 120.831 1.089 17919 72168 1 176 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.996 -0.004 17919 72169 1 176 . 1 1 44 44 ILE C C 44 176.060 176.060 174.316 1.744 17919 72170 1 176 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.112 -1.132 17919 72171 1 176 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.805 -0.385 17919 72172 1 176 . 1 1 44 44 ILE H H 44 9.030 9.030 8.630 0.400 17919 72173 1 176 . 1 1 45 45 PHE N N 45 125.390 125.390 126.031 -0.641 17919 72174 1 176 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.020 0.025 17919 72175 1 176 . 1 1 45 45 PHE C C 45 174.470 174.470 174.218 0.252 17919 72176 1 176 . 1 1 45 45 PHE CA C 45 57.020 57.020 57.265 -0.245 17919 72177 1 176 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.325 0.435 17919 72178 1 176 . 1 1 45 45 PHE H H 45 8.830 8.830 8.555 0.275 17919 72179 1 176 . 1 1 46 46 ALA N N 46 132.200 132.200 129.313 2.887 17919 72180 1 176 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.639 0.051 17919 72181 1 176 . 1 1 46 46 ALA C C 46 177.290 177.290 177.809 -0.519 17919 72182 1 176 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.203 0.337 17919 72183 1 176 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.610 -0.040 17919 72184 1 176 . 1 1 46 46 ALA H H 46 8.810 8.810 8.451 0.359 17919 72185 1 176 . 1 1 47 47 GLY N N 47 102.340 102.340 106.206 -3.866 17919 72186 1 176 . 1 1 47 47 GLY C C 47 173.810 173.810 174.515 -0.705 17919 72187 1 176 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.957 0.393 17919 72188 1 176 . 1 1 47 47 GLY H H 47 8.130 8.130 8.524 -0.394 17919 72189 1 176 . 1 1 48 48 LYS N N 48 121.570 121.570 121.392 0.178 17919 72190 1 176 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.562 0.060 17919 72191 1 176 . 1 1 48 48 LYS C C 48 174.700 174.700 175.199 -0.499 17919 72192 1 176 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.973 -0.423 17919 72193 1 176 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.280 0.250 17919 72194 1 176 . 1 1 48 48 LYS H H 48 7.980 7.980 7.675 0.305 17919 72195 1 176 . 1 1 49 49 GLN N N 49 122.410 122.410 121.479 0.931 17919 72196 1 176 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.497 0.063 17919 72197 1 176 . 1 1 49 49 GLN C C 49 175.670 175.670 175.782 -0.112 17919 72198 1 176 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.628 0.112 17919 72199 1 176 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.056 -0.056 17919 72200 1 176 . 1 1 49 49 GLN H H 49 8.600 8.600 8.444 0.156 17919 72201 1 176 . 1 1 50 50 LEU N N 50 125.520 125.520 128.587 -3.067 17919 72202 1 176 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.295 -0.205 17919 72203 1 176 . 1 1 50 50 LEU C C 50 176.660 176.660 176.678 -0.018 17919 72204 1 176 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.410 -0.170 17919 72205 1 176 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.372 -0.802 17919 72206 1 176 . 1 1 50 50 LEU H H 50 8.530 8.530 8.491 0.039 17919 72207 1 176 . 1 1 51 51 GLU N N 51 122.940 122.940 122.418 0.522 17919 72208 1 176 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.569 -0.081 17919 72209 1 176 . 1 1 51 51 GLU C C 51 175.870 175.870 176.691 -0.821 17919 72210 1 176 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.464 0.496 17919 72211 1 176 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.942 -0.372 17919 72212 1 176 . 1 1 51 51 GLU H H 51 8.400 8.400 8.759 -0.359 17919 72213 1 176 . 1 1 52 52 ASP N N 52 120.030 120.030 125.078 -5.048 17919 72214 1 176 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.383 -0.024 17919 72215 1 176 . 1 1 52 52 ASP C C 52 177.330 177.330 177.804 -0.474 17919 72216 1 176 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.352 -0.392 17919 72217 1 176 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.683 0.167 17919 72218 1 176 . 1 1 52 52 ASP H H 52 8.160 8.160 8.956 -0.796 17919 72219 1 176 . 1 1 53 53 GLY N N 53 106.660 106.660 106.269 0.391 17919 72220 1 176 . 1 1 53 53 GLY C C 53 174.870 174.870 173.966 0.904 17919 72221 1 176 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.908 0.262 17919 72222 1 176 . 1 1 53 53 GLY H H 53 9.390 9.390 8.527 0.863 17919 72223 1 176 . 1 1 54 54 ARG N N 54 119.050 119.050 120.692 -1.642 17919 72224 1 176 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.641 0.054 17919 72225 1 176 . 1 1 54 54 ARG C C 54 175.350 175.350 175.859 -0.509 17919 72226 1 176 . 1 1 54 54 ARG CA C 54 54.390 54.390 52.622 1.768 17919 72227 1 176 . 1 1 54 54 ARG CB C 54 32.650 32.650 31.997 0.653 17919 72228 1 176 . 1 1 54 54 ARG H H 54 7.460 7.460 7.433 0.027 17919 72229 1 176 . 1 1 55 55 THR N N 55 108.400 108.400 112.644 -4.244 17919 72230 1 176 . 1 1 55 55 THR HA H 55 5.240 5.240 4.822 0.418 17919 72231 1 176 . 1 1 55 55 THR C C 55 176.560 176.560 176.276 0.284 17919 72232 1 176 . 1 1 55 55 THR CA C 55 59.690 59.690 60.832 -1.142 17919 72233 1 176 . 1 1 55 55 THR CB C 55 72.260 72.260 70.579 1.681 17919 72234 1 176 . 1 1 55 55 THR H H 55 8.730 8.730 8.772 -0.042 17919 72235 1 176 . 1 1 56 56 LEU N N 56 117.920 117.920 121.679 -3.759 17919 72236 1 176 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.031 0.029 17919 72237 1 176 . 1 1 56 56 LEU C C 56 180.810 180.810 178.915 1.895 17919 72238 1 176 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.115 0.595 17919 72239 1 176 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.101 -0.731 17919 72240 1 176 . 1 1 56 56 LEU H H 56 8.140 8.140 8.892 -0.752 17919 72241 1 176 . 1 1 57 57 SER N N 57 113.330 113.330 115.244 -1.914 17919 72242 1 176 . 1 1 57 57 SER HA H 57 4.370 4.370 4.281 0.089 17919 72243 1 176 . 1 1 57 57 SER C C 57 178.310 178.310 176.775 1.535 17919 72244 1 176 . 1 1 57 57 SER CA C 57 61.080 61.080 62.054 -0.974 17919 72245 1 176 . 1 1 57 57 SER CB C 57 62.530 62.530 62.799 -0.269 17919 72246 1 176 . 1 1 57 57 SER H H 57 8.470 8.470 8.040 0.430 17919 72247 1 176 . 1 1 58 58 ASP N N 58 124.190 124.190 122.160 2.030 17919 72248 1 176 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.390 -0.094 17919 72249 1 176 . 1 1 58 58 ASP C C 58 177.400 177.400 176.926 0.474 17919 72250 1 176 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.782 0.398 17919 72251 1 176 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.535 -0.435 17919 72252 1 176 . 1 1 58 58 ASP H H 58 7.930 7.930 7.862 0.068 17919 72253 1 176 . 1 1 59 59 TYR N N 59 115.510 115.510 115.757 -0.247 17919 72254 1 176 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.639 0.031 17919 72255 1 176 . 1 1 59 59 TYR C C 59 174.700 174.700 174.875 -0.175 17919 72256 1 176 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.294 0.956 17919 72257 1 176 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.386 1.685 17919 72258 1 176 . 1 1 59 59 TYR H H 59 7.250 7.250 7.312 -0.062 17919 72259 1 176 . 1 1 60 60 ASN N N 60 115.900 115.900 115.453 0.447 17919 72260 1 176 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.337 0.018 17919 72261 1 176 . 1 1 60 60 ASN C C 60 174.340 174.340 174.429 -0.089 17919 72262 1 176 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.553 -0.433 17919 72263 1 176 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.048 0.362 17919 72264 1 176 . 1 1 60 60 ASN H H 60 8.150 8.150 7.735 0.415 17919 72265 1 176 . 1 1 61 61 ILE N N 61 118.600 118.600 120.181 -1.581 17919 72266 1 176 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.651 -0.258 17919 72267 1 176 . 1 1 61 61 ILE C C 61 174.610 174.610 175.020 -0.410 17919 72268 1 176 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.980 0.440 17919 72269 1 176 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.520 -0.779 17919 72270 1 176 . 1 1 61 61 ILE H H 61 7.250 7.250 8.306 -1.056 17919 72271 1 176 . 1 1 62 62 GLN N N 62 124.740 124.740 125.442 -0.702 17919 72272 1 176 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.779 -0.273 17919 72273 1 176 . 1 1 62 62 GLN C C 62 175.970 175.970 176.071 -0.101 17919 72274 1 176 . 1 1 62 62 GLN CA C 62 53.660 53.660 52.614 1.046 17919 72275 1 176 . 1 1 62 62 GLN CB C 62 31.650 31.650 32.717 -1.067 17919 72276 1 176 . 1 1 62 62 GLN H H 62 7.610 7.610 7.803 -0.193 17919 72277 1 176 . 1 1 63 63 LYS N N 63 120.300 120.300 120.751 -0.451 17919 72278 1 176 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.034 -0.033 17919 72279 1 176 . 1 1 63 63 LYS C C 63 175.810 175.810 177.348 -1.538 17919 72280 1 176 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.852 -0.062 17919 72281 1 176 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.951 0.699 17919 72282 1 176 . 1 1 63 63 LYS H H 63 8.490 8.490 8.677 -0.187 17919 72283 1 176 . 1 1 64 64 GLU N N 64 113.950 113.950 117.596 -3.646 17919 72284 1 176 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.197 0.268 17919 72285 1 176 . 1 1 64 64 GLU C C 64 175.250 175.250 175.612 -0.362 17919 72286 1 176 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.519 0.371 17919 72287 1 176 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.070 -2.170 17919 72288 1 176 . 1 1 64 64 GLU H H 64 9.280 9.280 8.924 0.356 17919 72289 1 176 . 1 1 65 65 SER N N 65 114.730 114.730 117.231 -2.501 17919 72290 1 176 . 1 1 65 65 SER HA H 65 4.640 4.640 4.529 0.111 17919 72291 1 176 . 1 1 65 65 SER C C 65 172.160 172.160 173.941 -1.781 17919 72292 1 176 . 1 1 65 65 SER CA C 65 60.890 60.890 60.380 0.510 17919 72293 1 176 . 1 1 65 65 SER CB C 65 64.910 64.910 64.406 0.504 17919 72294 1 176 . 1 1 65 65 SER H H 65 7.670 7.670 7.371 0.299 17919 72295 1 176 . 1 1 66 66 THR N N 66 117.110 117.110 119.454 -2.344 17919 72296 1 176 . 1 1 66 66 THR HA H 66 5.270 5.270 5.425 -0.155 17919 72297 1 176 . 1 1 66 66 THR C C 66 173.950 173.950 174.368 -0.418 17919 72298 1 176 . 1 1 66 66 THR CA C 66 62.340 62.340 61.828 0.512 17919 72299 1 176 . 1 1 66 66 THR CB C 66 70.080 70.080 70.980 -0.900 17919 72300 1 176 . 1 1 66 66 THR H H 66 8.730 8.730 8.525 0.205 17919 72301 1 176 . 1 1 67 67 LEU N N 67 127.110 127.110 126.124 0.986 17919 72302 1 176 . 1 1 67 67 LEU HA H 67 5.060 5.060 5.151 -0.091 17919 72303 1 176 . 1 1 67 67 LEU C C 67 175.770 175.770 175.389 0.381 17919 72304 1 176 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.884 0.016 17919 72305 1 176 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.890 -0.630 17919 72306 1 176 . 1 1 67 67 LEU H H 67 9.410 9.410 9.251 0.159 17919 72307 1 176 . 1 1 68 68 HIS N N 68 118.380 118.380 121.100 -2.720 17919 72308 1 176 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.479 -0.239 17919 72309 1 176 . 1 1 68 68 HIS C C 68 173.150 173.150 174.090 -0.940 17919 72310 1 176 . 1 1 68 68 HIS CA C 68 55.000 55.000 53.696 1.304 17919 72311 1 176 . 1 1 68 68 HIS CB C 68 30.530 30.530 31.965 -1.435 17919 72312 1 176 . 1 1 68 68 HIS H H 68 9.230 9.230 8.707 0.523 17919 72313 1 176 . 1 1 69 69 LEU N N 69 124.460 124.460 130.352 -5.892 17919 72314 1 176 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.054 0.136 17919 72315 1 176 . 1 1 69 69 LEU C C 69 175.270 175.270 174.353 0.917 17919 72316 1 176 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.662 0.228 17919 72317 1 176 . 1 1 69 69 LEU CB C 69 44.380 44.380 43.944 0.436 17919 72318 1 176 . 1 1 69 69 LEU H H 69 8.340 8.340 8.294 0.046 17919 72319 1 176 . 1 1 70 70 VAL N N 70 126.940 126.940 125.987 0.953 17919 72320 1 176 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.317 0.033 17919 72321 1 176 . 1 1 70 70 VAL C C 70 174.000 174.000 174.277 -0.277 17919 72322 1 176 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.606 0.194 17919 72323 1 176 . 1 1 70 70 VAL CB C 70 34.910 34.910 34.578 0.332 17919 72324 1 176 . 1 1 70 70 VAL H H 70 9.200 9.200 8.685 0.515 17919 72325 1 176 . 1 1 71 71 LEU N N 71 123.130 123.130 124.381 -1.251 17919 72326 1 176 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.060 0.000 17919 72327 1 176 . 1 1 71 71 LEU C C 71 177.830 177.830 176.347 1.483 17919 72328 1 176 . 1 1 71 71 LEU CA C 71 53.940 53.940 54.125 -0.185 17919 72329 1 176 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.679 -0.829 17919 72330 1 176 . 1 1 71 71 LEU H H 71 8.120 8.120 8.269 -0.149 17919 72331 1 176 . 1 1 72 72 ARG N N 72 123.490 123.490 126.501 -3.011 17919 72332 1 176 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.600 -0.299 17919 72333 1 176 . 1 1 72 72 ARG C C 72 175.350 175.350 176.166 -0.816 17919 72334 1 176 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.658 -0.048 17919 72335 1 176 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.498 0.852 17919 72336 1 176 . 1 1 72 72 ARG H H 72 8.580 8.580 8.499 0.081 17919 72337 1 177 . 1 1 2 2 GLN N N 2 123.220 123.220 121.583 1.637 17919 72338 1 177 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.071 0.178 17919 72339 1 177 . 1 1 2 2 GLN C C 2 175.920 175.920 175.948 -0.028 17919 72340 1 177 . 1 1 2 2 GLN CA C 2 55.080 55.080 55.274 -0.194 17919 72341 1 177 . 1 1 2 2 GLN CB C 2 30.760 30.760 29.702 1.058 17919 72342 1 177 . 1 1 2 2 GLN H H 2 8.900 8.900 8.475 0.425 17919 72343 1 177 . 1 1 3 3 ILE N N 3 115.340 115.340 114.831 0.509 17919 72344 1 177 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.504 -0.291 17919 72345 1 177 . 1 1 3 3 ILE C C 3 172.450 172.450 173.495 -1.045 17919 72346 1 177 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.007 0.563 17919 72347 1 177 . 1 1 3 3 ILE CB C 3 42.210 42.210 42.130 0.080 17919 72348 1 177 . 1 1 3 3 ILE H H 3 8.320 8.320 8.128 0.192 17919 72349 1 177 . 1 1 4 4 PHE N N 4 118.110 118.110 119.292 -1.182 17919 72350 1 177 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.325 0.305 17919 72351 1 177 . 1 1 4 4 PHE C C 4 175.320 175.320 175.207 0.113 17919 72352 1 177 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.653 -0.443 17919 72353 1 177 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.418 0.062 17919 72354 1 177 . 1 1 4 4 PHE H H 4 8.610 8.610 8.446 0.164 17919 72355 1 177 . 1 1 5 5 VAL N N 5 121.000 121.000 121.954 -0.954 17919 72356 1 177 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.662 0.063 17919 72357 1 177 . 1 1 5 5 VAL C C 5 174.870 174.870 174.662 0.208 17919 72358 1 177 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.275 -0.655 17919 72359 1 177 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.811 0.419 17919 72360 1 177 . 1 1 5 5 VAL H H 5 9.300 9.300 9.221 0.079 17919 72361 1 177 . 1 1 6 6 LYS N N 6 127.520 127.520 129.534 -2.014 17919 72362 1 177 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.386 -0.019 17919 72363 1 177 . 1 1 6 6 LYS C C 6 177.140 177.140 176.608 0.532 17919 72364 1 177 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.794 -0.274 17919 72365 1 177 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.242 -0.192 17919 72366 1 177 . 1 1 6 6 LYS H H 6 8.820 8.820 9.035 -0.215 17919 72367 1 177 . 1 1 7 7 THR N N 7 115.400 115.400 118.250 -2.850 17919 72368 1 177 . 1 1 7 7 THR HA H 7 4.970 4.970 4.959 0.011 17919 72369 1 177 . 1 1 7 7 THR C C 7 176.910 176.910 176.726 0.184 17919 72370 1 177 . 1 1 7 7 THR CA C 7 60.470 60.470 60.684 -0.214 17919 72371 1 177 . 1 1 7 7 THR CB C 7 70.630 70.630 70.629 0.001 17919 72372 1 177 . 1 1 7 7 THR H H 7 8.730 8.730 8.484 0.246 17919 72373 1 177 . 1 1 8 8 LEU N N 8 121.330 121.330 120.958 0.372 17919 72374 1 177 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.322 -0.012 17919 72375 1 177 . 1 1 8 8 LEU C C 8 178.800 178.800 178.187 0.613 17919 72376 1 177 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.254 0.326 17919 72377 1 177 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.579 0.391 17919 72378 1 177 . 1 1 8 8 LEU H H 8 9.100 9.100 8.940 0.160 17919 72379 1 177 . 1 1 9 9 THR N N 9 105.590 105.590 110.272 -4.682 17919 72380 1 177 . 1 1 9 9 THR HA H 9 4.428 4.428 4.258 0.170 17919 72381 1 177 . 1 1 9 9 THR C C 9 175.520 175.520 175.837 -0.317 17919 72382 1 177 . 1 1 9 9 THR CA C 9 61.400 61.400 62.640 -1.240 17919 72383 1 177 . 1 1 9 9 THR CB C 9 69.140 69.140 69.302 -0.162 17919 72384 1 177 . 1 1 9 9 THR H H 9 7.630 7.630 7.830 -0.200 17919 72385 1 177 . 1 1 10 10 GLY N N 10 108.890 108.890 111.145 -2.255 17919 72386 1 177 . 1 1 10 10 GLY C C 10 174.070 174.070 173.768 0.302 17919 72387 1 177 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.748 0.712 17919 72388 1 177 . 1 1 10 10 GLY H H 10 7.810 7.810 7.592 0.218 17919 72389 1 177 . 1 1 11 11 LYS N N 11 121.600 121.600 121.709 -0.109 17919 72390 1 177 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.270 0.091 17919 72391 1 177 . 1 1 11 11 LYS C C 11 175.940 175.940 175.668 0.272 17919 72392 1 177 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.576 -0.296 17919 72393 1 177 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.389 -0.189 17919 72394 1 177 . 1 1 11 11 LYS H H 11 7.280 7.280 7.591 -0.311 17919 72395 1 177 . 1 1 12 12 THR N N 12 120.440 120.440 120.902 -0.462 17919 72396 1 177 . 1 1 12 12 THR HA H 12 5.046 5.046 4.665 0.381 17919 72397 1 177 . 1 1 12 12 THR C C 12 174.320 174.320 174.295 0.025 17919 72398 1 177 . 1 1 12 12 THR CA C 12 62.390 62.390 62.621 -0.231 17919 72399 1 177 . 1 1 12 12 THR CB C 12 69.910 69.910 69.122 0.788 17919 72400 1 177 . 1 1 12 12 THR H H 12 8.650 8.650 8.253 0.397 17919 72401 1 177 . 1 1 13 13 ILE N N 13 127.110 127.110 128.883 -1.773 17919 72402 1 177 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.453 0.091 17919 72403 1 177 . 1 1 13 13 ILE C C 13 175.220 175.220 175.348 -0.128 17919 72404 1 177 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.636 -0.656 17919 72405 1 177 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.010 0.941 17919 72406 1 177 . 1 1 13 13 ILE H H 13 9.450 9.450 9.075 0.375 17919 72407 1 177 . 1 1 14 14 THR N N 14 121.520 121.520 123.093 -1.573 17919 72408 1 177 . 1 1 14 14 THR HA H 14 4.964 4.964 4.718 0.246 17919 72409 1 177 . 1 1 14 14 THR C C 14 173.790 173.790 173.949 -0.159 17919 72410 1 177 . 1 1 14 14 THR CA C 14 61.940 61.940 62.516 -0.576 17919 72411 1 177 . 1 1 14 14 THR CB C 14 69.650 69.650 69.772 -0.122 17919 72412 1 177 . 1 1 14 14 THR H H 14 8.710 8.710 8.500 0.210 17919 72413 1 177 . 1 1 15 15 LEU N N 15 124.800 124.800 127.788 -2.988 17919 72414 1 177 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.626 0.154 17919 72415 1 177 . 1 1 15 15 LEU C C 15 174.670 174.670 175.605 -0.935 17919 72416 1 177 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.648 -0.818 17919 72417 1 177 . 1 1 15 15 LEU CB C 15 47.070 47.070 44.069 3.001 17919 72418 1 177 . 1 1 15 15 LEU H H 15 8.710 8.710 8.700 0.010 17919 72419 1 177 . 1 1 16 16 GLU N N 16 122.160 122.160 124.495 -2.335 17919 72420 1 177 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.901 0.016 17919 72421 1 177 . 1 1 16 16 GLU C C 16 175.860 175.860 176.095 -0.235 17919 72422 1 177 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.682 -0.862 17919 72423 1 177 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.239 -0.789 17919 72424 1 177 . 1 1 16 16 GLU H H 16 8.140 8.140 8.708 -0.568 17919 72425 1 177 . 1 1 17 17 VAL N N 17 117.210 117.210 121.982 -4.772 17919 72426 1 177 . 1 1 17 17 VAL HA H 17 4.714 4.714 5.015 -0.301 17919 72427 1 177 . 1 1 17 17 VAL C C 17 174.160 174.160 174.705 -0.545 17919 72428 1 177 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.151 -0.721 17919 72429 1 177 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.516 0.884 17919 72430 1 177 . 1 1 17 17 VAL H H 17 8.900 8.900 8.500 0.400 17919 72431 1 177 . 1 1 18 18 GLU N N 18 118.990 118.990 121.039 -2.049 17919 72432 1 177 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.809 0.270 17919 72433 1 177 . 1 1 18 18 GLU C C 18 176.160 176.160 176.259 -0.099 17919 72434 1 177 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.455 -0.735 17919 72435 1 177 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.427 -0.117 17919 72436 1 177 . 1 1 18 18 GLU H H 18 8.640 8.640 8.577 0.063 17919 72437 1 177 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.243 -0.102 17919 72438 1 177 . 1 1 19 19 PRO C C 19 175.310 175.310 177.855 -2.545 17919 72439 1 177 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.736 -0.266 17919 72440 1 177 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.935 0.015 17919 72441 1 177 . 1 1 20 20 SER N N 20 103.400 103.400 109.048 -5.648 17919 72442 1 177 . 1 1 20 20 SER HA H 20 4.370 4.370 4.271 0.099 17919 72443 1 177 . 1 1 20 20 SER C C 20 174.660 174.660 174.850 -0.190 17919 72444 1 177 . 1 1 20 20 SER CA C 20 57.400 57.400 59.114 -1.714 17919 72445 1 177 . 1 1 20 20 SER CB C 20 63.370 63.370 62.592 0.778 17919 72446 1 177 . 1 1 20 20 SER H H 20 7.040 7.040 8.014 -0.974 17919 72447 1 177 . 1 1 21 21 ASP N N 21 123.480 123.480 123.882 -0.402 17919 72448 1 177 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.686 0.009 17919 72449 1 177 . 1 1 21 21 ASP C C 21 176.360 176.360 175.900 0.460 17919 72450 1 177 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.578 0.122 17919 72451 1 177 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.573 -0.773 17919 72452 1 177 . 1 1 21 21 ASP H H 21 8.030 8.030 7.620 0.410 17919 72453 1 177 . 1 1 22 22 THR N N 22 108.800 108.800 112.333 -3.533 17919 72454 1 177 . 1 1 22 22 THR HA H 22 4.920 4.920 4.761 0.159 17919 72455 1 177 . 1 1 22 22 THR C C 22 176.750 176.750 176.084 0.666 17919 72456 1 177 . 1 1 22 22 THR CA C 22 59.690 59.690 60.665 -0.975 17919 72457 1 177 . 1 1 22 22 THR CB C 22 71.200 71.200 70.832 0.368 17919 72458 1 177 . 1 1 22 22 THR H H 22 7.900 7.900 8.218 -0.318 17919 72459 1 177 . 1 1 23 23 ILE N N 23 121.190 121.190 122.901 -1.711 17919 72460 1 177 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.716 -0.059 17919 72461 1 177 . 1 1 23 23 ILE C C 23 179.040 179.040 177.601 1.439 17919 72462 1 177 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.189 -0.929 17919 72463 1 177 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.348 -1.998 17919 72464 1 177 . 1 1 23 23 ILE H H 23 8.560 8.560 8.711 -0.151 17919 72465 1 177 . 1 1 24 24 GLU N N 24 120.830 120.830 121.007 -0.177 17919 72466 1 177 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.812 0.105 17919 72467 1 177 . 1 1 24 24 GLU C C 24 178.640 178.640 178.649 -0.009 17919 72468 1 177 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.105 0.115 17919 72469 1 177 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.393 -1.113 17919 72470 1 177 . 1 1 24 24 GLU H H 24 9.760 9.760 8.292 1.468 17919 72471 1 177 . 1 1 25 25 ASN N N 25 120.570 120.570 117.548 3.022 17919 72472 1 177 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.508 0.017 17919 72473 1 177 . 1 1 25 25 ASN C C 25 178.380 178.380 178.034 0.346 17919 72474 1 177 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.962 0.099 17919 72475 1 177 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.929 -0.479 17919 72476 1 177 . 1 1 25 25 ASN H H 25 7.920 7.920 7.468 0.452 17919 72477 1 177 . 1 1 26 26 VAL N N 26 121.710 121.710 120.821 0.889 17919 72478 1 177 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.536 -0.139 17919 72479 1 177 . 1 1 26 26 VAL C C 26 177.950 177.950 177.897 0.053 17919 72480 1 177 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.777 0.883 17919 72481 1 177 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.610 -0.770 17919 72482 1 177 . 1 1 26 26 VAL H H 26 8.070 8.070 8.344 -0.274 17919 72483 1 177 . 1 1 27 27 LYS N N 27 118.860 118.860 119.455 -0.595 17919 72484 1 177 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.178 0.402 17919 72485 1 177 . 1 1 27 27 LYS C C 27 180.550 180.550 178.981 1.569 17919 72486 1 177 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.458 -0.208 17919 72487 1 177 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.339 1.391 17919 72488 1 177 . 1 1 27 27 LYS H H 27 8.560 8.560 8.493 0.067 17919 72489 1 177 . 1 1 28 28 ALA N N 28 123.440 123.440 121.834 1.606 17919 72490 1 177 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.196 -0.036 17919 72491 1 177 . 1 1 28 28 ALA C C 28 180.300 180.300 179.156 1.144 17919 72492 1 177 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.705 0.665 17919 72493 1 177 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.432 -0.722 17919 72494 1 177 . 1 1 28 28 ALA H H 28 8.060 8.060 7.664 0.396 17919 72495 1 177 . 1 1 29 29 LYS N N 29 119.940 119.940 119.447 0.493 17919 72496 1 177 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.005 0.202 17919 72497 1 177 . 1 1 29 29 LYS C C 29 180.320 180.320 179.000 1.320 17919 72498 1 177 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.201 0.449 17919 72499 1 177 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.301 0.989 17919 72500 1 177 . 1 1 29 29 LYS H H 29 7.850 7.850 7.552 0.298 17919 72501 1 177 . 1 1 30 30 ILE N N 30 121.080 121.080 120.299 0.781 17919 72502 1 177 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.584 -0.077 17919 72503 1 177 . 1 1 30 30 ILE C C 30 178.310 178.310 177.178 1.132 17919 72504 1 177 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.616 0.534 17919 72505 1 177 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.981 -1.181 17919 72506 1 177 . 1 1 30 30 ILE H H 30 8.280 8.280 7.722 0.558 17919 72507 1 177 . 1 1 31 31 GLN N N 31 123.490 123.490 120.641 2.849 17919 72508 1 177 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.905 -0.076 17919 72509 1 177 . 1 1 31 31 GLN C C 31 178.890 178.890 178.307 0.583 17919 72510 1 177 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.252 0.748 17919 72511 1 177 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.364 -0.644 17919 72512 1 177 . 1 1 31 31 GLN H H 31 8.580 8.580 7.784 0.796 17919 72513 1 177 . 1 1 32 32 ASP N N 32 119.360 119.360 118.708 0.652 17919 72514 1 177 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.425 -0.071 17919 72515 1 177 . 1 1 32 32 ASP C C 32 177.250 177.250 177.591 -0.341 17919 72516 1 177 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.520 0.670 17919 72517 1 177 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.749 -0.169 17919 72518 1 177 . 1 1 32 32 ASP H H 32 8.010 8.010 8.062 -0.052 17919 72519 1 177 . 1 1 33 33 LYS N N 33 115.130 115.130 116.733 -1.603 17919 72520 1 177 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.458 -0.121 17919 72521 1 177 . 1 1 33 33 LYS C C 33 177.870 177.870 177.623 0.247 17919 72522 1 177 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.713 0.337 17919 72523 1 177 . 1 1 33 33 LYS CB C 33 34.170 34.170 34.659 -0.489 17919 72524 1 177 . 1 1 33 33 LYS H H 33 7.430 7.430 7.696 -0.266 17919 72525 1 177 . 1 1 34 34 GLU N N 34 113.870 113.870 115.443 -1.573 17919 72526 1 177 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.446 0.179 17919 72527 1 177 . 1 1 34 34 GLU C C 34 177.840 177.840 177.536 0.304 17919 72528 1 177 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.883 -0.713 17919 72529 1 177 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.811 0.850 17919 72530 1 177 . 1 1 34 34 GLU H H 34 8.740 8.740 8.249 0.491 17919 72531 1 177 . 1 1 35 35 GLY N N 35 108.650 108.650 109.254 -0.604 17919 72532 1 177 . 1 1 35 35 GLY C C 35 173.960 173.960 174.260 -0.300 17919 72533 1 177 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.877 0.203 17919 72534 1 177 . 1 1 35 35 GLY H H 35 8.530 8.530 8.374 0.156 17919 72535 1 177 . 1 1 36 36 ILE N N 36 119.880 119.880 120.860 -0.980 17919 72536 1 177 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.357 0.088 17919 72537 1 177 . 1 1 36 36 ILE C C 36 173.590 173.590 174.575 -0.985 17919 72538 1 177 . 1 1 36 36 ILE CA C 36 57.750 57.750 56.626 1.124 17919 72539 1 177 . 1 1 36 36 ILE CB C 36 40.580 40.580 36.719 3.861 17919 72540 1 177 . 1 1 36 36 ILE H H 36 6.150 6.150 7.707 -1.557 17919 72541 1 177 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.680 -0.046 17919 72542 1 177 . 1 1 37 37 PRO C C 37 176.940 176.940 176.273 0.667 17919 72543 1 177 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.386 0.274 17919 72544 1 177 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.233 0.617 17919 72545 1 177 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.141 -0.024 17919 72546 1 177 . 1 1 38 38 PRO C C 38 178.320 178.320 178.605 -0.285 17919 72547 1 177 . 1 1 38 38 PRO CA C 38 66.260 66.260 66.046 0.214 17919 72548 1 177 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.854 1.036 17919 72549 1 177 . 1 1 39 39 ASP N N 39 113.380 113.380 116.426 -3.046 17919 72550 1 177 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.298 0.132 17919 72551 1 177 . 1 1 39 39 ASP C C 39 177.090 177.090 177.738 -0.648 17919 72552 1 177 . 1 1 39 39 ASP CA C 39 55.640 55.640 57.311 -1.671 17919 72553 1 177 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.633 -1.093 17919 72554 1 177 . 1 1 39 39 ASP H H 39 8.550 8.550 8.735 -0.185 17919 72555 1 177 . 1 1 40 40 GLN N N 40 116.780 116.780 116.131 0.649 17919 72556 1 177 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.240 0.224 17919 72557 1 177 . 1 1 40 40 GLN C C 40 175.380 175.380 175.703 -0.323 17919 72558 1 177 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.143 -0.503 17919 72559 1 177 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.488 0.652 17919 72560 1 177 . 1 1 40 40 GLN H H 40 7.820 7.820 7.649 0.171 17919 72561 1 177 . 1 1 41 41 GLN N N 41 117.720 117.720 118.661 -0.941 17919 72562 1 177 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.393 -0.149 17919 72563 1 177 . 1 1 41 41 GLN C C 41 176.300 176.300 174.450 1.850 17919 72564 1 177 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.759 0.711 17919 72565 1 177 . 1 1 41 41 GLN CB C 41 31.650 31.650 30.380 1.270 17919 72566 1 177 . 1 1 41 41 GLN H H 41 7.480 7.480 7.329 0.151 17919 72567 1 177 . 1 1 42 42 ARG N N 42 122.680 122.680 123.840 -1.160 17919 72568 1 177 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.575 -0.075 17919 72569 1 177 . 1 1 42 42 ARG C C 42 174.050 174.050 173.801 0.249 17919 72570 1 177 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.956 0.093 17919 72571 1 177 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.998 -1.248 17919 72572 1 177 . 1 1 42 42 ARG H H 42 8.530 8.530 8.460 0.070 17919 72573 1 177 . 1 1 43 43 LEU N N 43 124.040 124.040 127.660 -3.620 17919 72574 1 177 . 1 1 43 43 LEU C C 43 175.290 175.290 175.392 -0.102 17919 72575 1 177 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.487 -1.507 17919 72576 1 177 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.110 1.680 17919 72577 1 177 . 1 1 43 43 LEU H H 43 8.820 8.820 8.501 0.319 17919 72578 1 177 . 1 1 44 44 ILE N N 44 121.920 121.920 122.366 -0.446 17919 72579 1 177 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.823 0.169 17919 72580 1 177 . 1 1 44 44 ILE C C 44 176.060 176.060 173.964 2.096 17919 72581 1 177 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.442 -1.462 17919 72582 1 177 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.646 -0.226 17919 72583 1 177 . 1 1 44 44 ILE H H 44 9.030 9.030 9.016 0.014 17919 72584 1 177 . 1 1 45 45 PHE N N 45 125.390 125.390 126.932 -1.542 17919 72585 1 177 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.065 -0.020 17919 72586 1 177 . 1 1 45 45 PHE C C 45 174.470 174.470 174.189 0.281 17919 72587 1 177 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.375 0.645 17919 72588 1 177 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.328 0.432 17919 72589 1 177 . 1 1 45 45 PHE H H 45 8.830 8.830 9.093 -0.263 17919 72590 1 177 . 1 1 46 46 ALA N N 46 132.200 132.200 129.788 2.412 17919 72591 1 177 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.605 0.085 17919 72592 1 177 . 1 1 46 46 ALA C C 46 177.290 177.290 177.532 -0.242 17919 72593 1 177 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.942 -0.402 17919 72594 1 177 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.488 0.081 17919 72595 1 177 . 1 1 46 46 ALA H H 46 8.810 8.810 8.910 -0.100 17919 72596 1 177 . 1 1 47 47 GLY N N 47 102.340 102.340 103.969 -1.629 17919 72597 1 177 . 1 1 47 47 GLY C C 47 173.810 173.810 174.448 -0.638 17919 72598 1 177 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.386 -0.036 17919 72599 1 177 . 1 1 47 47 GLY H H 47 8.130 8.130 8.444 -0.314 17919 72600 1 177 . 1 1 48 48 LYS N N 48 121.570 121.570 121.791 -0.221 17919 72601 1 177 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.631 -0.009 17919 72602 1 177 . 1 1 48 48 LYS C C 48 174.700 174.700 175.161 -0.461 17919 72603 1 177 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.156 -0.606 17919 72604 1 177 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.143 0.387 17919 72605 1 177 . 1 1 48 48 LYS H H 48 7.980 7.980 7.939 0.041 17919 72606 1 177 . 1 1 49 49 GLN N N 49 122.410 122.410 123.914 -1.504 17919 72607 1 177 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.674 -0.114 17919 72608 1 177 . 1 1 49 49 GLN C C 49 175.670 175.670 175.257 0.413 17919 72609 1 177 . 1 1 49 49 GLN CA C 49 55.740 55.740 54.967 0.773 17919 72610 1 177 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.890 -0.890 17919 72611 1 177 . 1 1 49 49 GLN H H 49 8.600 8.600 8.490 0.110 17919 72612 1 177 . 1 1 50 50 LEU N N 50 125.520 125.520 124.984 0.536 17919 72613 1 177 . 1 1 50 50 LEU HA H 50 4.090 4.090 3.948 0.142 17919 72614 1 177 . 1 1 50 50 LEU C C 50 176.660 176.660 175.433 1.227 17919 72615 1 177 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.496 0.744 17919 72616 1 177 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.892 -0.322 17919 72617 1 177 . 1 1 50 50 LEU H H 50 8.530 8.530 8.744 -0.214 17919 72618 1 177 . 1 1 51 51 GLU N N 51 122.940 122.940 123.564 -0.624 17919 72619 1 177 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.465 0.023 17919 72620 1 177 . 1 1 51 51 GLU C C 51 175.870 175.870 177.385 -1.515 17919 72621 1 177 . 1 1 51 51 GLU CA C 51 55.960 55.960 54.554 1.406 17919 72622 1 177 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.675 -1.105 17919 72623 1 177 . 1 1 51 51 GLU H H 51 8.400 8.400 8.104 0.296 17919 72624 1 177 . 1 1 52 52 ASP N N 52 120.030 120.030 123.597 -3.567 17919 72625 1 177 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.419 -0.060 17919 72626 1 177 . 1 1 52 52 ASP C C 52 177.330 177.330 177.297 0.033 17919 72627 1 177 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.499 -0.539 17919 72628 1 177 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.748 0.102 17919 72629 1 177 . 1 1 52 52 ASP H H 52 8.160 8.160 8.797 -0.637 17919 72630 1 177 . 1 1 53 53 GLY N N 53 106.660 106.660 105.126 1.534 17919 72631 1 177 . 1 1 53 53 GLY C C 53 174.870 174.870 173.895 0.975 17919 72632 1 177 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.760 0.410 17919 72633 1 177 . 1 1 53 53 GLY H H 53 9.390 9.390 8.510 0.880 17919 72634 1 177 . 1 1 54 54 ARG N N 54 119.050 119.050 120.730 -1.680 17919 72635 1 177 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.812 -0.117 17919 72636 1 177 . 1 1 54 54 ARG C C 54 175.350 175.350 175.296 0.054 17919 72637 1 177 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.231 0.159 17919 72638 1 177 . 1 1 54 54 ARG CB C 54 32.650 32.650 34.018 -1.368 17919 72639 1 177 . 1 1 54 54 ARG H H 54 7.460 7.460 7.464 -0.004 17919 72640 1 177 . 1 1 55 55 THR N N 55 108.400 108.400 111.939 -3.539 17919 72641 1 177 . 1 1 55 55 THR HA H 55 5.240 5.240 5.124 0.116 17919 72642 1 177 . 1 1 55 55 THR C C 55 176.560 176.560 176.438 0.122 17919 72643 1 177 . 1 1 55 55 THR CA C 55 59.690 59.690 60.156 -0.466 17919 72644 1 177 . 1 1 55 55 THR CB C 55 72.260 72.260 71.234 1.026 17919 72645 1 177 . 1 1 55 55 THR H H 55 8.730 8.730 9.311 -0.581 17919 72646 1 177 . 1 1 56 56 LEU N N 56 117.920 117.920 122.067 -4.147 17919 72647 1 177 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.067 -0.007 17919 72648 1 177 . 1 1 56 56 LEU C C 56 180.810 180.810 178.921 1.889 17919 72649 1 177 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.493 0.217 17919 72650 1 177 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.370 -1.000 17919 72651 1 177 . 1 1 56 56 LEU H H 56 8.140 8.140 8.969 -0.829 17919 72652 1 177 . 1 1 57 57 SER N N 57 113.330 113.330 113.812 -0.482 17919 72653 1 177 . 1 1 57 57 SER HA H 57 4.370 4.370 4.335 0.035 17919 72654 1 177 . 1 1 57 57 SER C C 57 178.310 178.310 177.053 1.257 17919 72655 1 177 . 1 1 57 57 SER CA C 57 61.080 61.080 60.860 0.220 17919 72656 1 177 . 1 1 57 57 SER CB C 57 62.530 62.530 62.665 -0.135 17919 72657 1 177 . 1 1 57 57 SER H H 57 8.470 8.470 8.017 0.453 17919 72658 1 177 . 1 1 58 58 ASP N N 58 124.190 124.190 122.985 1.205 17919 72659 1 177 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.325 -0.029 17919 72660 1 177 . 1 1 58 58 ASP C C 58 177.400 177.400 177.560 -0.160 17919 72661 1 177 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.637 0.543 17919 72662 1 177 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.333 -0.233 17919 72663 1 177 . 1 1 58 58 ASP H H 58 7.930 7.930 7.862 0.069 17919 72664 1 177 . 1 1 59 59 TYR N N 59 115.510 115.510 115.983 -0.473 17919 72665 1 177 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.633 0.037 17919 72666 1 177 . 1 1 59 59 TYR C C 59 174.700 174.700 174.894 -0.194 17919 72667 1 177 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.375 0.875 17919 72668 1 177 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.063 2.007 17919 72669 1 177 . 1 1 59 59 TYR H H 59 7.250 7.250 7.390 -0.140 17919 72670 1 177 . 1 1 60 60 ASN N N 60 115.900 115.900 117.395 -1.495 17919 72671 1 177 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.341 0.014 17919 72672 1 177 . 1 1 60 60 ASN C C 60 174.340 174.340 174.461 -0.121 17919 72673 1 177 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.414 -0.294 17919 72674 1 177 . 1 1 60 60 ASN CB C 60 37.410 37.410 36.620 0.790 17919 72675 1 177 . 1 1 60 60 ASN H H 60 8.150 8.150 7.848 0.302 17919 72676 1 177 . 1 1 61 61 ILE N N 61 118.600 118.600 119.739 -1.139 17919 72677 1 177 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.935 -0.542 17919 72678 1 177 . 1 1 61 61 ILE C C 61 174.610 174.610 175.443 -0.833 17919 72679 1 177 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.845 0.575 17919 72680 1 177 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.929 -1.189 17919 72681 1 177 . 1 1 61 61 ILE H H 61 7.250 7.250 7.983 -0.733 17919 72682 1 177 . 1 1 62 62 GLN N N 62 124.740 124.740 127.484 -2.744 17919 72683 1 177 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.694 -0.188 17919 72684 1 177 . 1 1 62 62 GLN C C 62 175.970 175.970 175.364 0.606 17919 72685 1 177 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.662 -0.002 17919 72686 1 177 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.096 0.554 17919 72687 1 177 . 1 1 62 62 GLN H H 62 7.610 7.610 8.066 -0.456 17919 72688 1 177 . 1 1 63 63 LYS N N 63 120.300 120.300 120.278 0.022 17919 72689 1 177 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.209 -0.208 17919 72690 1 177 . 1 1 63 63 LYS C C 63 175.810 175.810 176.680 -0.870 17919 72691 1 177 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.367 0.423 17919 72692 1 177 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.034 0.616 17919 72693 1 177 . 1 1 63 63 LYS H H 63 8.490 8.490 8.387 0.103 17919 72694 1 177 . 1 1 64 64 GLU N N 64 113.950 113.950 118.208 -4.258 17919 72695 1 177 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.690 -0.225 17919 72696 1 177 . 1 1 64 64 GLU C C 64 175.250 175.250 176.227 -0.977 17919 72697 1 177 . 1 1 64 64 GLU CA C 64 57.890 57.890 58.100 -0.210 17919 72698 1 177 . 1 1 64 64 GLU CB C 64 25.900 25.900 29.109 -3.209 17919 72699 1 177 . 1 1 64 64 GLU H H 64 9.280 9.280 8.829 0.451 17919 72700 1 177 . 1 1 65 65 SER N N 65 114.730 114.730 114.779 -0.049 17919 72701 1 177 . 1 1 65 65 SER HA H 65 4.640 4.640 4.402 0.238 17919 72702 1 177 . 1 1 65 65 SER C C 65 172.160 172.160 173.801 -1.641 17919 72703 1 177 . 1 1 65 65 SER CA C 65 60.890 60.890 61.120 -0.230 17919 72704 1 177 . 1 1 65 65 SER CB C 65 64.910 64.910 63.778 1.132 17919 72705 1 177 . 1 1 65 65 SER H H 65 7.670 7.670 7.535 0.135 17919 72706 1 177 . 1 1 66 66 THR N N 66 117.110 117.110 119.039 -1.929 17919 72707 1 177 . 1 1 66 66 THR HA H 66 5.270 5.270 4.888 0.382 17919 72708 1 177 . 1 1 66 66 THR C C 66 173.950 173.950 173.722 0.228 17919 72709 1 177 . 1 1 66 66 THR CA C 66 62.340 62.340 61.901 0.439 17919 72710 1 177 . 1 1 66 66 THR CB C 66 70.080 70.080 70.026 0.054 17919 72711 1 177 . 1 1 66 66 THR H H 66 8.730 8.730 8.323 0.407 17919 72712 1 177 . 1 1 67 67 LEU N N 67 127.110 127.110 127.566 -0.456 17919 72713 1 177 . 1 1 67 67 LEU HA H 67 5.060 5.060 5.044 0.016 17919 72714 1 177 . 1 1 67 67 LEU C C 67 175.770 175.770 175.637 0.133 17919 72715 1 177 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.031 -0.131 17919 72716 1 177 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.170 0.090 17919 72717 1 177 . 1 1 67 67 LEU H H 67 9.410 9.410 9.218 0.192 17919 72718 1 177 . 1 1 68 68 HIS N N 68 118.380 118.380 121.935 -3.555 17919 72719 1 177 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.396 -0.156 17919 72720 1 177 . 1 1 68 68 HIS C C 68 173.150 173.150 173.628 -0.478 17919 72721 1 177 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.049 0.951 17919 72722 1 177 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.340 -1.810 17919 72723 1 177 . 1 1 68 68 HIS H H 68 9.230 9.230 9.236 -0.006 17919 72724 1 177 . 1 1 69 69 LEU N N 69 124.460 124.460 129.167 -4.707 17919 72725 1 177 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.421 -0.231 17919 72726 1 177 . 1 1 69 69 LEU C C 69 175.270 175.270 174.533 0.737 17919 72727 1 177 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.015 0.875 17919 72728 1 177 . 1 1 69 69 LEU CB C 69 44.380 44.380 45.198 -0.818 17919 72729 1 177 . 1 1 69 69 LEU H H 69 8.340 8.340 8.724 -0.384 17919 72730 1 177 . 1 1 70 70 VAL N N 70 126.940 126.940 121.884 5.056 17919 72731 1 177 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.488 -0.138 17919 72732 1 177 . 1 1 70 70 VAL C C 70 174.000 174.000 173.841 0.159 17919 72733 1 177 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.547 1.253 17919 72734 1 177 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.692 -0.782 17919 72735 1 177 . 1 1 70 70 VAL H H 70 9.200 9.200 8.818 0.382 17919 72736 1 177 . 1 1 71 71 LEU N N 71 123.130 123.130 122.984 0.146 17919 72737 1 177 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.994 0.066 17919 72738 1 177 . 1 1 71 71 LEU C C 71 177.830 177.830 178.051 -0.221 17919 72739 1 177 . 1 1 71 71 LEU CA C 71 53.940 53.940 52.499 1.441 17919 72740 1 177 . 1 1 71 71 LEU CB C 71 42.850 42.850 41.707 1.143 17919 72741 1 177 . 1 1 71 71 LEU H H 71 8.120 8.120 8.476 -0.356 17919 72742 1 177 . 1 1 72 72 ARG N N 72 123.490 123.490 125.940 -2.450 17919 72743 1 177 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.112 0.189 17919 72744 1 177 . 1 1 72 72 ARG C C 72 175.350 175.350 176.232 -0.882 17919 72745 1 177 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.982 -1.372 17919 72746 1 177 . 1 1 72 72 ARG CB C 72 31.350 31.350 27.722 3.628 17919 72747 1 177 . 1 1 72 72 ARG H H 72 8.580 8.580 8.356 0.224 17919 72748 1 178 . 1 1 2 2 GLN N N 2 123.220 123.220 125.918 -2.698 17919 72749 1 178 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.321 -0.072 17919 72750 1 178 . 1 1 2 2 GLN C C 2 175.920 175.920 174.746 1.174 17919 72751 1 178 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.896 0.184 17919 72752 1 178 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.463 0.297 17919 72753 1 178 . 1 1 2 2 GLN H H 2 8.900 8.900 8.461 0.439 17919 72754 1 178 . 1 1 3 3 ILE N N 3 115.340 115.340 118.768 -3.428 17919 72755 1 178 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.615 -0.402 17919 72756 1 178 . 1 1 3 3 ILE C C 3 172.450 172.450 173.386 -0.936 17919 72757 1 178 . 1 1 3 3 ILE CA C 3 59.570 59.570 58.646 0.924 17919 72758 1 178 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.959 0.251 17919 72759 1 178 . 1 1 3 3 ILE H H 3 8.320 8.320 8.154 0.166 17919 72760 1 178 . 1 1 4 4 PHE N N 4 118.110 118.110 119.236 -1.126 17919 72761 1 178 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.425 0.205 17919 72762 1 178 . 1 1 4 4 PHE C C 4 175.320 175.320 175.205 0.115 17919 72763 1 178 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.629 -0.419 17919 72764 1 178 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.506 -0.026 17919 72765 1 178 . 1 1 4 4 PHE H H 4 8.610 8.610 8.591 0.019 17919 72766 1 178 . 1 1 5 5 VAL N N 5 121.000 121.000 122.083 -1.083 17919 72767 1 178 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.680 0.045 17919 72768 1 178 . 1 1 5 5 VAL C C 5 174.870 174.870 174.680 0.190 17919 72769 1 178 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.284 -0.664 17919 72770 1 178 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.282 -0.052 17919 72771 1 178 . 1 1 5 5 VAL H H 5 9.300 9.300 9.270 0.030 17919 72772 1 178 . 1 1 6 6 LYS N N 6 127.520 127.520 128.004 -0.484 17919 72773 1 178 . 1 1 6 6 LYS HA H 6 5.367 5.367 4.886 0.481 17919 72774 1 178 . 1 1 6 6 LYS C C 6 177.140 177.140 175.913 1.227 17919 72775 1 178 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.103 0.417 17919 72776 1 178 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.216 -0.166 17919 72777 1 178 . 1 1 6 6 LYS H H 6 8.820 8.820 9.124 -0.304 17919 72778 1 178 . 1 1 7 7 THR N N 7 115.400 115.400 116.628 -1.228 17919 72779 1 178 . 1 1 7 7 THR HA H 7 4.970 4.970 4.815 0.155 17919 72780 1 178 . 1 1 7 7 THR C C 7 176.910 176.910 175.464 1.446 17919 72781 1 178 . 1 1 7 7 THR CA C 7 60.470 60.470 59.645 0.825 17919 72782 1 178 . 1 1 7 7 THR CB C 7 70.630 70.630 71.297 -0.667 17919 72783 1 178 . 1 1 7 7 THR H H 7 8.730 8.730 8.031 0.699 17919 72784 1 178 . 1 1 8 8 LEU N N 8 121.330 121.330 119.416 1.914 17919 72785 1 178 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.318 -0.008 17919 72786 1 178 . 1 1 8 8 LEU C C 8 178.800 178.800 178.026 0.774 17919 72787 1 178 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.070 0.510 17919 72788 1 178 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.294 -0.324 17919 72789 1 178 . 1 1 8 8 LEU H H 8 9.100 9.100 8.657 0.443 17919 72790 1 178 . 1 1 9 9 THR N N 9 105.590 105.590 108.997 -3.407 17919 72791 1 178 . 1 1 9 9 THR HA H 9 4.428 4.428 4.315 0.113 17919 72792 1 178 . 1 1 9 9 THR C C 9 175.520 175.520 175.545 -0.025 17919 72793 1 178 . 1 1 9 9 THR CA C 9 61.400 61.400 62.059 -0.659 17919 72794 1 178 . 1 1 9 9 THR CB C 9 69.140 69.140 69.255 -0.115 17919 72795 1 178 . 1 1 9 9 THR H H 9 7.630 7.630 8.011 -0.381 17919 72796 1 178 . 1 1 10 10 GLY N N 10 108.890 108.890 110.615 -1.725 17919 72797 1 178 . 1 1 10 10 GLY C C 10 174.070 174.070 173.655 0.415 17919 72798 1 178 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.662 0.798 17919 72799 1 178 . 1 1 10 10 GLY H H 10 7.810 7.810 7.401 0.409 17919 72800 1 178 . 1 1 11 11 LYS N N 11 121.600 121.600 123.300 -1.700 17919 72801 1 178 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.206 0.155 17919 72802 1 178 . 1 1 11 11 LYS C C 11 175.940 175.940 175.746 0.194 17919 72803 1 178 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.555 -0.275 17919 72804 1 178 . 1 1 11 11 LYS CB C 11 33.200 33.200 32.882 0.318 17919 72805 1 178 . 1 1 11 11 LYS H H 11 7.280 7.280 7.937 -0.657 17919 72806 1 178 . 1 1 12 12 THR N N 12 120.440 120.440 122.277 -1.837 17919 72807 1 178 . 1 1 12 12 THR HA H 12 5.046 5.046 4.879 0.167 17919 72808 1 178 . 1 1 12 12 THR C C 12 174.320 174.320 174.684 -0.364 17919 72809 1 178 . 1 1 12 12 THR CA C 12 62.390 62.390 62.910 -0.520 17919 72810 1 178 . 1 1 12 12 THR CB C 12 69.910 69.910 69.483 0.427 17919 72811 1 178 . 1 1 12 12 THR H H 12 8.650 8.650 8.332 0.318 17919 72812 1 178 . 1 1 13 13 ILE N N 13 127.110 127.110 128.566 -1.456 17919 72813 1 178 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.328 0.216 17919 72814 1 178 . 1 1 13 13 ILE C C 13 175.220 175.220 174.936 0.284 17919 72815 1 178 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.877 -0.897 17919 72816 1 178 . 1 1 13 13 ILE CB C 13 40.950 40.950 39.767 1.183 17919 72817 1 178 . 1 1 13 13 ILE H H 13 9.450 9.450 9.253 0.197 17919 72818 1 178 . 1 1 14 14 THR N N 14 121.520 121.520 124.119 -2.599 17919 72819 1 178 . 1 1 14 14 THR HA H 14 4.964 4.964 4.988 -0.024 17919 72820 1 178 . 1 1 14 14 THR C C 14 173.790 173.790 173.747 0.043 17919 72821 1 178 . 1 1 14 14 THR CA C 14 61.940 61.940 62.166 -0.226 17919 72822 1 178 . 1 1 14 14 THR CB C 14 69.650 69.650 69.614 0.036 17919 72823 1 178 . 1 1 14 14 THR H H 14 8.710 8.710 8.746 -0.036 17919 72824 1 178 . 1 1 15 15 LEU N N 15 124.800 124.800 126.694 -1.894 17919 72825 1 178 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.619 0.161 17919 72826 1 178 . 1 1 15 15 LEU C C 15 174.670 174.670 175.846 -1.176 17919 72827 1 178 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.909 -1.079 17919 72828 1 178 . 1 1 15 15 LEU CB C 15 47.070 47.070 43.916 3.154 17919 72829 1 178 . 1 1 15 15 LEU H H 15 8.710 8.710 9.122 -0.412 17919 72830 1 178 . 1 1 16 16 GLU N N 16 122.160 122.160 122.368 -0.208 17919 72831 1 178 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.048 -0.131 17919 72832 1 178 . 1 1 16 16 GLU C C 16 175.860 175.860 175.826 0.034 17919 72833 1 178 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.312 -0.492 17919 72834 1 178 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.615 -1.165 17919 72835 1 178 . 1 1 16 16 GLU H H 16 8.140 8.140 8.667 -0.527 17919 72836 1 178 . 1 1 17 17 VAL N N 17 117.210 117.210 119.075 -1.865 17919 72837 1 178 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.892 -0.178 17919 72838 1 178 . 1 1 17 17 VAL C C 17 174.160 174.160 174.389 -0.229 17919 72839 1 178 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.074 -0.644 17919 72840 1 178 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.723 0.677 17919 72841 1 178 . 1 1 17 17 VAL H H 17 8.900 8.900 8.998 -0.098 17919 72842 1 178 . 1 1 18 18 GLU N N 18 118.990 118.990 121.584 -2.594 17919 72843 1 178 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.899 0.180 17919 72844 1 178 . 1 1 18 18 GLU C C 18 176.160 176.160 175.271 0.889 17919 72845 1 178 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.461 0.260 17919 72846 1 178 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.268 0.042 17919 72847 1 178 . 1 1 18 18 GLU H H 18 8.640 8.640 8.932 -0.292 17919 72848 1 178 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.298 -0.157 17919 72849 1 178 . 1 1 19 19 PRO C C 19 175.310 175.310 178.285 -2.975 17919 72850 1 178 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.656 -0.186 17919 72851 1 178 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.905 0.045 17919 72852 1 178 . 1 1 20 20 SER N N 20 103.400 103.400 111.072 -7.672 17919 72853 1 178 . 1 1 20 20 SER HA H 20 4.370 4.370 4.342 0.028 17919 72854 1 178 . 1 1 20 20 SER C C 20 174.660 174.660 174.828 -0.168 17919 72855 1 178 . 1 1 20 20 SER CA C 20 57.400 57.400 59.275 -1.875 17919 72856 1 178 . 1 1 20 20 SER CB C 20 63.370 63.370 63.207 0.163 17919 72857 1 178 . 1 1 20 20 SER H H 20 7.040 7.040 8.015 -0.975 17919 72858 1 178 . 1 1 21 21 ASP N N 21 123.480 123.480 123.524 -0.044 17919 72859 1 178 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.691 0.004 17919 72860 1 178 . 1 1 21 21 ASP C C 21 176.360 176.360 176.112 0.248 17919 72861 1 178 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.244 0.456 17919 72862 1 178 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.271 -0.471 17919 72863 1 178 . 1 1 21 21 ASP H H 21 8.030 8.030 8.019 0.011 17919 72864 1 178 . 1 1 22 22 THR N N 22 108.800 108.800 112.459 -3.659 17919 72865 1 178 . 1 1 22 22 THR HA H 22 4.920 4.920 4.797 0.123 17919 72866 1 178 . 1 1 22 22 THR C C 22 176.750 176.750 176.128 0.622 17919 72867 1 178 . 1 1 22 22 THR CA C 22 59.690 59.690 61.007 -1.317 17919 72868 1 178 . 1 1 22 22 THR CB C 22 71.200 71.200 70.882 0.318 17919 72869 1 178 . 1 1 22 22 THR H H 22 7.900 7.900 8.073 -0.173 17919 72870 1 178 . 1 1 23 23 ILE N N 23 121.190 121.190 122.019 -0.829 17919 72871 1 178 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.824 -0.167 17919 72872 1 178 . 1 1 23 23 ILE C C 23 179.040 179.040 177.708 1.332 17919 72873 1 178 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.212 0.048 17919 72874 1 178 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.102 -1.752 17919 72875 1 178 . 1 1 23 23 ILE H H 23 8.560 8.560 8.937 -0.377 17919 72876 1 178 . 1 1 24 24 GLU N N 24 120.830 120.830 122.342 -1.512 17919 72877 1 178 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.902 0.015 17919 72878 1 178 . 1 1 24 24 GLU C C 24 178.640 178.640 178.742 -0.102 17919 72879 1 178 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.022 0.198 17919 72880 1 178 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.456 -1.176 17919 72881 1 178 . 1 1 24 24 GLU H H 24 9.760 9.760 8.378 1.382 17919 72882 1 178 . 1 1 25 25 ASN N N 25 120.570 120.570 118.050 2.520 17919 72883 1 178 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.430 0.095 17919 72884 1 178 . 1 1 25 25 ASN C C 25 178.380 178.380 177.897 0.483 17919 72885 1 178 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.274 -0.214 17919 72886 1 178 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.606 -0.156 17919 72887 1 178 . 1 1 25 25 ASN H H 25 7.920 7.920 7.891 0.029 17919 72888 1 178 . 1 1 26 26 VAL N N 26 121.710 121.710 120.431 1.279 17919 72889 1 178 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.604 -0.207 17919 72890 1 178 . 1 1 26 26 VAL C C 26 177.950 177.950 177.745 0.205 17919 72891 1 178 . 1 1 26 26 VAL CA C 26 67.660 67.660 67.084 0.576 17919 72892 1 178 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.773 -0.932 17919 72893 1 178 . 1 1 26 26 VAL H H 26 8.070 8.070 8.241 -0.171 17919 72894 1 178 . 1 1 27 27 LYS N N 27 118.860 118.860 120.325 -1.465 17919 72895 1 178 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.143 0.437 17919 72896 1 178 . 1 1 27 27 LYS C C 27 180.550 180.550 179.116 1.434 17919 72897 1 178 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.728 -0.478 17919 72898 1 178 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.223 1.507 17919 72899 1 178 . 1 1 27 27 LYS H H 27 8.560 8.560 8.391 0.169 17919 72900 1 178 . 1 1 28 28 ALA N N 28 123.440 123.440 121.939 1.501 17919 72901 1 178 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.022 0.138 17919 72902 1 178 . 1 1 28 28 ALA C C 28 180.300 180.300 178.831 1.469 17919 72903 1 178 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.196 0.174 17919 72904 1 178 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.374 -0.664 17919 72905 1 178 . 1 1 28 28 ALA H H 28 8.060 8.060 8.393 -0.333 17919 72906 1 178 . 1 1 29 29 LYS N N 29 119.940 119.940 119.489 0.451 17919 72907 1 178 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.120 0.087 17919 72908 1 178 . 1 1 29 29 LYS C C 29 180.320 180.320 179.107 1.213 17919 72909 1 178 . 1 1 29 29 LYS CA C 29 59.650 59.650 58.911 0.739 17919 72910 1 178 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.528 0.762 17919 72911 1 178 . 1 1 29 29 LYS H H 29 7.850 7.850 7.778 0.072 17919 72912 1 178 . 1 1 30 30 ILE N N 30 121.080 121.080 120.549 0.531 17919 72913 1 178 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.633 -0.126 17919 72914 1 178 . 1 1 30 30 ILE C C 30 178.310 178.310 177.279 1.031 17919 72915 1 178 . 1 1 30 30 ILE CA C 30 66.150 66.150 64.941 1.209 17919 72916 1 178 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.790 -0.990 17919 72917 1 178 . 1 1 30 30 ILE H H 30 8.280 8.280 8.211 0.069 17919 72918 1 178 . 1 1 31 31 GLN N N 31 123.490 123.490 120.832 2.658 17919 72919 1 178 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.946 -0.117 17919 72920 1 178 . 1 1 31 31 GLN C C 31 178.890 178.890 178.336 0.554 17919 72921 1 178 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.181 0.819 17919 72922 1 178 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.547 -0.827 17919 72923 1 178 . 1 1 31 31 GLN H H 31 8.580 8.580 8.252 0.328 17919 72924 1 178 . 1 1 32 32 ASP N N 32 119.360 119.360 119.699 -0.339 17919 72925 1 178 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.401 -0.047 17919 72926 1 178 . 1 1 32 32 ASP C C 32 177.250 177.250 178.004 -0.754 17919 72927 1 178 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.750 0.440 17919 72928 1 178 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.821 -0.241 17919 72929 1 178 . 1 1 32 32 ASP H H 32 8.010 8.010 8.097 -0.087 17919 72930 1 178 . 1 1 33 33 LYS N N 33 115.130 115.130 116.327 -1.197 17919 72931 1 178 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.394 -0.057 17919 72932 1 178 . 1 1 33 33 LYS C C 33 177.870 177.870 177.615 0.255 17919 72933 1 178 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.610 0.440 17919 72934 1 178 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.853 0.317 17919 72935 1 178 . 1 1 33 33 LYS H H 33 7.430 7.430 7.572 -0.142 17919 72936 1 178 . 1 1 34 34 GLU N N 34 113.870 113.870 115.959 -2.089 17919 72937 1 178 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.448 0.177 17919 72938 1 178 . 1 1 34 34 GLU C C 34 177.840 177.840 177.353 0.487 17919 72939 1 178 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.171 -1.001 17919 72940 1 178 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.644 1.016 17919 72941 1 178 . 1 1 34 34 GLU H H 34 8.740 8.740 8.109 0.631 17919 72942 1 178 . 1 1 35 35 GLY N N 35 108.650 108.650 109.701 -1.051 17919 72943 1 178 . 1 1 35 35 GLY C C 35 173.960 173.960 174.226 -0.266 17919 72944 1 178 . 1 1 35 35 GLY CA C 35 46.080 46.080 46.064 0.016 17919 72945 1 178 . 1 1 35 35 GLY H H 35 8.530 8.530 8.263 0.267 17919 72946 1 178 . 1 1 36 36 ILE N N 36 119.880 119.880 121.771 -1.891 17919 72947 1 178 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.436 0.009 17919 72948 1 178 . 1 1 36 36 ILE C C 36 173.590 173.590 174.496 -0.906 17919 72949 1 178 . 1 1 36 36 ILE CA C 36 57.750 57.750 56.272 1.478 17919 72950 1 178 . 1 1 36 36 ILE CB C 36 40.580 40.580 37.327 3.253 17919 72951 1 178 . 1 1 36 36 ILE H H 36 6.150 6.150 7.631 -1.481 17919 72952 1 178 . 1 1 37 37 PRO HA H 37 4.634 4.634 5.035 -0.401 17919 72953 1 178 . 1 1 37 37 PRO C C 37 176.940 176.940 176.458 0.482 17919 72954 1 178 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.219 0.441 17919 72955 1 178 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.442 0.408 17919 72956 1 178 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.197 -0.080 17919 72957 1 178 . 1 1 38 38 PRO C C 38 178.320 178.320 178.187 0.133 17919 72958 1 178 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.491 0.769 17919 72959 1 178 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.730 1.160 17919 72960 1 178 . 1 1 39 39 ASP N N 39 113.380 113.380 115.817 -2.437 17919 72961 1 178 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.311 0.119 17919 72962 1 178 . 1 1 39 39 ASP C C 39 177.090 177.090 177.350 -0.260 17919 72963 1 178 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.698 -1.058 17919 72964 1 178 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.428 -0.888 17919 72965 1 178 . 1 1 39 39 ASP H H 39 8.550 8.550 8.776 -0.226 17919 72966 1 178 . 1 1 40 40 GLN N N 40 116.780 116.780 116.425 0.355 17919 72967 1 178 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.273 0.191 17919 72968 1 178 . 1 1 40 40 GLN C C 40 175.380 175.380 176.745 -1.365 17919 72969 1 178 . 1 1 40 40 GLN CA C 40 55.640 55.640 57.553 -1.913 17919 72970 1 178 . 1 1 40 40 GLN CB C 40 30.140 30.140 30.285 -0.145 17919 72971 1 178 . 1 1 40 40 GLN H H 40 7.820 7.820 7.698 0.122 17919 72972 1 178 . 1 1 41 41 GLN N N 41 117.720 117.720 118.796 -1.076 17919 72973 1 178 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.464 -0.220 17919 72974 1 178 . 1 1 41 41 GLN C C 41 176.300 176.300 175.875 0.425 17919 72975 1 178 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.796 -0.326 17919 72976 1 178 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.024 2.626 17919 72977 1 178 . 1 1 41 41 GLN H H 41 7.480 7.480 7.296 0.184 17919 72978 1 178 . 1 1 42 42 ARG N N 42 122.680 122.680 124.025 -1.345 17919 72979 1 178 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.632 -0.132 17919 72980 1 178 . 1 1 42 42 ARG C C 42 174.050 174.050 174.417 -0.367 17919 72981 1 178 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.901 0.149 17919 72982 1 178 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.121 -1.371 17919 72983 1 178 . 1 1 42 42 ARG H H 42 8.530 8.530 9.050 -0.520 17919 72984 1 178 . 1 1 43 43 LEU N N 43 124.040 124.040 125.966 -1.926 17919 72985 1 178 . 1 1 43 43 LEU C C 43 175.290 175.290 175.498 -0.208 17919 72986 1 178 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.842 -0.862 17919 72987 1 178 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.849 1.941 17919 72988 1 178 . 1 1 43 43 LEU H H 43 8.820 8.820 8.899 -0.079 17919 72989 1 178 . 1 1 44 44 ILE N N 44 121.920 121.920 122.859 -0.939 17919 72990 1 178 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.088 -0.096 17919 72991 1 178 . 1 1 44 44 ILE C C 44 176.060 176.060 174.489 1.571 17919 72992 1 178 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.074 -0.094 17919 72993 1 178 . 1 1 44 44 ILE CB C 44 41.420 41.420 39.484 1.936 17919 72994 1 178 . 1 1 44 44 ILE H H 44 9.030 9.030 9.049 -0.019 17919 72995 1 178 . 1 1 45 45 PHE N N 45 125.390 125.390 127.926 -2.536 17919 72996 1 178 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.990 0.055 17919 72997 1 178 . 1 1 45 45 PHE C C 45 174.470 174.470 174.269 0.201 17919 72998 1 178 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.400 0.620 17919 72999 1 178 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.821 0.939 17919 73000 1 178 . 1 1 45 45 PHE H H 45 8.830 8.830 8.998 -0.168 17919 73001 1 178 . 1 1 46 46 ALA N N 46 132.200 132.200 130.656 1.544 17919 73002 1 178 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.743 -0.053 17919 73003 1 178 . 1 1 46 46 ALA C C 46 177.290 177.290 177.379 -0.089 17919 73004 1 178 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.460 0.080 17919 73005 1 178 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.198 0.372 17919 73006 1 178 . 1 1 46 46 ALA H H 46 8.810 8.810 8.716 0.094 17919 73007 1 178 . 1 1 47 47 GLY N N 47 102.340 102.340 104.652 -2.312 17919 73008 1 178 . 1 1 47 47 GLY C C 47 173.810 173.810 174.251 -0.441 17919 73009 1 178 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.467 -0.117 17919 73010 1 178 . 1 1 47 47 GLY H H 47 8.130 8.130 8.556 -0.426 17919 73011 1 178 . 1 1 48 48 LYS N N 48 121.570 121.570 120.399 1.171 17919 73012 1 178 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.565 0.057 17919 73013 1 178 . 1 1 48 48 LYS C C 48 174.700 174.700 175.068 -0.368 17919 73014 1 178 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.812 -0.262 17919 73015 1 178 . 1 1 48 48 LYS CB C 48 34.530 34.530 35.055 -0.525 17919 73016 1 178 . 1 1 48 48 LYS H H 48 7.980 7.980 7.710 0.270 17919 73017 1 178 . 1 1 49 49 GLN N N 49 122.410 122.410 123.667 -1.257 17919 73018 1 178 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.636 -0.076 17919 73019 1 178 . 1 1 49 49 GLN C C 49 175.670 175.670 175.869 -0.199 17919 73020 1 178 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.983 -0.243 17919 73021 1 178 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.201 -0.201 17919 73022 1 178 . 1 1 49 49 GLN H H 49 8.600 8.600 8.567 0.033 17919 73023 1 178 . 1 1 50 50 LEU N N 50 125.520 125.520 128.637 -3.117 17919 73024 1 178 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.462 -0.372 17919 73025 1 178 . 1 1 50 50 LEU C C 50 176.660 176.660 175.893 0.767 17919 73026 1 178 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.961 0.279 17919 73027 1 178 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.257 -0.687 17919 73028 1 178 . 1 1 50 50 LEU H H 50 8.530 8.530 8.544 -0.014 17919 73029 1 178 . 1 1 51 51 GLU N N 51 122.940 122.940 123.476 -0.536 17919 73030 1 178 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.426 0.062 17919 73031 1 178 . 1 1 51 51 GLU C C 51 175.870 175.870 177.154 -1.284 17919 73032 1 178 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.457 0.503 17919 73033 1 178 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.991 -0.421 17919 73034 1 178 . 1 1 51 51 GLU H H 51 8.400 8.400 8.212 0.188 17919 73035 1 178 . 1 1 52 52 ASP N N 52 120.030 120.030 126.864 -6.834 17919 73036 1 178 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.371 -0.012 17919 73037 1 178 . 1 1 52 52 ASP C C 52 177.330 177.330 177.534 -0.204 17919 73038 1 178 . 1 1 52 52 ASP CA C 52 56.960 56.960 58.032 -1.072 17919 73039 1 178 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.681 0.169 17919 73040 1 178 . 1 1 52 52 ASP H H 52 8.160 8.160 8.824 -0.664 17919 73041 1 178 . 1 1 53 53 GLY N N 53 106.660 106.660 103.930 2.730 17919 73042 1 178 . 1 1 53 53 GLY C C 53 174.870 174.870 174.563 0.307 17919 73043 1 178 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.849 0.321 17919 73044 1 178 . 1 1 53 53 GLY H H 53 9.390 9.390 8.525 0.865 17919 73045 1 178 . 1 1 54 54 ARG N N 54 119.050 119.050 119.594 -0.544 17919 73046 1 178 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.590 0.105 17919 73047 1 178 . 1 1 54 54 ARG C C 54 175.350 175.350 174.908 0.442 17919 73048 1 178 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.738 -0.348 17919 73049 1 178 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.027 -0.377 17919 73050 1 178 . 1 1 54 54 ARG H H 54 7.460 7.460 7.360 0.100 17919 73051 1 178 . 1 1 55 55 THR N N 55 108.400 108.400 112.504 -4.104 17919 73052 1 178 . 1 1 55 55 THR HA H 55 5.240 5.240 5.118 0.122 17919 73053 1 178 . 1 1 55 55 THR C C 55 176.560 176.560 176.346 0.214 17919 73054 1 178 . 1 1 55 55 THR CA C 55 59.690 59.690 60.536 -0.846 17919 73055 1 178 . 1 1 55 55 THR CB C 55 72.260 72.260 71.034 1.226 17919 73056 1 178 . 1 1 55 55 THR H H 55 8.730 8.730 8.064 0.666 17919 73057 1 178 . 1 1 56 56 LEU N N 56 117.920 117.920 121.647 -3.727 17919 73058 1 178 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.884 0.176 17919 73059 1 178 . 1 1 56 56 LEU C C 56 180.810 180.810 179.062 1.748 17919 73060 1 178 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.595 0.115 17919 73061 1 178 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.407 -1.038 17919 73062 1 178 . 1 1 56 56 LEU H H 56 8.140 8.140 8.396 -0.256 17919 73063 1 178 . 1 1 57 57 SER N N 57 113.330 113.330 113.890 -0.560 17919 73064 1 178 . 1 1 57 57 SER HA H 57 4.370 4.370 4.148 0.222 17919 73065 1 178 . 1 1 57 57 SER C C 57 178.310 178.310 176.550 1.760 17919 73066 1 178 . 1 1 57 57 SER CA C 57 61.080 61.080 62.276 -1.196 17919 73067 1 178 . 1 1 57 57 SER CB C 57 62.530 62.530 62.631 -0.101 17919 73068 1 178 . 1 1 57 57 SER H H 57 8.470 8.470 8.153 0.317 17919 73069 1 178 . 1 1 58 58 ASP N N 58 124.190 124.190 122.200 1.990 17919 73070 1 178 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.289 0.007 17919 73071 1 178 . 1 1 58 58 ASP C C 58 177.400 177.400 177.505 -0.105 17919 73072 1 178 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.736 0.444 17919 73073 1 178 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.672 -0.572 17919 73074 1 178 . 1 1 58 58 ASP H H 58 7.930 7.930 7.596 0.334 17919 73075 1 178 . 1 1 59 59 TYR N N 59 115.510 115.510 115.506 0.004 17919 73076 1 178 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.577 0.093 17919 73077 1 178 . 1 1 59 59 TYR C C 59 174.700 174.700 174.955 -0.255 17919 73078 1 178 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.971 0.279 17919 73079 1 178 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.050 2.020 17919 73080 1 178 . 1 1 59 59 TYR H H 59 7.250 7.250 7.452 -0.202 17919 73081 1 178 . 1 1 60 60 ASN N N 60 115.900 115.900 117.415 -1.515 17919 73082 1 178 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.424 -0.069 17919 73083 1 178 . 1 1 60 60 ASN C C 60 174.340 174.340 174.634 -0.294 17919 73084 1 178 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.366 -0.246 17919 73085 1 178 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.045 0.365 17919 73086 1 178 . 1 1 60 60 ASN H H 60 8.150 8.150 7.939 0.211 17919 73087 1 178 . 1 1 61 61 ILE N N 61 118.600 118.600 118.938 -0.338 17919 73088 1 178 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.972 -0.579 17919 73089 1 178 . 1 1 61 61 ILE C C 61 174.610 174.610 174.842 -0.232 17919 73090 1 178 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.260 1.160 17919 73091 1 178 . 1 1 61 61 ILE CB C 61 36.740 36.740 38.633 -1.893 17919 73092 1 178 . 1 1 61 61 ILE H H 61 7.250 7.250 7.837 -0.587 17919 73093 1 178 . 1 1 62 62 GLN N N 62 124.740 124.740 123.989 0.751 17919 73094 1 178 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.855 -0.349 17919 73095 1 178 . 1 1 62 62 GLN C C 62 175.970 175.970 175.409 0.561 17919 73096 1 178 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.358 0.302 17919 73097 1 178 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.970 -0.320 17919 73098 1 178 . 1 1 62 62 GLN H H 62 7.610 7.610 8.150 -0.540 17919 73099 1 178 . 1 1 63 63 LYS N N 63 120.300 120.300 121.562 -1.262 17919 73100 1 178 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.112 -0.111 17919 73101 1 178 . 1 1 63 63 LYS C C 63 175.810 175.810 177.005 -1.195 17919 73102 1 178 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.913 -0.123 17919 73103 1 178 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.094 0.556 17919 73104 1 178 . 1 1 63 63 LYS H H 63 8.490 8.490 8.643 -0.153 17919 73105 1 178 . 1 1 64 64 GLU N N 64 113.950 113.950 117.585 -3.635 17919 73106 1 178 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.793 -0.328 17919 73107 1 178 . 1 1 64 64 GLU C C 64 175.250 175.250 175.972 -0.722 17919 73108 1 178 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.894 -0.004 17919 73109 1 178 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.689 -2.789 17919 73110 1 178 . 1 1 64 64 GLU H H 64 9.280 9.280 8.633 0.647 17919 73111 1 178 . 1 1 65 65 SER N N 65 114.730 114.730 116.483 -1.753 17919 73112 1 178 . 1 1 65 65 SER HA H 65 4.640 4.640 4.366 0.274 17919 73113 1 178 . 1 1 65 65 SER C C 65 172.160 172.160 173.941 -1.781 17919 73114 1 178 . 1 1 65 65 SER CA C 65 60.890 60.890 60.515 0.375 17919 73115 1 178 . 1 1 65 65 SER CB C 65 64.910 64.910 63.995 0.915 17919 73116 1 178 . 1 1 65 65 SER H H 65 7.670 7.670 7.309 0.361 17919 73117 1 178 . 1 1 66 66 THR N N 66 117.110 117.110 119.911 -2.801 17919 73118 1 178 . 1 1 66 66 THR HA H 66 5.270 5.270 5.192 0.078 17919 73119 1 178 . 1 1 66 66 THR C C 66 173.950 173.950 173.857 0.093 17919 73120 1 178 . 1 1 66 66 THR CA C 66 62.340 62.340 61.452 0.888 17919 73121 1 178 . 1 1 66 66 THR CB C 66 70.080 70.080 70.903 -0.823 17919 73122 1 178 . 1 1 66 66 THR H H 66 8.730 8.730 8.460 0.270 17919 73123 1 178 . 1 1 67 67 LEU N N 67 127.110 127.110 127.412 -0.302 17919 73124 1 178 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.738 0.322 17919 73125 1 178 . 1 1 67 67 LEU C C 67 175.770 175.770 175.408 0.362 17919 73126 1 178 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.521 0.379 17919 73127 1 178 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.671 -0.411 17919 73128 1 178 . 1 1 67 67 LEU H H 67 9.410 9.410 9.120 0.290 17919 73129 1 178 . 1 1 68 68 HIS N N 68 118.380 118.380 119.630 -1.250 17919 73130 1 178 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.253 -0.013 17919 73131 1 178 . 1 1 68 68 HIS C C 68 173.150 173.150 174.253 -1.103 17919 73132 1 178 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.570 0.430 17919 73133 1 178 . 1 1 68 68 HIS CB C 68 30.530 30.530 30.960 -0.430 17919 73134 1 178 . 1 1 68 68 HIS H H 68 9.230 9.230 8.884 0.346 17919 73135 1 178 . 1 1 69 69 LEU N N 69 124.460 124.460 128.229 -3.769 17919 73136 1 178 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.098 0.092 17919 73137 1 178 . 1 1 69 69 LEU C C 69 175.270 175.270 174.885 0.385 17919 73138 1 178 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.791 0.098 17919 73139 1 178 . 1 1 69 69 LEU CB C 69 44.380 44.380 43.429 0.951 17919 73140 1 178 . 1 1 69 69 LEU H H 69 8.340 8.340 8.536 -0.196 17919 73141 1 178 . 1 1 70 70 VAL N N 70 126.940 126.940 127.603 -0.663 17919 73142 1 178 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.402 -0.052 17919 73143 1 178 . 1 1 70 70 VAL C C 70 174.000 174.000 174.718 -0.718 17919 73144 1 178 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.968 -0.168 17919 73145 1 178 . 1 1 70 70 VAL CB C 70 34.910 34.910 34.331 0.579 17919 73146 1 178 . 1 1 70 70 VAL H H 70 9.200 9.200 9.217 -0.017 17919 73147 1 178 . 1 1 71 71 LEU N N 71 123.130 123.130 125.496 -2.366 17919 73148 1 178 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.654 0.406 17919 73149 1 178 . 1 1 71 71 LEU C C 71 177.830 177.830 176.775 1.055 17919 73150 1 178 . 1 1 71 71 LEU CA C 71 53.940 53.940 54.269 -0.329 17919 73151 1 178 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.512 0.338 17919 73152 1 178 . 1 1 71 71 LEU H H 71 8.120 8.120 8.560 -0.440 17919 73153 1 178 . 1 1 72 72 ARG N N 72 123.490 123.490 124.542 -1.052 17919 73154 1 178 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.391 -0.090 17919 73155 1 178 . 1 1 72 72 ARG C C 72 175.350 175.350 175.749 -0.399 17919 73156 1 178 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.006 -0.396 17919 73157 1 178 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.862 0.488 17919 73158 1 178 . 1 1 72 72 ARG H H 72 8.580 8.580 8.627 -0.047 17919 73159 1 179 . 1 1 2 2 GLN N N 2 123.220 123.220 121.690 1.530 17919 73160 1 179 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.235 0.014 17919 73161 1 179 . 1 1 2 2 GLN C C 2 175.920 175.920 175.239 0.681 17919 73162 1 179 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.888 0.193 17919 73163 1 179 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.397 0.363 17919 73164 1 179 . 1 1 2 2 GLN H H 2 8.900 8.900 8.355 0.545 17919 73165 1 179 . 1 1 3 3 ILE N N 3 115.340 115.340 118.797 -3.457 17919 73166 1 179 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.354 -0.141 17919 73167 1 179 . 1 1 3 3 ILE C C 3 172.450 172.450 173.319 -0.869 17919 73168 1 179 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.476 0.094 17919 73169 1 179 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.987 0.223 17919 73170 1 179 . 1 1 3 3 ILE H H 3 8.320 8.320 8.098 0.222 17919 73171 1 179 . 1 1 4 4 PHE N N 4 118.110 118.110 121.487 -3.377 17919 73172 1 179 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.375 0.255 17919 73173 1 179 . 1 1 4 4 PHE C C 4 175.320 175.320 174.794 0.526 17919 73174 1 179 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.523 -0.313 17919 73175 1 179 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.190 0.290 17919 73176 1 179 . 1 1 4 4 PHE H H 4 8.610 8.610 8.373 0.237 17919 73177 1 179 . 1 1 5 5 VAL N N 5 121.000 121.000 123.577 -2.577 17919 73178 1 179 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.813 -0.088 17919 73179 1 179 . 1 1 5 5 VAL C C 5 174.870 174.870 174.426 0.444 17919 73180 1 179 . 1 1 5 5 VAL CA C 5 60.620 60.620 60.444 0.176 17919 73181 1 179 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.373 -0.143 17919 73182 1 179 . 1 1 5 5 VAL H H 5 9.300 9.300 9.278 0.022 17919 73183 1 179 . 1 1 6 6 LYS N N 6 127.520 127.520 129.155 -1.635 17919 73184 1 179 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.297 0.070 17919 73185 1 179 . 1 1 6 6 LYS C C 6 177.140 177.140 176.817 0.323 17919 73186 1 179 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.780 -0.260 17919 73187 1 179 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.398 -0.348 17919 73188 1 179 . 1 1 6 6 LYS H H 6 8.820 8.820 9.347 -0.527 17919 73189 1 179 . 1 1 7 7 THR N N 7 115.400 115.400 117.517 -2.117 17919 73190 1 179 . 1 1 7 7 THR HA H 7 4.970 4.970 5.064 -0.094 17919 73191 1 179 . 1 1 7 7 THR C C 7 176.910 176.910 176.655 0.255 17919 73192 1 179 . 1 1 7 7 THR CA C 7 60.470 60.470 60.345 0.125 17919 73193 1 179 . 1 1 7 7 THR CB C 7 70.630 70.630 71.013 -0.383 17919 73194 1 179 . 1 1 7 7 THR H H 7 8.730 8.730 8.792 -0.062 17919 73195 1 179 . 1 1 8 8 LEU N N 8 121.330 121.330 120.186 1.144 17919 73196 1 179 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.437 -0.127 17919 73197 1 179 . 1 1 8 8 LEU C C 8 178.800 178.800 178.299 0.501 17919 73198 1 179 . 1 1 8 8 LEU CA C 8 57.580 57.580 56.832 0.748 17919 73199 1 179 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.649 0.321 17919 73200 1 179 . 1 1 8 8 LEU H H 8 9.100 9.100 8.772 0.328 17919 73201 1 179 . 1 1 9 9 THR N N 9 105.590 105.590 109.840 -4.250 17919 73202 1 179 . 1 1 9 9 THR HA H 9 4.428 4.428 4.323 0.105 17919 73203 1 179 . 1 1 9 9 THR C C 9 175.520 175.520 175.736 -0.216 17919 73204 1 179 . 1 1 9 9 THR CA C 9 61.400 61.400 62.028 -0.627 17919 73205 1 179 . 1 1 9 9 THR CB C 9 69.140 69.140 69.398 -0.258 17919 73206 1 179 . 1 1 9 9 THR H H 9 7.630 7.630 7.683 -0.053 17919 73207 1 179 . 1 1 10 10 GLY N N 10 108.890 108.890 111.213 -2.323 17919 73208 1 179 . 1 1 10 10 GLY C C 10 174.070 174.070 173.724 0.346 17919 73209 1 179 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.102 0.358 17919 73210 1 179 . 1 1 10 10 GLY H H 10 7.810 7.810 7.755 0.055 17919 73211 1 179 . 1 1 11 11 LYS N N 11 121.600 121.600 120.321 1.279 17919 73212 1 179 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.496 -0.135 17919 73213 1 179 . 1 1 11 11 LYS C C 11 175.940 175.940 175.630 0.310 17919 73214 1 179 . 1 1 11 11 LYS CA C 11 56.280 56.280 55.683 0.597 17919 73215 1 179 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.694 -0.494 17919 73216 1 179 . 1 1 11 11 LYS H H 11 7.280 7.280 7.822 -0.542 17919 73217 1 179 . 1 1 12 12 THR N N 12 120.440 120.440 118.904 1.536 17919 73218 1 179 . 1 1 12 12 THR HA H 12 5.046 5.046 5.299 -0.253 17919 73219 1 179 . 1 1 12 12 THR C C 12 174.320 174.320 174.264 0.056 17919 73220 1 179 . 1 1 12 12 THR CA C 12 62.390 62.390 61.416 0.974 17919 73221 1 179 . 1 1 12 12 THR CB C 12 69.910 69.910 70.049 -0.139 17919 73222 1 179 . 1 1 12 12 THR H H 12 8.650 8.650 8.324 0.326 17919 73223 1 179 . 1 1 13 13 ILE N N 13 127.110 127.110 128.335 -1.225 17919 73224 1 179 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.491 0.053 17919 73225 1 179 . 1 1 13 13 ILE C C 13 175.220 175.220 175.312 -0.092 17919 73226 1 179 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.368 -0.388 17919 73227 1 179 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.454 0.496 17919 73228 1 179 . 1 1 13 13 ILE H H 13 9.450 9.450 9.070 0.380 17919 73229 1 179 . 1 1 14 14 THR N N 14 121.520 121.520 120.049 1.471 17919 73230 1 179 . 1 1 14 14 THR HA H 14 4.964 4.964 4.970 -0.006 17919 73231 1 179 . 1 1 14 14 THR C C 14 173.790 173.790 173.892 -0.102 17919 73232 1 179 . 1 1 14 14 THR CA C 14 61.940 61.940 61.025 0.915 17919 73233 1 179 . 1 1 14 14 THR CB C 14 69.650 69.650 69.849 -0.199 17919 73234 1 179 . 1 1 14 14 THR H H 14 8.710 8.710 8.477 0.233 17919 73235 1 179 . 1 1 15 15 LEU N N 15 124.800 124.800 126.742 -1.942 17919 73236 1 179 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.739 0.041 17919 73237 1 179 . 1 1 15 15 LEU C C 15 174.670 174.670 175.644 -0.974 17919 73238 1 179 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.553 -0.723 17919 73239 1 179 . 1 1 15 15 LEU CB C 15 47.070 47.070 46.570 0.500 17919 73240 1 179 . 1 1 15 15 LEU H H 15 8.710 8.710 8.878 -0.168 17919 73241 1 179 . 1 1 16 16 GLU N N 16 122.160 122.160 122.270 -0.110 17919 73242 1 179 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.267 -0.350 17919 73243 1 179 . 1 1 16 16 GLU C C 16 175.860 175.860 176.155 -0.295 17919 73244 1 179 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.246 -0.426 17919 73245 1 179 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.472 -1.022 17919 73246 1 179 . 1 1 16 16 GLU H H 16 8.140 8.140 8.654 -0.514 17919 73247 1 179 . 1 1 17 17 VAL N N 17 117.210 117.210 118.636 -1.426 17919 73248 1 179 . 1 1 17 17 VAL HA H 17 4.714 4.714 5.014 -0.300 17919 73249 1 179 . 1 1 17 17 VAL C C 17 174.160 174.160 174.723 -0.563 17919 73250 1 179 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.064 -0.634 17919 73251 1 179 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.720 0.680 17919 73252 1 179 . 1 1 17 17 VAL H H 17 8.900 8.900 8.691 0.209 17919 73253 1 179 . 1 1 18 18 GLU N N 18 118.990 118.990 121.320 -2.330 17919 73254 1 179 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.797 0.282 17919 73255 1 179 . 1 1 18 18 GLU C C 18 176.160 176.160 174.914 1.246 17919 73256 1 179 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.776 -0.056 17919 73257 1 179 . 1 1 18 18 GLU CB C 18 30.310 30.310 31.233 -0.923 17919 73258 1 179 . 1 1 18 18 GLU H H 18 8.640 8.640 9.230 -0.590 17919 73259 1 179 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.314 -0.173 17919 73260 1 179 . 1 1 19 19 PRO C C 19 175.310 175.310 177.540 -2.230 17919 73261 1 179 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.303 0.167 17919 73262 1 179 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.017 -0.067 17919 73263 1 179 . 1 1 20 20 SER N N 20 103.400 103.400 110.294 -6.894 17919 73264 1 179 . 1 1 20 20 SER HA H 20 4.370 4.370 4.328 0.042 17919 73265 1 179 . 1 1 20 20 SER C C 20 174.660 174.660 173.955 0.705 17919 73266 1 179 . 1 1 20 20 SER CA C 20 57.400 57.400 59.477 -2.077 17919 73267 1 179 . 1 1 20 20 SER CB C 20 63.370 63.370 62.802 0.568 17919 73268 1 179 . 1 1 20 20 SER H H 20 7.040 7.040 8.013 -0.973 17919 73269 1 179 . 1 1 21 21 ASP N N 21 123.480 123.480 122.419 1.061 17919 73270 1 179 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.819 -0.124 17919 73271 1 179 . 1 1 21 21 ASP C C 21 176.360 176.360 175.564 0.796 17919 73272 1 179 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.858 0.842 17919 73273 1 179 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.833 -1.033 17919 73274 1 179 . 1 1 21 21 ASP H H 21 8.030 8.030 7.714 0.316 17919 73275 1 179 . 1 1 22 22 THR N N 22 108.800 108.800 112.378 -3.578 17919 73276 1 179 . 1 1 22 22 THR HA H 22 4.920 4.920 4.856 0.064 17919 73277 1 179 . 1 1 22 22 THR C C 22 176.750 176.750 175.995 0.755 17919 73278 1 179 . 1 1 22 22 THR CA C 22 59.690 59.690 61.092 -1.401 17919 73279 1 179 . 1 1 22 22 THR CB C 22 71.200 71.200 70.553 0.647 17919 73280 1 179 . 1 1 22 22 THR H H 22 7.900 7.900 8.254 -0.354 17919 73281 1 179 . 1 1 23 23 ILE N N 23 121.190 121.190 122.846 -1.656 17919 73282 1 179 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.851 -0.194 17919 73283 1 179 . 1 1 23 23 ILE C C 23 179.040 179.040 177.633 1.407 17919 73284 1 179 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.754 -0.494 17919 73285 1 179 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.526 -2.176 17919 73286 1 179 . 1 1 23 23 ILE H H 23 8.560 8.560 8.968 -0.408 17919 73287 1 179 . 1 1 24 24 GLU N N 24 120.830 120.830 121.204 -0.374 17919 73288 1 179 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.883 0.034 17919 73289 1 179 . 1 1 24 24 GLU C C 24 178.640 178.640 178.588 0.052 17919 73290 1 179 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.075 0.145 17919 73291 1 179 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.303 -1.023 17919 73292 1 179 . 1 1 24 24 GLU H H 24 9.760 9.760 8.715 1.045 17919 73293 1 179 . 1 1 25 25 ASN N N 25 120.570 120.570 117.221 3.349 17919 73294 1 179 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.489 0.036 17919 73295 1 179 . 1 1 25 25 ASN C C 25 178.380 178.380 178.030 0.350 17919 73296 1 179 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.947 0.113 17919 73297 1 179 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.754 -0.304 17919 73298 1 179 . 1 1 25 25 ASN H H 25 7.920 7.920 7.794 0.126 17919 73299 1 179 . 1 1 26 26 VAL N N 26 121.710 121.710 121.170 0.540 17919 73300 1 179 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.569 -0.172 17919 73301 1 179 . 1 1 26 26 VAL C C 26 177.950 177.950 177.525 0.425 17919 73302 1 179 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.579 1.081 17919 73303 1 179 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.782 -0.942 17919 73304 1 179 . 1 1 26 26 VAL H H 26 8.070 8.070 8.020 0.050 17919 73305 1 179 . 1 1 27 27 LYS N N 27 118.860 118.860 120.195 -1.335 17919 73306 1 179 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.154 0.426 17919 73307 1 179 . 1 1 27 27 LYS C C 27 180.550 180.550 178.971 1.579 17919 73308 1 179 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.782 -0.532 17919 73309 1 179 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.292 1.438 17919 73310 1 179 . 1 1 27 27 LYS H H 27 8.560 8.560 8.453 0.107 17919 73311 1 179 . 1 1 28 28 ALA N N 28 123.440 123.440 121.099 2.341 17919 73312 1 179 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.191 -0.031 17919 73313 1 179 . 1 1 28 28 ALA C C 28 180.300 180.300 179.265 1.035 17919 73314 1 179 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.769 0.601 17919 73315 1 179 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.506 -0.796 17919 73316 1 179 . 1 1 28 28 ALA H H 28 8.060 8.060 8.317 -0.257 17919 73317 1 179 . 1 1 29 29 LYS N N 29 119.940 119.940 119.289 0.651 17919 73318 1 179 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.128 0.079 17919 73319 1 179 . 1 1 29 29 LYS C C 29 180.320 180.320 178.902 1.418 17919 73320 1 179 . 1 1 29 29 LYS CA C 29 59.650 59.650 58.909 0.741 17919 73321 1 179 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.345 0.945 17919 73322 1 179 . 1 1 29 29 LYS H H 29 7.850 7.850 7.582 0.268 17919 73323 1 179 . 1 1 30 30 ILE N N 30 121.080 121.080 121.662 -0.582 17919 73324 1 179 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.611 -0.104 17919 73325 1 179 . 1 1 30 30 ILE C C 30 178.310 178.310 177.324 0.986 17919 73326 1 179 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.545 0.605 17919 73327 1 179 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.771 -0.971 17919 73328 1 179 . 1 1 30 30 ILE H H 30 8.280 8.280 8.368 -0.088 17919 73329 1 179 . 1 1 31 31 GLN N N 31 123.490 123.490 120.888 2.602 17919 73330 1 179 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.037 -0.208 17919 73331 1 179 . 1 1 31 31 GLN C C 31 178.890 178.890 177.969 0.921 17919 73332 1 179 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.113 0.887 17919 73333 1 179 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.631 -0.911 17919 73334 1 179 . 1 1 31 31 GLN H H 31 8.580 8.580 8.166 0.414 17919 73335 1 179 . 1 1 32 32 ASP N N 32 119.360 119.360 118.027 1.333 17919 73336 1 179 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.418 -0.064 17919 73337 1 179 . 1 1 32 32 ASP C C 32 177.250 177.250 178.266 -1.016 17919 73338 1 179 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.593 0.597 17919 73339 1 179 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.953 -0.373 17919 73340 1 179 . 1 1 32 32 ASP H H 32 8.010 8.010 7.889 0.121 17919 73341 1 179 . 1 1 33 33 LYS N N 33 115.130 115.130 118.734 -3.604 17919 73342 1 179 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.221 0.116 17919 73343 1 179 . 1 1 33 33 LYS C C 33 177.870 177.870 177.799 0.071 17919 73344 1 179 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.137 -0.087 17919 73345 1 179 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.318 0.852 17919 73346 1 179 . 1 1 33 33 LYS H H 33 7.430 7.430 7.607 -0.177 17919 73347 1 179 . 1 1 34 34 GLU N N 34 113.870 113.870 115.398 -1.528 17919 73348 1 179 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.460 0.165 17919 73349 1 179 . 1 1 34 34 GLU C C 34 177.840 177.840 176.861 0.979 17919 73350 1 179 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.404 -0.234 17919 73351 1 179 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.806 0.854 17919 73352 1 179 . 1 1 34 34 GLU H H 34 8.740 8.740 7.966 0.774 17919 73353 1 179 . 1 1 35 35 GLY N N 35 108.650 108.650 107.461 1.189 17919 73354 1 179 . 1 1 35 35 GLY C C 35 173.960 173.960 174.501 -0.541 17919 73355 1 179 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.619 0.461 17919 73356 1 179 . 1 1 35 35 GLY H H 35 8.530 8.530 7.824 0.706 17919 73357 1 179 . 1 1 36 36 ILE N N 36 119.880 119.880 122.793 -2.913 17919 73358 1 179 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.379 0.066 17919 73359 1 179 . 1 1 36 36 ILE C C 36 173.590 173.590 174.433 -0.843 17919 73360 1 179 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.131 -0.381 17919 73361 1 179 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.757 1.823 17919 73362 1 179 . 1 1 36 36 ILE H H 36 6.150 6.150 7.566 -1.416 17919 73363 1 179 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.665 -0.031 17919 73364 1 179 . 1 1 37 37 PRO C C 37 176.940 176.940 175.845 1.095 17919 73365 1 179 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.320 0.340 17919 73366 1 179 . 1 1 37 37 PRO CB C 37 31.850 31.850 30.942 0.908 17919 73367 1 179 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.170 -0.053 17919 73368 1 179 . 1 1 38 38 PRO C C 38 178.320 178.320 178.529 -0.209 17919 73369 1 179 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.904 0.356 17919 73370 1 179 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.948 0.942 17919 73371 1 179 . 1 1 39 39 ASP N N 39 113.380 113.380 115.791 -2.411 17919 73372 1 179 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.373 0.057 17919 73373 1 179 . 1 1 39 39 ASP C C 39 177.090 177.090 177.958 -0.868 17919 73374 1 179 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.976 -1.336 17919 73375 1 179 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.453 -0.913 17919 73376 1 179 . 1 1 39 39 ASP H H 39 8.550 8.550 8.660 -0.110 17919 73377 1 179 . 1 1 40 40 GLN N N 40 116.780 116.780 118.524 -1.744 17919 73378 1 179 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.184 0.280 17919 73379 1 179 . 1 1 40 40 GLN C C 40 175.380 175.380 176.775 -1.395 17919 73380 1 179 . 1 1 40 40 GLN CA C 40 55.640 55.640 57.419 -1.779 17919 73381 1 179 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.605 0.535 17919 73382 1 179 . 1 1 40 40 GLN H H 40 7.820 7.820 7.804 0.016 17919 73383 1 179 . 1 1 41 41 GLN N N 41 117.720 117.720 120.330 -2.610 17919 73384 1 179 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.031 0.213 17919 73385 1 179 . 1 1 41 41 GLN C C 41 176.300 176.300 175.125 1.175 17919 73386 1 179 . 1 1 41 41 GLN CA C 41 56.470 56.470 57.396 -0.926 17919 73387 1 179 . 1 1 41 41 GLN CB C 41 31.650 31.650 28.598 3.052 17919 73388 1 179 . 1 1 41 41 GLN H H 41 7.480 7.480 7.645 -0.165 17919 73389 1 179 . 1 1 42 42 ARG N N 42 122.680 122.680 125.781 -3.101 17919 73390 1 179 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.602 -0.102 17919 73391 1 179 . 1 1 42 42 ARG C C 42 174.050 174.050 173.996 0.054 17919 73392 1 179 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.673 0.377 17919 73393 1 179 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.725 -0.975 17919 73394 1 179 . 1 1 42 42 ARG H H 42 8.530 8.530 8.733 -0.203 17919 73395 1 179 . 1 1 43 43 LEU N N 43 124.040 124.040 127.596 -3.556 17919 73396 1 179 . 1 1 43 43 LEU C C 43 175.290 175.290 175.463 -0.173 17919 73397 1 179 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.603 -0.623 17919 73398 1 179 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.110 1.680 17919 73399 1 179 . 1 1 43 43 LEU H H 43 8.820 8.820 8.816 0.004 17919 73400 1 179 . 1 1 44 44 ILE N N 44 121.920 121.920 123.339 -1.419 17919 73401 1 179 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.047 -0.055 17919 73402 1 179 . 1 1 44 44 ILE C C 44 176.060 176.060 174.238 1.822 17919 73403 1 179 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.918 -0.938 17919 73404 1 179 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.940 -0.520 17919 73405 1 179 . 1 1 44 44 ILE H H 44 9.030 9.030 8.763 0.267 17919 73406 1 179 . 1 1 45 45 PHE N N 45 125.390 125.390 126.370 -0.980 17919 73407 1 179 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.013 0.032 17919 73408 1 179 . 1 1 45 45 PHE C C 45 174.470 174.470 174.368 0.102 17919 73409 1 179 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.118 0.902 17919 73410 1 179 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.113 0.647 17919 73411 1 179 . 1 1 45 45 PHE H H 45 8.830 8.830 8.702 0.128 17919 73412 1 179 . 1 1 46 46 ALA N N 46 132.200 132.200 130.043 2.157 17919 73413 1 179 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.658 0.032 17919 73414 1 179 . 1 1 46 46 ALA C C 46 177.290 177.290 177.566 -0.276 17919 73415 1 179 . 1 1 46 46 ALA CA C 46 52.540 52.540 53.189 -0.649 17919 73416 1 179 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.580 -0.010 17919 73417 1 179 . 1 1 46 46 ALA H H 46 8.810 8.810 8.839 -0.029 17919 73418 1 179 . 1 1 47 47 GLY N N 47 102.340 102.340 104.175 -1.835 17919 73419 1 179 . 1 1 47 47 GLY C C 47 173.810 173.810 174.455 -0.645 17919 73420 1 179 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.210 0.140 17919 73421 1 179 . 1 1 47 47 GLY H H 47 8.130 8.130 8.384 -0.254 17919 73422 1 179 . 1 1 48 48 LYS N N 48 121.570 121.570 122.137 -0.567 17919 73423 1 179 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.510 0.112 17919 73424 1 179 . 1 1 48 48 LYS C C 48 174.700 174.700 175.581 -0.881 17919 73425 1 179 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.307 -0.757 17919 73426 1 179 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.081 0.449 17919 73427 1 179 . 1 1 48 48 LYS H H 48 7.980 7.980 8.079 -0.099 17919 73428 1 179 . 1 1 49 49 GLN N N 49 122.410 122.410 126.024 -3.614 17919 73429 1 179 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.568 -0.008 17919 73430 1 179 . 1 1 49 49 GLN C C 49 175.670 175.670 175.633 0.037 17919 73431 1 179 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.065 -0.325 17919 73432 1 179 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.241 -0.241 17919 73433 1 179 . 1 1 49 49 GLN H H 49 8.600 8.600 8.602 -0.002 17919 73434 1 179 . 1 1 50 50 LEU N N 50 125.520 125.520 129.263 -3.743 17919 73435 1 179 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.092 -0.002 17919 73436 1 179 . 1 1 50 50 LEU C C 50 176.660 176.660 176.268 0.392 17919 73437 1 179 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.466 -0.226 17919 73438 1 179 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.886 -0.316 17919 73439 1 179 . 1 1 50 50 LEU H H 50 8.530 8.530 8.538 -0.008 17919 73440 1 179 . 1 1 51 51 GLU N N 51 122.940 122.940 123.593 -0.653 17919 73441 1 179 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.617 -0.129 17919 73442 1 179 . 1 1 51 51 GLU C C 51 175.870 175.870 176.548 -0.678 17919 73443 1 179 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.175 0.785 17919 73444 1 179 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.809 -1.239 17919 73445 1 179 . 1 1 51 51 GLU H H 51 8.400 8.400 8.520 -0.120 17919 73446 1 179 . 1 1 52 52 ASP N N 52 120.030 120.030 123.570 -3.540 17919 73447 1 179 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.553 -0.194 17919 73448 1 179 . 1 1 52 52 ASP C C 52 177.330 177.330 177.215 0.115 17919 73449 1 179 . 1 1 52 52 ASP CA C 52 56.960 56.960 56.593 0.367 17919 73450 1 179 . 1 1 52 52 ASP CB C 52 40.850 40.850 41.076 -0.226 17919 73451 1 179 . 1 1 52 52 ASP H H 52 8.160 8.160 8.854 -0.694 17919 73452 1 179 . 1 1 53 53 GLY N N 53 106.660 106.660 105.610 1.050 17919 73453 1 179 . 1 1 53 53 GLY C C 53 174.870 174.870 174.017 0.853 17919 73454 1 179 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.675 0.494 17919 73455 1 179 . 1 1 53 53 GLY H H 53 9.390 9.390 8.448 0.942 17919 73456 1 179 . 1 1 54 54 ARG N N 54 119.050 119.050 121.446 -2.396 17919 73457 1 179 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.776 -0.081 17919 73458 1 179 . 1 1 54 54 ARG C C 54 175.350 175.350 175.513 -0.163 17919 73459 1 179 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.504 -0.114 17919 73460 1 179 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.954 -0.304 17919 73461 1 179 . 1 1 54 54 ARG H H 54 7.460 7.460 7.540 -0.080 17919 73462 1 179 . 1 1 55 55 THR N N 55 108.400 108.400 112.120 -3.720 17919 73463 1 179 . 1 1 55 55 THR HA H 55 5.240 5.240 5.191 0.049 17919 73464 1 179 . 1 1 55 55 THR C C 55 176.560 176.560 176.020 0.540 17919 73465 1 179 . 1 1 55 55 THR CA C 55 59.690 59.690 59.707 -0.017 17919 73466 1 179 . 1 1 55 55 THR CB C 55 72.260 72.260 71.634 0.626 17919 73467 1 179 . 1 1 55 55 THR H H 55 8.730 8.730 9.209 -0.479 17919 73468 1 179 . 1 1 56 56 LEU N N 56 117.920 117.920 120.812 -2.892 17919 73469 1 179 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.999 0.061 17919 73470 1 179 . 1 1 56 56 LEU C C 56 180.810 180.810 179.114 1.696 17919 73471 1 179 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.412 0.298 17919 73472 1 179 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.423 -1.053 17919 73473 1 179 . 1 1 56 56 LEU H H 56 8.140 8.140 8.758 -0.618 17919 73474 1 179 . 1 1 57 57 SER N N 57 113.330 113.330 114.464 -1.134 17919 73475 1 179 . 1 1 57 57 SER HA H 57 4.370 4.370 4.211 0.159 17919 73476 1 179 . 1 1 57 57 SER C C 57 178.310 178.310 176.574 1.736 17919 73477 1 179 . 1 1 57 57 SER CA C 57 61.080 61.080 61.533 -0.453 17919 73478 1 179 . 1 1 57 57 SER CB C 57 62.530 62.530 62.351 0.179 17919 73479 1 179 . 1 1 57 57 SER H H 57 8.470 8.470 8.518 -0.048 17919 73480 1 179 . 1 1 58 58 ASP N N 58 124.190 124.190 122.752 1.438 17919 73481 1 179 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.376 -0.080 17919 73482 1 179 . 1 1 58 58 ASP C C 58 177.400 177.400 177.162 0.238 17919 73483 1 179 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.479 0.701 17919 73484 1 179 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.522 -0.422 17919 73485 1 179 . 1 1 58 58 ASP H H 58 7.930 7.930 7.578 0.352 17919 73486 1 179 . 1 1 59 59 TYR N N 59 115.510 115.510 116.536 -1.026 17919 73487 1 179 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.587 0.083 17919 73488 1 179 . 1 1 59 59 TYR C C 59 174.700 174.700 174.940 -0.240 17919 73489 1 179 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.632 0.618 17919 73490 1 179 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.544 1.526 17919 73491 1 179 . 1 1 59 59 TYR H H 59 7.250 7.250 7.522 -0.272 17919 73492 1 179 . 1 1 60 60 ASN N N 60 115.900 115.900 116.510 -0.610 17919 73493 1 179 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.395 -0.040 17919 73494 1 179 . 1 1 60 60 ASN C C 60 174.340 174.340 174.704 -0.364 17919 73495 1 179 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.070 0.050 17919 73496 1 179 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.080 0.330 17919 73497 1 179 . 1 1 60 60 ASN H H 60 8.150 8.150 7.514 0.636 17919 73498 1 179 . 1 1 61 61 ILE N N 61 118.600 118.600 118.941 -0.341 17919 73499 1 179 . 1 1 61 61 ILE HA H 61 3.393 3.393 4.017 -0.624 17919 73500 1 179 . 1 1 61 61 ILE C C 61 174.610 174.610 174.946 -0.336 17919 73501 1 179 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.907 0.513 17919 73502 1 179 . 1 1 61 61 ILE CB C 61 36.740 36.740 38.237 -1.497 17919 73503 1 179 . 1 1 61 61 ILE H H 61 7.250 7.250 8.329 -1.079 17919 73504 1 179 . 1 1 62 62 GLN N N 62 124.740 124.740 123.921 0.819 17919 73505 1 179 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.660 -0.154 17919 73506 1 179 . 1 1 62 62 GLN C C 62 175.970 175.970 175.466 0.504 17919 73507 1 179 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.782 -0.122 17919 73508 1 179 . 1 1 62 62 GLN CB C 62 31.650 31.650 32.546 -0.896 17919 73509 1 179 . 1 1 62 62 GLN H H 62 7.610 7.610 8.018 -0.408 17919 73510 1 179 . 1 1 63 63 LYS N N 63 120.300 120.300 121.352 -1.052 17919 73511 1 179 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.182 -0.181 17919 73512 1 179 . 1 1 63 63 LYS C C 63 175.810 175.810 176.830 -1.020 17919 73513 1 179 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.224 0.566 17919 73514 1 179 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.286 0.364 17919 73515 1 179 . 1 1 63 63 LYS H H 63 8.490 8.490 8.564 -0.074 17919 73516 1 179 . 1 1 64 64 GLU N N 64 113.950 113.950 118.354 -4.404 17919 73517 1 179 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.627 -0.162 17919 73518 1 179 . 1 1 64 64 GLU C C 64 175.250 175.250 175.651 -0.401 17919 73519 1 179 . 1 1 64 64 GLU CA C 64 57.890 57.890 58.052 -0.162 17919 73520 1 179 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.799 -2.899 17919 73521 1 179 . 1 1 64 64 GLU H H 64 9.280 9.280 8.612 0.668 17919 73522 1 179 . 1 1 65 65 SER N N 65 114.730 114.730 115.275 -0.545 17919 73523 1 179 . 1 1 65 65 SER HA H 65 4.640 4.640 4.738 -0.098 17919 73524 1 179 . 1 1 65 65 SER C C 65 172.160 172.160 173.881 -1.721 17919 73525 1 179 . 1 1 65 65 SER CA C 65 60.890 60.890 58.581 2.309 17919 73526 1 179 . 1 1 65 65 SER CB C 65 64.910 64.910 64.456 0.454 17919 73527 1 179 . 1 1 65 65 SER H H 65 7.670 7.670 7.699 -0.029 17919 73528 1 179 . 1 1 66 66 THR N N 66 117.110 117.110 120.017 -2.907 17919 73529 1 179 . 1 1 66 66 THR HA H 66 5.270 5.270 5.283 -0.013 17919 73530 1 179 . 1 1 66 66 THR C C 66 173.950 173.950 174.194 -0.244 17919 73531 1 179 . 1 1 66 66 THR CA C 66 62.340 62.340 61.656 0.684 17919 73532 1 179 . 1 1 66 66 THR CB C 66 70.080 70.080 70.169 -0.090 17919 73533 1 179 . 1 1 66 66 THR H H 66 8.730 8.730 8.509 0.221 17919 73534 1 179 . 1 1 67 67 LEU N N 67 127.110 127.110 127.275 -0.165 17919 73535 1 179 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.871 0.189 17919 73536 1 179 . 1 1 67 67 LEU C C 67 175.770 175.770 174.978 0.792 17919 73537 1 179 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.899 0.001 17919 73538 1 179 . 1 1 67 67 LEU CB C 67 44.260 44.260 45.554 -1.294 17919 73539 1 179 . 1 1 67 67 LEU H H 67 9.410 9.410 9.179 0.231 17919 73540 1 179 . 1 1 68 68 HIS N N 68 118.380 118.380 120.926 -2.546 17919 73541 1 179 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.165 0.075 17919 73542 1 179 . 1 1 68 68 HIS C C 68 173.150 173.150 173.284 -0.134 17919 73543 1 179 . 1 1 68 68 HIS CA C 68 55.000 55.000 53.694 1.306 17919 73544 1 179 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.595 -2.065 17919 73545 1 179 . 1 1 68 68 HIS H H 68 9.230 9.230 9.084 0.146 17919 73546 1 179 . 1 1 69 69 LEU N N 69 124.460 124.460 130.083 -5.623 17919 73547 1 179 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.172 0.018 17919 73548 1 179 . 1 1 69 69 LEU C C 69 175.270 175.270 174.415 0.855 17919 73549 1 179 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.444 0.446 17919 73550 1 179 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.627 -0.247 17919 73551 1 179 . 1 1 69 69 LEU H H 69 8.340 8.340 8.545 -0.205 17919 73552 1 179 . 1 1 70 70 VAL N N 70 126.940 126.940 125.981 0.959 17919 73553 1 179 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.262 0.088 17919 73554 1 179 . 1 1 70 70 VAL C C 70 174.000 174.000 174.417 -0.417 17919 73555 1 179 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.848 -0.048 17919 73556 1 179 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.434 -0.524 17919 73557 1 179 . 1 1 70 70 VAL H H 70 9.200 9.200 9.017 0.183 17919 73558 1 179 . 1 1 71 71 LEU N N 71 123.130 123.130 123.695 -0.565 17919 73559 1 179 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.757 0.303 17919 73560 1 179 . 1 1 71 71 LEU C C 71 177.830 177.830 176.964 0.866 17919 73561 1 179 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.724 0.216 17919 73562 1 179 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.505 0.345 17919 73563 1 179 . 1 1 71 71 LEU H H 71 8.120 8.120 8.243 -0.123 17919 73564 1 179 . 1 1 72 72 ARG N N 72 123.490 123.490 122.966 0.524 17919 73565 1 179 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.304 -0.003 17919 73566 1 179 . 1 1 72 72 ARG C C 72 175.350 175.350 174.751 0.599 17919 73567 1 179 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.550 -0.940 17919 73568 1 179 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.657 0.693 17919 73569 1 179 . 1 1 72 72 ARG H H 72 8.580 8.580 8.497 0.083 17919 73570 1 180 . 1 1 2 2 GLN N N 2 123.220 123.220 120.881 2.339 17919 73571 1 180 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.502 -0.253 17919 73572 1 180 . 1 1 2 2 GLN C C 2 175.920 175.920 175.278 0.642 17919 73573 1 180 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.428 0.652 17919 73574 1 180 . 1 1 2 2 GLN CB C 2 30.760 30.760 31.212 -0.452 17919 73575 1 180 . 1 1 2 2 GLN H H 2 8.900 8.900 8.477 0.423 17919 73576 1 180 . 1 1 3 3 ILE N N 3 115.340 115.340 114.812 0.528 17919 73577 1 180 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.388 -0.175 17919 73578 1 180 . 1 1 3 3 ILE C C 3 172.450 172.450 173.329 -0.879 17919 73579 1 180 . 1 1 3 3 ILE CA C 3 59.570 59.570 58.932 0.638 17919 73580 1 180 . 1 1 3 3 ILE CB C 3 42.210 42.210 42.215 -0.005 17919 73581 1 180 . 1 1 3 3 ILE H H 3 8.320 8.320 8.909 -0.589 17919 73582 1 180 . 1 1 4 4 PHE N N 4 118.110 118.110 118.961 -0.851 17919 73583 1 180 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.377 0.253 17919 73584 1 180 . 1 1 4 4 PHE C C 4 175.320 175.320 174.840 0.480 17919 73585 1 180 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.104 0.106 17919 73586 1 180 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.487 -0.007 17919 73587 1 180 . 1 1 4 4 PHE H H 4 8.610 8.610 8.268 0.342 17919 73588 1 180 . 1 1 5 5 VAL N N 5 121.000 121.000 123.238 -2.238 17919 73589 1 180 . 1 1 5 5 VAL HA H 5 4.725 4.725 5.076 -0.351 17919 73590 1 180 . 1 1 5 5 VAL C C 5 174.870 174.870 175.618 -0.748 17919 73591 1 180 . 1 1 5 5 VAL CA C 5 60.620 60.620 60.898 -0.278 17919 73592 1 180 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.719 -0.489 17919 73593 1 180 . 1 1 5 5 VAL H H 5 9.300 9.300 9.103 0.197 17919 73594 1 180 . 1 1 6 6 LYS N N 6 127.520 127.520 127.766 -0.246 17919 73595 1 180 . 1 1 6 6 LYS HA H 6 5.367 5.367 4.790 0.577 17919 73596 1 180 . 1 1 6 6 LYS C C 6 177.140 177.140 176.500 0.640 17919 73597 1 180 . 1 1 6 6 LYS CA C 6 54.520 54.520 53.844 0.676 17919 73598 1 180 . 1 1 6 6 LYS CB C 6 35.050 35.050 33.481 1.569 17919 73599 1 180 . 1 1 6 6 LYS H H 6 8.820 8.820 9.117 -0.297 17919 73600 1 180 . 1 1 7 7 THR N N 7 115.400 115.400 115.271 0.129 17919 73601 1 180 . 1 1 7 7 THR HA H 7 4.970 4.970 4.706 0.264 17919 73602 1 180 . 1 1 7 7 THR C C 7 176.910 176.910 176.780 0.130 17919 73603 1 180 . 1 1 7 7 THR CA C 7 60.470 60.470 59.842 0.628 17919 73604 1 180 . 1 1 7 7 THR CB C 7 70.630 70.630 70.337 0.293 17919 73605 1 180 . 1 1 7 7 THR H H 7 8.730 8.730 8.274 0.456 17919 73606 1 180 . 1 1 8 8 LEU N N 8 121.330 121.330 120.352 0.978 17919 73607 1 180 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.099 0.211 17919 73608 1 180 . 1 1 8 8 LEU C C 8 178.800 178.800 177.987 0.813 17919 73609 1 180 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.588 -0.008 17919 73610 1 180 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.428 0.542 17919 73611 1 180 . 1 1 8 8 LEU H H 8 9.100 9.100 8.871 0.229 17919 73612 1 180 . 1 1 9 9 THR N N 9 105.590 105.590 108.526 -2.936 17919 73613 1 180 . 1 1 9 9 THR HA H 9 4.428 4.428 4.323 0.105 17919 73614 1 180 . 1 1 9 9 THR C C 9 175.520 175.520 175.764 -0.244 17919 73615 1 180 . 1 1 9 9 THR CA C 9 61.400 61.400 61.755 -0.354 17919 73616 1 180 . 1 1 9 9 THR CB C 9 69.140 69.140 69.541 -0.401 17919 73617 1 180 . 1 1 9 9 THR H H 9 7.630 7.630 7.622 0.008 17919 73618 1 180 . 1 1 10 10 GLY N N 10 108.890 108.890 111.223 -2.333 17919 73619 1 180 . 1 1 10 10 GLY C C 10 174.070 174.070 173.672 0.398 17919 73620 1 180 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.016 0.444 17919 73621 1 180 . 1 1 10 10 GLY H H 10 7.810 7.810 7.780 0.030 17919 73622 1 180 . 1 1 11 11 LYS N N 11 121.600 121.600 122.290 -0.690 17919 73623 1 180 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.478 -0.117 17919 73624 1 180 . 1 1 11 11 LYS C C 11 175.940 175.940 175.820 0.120 17919 73625 1 180 . 1 1 11 11 LYS CA C 11 56.280 56.280 55.087 1.193 17919 73626 1 180 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.168 0.032 17919 73627 1 180 . 1 1 11 11 LYS H H 11 7.280 7.280 7.785 -0.505 17919 73628 1 180 . 1 1 12 12 THR N N 12 120.440 120.440 123.755 -3.315 17919 73629 1 180 . 1 1 12 12 THR HA H 12 5.046 5.046 4.489 0.557 17919 73630 1 180 . 1 1 12 12 THR C C 12 174.320 174.320 174.565 -0.245 17919 73631 1 180 . 1 1 12 12 THR CA C 12 62.390 62.390 63.641 -1.251 17919 73632 1 180 . 1 1 12 12 THR CB C 12 69.910 69.910 68.901 1.009 17919 73633 1 180 . 1 1 12 12 THR H H 12 8.650 8.650 8.468 0.182 17919 73634 1 180 . 1 1 13 13 ILE N N 13 127.110 127.110 128.192 -1.082 17919 73635 1 180 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.442 0.102 17919 73636 1 180 . 1 1 13 13 ILE C C 13 175.220 175.220 176.251 -1.031 17919 73637 1 180 . 1 1 13 13 ILE CA C 13 59.980 59.980 58.361 1.619 17919 73638 1 180 . 1 1 13 13 ILE CB C 13 40.950 40.950 38.456 2.494 17919 73639 1 180 . 1 1 13 13 ILE H H 13 9.450 9.450 9.065 0.385 17919 73640 1 180 . 1 1 14 14 THR N N 14 121.520 121.520 118.659 2.861 17919 73641 1 180 . 1 1 14 14 THR HA H 14 4.964 4.964 4.819 0.145 17919 73642 1 180 . 1 1 14 14 THR C C 14 173.790 173.790 174.107 -0.317 17919 73643 1 180 . 1 1 14 14 THR CA C 14 61.940 61.940 61.747 0.193 17919 73644 1 180 . 1 1 14 14 THR CB C 14 69.650 69.650 69.738 -0.088 17919 73645 1 180 . 1 1 14 14 THR H H 14 8.710 8.710 8.493 0.217 17919 73646 1 180 . 1 1 15 15 LEU N N 15 124.800 124.800 127.898 -3.098 17919 73647 1 180 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.684 0.096 17919 73648 1 180 . 1 1 15 15 LEU C C 15 174.670 174.670 175.221 -0.551 17919 73649 1 180 . 1 1 15 15 LEU CA C 15 52.830 52.830 54.170 -1.340 17919 73650 1 180 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.736 1.334 17919 73651 1 180 . 1 1 15 15 LEU H H 15 8.710 8.710 9.343 -0.633 17919 73652 1 180 . 1 1 16 16 GLU N N 16 122.160 122.160 124.589 -2.429 17919 73653 1 180 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.064 -0.147 17919 73654 1 180 . 1 1 16 16 GLU C C 16 175.860 175.860 176.003 -0.143 17919 73655 1 180 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.753 -0.933 17919 73656 1 180 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.771 -1.321 17919 73657 1 180 . 1 1 16 16 GLU H H 16 8.140 8.140 8.801 -0.661 17919 73658 1 180 . 1 1 17 17 VAL N N 17 117.210 117.210 122.106 -4.896 17919 73659 1 180 . 1 1 17 17 VAL HA H 17 4.714 4.714 5.020 -0.306 17919 73660 1 180 . 1 1 17 17 VAL C C 17 174.160 174.160 174.698 -0.538 17919 73661 1 180 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.075 -0.645 17919 73662 1 180 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.714 0.686 17919 73663 1 180 . 1 1 17 17 VAL H H 17 8.900 8.900 8.685 0.215 17919 73664 1 180 . 1 1 18 18 GLU N N 18 118.990 118.990 119.937 -0.947 17919 73665 1 180 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.836 0.243 17919 73666 1 180 . 1 1 18 18 GLU C C 18 176.160 176.160 175.750 0.410 17919 73667 1 180 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.466 -0.746 17919 73668 1 180 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.443 -0.133 17919 73669 1 180 . 1 1 18 18 GLU H H 18 8.640 8.640 8.857 -0.217 17919 73670 1 180 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.370 -0.229 17919 73671 1 180 . 1 1 19 19 PRO C C 19 175.310 175.310 177.176 -1.866 17919 73672 1 180 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.091 0.379 17919 73673 1 180 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.018 -0.068 17919 73674 1 180 . 1 1 20 20 SER N N 20 103.400 103.400 110.323 -6.923 17919 73675 1 180 . 1 1 20 20 SER HA H 20 4.370 4.370 4.451 -0.081 17919 73676 1 180 . 1 1 20 20 SER C C 20 174.660 174.660 173.639 1.021 17919 73677 1 180 . 1 1 20 20 SER CA C 20 57.400 57.400 57.831 -0.431 17919 73678 1 180 . 1 1 20 20 SER CB C 20 63.370 63.370 63.642 -0.272 17919 73679 1 180 . 1 1 20 20 SER H H 20 7.040 7.040 7.907 -0.867 17919 73680 1 180 . 1 1 21 21 ASP N N 21 123.480 123.480 123.383 0.097 17919 73681 1 180 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.719 -0.024 17919 73682 1 180 . 1 1 21 21 ASP C C 21 176.360 176.360 175.996 0.364 17919 73683 1 180 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.978 0.722 17919 73684 1 180 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.318 -0.518 17919 73685 1 180 . 1 1 21 21 ASP H H 21 8.030 8.030 7.500 0.530 17919 73686 1 180 . 1 1 22 22 THR N N 22 108.800 108.800 114.138 -5.338 17919 73687 1 180 . 1 1 22 22 THR HA H 22 4.920 4.920 4.674 0.246 17919 73688 1 180 . 1 1 22 22 THR C C 22 176.750 176.750 176.239 0.511 17919 73689 1 180 . 1 1 22 22 THR CA C 22 59.690 59.690 61.861 -2.171 17919 73690 1 180 . 1 1 22 22 THR CB C 22 71.200 71.200 70.459 0.741 17919 73691 1 180 . 1 1 22 22 THR H H 22 7.900 7.900 8.275 -0.375 17919 73692 1 180 . 1 1 23 23 ILE N N 23 121.190 121.190 122.690 -1.500 17919 73693 1 180 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.716 -0.059 17919 73694 1 180 . 1 1 23 23 ILE C C 23 179.040 179.040 177.817 1.223 17919 73695 1 180 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.141 0.119 17919 73696 1 180 . 1 1 23 23 ILE CB C 23 34.350 34.350 35.950 -1.600 17919 73697 1 180 . 1 1 23 23 ILE H H 23 8.560 8.560 8.809 -0.249 17919 73698 1 180 . 1 1 24 24 GLU N N 24 120.830 120.830 120.645 0.185 17919 73699 1 180 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.857 0.060 17919 73700 1 180 . 1 1 24 24 GLU C C 24 178.640 178.640 178.883 -0.243 17919 73701 1 180 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.023 0.197 17919 73702 1 180 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.446 -1.166 17919 73703 1 180 . 1 1 24 24 GLU H H 24 9.760 9.760 8.541 1.219 17919 73704 1 180 . 1 1 25 25 ASN N N 25 120.570 120.570 117.405 3.165 17919 73705 1 180 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.557 -0.032 17919 73706 1 180 . 1 1 25 25 ASN C C 25 178.380 178.380 177.924 0.456 17919 73707 1 180 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.985 0.075 17919 73708 1 180 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.762 -0.312 17919 73709 1 180 . 1 1 25 25 ASN H H 25 7.920 7.920 7.697 0.223 17919 73710 1 180 . 1 1 26 26 VAL N N 26 121.710 121.710 121.097 0.613 17919 73711 1 180 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.686 -0.289 17919 73712 1 180 . 1 1 26 26 VAL C C 26 177.950 177.950 177.826 0.124 17919 73713 1 180 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.404 1.256 17919 73714 1 180 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.244 -0.404 17919 73715 1 180 . 1 1 26 26 VAL H H 26 8.070 8.070 8.063 0.006 17919 73716 1 180 . 1 1 27 27 LYS N N 27 118.860 118.860 120.385 -1.525 17919 73717 1 180 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.160 0.420 17919 73718 1 180 . 1 1 27 27 LYS C C 27 180.550 180.550 179.312 1.238 17919 73719 1 180 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.724 -0.474 17919 73720 1 180 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.153 1.577 17919 73721 1 180 . 1 1 27 27 LYS H H 27 8.560 8.560 8.435 0.125 17919 73722 1 180 . 1 1 28 28 ALA N N 28 123.440 123.440 121.876 1.564 17919 73723 1 180 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.065 0.095 17919 73724 1 180 . 1 1 28 28 ALA C C 28 180.300 180.300 179.426 0.874 17919 73725 1 180 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.108 0.262 17919 73726 1 180 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.358 -0.648 17919 73727 1 180 . 1 1 28 28 ALA H H 28 8.060 8.060 8.305 -0.245 17919 73728 1 180 . 1 1 29 29 LYS N N 29 119.940 119.940 118.717 1.223 17919 73729 1 180 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.071 0.136 17919 73730 1 180 . 1 1 29 29 LYS C C 29 180.320 180.320 179.298 1.022 17919 73731 1 180 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.382 0.268 17919 73732 1 180 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.373 0.917 17919 73733 1 180 . 1 1 29 29 LYS H H 29 7.850 7.850 7.681 0.169 17919 73734 1 180 . 1 1 30 30 ILE N N 30 121.080 121.080 120.316 0.764 17919 73735 1 180 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.742 -0.235 17919 73736 1 180 . 1 1 30 30 ILE C C 30 178.310 178.310 177.466 0.844 17919 73737 1 180 . 1 1 30 30 ILE CA C 30 66.150 66.150 64.343 1.807 17919 73738 1 180 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.094 -0.294 17919 73739 1 180 . 1 1 30 30 ILE H H 30 8.280 8.280 8.085 0.195 17919 73740 1 180 . 1 1 31 31 GLN N N 31 123.490 123.490 121.355 2.135 17919 73741 1 180 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.939 -0.110 17919 73742 1 180 . 1 1 31 31 GLN C C 31 178.890 178.890 178.224 0.666 17919 73743 1 180 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.322 0.678 17919 73744 1 180 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.511 -0.791 17919 73745 1 180 . 1 1 31 31 GLN H H 31 8.580 8.580 8.342 0.238 17919 73746 1 180 . 1 1 32 32 ASP N N 32 119.360 119.360 119.388 -0.028 17919 73747 1 180 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.369 -0.015 17919 73748 1 180 . 1 1 32 32 ASP C C 32 177.250 177.250 178.261 -1.011 17919 73749 1 180 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.964 0.226 17919 73750 1 180 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.753 -0.173 17919 73751 1 180 . 1 1 32 32 ASP H H 32 8.010 8.010 8.407 -0.397 17919 73752 1 180 . 1 1 33 33 LYS N N 33 115.130 115.130 118.392 -3.262 17919 73753 1 180 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.241 0.096 17919 73754 1 180 . 1 1 33 33 LYS C C 33 177.870 177.870 177.986 -0.116 17919 73755 1 180 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.885 0.165 17919 73756 1 180 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.012 1.158 17919 73757 1 180 . 1 1 33 33 LYS H H 33 7.430 7.430 7.468 -0.038 17919 73758 1 180 . 1 1 34 34 GLU N N 34 113.870 113.870 114.178 -0.308 17919 73759 1 180 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.546 0.079 17919 73760 1 180 . 1 1 34 34 GLU C C 34 177.840 177.840 177.136 0.704 17919 73761 1 180 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.842 -0.672 17919 73762 1 180 . 1 1 34 34 GLU CB C 34 32.660 32.660 30.839 1.821 17919 73763 1 180 . 1 1 34 34 GLU H H 34 8.740 8.740 7.924 0.816 17919 73764 1 180 . 1 1 35 35 GLY N N 35 108.650 108.650 110.336 -1.686 17919 73765 1 180 . 1 1 35 35 GLY C C 35 173.960 173.960 174.212 -0.252 17919 73766 1 180 . 1 1 35 35 GLY CA C 35 46.080 46.080 46.344 -0.264 17919 73767 1 180 . 1 1 35 35 GLY H H 35 8.530 8.530 8.264 0.266 17919 73768 1 180 . 1 1 36 36 ILE N N 36 119.880 119.880 121.256 -1.376 17919 73769 1 180 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.317 0.128 17919 73770 1 180 . 1 1 36 36 ILE C C 36 173.590 173.590 174.307 -0.717 17919 73771 1 180 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.585 0.165 17919 73772 1 180 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.981 1.599 17919 73773 1 180 . 1 1 36 36 ILE H H 36 6.150 6.150 7.431 -1.281 17919 73774 1 180 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.617 0.017 17919 73775 1 180 . 1 1 37 37 PRO C C 37 176.940 176.940 176.133 0.807 17919 73776 1 180 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.536 0.124 17919 73777 1 180 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.066 0.784 17919 73778 1 180 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.136 -0.019 17919 73779 1 180 . 1 1 38 38 PRO C C 38 178.320 178.320 178.267 0.053 17919 73780 1 180 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.822 0.438 17919 73781 1 180 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.934 0.956 17919 73782 1 180 . 1 1 39 39 ASP N N 39 113.380 113.380 114.621 -1.241 17919 73783 1 180 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.376 0.054 17919 73784 1 180 . 1 1 39 39 ASP C C 39 177.090 177.090 178.024 -0.934 17919 73785 1 180 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.571 -0.931 17919 73786 1 180 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.369 -0.829 17919 73787 1 180 . 1 1 39 39 ASP H H 39 8.550 8.550 8.400 0.150 17919 73788 1 180 . 1 1 40 40 GLN N N 40 116.780 116.780 117.813 -1.033 17919 73789 1 180 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.141 0.323 17919 73790 1 180 . 1 1 40 40 GLN C C 40 175.380 175.380 176.999 -1.619 17919 73791 1 180 . 1 1 40 40 GLN CA C 40 55.640 55.640 57.529 -1.889 17919 73792 1 180 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.259 0.881 17919 73793 1 180 . 1 1 40 40 GLN H H 40 7.820 7.820 8.268 -0.448 17919 73794 1 180 . 1 1 41 41 GLN N N 41 117.720 117.720 118.505 -0.785 17919 73795 1 180 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.414 -0.170 17919 73796 1 180 . 1 1 41 41 GLN C C 41 176.300 176.300 175.865 0.435 17919 73797 1 180 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.476 -0.006 17919 73798 1 180 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.230 2.420 17919 73799 1 180 . 1 1 41 41 GLN H H 41 7.480 7.480 7.338 0.142 17919 73800 1 180 . 1 1 42 42 ARG N N 42 122.680 122.680 124.050 -1.370 17919 73801 1 180 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.600 -0.100 17919 73802 1 180 . 1 1 42 42 ARG C C 42 174.050 174.050 174.364 -0.314 17919 73803 1 180 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.927 0.123 17919 73804 1 180 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.296 -1.546 17919 73805 1 180 . 1 1 42 42 ARG H H 42 8.530 8.530 8.926 -0.396 17919 73806 1 180 . 1 1 43 43 LEU N N 43 124.040 124.040 124.223 -0.183 17919 73807 1 180 . 1 1 43 43 LEU C C 43 175.290 175.290 175.866 -0.576 17919 73808 1 180 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.633 -0.653 17919 73809 1 180 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.534 1.256 17919 73810 1 180 . 1 1 43 43 LEU H H 43 8.820 8.820 8.767 0.053 17919 73811 1 180 . 1 1 44 44 ILE N N 44 121.920 121.920 119.701 2.219 17919 73812 1 180 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.816 0.176 17919 73813 1 180 . 1 1 44 44 ILE C C 44 176.060 176.060 173.927 2.133 17919 73814 1 180 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.063 -1.083 17919 73815 1 180 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.334 0.086 17919 73816 1 180 . 1 1 44 44 ILE H H 44 9.030 9.030 8.651 0.379 17919 73817 1 180 . 1 1 45 45 PHE N N 45 125.390 125.390 125.984 -0.594 17919 73818 1 180 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.968 0.077 17919 73819 1 180 . 1 1 45 45 PHE C C 45 174.470 174.470 174.256 0.214 17919 73820 1 180 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.944 0.076 17919 73821 1 180 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.103 0.657 17919 73822 1 180 . 1 1 45 45 PHE H H 45 8.830 8.830 8.792 0.038 17919 73823 1 180 . 1 1 46 46 ALA N N 46 132.200 132.200 130.068 2.132 17919 73824 1 180 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.555 0.135 17919 73825 1 180 . 1 1 46 46 ALA C C 46 177.290 177.290 177.744 -0.454 17919 73826 1 180 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.994 -0.454 17919 73827 1 180 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.797 -0.227 17919 73828 1 180 . 1 1 46 46 ALA H H 46 8.810 8.810 8.647 0.163 17919 73829 1 180 . 1 1 47 47 GLY N N 47 102.340 102.340 103.168 -0.828 17919 73830 1 180 . 1 1 47 47 GLY C C 47 173.810 173.810 174.354 -0.544 17919 73831 1 180 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.057 0.293 17919 73832 1 180 . 1 1 47 47 GLY H H 47 8.130 8.130 8.524 -0.394 17919 73833 1 180 . 1 1 48 48 LYS N N 48 121.570 121.570 121.050 0.520 17919 73834 1 180 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.527 0.095 17919 73835 1 180 . 1 1 48 48 LYS C C 48 174.700 174.700 175.457 -0.757 17919 73836 1 180 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.018 -0.468 17919 73837 1 180 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.044 0.486 17919 73838 1 180 . 1 1 48 48 LYS H H 48 7.980 7.980 7.916 0.064 17919 73839 1 180 . 1 1 49 49 GLN N N 49 122.410 122.410 122.744 -0.334 17919 73840 1 180 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.499 0.061 17919 73841 1 180 . 1 1 49 49 GLN C C 49 175.670 175.670 175.830 -0.160 17919 73842 1 180 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.397 0.343 17919 73843 1 180 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.679 -0.679 17919 73844 1 180 . 1 1 49 49 GLN H H 49 8.600 8.600 8.562 0.038 17919 73845 1 180 . 1 1 50 50 LEU N N 50 125.520 125.520 127.265 -1.745 17919 73846 1 180 . 1 1 50 50 LEU HA H 50 4.090 4.090 3.942 0.148 17919 73847 1 180 . 1 1 50 50 LEU C C 50 176.660 176.660 175.818 0.842 17919 73848 1 180 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.279 -0.039 17919 73849 1 180 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.776 -0.206 17919 73850 1 180 . 1 1 50 50 LEU H H 50 8.530 8.530 8.471 0.059 17919 73851 1 180 . 1 1 51 51 GLU N N 51 122.940 122.940 122.930 0.010 17919 73852 1 180 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.568 -0.080 17919 73853 1 180 . 1 1 51 51 GLU C C 51 175.870 175.870 176.939 -1.069 17919 73854 1 180 . 1 1 51 51 GLU CA C 51 55.960 55.960 54.703 1.256 17919 73855 1 180 . 1 1 51 51 GLU CB C 51 31.570 31.570 33.096 -1.526 17919 73856 1 180 . 1 1 51 51 GLU H H 51 8.400 8.400 8.099 0.301 17919 73857 1 180 . 1 1 52 52 ASP N N 52 120.030 120.030 127.441 -7.411 17919 73858 1 180 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.375 -0.016 17919 73859 1 180 . 1 1 52 52 ASP C C 52 177.330 177.330 177.482 -0.152 17919 73860 1 180 . 1 1 52 52 ASP CA C 52 56.960 56.960 58.241 -1.281 17919 73861 1 180 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.779 0.071 17919 73862 1 180 . 1 1 52 52 ASP H H 52 8.160 8.160 8.818 -0.658 17919 73863 1 180 . 1 1 53 53 GLY N N 53 106.660 106.660 105.513 1.147 17919 73864 1 180 . 1 1 53 53 GLY C C 53 174.870 174.870 174.250 0.620 17919 73865 1 180 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.951 0.219 17919 73866 1 180 . 1 1 53 53 GLY H H 53 9.390 9.390 8.522 0.868 17919 73867 1 180 . 1 1 54 54 ARG N N 54 119.050 119.050 120.055 -1.005 17919 73868 1 180 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.687 0.008 17919 73869 1 180 . 1 1 54 54 ARG C C 54 175.350 175.350 174.883 0.467 17919 73870 1 180 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.384 0.006 17919 73871 1 180 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.610 0.040 17919 73872 1 180 . 1 1 54 54 ARG H H 54 7.460 7.460 7.586 -0.126 17919 73873 1 180 . 1 1 55 55 THR N N 55 108.400 108.400 112.013 -3.613 17919 73874 1 180 . 1 1 55 55 THR HA H 55 5.240 5.240 4.828 0.412 17919 73875 1 180 . 1 1 55 55 THR C C 55 176.560 176.560 175.823 0.737 17919 73876 1 180 . 1 1 55 55 THR CA C 55 59.690 59.690 60.622 -0.932 17919 73877 1 180 . 1 1 55 55 THR CB C 55 72.260 72.260 70.493 1.767 17919 73878 1 180 . 1 1 55 55 THR H H 55 8.730 8.730 8.089 0.641 17919 73879 1 180 . 1 1 56 56 LEU N N 56 117.920 117.920 121.346 -3.426 17919 73880 1 180 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.058 0.002 17919 73881 1 180 . 1 1 56 56 LEU C C 56 180.810 180.810 178.715 2.095 17919 73882 1 180 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.337 0.372 17919 73883 1 180 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.519 -1.149 17919 73884 1 180 . 1 1 56 56 LEU H H 56 8.140 8.140 8.999 -0.859 17919 73885 1 180 . 1 1 57 57 SER N N 57 113.330 113.330 114.159 -0.829 17919 73886 1 180 . 1 1 57 57 SER HA H 57 4.370 4.370 4.202 0.168 17919 73887 1 180 . 1 1 57 57 SER C C 57 178.310 178.310 177.051 1.259 17919 73888 1 180 . 1 1 57 57 SER CA C 57 61.080 61.080 61.547 -0.467 17919 73889 1 180 . 1 1 57 57 SER CB C 57 62.530 62.530 62.502 0.028 17919 73890 1 180 . 1 1 57 57 SER H H 57 8.470 8.470 8.599 -0.129 17919 73891 1 180 . 1 1 58 58 ASP N N 58 124.190 124.190 124.218 -0.028 17919 73892 1 180 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.331 -0.035 17919 73893 1 180 . 1 1 58 58 ASP C C 58 177.400 177.400 177.013 0.387 17919 73894 1 180 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.455 0.725 17919 73895 1 180 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.584 -0.484 17919 73896 1 180 . 1 1 58 58 ASP H H 58 7.930 7.930 7.612 0.318 17919 73897 1 180 . 1 1 59 59 TYR N N 59 115.510 115.510 115.403 0.107 17919 73898 1 180 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.490 0.180 17919 73899 1 180 . 1 1 59 59 TYR C C 59 174.700 174.700 174.958 -0.258 17919 73900 1 180 . 1 1 59 59 TYR CA C 59 58.250 58.250 58.514 -0.264 17919 73901 1 180 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.112 1.958 17919 73902 1 180 . 1 1 59 59 TYR H H 59 7.250 7.250 7.433 -0.183 17919 73903 1 180 . 1 1 60 60 ASN N N 60 115.900 115.900 114.904 0.996 17919 73904 1 180 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.381 -0.026 17919 73905 1 180 . 1 1 60 60 ASN C C 60 174.340 174.340 174.416 -0.076 17919 73906 1 180 . 1 1 60 60 ASN CA C 60 54.120 54.120 53.917 0.203 17919 73907 1 180 . 1 1 60 60 ASN CB C 60 37.410 37.410 36.632 0.778 17919 73908 1 180 . 1 1 60 60 ASN H H 60 8.150 8.150 7.625 0.525 17919 73909 1 180 . 1 1 61 61 ILE N N 61 118.600 118.600 118.508 0.092 17919 73910 1 180 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.885 -0.492 17919 73911 1 180 . 1 1 61 61 ILE C C 61 174.610 174.610 175.604 -0.994 17919 73912 1 180 . 1 1 61 61 ILE CA C 61 62.420 62.420 60.818 1.602 17919 73913 1 180 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.583 -0.843 17919 73914 1 180 . 1 1 61 61 ILE H H 61 7.250 7.250 7.998 -0.748 17919 73915 1 180 . 1 1 62 62 GLN N N 62 124.740 124.740 124.838 -0.098 17919 73916 1 180 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.718 -0.212 17919 73917 1 180 . 1 1 62 62 GLN C C 62 175.970 175.970 175.771 0.199 17919 73918 1 180 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.726 -0.066 17919 73919 1 180 . 1 1 62 62 GLN CB C 62 31.650 31.650 32.203 -0.553 17919 73920 1 180 . 1 1 62 62 GLN H H 62 7.610 7.610 7.929 -0.319 17919 73921 1 180 . 1 1 63 63 LYS N N 63 120.300 120.300 123.664 -3.364 17919 73922 1 180 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.871 0.130 17919 73923 1 180 . 1 1 63 63 LYS C C 63 175.810 175.810 176.916 -1.106 17919 73924 1 180 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.728 0.062 17919 73925 1 180 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.268 1.382 17919 73926 1 180 . 1 1 63 63 LYS H H 63 8.490 8.490 8.726 -0.236 17919 73927 1 180 . 1 1 64 64 GLU N N 64 113.950 113.950 118.411 -4.461 17919 73928 1 180 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.365 0.100 17919 73929 1 180 . 1 1 64 64 GLU C C 64 175.250 175.250 175.719 -0.469 17919 73930 1 180 . 1 1 64 64 GLU CA C 64 57.890 57.890 58.104 -0.214 17919 73931 1 180 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.199 -2.299 17919 73932 1 180 . 1 1 64 64 GLU H H 64 9.280 9.280 8.798 0.482 17919 73933 1 180 . 1 1 65 65 SER N N 65 114.730 114.730 114.862 -0.132 17919 73934 1 180 . 1 1 65 65 SER HA H 65 4.640 4.640 4.258 0.382 17919 73935 1 180 . 1 1 65 65 SER C C 65 172.160 172.160 173.710 -1.550 17919 73936 1 180 . 1 1 65 65 SER CA C 65 60.890 60.890 60.840 0.050 17919 73937 1 180 . 1 1 65 65 SER CB C 65 64.910 64.910 63.736 1.175 17919 73938 1 180 . 1 1 65 65 SER H H 65 7.670 7.670 7.476 0.194 17919 73939 1 180 . 1 1 66 66 THR N N 66 117.110 117.110 119.373 -2.263 17919 73940 1 180 . 1 1 66 66 THR HA H 66 5.270 5.270 5.005 0.265 17919 73941 1 180 . 1 1 66 66 THR C C 66 173.950 173.950 174.026 -0.076 17919 73942 1 180 . 1 1 66 66 THR CA C 66 62.340 62.340 62.017 0.323 17919 73943 1 180 . 1 1 66 66 THR CB C 66 70.080 70.080 69.795 0.285 17919 73944 1 180 . 1 1 66 66 THR H H 66 8.730 8.730 8.224 0.506 17919 73945 1 180 . 1 1 67 67 LEU N N 67 127.110 127.110 127.363 -0.253 17919 73946 1 180 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.886 0.174 17919 73947 1 180 . 1 1 67 67 LEU C C 67 175.770 175.770 175.696 0.074 17919 73948 1 180 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.961 -0.061 17919 73949 1 180 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.357 -0.097 17919 73950 1 180 . 1 1 67 67 LEU H H 67 9.410 9.410 9.255 0.154 17919 73951 1 180 . 1 1 68 68 HIS N N 68 118.380 118.380 117.700 0.680 17919 73952 1 180 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.371 -0.131 17919 73953 1 180 . 1 1 68 68 HIS C C 68 173.150 173.150 173.964 -0.814 17919 73954 1 180 . 1 1 68 68 HIS CA C 68 55.000 55.000 53.411 1.589 17919 73955 1 180 . 1 1 68 68 HIS CB C 68 30.530 30.530 31.303 -0.773 17919 73956 1 180 . 1 1 68 68 HIS H H 68 9.230 9.230 8.627 0.603 17919 73957 1 180 . 1 1 69 69 LEU N N 69 124.460 124.460 126.305 -1.845 17919 73958 1 180 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.344 -0.154 17919 73959 1 180 . 1 1 69 69 LEU C C 69 175.270 175.270 174.778 0.492 17919 73960 1 180 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.115 -0.225 17919 73961 1 180 . 1 1 69 69 LEU CB C 69 44.380 44.380 43.962 0.418 17919 73962 1 180 . 1 1 69 69 LEU H H 69 8.340 8.340 8.502 -0.162 17919 73963 1 180 . 1 1 70 70 VAL N N 70 126.940 126.940 123.749 3.191 17919 73964 1 180 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.518 -0.168 17919 73965 1 180 . 1 1 70 70 VAL C C 70 174.000 174.000 173.861 0.139 17919 73966 1 180 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.638 1.162 17919 73967 1 180 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.860 -0.950 17919 73968 1 180 . 1 1 70 70 VAL H H 70 9.200 9.200 9.138 0.062 17919 73969 1 180 . 1 1 71 71 LEU N N 71 123.130 123.130 125.337 -2.207 17919 73970 1 180 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.087 -0.027 17919 73971 1 180 . 1 1 71 71 LEU C C 71 177.830 177.830 176.977 0.853 17919 73972 1 180 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.229 0.711 17919 73973 1 180 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.246 -0.396 17919 73974 1 180 . 1 1 71 71 LEU H H 71 8.120 8.120 8.354 -0.234 17919 73975 1 180 . 1 1 72 72 ARG N N 72 123.490 123.490 124.669 -1.179 17919 73976 1 180 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.277 0.024 17919 73977 1 180 . 1 1 72 72 ARG C C 72 175.350 175.350 175.259 0.091 17919 73978 1 180 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.134 -0.524 17919 73979 1 180 . 1 1 72 72 ARG CB C 72 31.350 31.350 31.406 -0.056 17919 73980 1 180 . 1 1 72 72 ARG H H 72 8.580 8.580 8.558 0.022 17919 73981 1 181 . 1 1 2 2 GLN N N 2 123.220 123.220 120.334 2.886 17919 73982 1 181 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.262 -0.013 17919 73983 1 181 . 1 1 2 2 GLN C C 2 175.920 175.920 174.922 0.998 17919 73984 1 181 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.550 0.530 17919 73985 1 181 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.924 -0.164 17919 73986 1 181 . 1 1 2 2 GLN H H 2 8.900 8.900 8.291 0.609 17919 73987 1 181 . 1 1 3 3 ILE N N 3 115.340 115.340 120.025 -4.685 17919 73988 1 181 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.617 -0.404 17919 73989 1 181 . 1 1 3 3 ILE C C 3 172.450 172.450 173.460 -1.010 17919 73990 1 181 . 1 1 3 3 ILE CA C 3 59.570 59.570 58.037 1.533 17919 73991 1 181 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.282 0.927 17919 73992 1 181 . 1 1 3 3 ILE H H 3 8.320 8.320 8.638 -0.318 17919 73993 1 181 . 1 1 4 4 PHE N N 4 118.110 118.110 119.752 -1.642 17919 73994 1 181 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.252 0.378 17919 73995 1 181 . 1 1 4 4 PHE C C 4 175.320 175.320 174.937 0.383 17919 73996 1 181 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.956 -0.746 17919 73997 1 181 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.038 -0.558 17919 73998 1 181 . 1 1 4 4 PHE H H 4 8.610 8.610 8.808 -0.198 17919 73999 1 181 . 1 1 5 5 VAL N N 5 121.000 121.000 122.607 -1.607 17919 74000 1 181 . 1 1 5 5 VAL HA H 5 4.725 4.725 5.023 -0.298 17919 74001 1 181 . 1 1 5 5 VAL C C 5 174.870 174.870 175.099 -0.229 17919 74002 1 181 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.148 -0.528 17919 74003 1 181 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.447 -0.217 17919 74004 1 181 . 1 1 5 5 VAL H H 5 9.300 9.300 9.393 -0.093 17919 74005 1 181 . 1 1 6 6 LYS N N 6 127.520 127.520 126.502 1.018 17919 74006 1 181 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.542 -0.175 17919 74007 1 181 . 1 1 6 6 LYS C C 6 177.140 177.140 176.534 0.606 17919 74008 1 181 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.436 0.084 17919 74009 1 181 . 1 1 6 6 LYS CB C 6 35.050 35.050 36.301 -1.251 17919 74010 1 181 . 1 1 6 6 LYS H H 6 8.820 8.820 9.321 -0.501 17919 74011 1 181 . 1 1 7 7 THR N N 7 115.400 115.400 117.251 -1.851 17919 74012 1 181 . 1 1 7 7 THR HA H 7 4.970 4.970 4.722 0.248 17919 74013 1 181 . 1 1 7 7 THR C C 7 176.910 176.910 176.692 0.218 17919 74014 1 181 . 1 1 7 7 THR CA C 7 60.470 60.470 61.834 -1.364 17919 74015 1 181 . 1 1 7 7 THR CB C 7 70.630 70.630 70.128 0.502 17919 74016 1 181 . 1 1 7 7 THR H H 7 8.730 8.730 8.967 -0.237 17919 74017 1 181 . 1 1 8 8 LEU N N 8 121.330 121.330 122.242 -0.912 17919 74018 1 181 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.162 0.148 17919 74019 1 181 . 1 1 8 8 LEU C C 8 178.800 178.800 177.823 0.977 17919 74020 1 181 . 1 1 8 8 LEU CA C 8 57.580 57.580 58.153 -0.573 17919 74021 1 181 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.533 0.437 17919 74022 1 181 . 1 1 8 8 LEU H H 8 9.100 9.100 8.483 0.617 17919 74023 1 181 . 1 1 9 9 THR N N 9 105.590 105.590 107.519 -1.929 17919 74024 1 181 . 1 1 9 9 THR HA H 9 4.428 4.428 4.328 0.100 17919 74025 1 181 . 1 1 9 9 THR C C 9 175.520 175.520 175.413 0.107 17919 74026 1 181 . 1 1 9 9 THR CA C 9 61.400 61.400 61.555 -0.155 17919 74027 1 181 . 1 1 9 9 THR CB C 9 69.140 69.140 68.279 0.861 17919 74028 1 181 . 1 1 9 9 THR H H 9 7.630 7.630 7.532 0.098 17919 74029 1 181 . 1 1 10 10 GLY N N 10 108.890 108.890 112.152 -3.262 17919 74030 1 181 . 1 1 10 10 GLY C C 10 174.070 174.070 172.966 1.104 17919 74031 1 181 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.493 -0.033 17919 74032 1 181 . 1 1 10 10 GLY H H 10 7.810 7.810 8.091 -0.281 17919 74033 1 181 . 1 1 11 11 LYS N N 11 121.600 121.600 118.354 3.246 17919 74034 1 181 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.642 -0.281 17919 74035 1 181 . 1 1 11 11 LYS C C 11 175.940 175.940 174.563 1.377 17919 74036 1 181 . 1 1 11 11 LYS CA C 11 56.280 56.280 55.046 1.234 17919 74037 1 181 . 1 1 11 11 LYS CB C 11 33.200 33.200 35.148 -1.948 17919 74038 1 181 . 1 1 11 11 LYS H H 11 7.280 7.280 7.504 -0.224 17919 74039 1 181 . 1 1 12 12 THR N N 12 120.440 120.440 117.182 3.258 17919 74040 1 181 . 1 1 12 12 THR HA H 12 5.046 5.046 5.206 -0.160 17919 74041 1 181 . 1 1 12 12 THR C C 12 174.320 174.320 174.819 -0.499 17919 74042 1 181 . 1 1 12 12 THR CA C 12 62.390 62.390 61.835 0.555 17919 74043 1 181 . 1 1 12 12 THR CB C 12 69.910 69.910 69.488 0.422 17919 74044 1 181 . 1 1 12 12 THR H H 12 8.650 8.650 8.311 0.339 17919 74045 1 181 . 1 1 13 13 ILE N N 13 127.110 127.110 123.647 3.463 17919 74046 1 181 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.659 -0.115 17919 74047 1 181 . 1 1 13 13 ILE C C 13 175.220 175.220 174.888 0.332 17919 74048 1 181 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.693 0.287 17919 74049 1 181 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.453 0.497 17919 74050 1 181 . 1 1 13 13 ILE H H 13 9.450 9.450 9.221 0.229 17919 74051 1 181 . 1 1 14 14 THR N N 14 121.520 121.520 121.498 0.022 17919 74052 1 181 . 1 1 14 14 THR HA H 14 4.964 4.964 4.891 0.073 17919 74053 1 181 . 1 1 14 14 THR C C 14 173.790 173.790 173.930 -0.140 17919 74054 1 181 . 1 1 14 14 THR CA C 14 61.940 61.940 62.138 -0.198 17919 74055 1 181 . 1 1 14 14 THR CB C 14 69.650 69.650 69.757 -0.107 17919 74056 1 181 . 1 1 14 14 THR H H 14 8.710 8.710 8.462 0.248 17919 74057 1 181 . 1 1 15 15 LEU N N 15 124.800 124.800 125.842 -1.042 17919 74058 1 181 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.887 -0.107 17919 74059 1 181 . 1 1 15 15 LEU C C 15 174.670 174.670 175.310 -0.640 17919 74060 1 181 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.072 -0.242 17919 74061 1 181 . 1 1 15 15 LEU CB C 15 47.070 47.070 46.123 0.947 17919 74062 1 181 . 1 1 15 15 LEU H H 15 8.710 8.710 8.595 0.115 17919 74063 1 181 . 1 1 16 16 GLU N N 16 122.160 122.160 120.299 1.861 17919 74064 1 181 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.415 -0.498 17919 74065 1 181 . 1 1 16 16 GLU C C 16 175.860 175.860 176.273 -0.413 17919 74066 1 181 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.077 -0.257 17919 74067 1 181 . 1 1 16 16 GLU CB C 16 29.450 29.450 31.079 -1.629 17919 74068 1 181 . 1 1 16 16 GLU H H 16 8.140 8.140 8.449 -0.309 17919 74069 1 181 . 1 1 17 17 VAL N N 17 117.210 117.210 117.487 -0.277 17919 74070 1 181 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.832 -0.118 17919 74071 1 181 . 1 1 17 17 VAL C C 17 174.160 174.160 174.467 -0.307 17919 74072 1 181 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.487 -1.057 17919 74073 1 181 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.270 1.130 17919 74074 1 181 . 1 1 17 17 VAL H H 17 8.900 8.900 8.694 0.206 17919 74075 1 181 . 1 1 18 18 GLU N N 18 118.990 118.990 120.428 -1.438 17919 74076 1 181 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.883 0.196 17919 74077 1 181 . 1 1 18 18 GLU C C 18 176.160 176.160 175.212 0.948 17919 74078 1 181 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.510 0.211 17919 74079 1 181 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.469 -0.159 17919 74080 1 181 . 1 1 18 18 GLU H H 18 8.640 8.640 8.886 -0.246 17919 74081 1 181 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.177 -0.036 17919 74082 1 181 . 1 1 19 19 PRO C C 19 175.310 175.310 177.697 -2.387 17919 74083 1 181 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.556 -0.087 17919 74084 1 181 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.801 0.149 17919 74085 1 181 . 1 1 20 20 SER N N 20 103.400 103.400 109.985 -6.585 17919 74086 1 181 . 1 1 20 20 SER HA H 20 4.370 4.370 4.305 0.065 17919 74087 1 181 . 1 1 20 20 SER C C 20 174.660 174.660 173.731 0.929 17919 74088 1 181 . 1 1 20 20 SER CA C 20 57.400 57.400 58.810 -1.410 17919 74089 1 181 . 1 1 20 20 SER CB C 20 63.370 63.370 62.890 0.480 17919 74090 1 181 . 1 1 20 20 SER H H 20 7.040 7.040 8.284 -1.244 17919 74091 1 181 . 1 1 21 21 ASP N N 21 123.480 123.480 122.923 0.557 17919 74092 1 181 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.734 -0.039 17919 74093 1 181 . 1 1 21 21 ASP C C 21 176.360 176.360 176.160 0.200 17919 74094 1 181 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.682 1.018 17919 74095 1 181 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.300 -0.499 17919 74096 1 181 . 1 1 21 21 ASP H H 21 8.030 8.030 7.742 0.288 17919 74097 1 181 . 1 1 22 22 THR N N 22 108.800 108.800 114.661 -5.861 17919 74098 1 181 . 1 1 22 22 THR HA H 22 4.920 4.920 4.953 -0.033 17919 74099 1 181 . 1 1 22 22 THR C C 22 176.750 176.750 176.441 0.309 17919 74100 1 181 . 1 1 22 22 THR CA C 22 59.690 59.690 60.877 -1.187 17919 74101 1 181 . 1 1 22 22 THR CB C 22 71.200 71.200 70.673 0.527 17919 74102 1 181 . 1 1 22 22 THR H H 22 7.900 7.900 8.568 -0.668 17919 74103 1 181 . 1 1 23 23 ILE N N 23 121.190 121.190 121.609 -0.419 17919 74104 1 181 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.755 -0.098 17919 74105 1 181 . 1 1 23 23 ILE C C 23 179.040 179.040 177.932 1.108 17919 74106 1 181 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.104 -0.844 17919 74107 1 181 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.431 -2.081 17919 74108 1 181 . 1 1 23 23 ILE H H 23 8.560 8.560 8.587 -0.027 17919 74109 1 181 . 1 1 24 24 GLU N N 24 120.830 120.830 120.452 0.378 17919 74110 1 181 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.988 -0.071 17919 74111 1 181 . 1 1 24 24 GLU C C 24 178.640 178.640 178.425 0.215 17919 74112 1 181 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.738 0.482 17919 74113 1 181 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.486 -1.206 17919 74114 1 181 . 1 1 24 24 GLU H H 24 9.760 9.760 8.254 1.506 17919 74115 1 181 . 1 1 25 25 ASN N N 25 120.570 120.570 118.104 2.466 17919 74116 1 181 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.487 0.038 17919 74117 1 181 . 1 1 25 25 ASN C C 25 178.380 178.380 177.964 0.416 17919 74118 1 181 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.119 -0.059 17919 74119 1 181 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.367 0.083 17919 74120 1 181 . 1 1 25 25 ASN H H 25 7.920 7.920 7.696 0.224 17919 74121 1 181 . 1 1 26 26 VAL N N 26 121.710 121.710 120.825 0.885 17919 74122 1 181 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.657 -0.260 17919 74123 1 181 . 1 1 26 26 VAL C C 26 177.950 177.950 177.366 0.584 17919 74124 1 181 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.707 0.954 17919 74125 1 181 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.269 -0.429 17919 74126 1 181 . 1 1 26 26 VAL H H 26 8.070 8.070 7.659 0.411 17919 74127 1 181 . 1 1 27 27 LYS N N 27 118.860 118.860 120.596 -1.736 17919 74128 1 181 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.306 0.274 17919 74129 1 181 . 1 1 27 27 LYS C C 27 180.550 180.550 178.904 1.646 17919 74130 1 181 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.553 -0.303 17919 74131 1 181 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.305 1.425 17919 74132 1 181 . 1 1 27 27 LYS H H 27 8.560 8.560 7.794 0.766 17919 74133 1 181 . 1 1 28 28 ALA N N 28 123.440 123.440 122.267 1.173 17919 74134 1 181 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.211 -0.051 17919 74135 1 181 . 1 1 28 28 ALA C C 28 180.300 180.300 179.198 1.102 17919 74136 1 181 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.785 0.585 17919 74137 1 181 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.363 -0.653 17919 74138 1 181 . 1 1 28 28 ALA H H 28 8.060 8.060 8.407 -0.347 17919 74139 1 181 . 1 1 29 29 LYS N N 29 119.940 119.940 119.644 0.296 17919 74140 1 181 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.042 0.165 17919 74141 1 181 . 1 1 29 29 LYS C C 29 180.320 180.320 179.006 1.314 17919 74142 1 181 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.432 0.218 17919 74143 1 181 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.353 0.937 17919 74144 1 181 . 1 1 29 29 LYS H H 29 7.850 7.850 7.453 0.397 17919 74145 1 181 . 1 1 30 30 ILE N N 30 121.080 121.080 120.487 0.593 17919 74146 1 181 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.632 -0.125 17919 74147 1 181 . 1 1 30 30 ILE C C 30 178.310 178.310 177.474 0.836 17919 74148 1 181 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.148 1.002 17919 74149 1 181 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.673 -0.873 17919 74150 1 181 . 1 1 30 30 ILE H H 30 8.280 8.280 8.127 0.153 17919 74151 1 181 . 1 1 31 31 GLN N N 31 123.490 123.490 121.357 2.133 17919 74152 1 181 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.154 -0.325 17919 74153 1 181 . 1 1 31 31 GLN C C 31 178.890 178.890 178.163 0.727 17919 74154 1 181 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.223 0.777 17919 74155 1 181 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.658 -0.938 17919 74156 1 181 . 1 1 31 31 GLN H H 31 8.580 8.580 8.451 0.129 17919 74157 1 181 . 1 1 32 32 ASP N N 32 119.360 119.360 119.924 -0.564 17919 74158 1 181 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.366 -0.012 17919 74159 1 181 . 1 1 32 32 ASP C C 32 177.250 177.250 178.264 -1.014 17919 74160 1 181 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.914 0.276 17919 74161 1 181 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.833 -0.253 17919 74162 1 181 . 1 1 32 32 ASP H H 32 8.010 8.010 8.189 -0.179 17919 74163 1 181 . 1 1 33 33 LYS N N 33 115.130 115.130 118.000 -2.870 17919 74164 1 181 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.285 0.052 17919 74165 1 181 . 1 1 33 33 LYS C C 33 177.870 177.870 178.391 -0.521 17919 74166 1 181 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.950 0.100 17919 74167 1 181 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.442 0.728 17919 74168 1 181 . 1 1 33 33 LYS H H 33 7.430 7.430 7.671 -0.241 17919 74169 1 181 . 1 1 34 34 GLU N N 34 113.870 113.870 115.858 -1.988 17919 74170 1 181 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.463 0.162 17919 74171 1 181 . 1 1 34 34 GLU C C 34 177.840 177.840 177.261 0.579 17919 74172 1 181 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.055 -0.885 17919 74173 1 181 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.120 1.540 17919 74174 1 181 . 1 1 34 34 GLU H H 34 8.740 8.740 8.237 0.503 17919 74175 1 181 . 1 1 35 35 GLY N N 35 108.650 108.650 108.779 -0.129 17919 74176 1 181 . 1 1 35 35 GLY C C 35 173.960 173.960 174.283 -0.323 17919 74177 1 181 . 1 1 35 35 GLY CA C 35 46.080 46.080 46.035 0.045 17919 74178 1 181 . 1 1 35 35 GLY H H 35 8.530 8.530 8.418 0.112 17919 74179 1 181 . 1 1 36 36 ILE N N 36 119.880 119.880 122.329 -2.449 17919 74180 1 181 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.452 -0.006 17919 74181 1 181 . 1 1 36 36 ILE C C 36 173.590 173.590 175.019 -1.429 17919 74182 1 181 . 1 1 36 36 ILE CA C 36 57.750 57.750 56.425 1.325 17919 74183 1 181 . 1 1 36 36 ILE CB C 36 40.580 40.580 37.737 2.843 17919 74184 1 181 . 1 1 36 36 ILE H H 36 6.150 6.150 7.643 -1.493 17919 74185 1 181 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.678 -0.044 17919 74186 1 181 . 1 1 37 37 PRO C C 37 176.940 176.940 176.311 0.629 17919 74187 1 181 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.648 0.012 17919 74188 1 181 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.339 0.511 17919 74189 1 181 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.126 -0.009 17919 74190 1 181 . 1 1 38 38 PRO C C 38 178.320 178.320 178.745 -0.425 17919 74191 1 181 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.861 0.399 17919 74192 1 181 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.841 1.049 17919 74193 1 181 . 1 1 39 39 ASP N N 39 113.380 113.380 116.763 -3.383 17919 74194 1 181 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.297 0.133 17919 74195 1 181 . 1 1 39 39 ASP C C 39 177.090 177.090 177.850 -0.760 17919 74196 1 181 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.944 -1.304 17919 74197 1 181 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.449 -0.909 17919 74198 1 181 . 1 1 39 39 ASP H H 39 8.550 8.550 8.606 -0.056 17919 74199 1 181 . 1 1 40 40 GLN N N 40 116.780 116.780 116.797 -0.017 17919 74200 1 181 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.294 0.170 17919 74201 1 181 . 1 1 40 40 GLN C C 40 175.380 175.380 176.520 -1.140 17919 74202 1 181 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.068 -0.428 17919 74203 1 181 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.273 0.866 17919 74204 1 181 . 1 1 40 40 GLN H H 40 7.820 7.820 8.104 -0.284 17919 74205 1 181 . 1 1 41 41 GLN N N 41 117.720 117.720 119.541 -1.821 17919 74206 1 181 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.430 -0.186 17919 74207 1 181 . 1 1 41 41 GLN C C 41 176.300 176.300 175.350 0.950 17919 74208 1 181 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.432 0.038 17919 74209 1 181 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.886 1.764 17919 74210 1 181 . 1 1 41 41 GLN H H 41 7.480 7.480 7.825 -0.345 17919 74211 1 181 . 1 1 42 42 ARG N N 42 122.680 122.680 122.490 0.190 17919 74212 1 181 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.650 -0.150 17919 74213 1 181 . 1 1 42 42 ARG C C 42 174.050 174.050 174.383 -0.333 17919 74214 1 181 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.068 -0.018 17919 74215 1 181 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.096 -1.346 17919 74216 1 181 . 1 1 42 42 ARG H H 42 8.530 8.530 8.939 -0.409 17919 74217 1 181 . 1 1 43 43 LEU N N 43 124.040 124.040 125.898 -1.858 17919 74218 1 181 . 1 1 43 43 LEU C C 43 175.290 175.290 175.648 -0.358 17919 74219 1 181 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.020 -1.040 17919 74220 1 181 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.889 1.901 17919 74221 1 181 . 1 1 43 43 LEU H H 43 8.820 8.820 8.875 -0.055 17919 74222 1 181 . 1 1 44 44 ILE N N 44 121.920 121.920 122.015 -0.095 17919 74223 1 181 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.896 0.096 17919 74224 1 181 . 1 1 44 44 ILE C C 44 176.060 176.060 174.244 1.816 17919 74225 1 181 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.271 -1.291 17919 74226 1 181 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.712 -0.292 17919 74227 1 181 . 1 1 44 44 ILE H H 44 9.030 9.030 8.651 0.379 17919 74228 1 181 . 1 1 45 45 PHE N N 45 125.390 125.390 126.858 -1.468 17919 74229 1 181 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.023 0.022 17919 74230 1 181 . 1 1 45 45 PHE C C 45 174.470 174.470 174.747 -0.277 17919 74231 1 181 . 1 1 45 45 PHE CA C 45 57.020 57.020 55.916 1.104 17919 74232 1 181 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.996 0.764 17919 74233 1 181 . 1 1 45 45 PHE H H 45 8.830 8.830 9.136 -0.306 17919 74234 1 181 . 1 1 46 46 ALA N N 46 132.200 132.200 129.252 2.948 17919 74235 1 181 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.658 0.032 17919 74236 1 181 . 1 1 46 46 ALA C C 46 177.290 177.290 177.472 -0.182 17919 74237 1 181 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.509 0.031 17919 74238 1 181 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.369 0.201 17919 74239 1 181 . 1 1 46 46 ALA H H 46 8.810 8.810 8.913 -0.103 17919 74240 1 181 . 1 1 47 47 GLY N N 47 102.340 102.340 104.535 -2.195 17919 74241 1 181 . 1 1 47 47 GLY C C 47 173.810 173.810 174.191 -0.381 17919 74242 1 181 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.869 0.481 17919 74243 1 181 . 1 1 47 47 GLY H H 47 8.130 8.130 8.481 -0.351 17919 74244 1 181 . 1 1 48 48 LYS N N 48 121.570 121.570 121.394 0.176 17919 74245 1 181 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.608 0.014 17919 74246 1 181 . 1 1 48 48 LYS C C 48 174.700 174.700 174.952 -0.252 17919 74247 1 181 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.003 -0.453 17919 74248 1 181 . 1 1 48 48 LYS CB C 48 34.530 34.530 35.153 -0.623 17919 74249 1 181 . 1 1 48 48 LYS H H 48 7.980 7.980 7.869 0.111 17919 74250 1 181 . 1 1 49 49 GLN N N 49 122.410 122.410 124.320 -1.910 17919 74251 1 181 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.483 0.077 17919 74252 1 181 . 1 1 49 49 GLN C C 49 175.670 175.670 175.598 0.072 17919 74253 1 181 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.092 -0.352 17919 74254 1 181 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.200 -0.200 17919 74255 1 181 . 1 1 49 49 GLN H H 49 8.600 8.600 8.590 0.010 17919 74256 1 181 . 1 1 50 50 LEU N N 50 125.520 125.520 128.398 -2.878 17919 74257 1 181 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.550 -0.460 17919 74258 1 181 . 1 1 50 50 LEU C C 50 176.660 176.660 176.144 0.516 17919 74259 1 181 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.125 0.115 17919 74260 1 181 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.725 -1.155 17919 74261 1 181 . 1 1 50 50 LEU H H 50 8.530 8.530 8.785 -0.255 17919 74262 1 181 . 1 1 51 51 GLU N N 51 122.940 122.940 122.117 0.823 17919 74263 1 181 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.614 -0.126 17919 74264 1 181 . 1 1 51 51 GLU C C 51 175.870 175.870 176.540 -0.670 17919 74265 1 181 . 1 1 51 51 GLU CA C 51 55.960 55.960 54.745 1.215 17919 74266 1 181 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.804 -0.234 17919 74267 1 181 . 1 1 51 51 GLU H H 51 8.400 8.400 8.970 -0.570 17919 74268 1 181 . 1 1 52 52 ASP N N 52 120.030 120.030 122.879 -2.849 17919 74269 1 181 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.461 -0.102 17919 74270 1 181 . 1 1 52 52 ASP C C 52 177.330 177.330 178.107 -0.777 17919 74271 1 181 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.946 -0.986 17919 74272 1 181 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.678 0.172 17919 74273 1 181 . 1 1 52 52 ASP H H 52 8.160 8.160 8.841 -0.681 17919 74274 1 181 . 1 1 53 53 GLY N N 53 106.660 106.660 104.012 2.648 17919 74275 1 181 . 1 1 53 53 GLY C C 53 174.870 174.870 174.271 0.599 17919 74276 1 181 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.577 0.593 17919 74277 1 181 . 1 1 53 53 GLY H H 53 9.390 9.390 8.162 1.228 17919 74278 1 181 . 1 1 54 54 ARG N N 54 119.050 119.050 120.926 -1.876 17919 74279 1 181 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.450 0.245 17919 74280 1 181 . 1 1 54 54 ARG C C 54 175.350 175.350 175.288 0.062 17919 74281 1 181 . 1 1 54 54 ARG CA C 54 54.390 54.390 55.197 -0.807 17919 74282 1 181 . 1 1 54 54 ARG CB C 54 32.650 32.650 31.932 0.718 17919 74283 1 181 . 1 1 54 54 ARG H H 54 7.460 7.460 7.562 -0.102 17919 74284 1 181 . 1 1 55 55 THR N N 55 108.400 108.400 114.398 -5.998 17919 74285 1 181 . 1 1 55 55 THR HA H 55 5.240 5.240 4.652 0.589 17919 74286 1 181 . 1 1 55 55 THR C C 55 176.560 176.560 175.673 0.887 17919 74287 1 181 . 1 1 55 55 THR CA C 55 59.690 59.690 61.292 -1.602 17919 74288 1 181 . 1 1 55 55 THR CB C 55 72.260 72.260 69.871 2.389 17919 74289 1 181 . 1 1 55 55 THR H H 55 8.730 8.730 8.083 0.647 17919 74290 1 181 . 1 1 56 56 LEU N N 56 117.920 117.920 122.228 -4.308 17919 74291 1 181 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.124 -0.064 17919 74292 1 181 . 1 1 56 56 LEU C C 56 180.810 180.810 178.866 1.944 17919 74293 1 181 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.521 0.189 17919 74294 1 181 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.306 -0.936 17919 74295 1 181 . 1 1 56 56 LEU H H 56 8.140 8.140 8.819 -0.679 17919 74296 1 181 . 1 1 57 57 SER N N 57 113.330 113.330 114.093 -0.763 17919 74297 1 181 . 1 1 57 57 SER HA H 57 4.370 4.370 4.114 0.256 17919 74298 1 181 . 1 1 57 57 SER C C 57 178.310 178.310 176.736 1.574 17919 74299 1 181 . 1 1 57 57 SER CA C 57 61.080 61.080 61.681 -0.601 17919 74300 1 181 . 1 1 57 57 SER CB C 57 62.530 62.530 62.476 0.054 17919 74301 1 181 . 1 1 57 57 SER H H 57 8.470 8.470 8.567 -0.097 17919 74302 1 181 . 1 1 58 58 ASP N N 58 124.190 124.190 121.076 3.114 17919 74303 1 181 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.324 -0.028 17919 74304 1 181 . 1 1 58 58 ASP C C 58 177.400 177.400 176.494 0.906 17919 74305 1 181 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.247 0.933 17919 74306 1 181 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.521 -0.421 17919 74307 1 181 . 1 1 58 58 ASP H H 58 7.930 7.930 7.766 0.164 17919 74308 1 181 . 1 1 59 59 TYR N N 59 115.510 115.510 115.252 0.258 17919 74309 1 181 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.552 0.118 17919 74310 1 181 . 1 1 59 59 TYR C C 59 174.700 174.700 175.269 -0.569 17919 74311 1 181 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.584 0.666 17919 74312 1 181 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.539 1.530 17919 74313 1 181 . 1 1 59 59 TYR H H 59 7.250 7.250 7.363 -0.113 17919 74314 1 181 . 1 1 60 60 ASN N N 60 115.900 115.900 118.324 -2.424 17919 74315 1 181 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.375 -0.020 17919 74316 1 181 . 1 1 60 60 ASN C C 60 174.340 174.340 175.169 -0.829 17919 74317 1 181 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.096 0.024 17919 74318 1 181 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.303 0.107 17919 74319 1 181 . 1 1 60 60 ASN H H 60 8.150 8.150 7.963 0.187 17919 74320 1 181 . 1 1 61 61 ILE N N 61 118.600 118.600 119.214 -0.614 17919 74321 1 181 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.776 -0.383 17919 74322 1 181 . 1 1 61 61 ILE C C 61 174.610 174.610 175.927 -1.317 17919 74323 1 181 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.871 0.549 17919 74324 1 181 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.541 -0.800 17919 74325 1 181 . 1 1 61 61 ILE H H 61 7.250 7.250 7.569 -0.319 17919 74326 1 181 . 1 1 62 62 GLN N N 62 124.740 124.740 123.968 0.772 17919 74327 1 181 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.694 -0.188 17919 74328 1 181 . 1 1 62 62 GLN C C 62 175.970 175.970 175.626 0.344 17919 74329 1 181 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.962 -0.302 17919 74330 1 181 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.999 -0.349 17919 74331 1 181 . 1 1 62 62 GLN H H 62 7.610 7.610 8.001 -0.391 17919 74332 1 181 . 1 1 63 63 LYS N N 63 120.300 120.300 119.618 0.682 17919 74333 1 181 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.295 -0.294 17919 74334 1 181 . 1 1 63 63 LYS C C 63 175.810 175.810 177.544 -1.734 17919 74335 1 181 . 1 1 63 63 LYS CA C 63 57.790 57.790 56.923 0.867 17919 74336 1 181 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.574 0.076 17919 74337 1 181 . 1 1 63 63 LYS H H 63 8.490 8.490 8.560 -0.070 17919 74338 1 181 . 1 1 64 64 GLU N N 64 113.950 113.950 117.054 -3.104 17919 74339 1 181 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.633 -0.168 17919 74340 1 181 . 1 1 64 64 GLU C C 64 175.250 175.250 176.052 -0.802 17919 74341 1 181 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.894 -0.004 17919 74342 1 181 . 1 1 64 64 GLU CB C 64 25.900 25.900 29.208 -3.308 17919 74343 1 181 . 1 1 64 64 GLU H H 64 9.280 9.280 8.759 0.521 17919 74344 1 181 . 1 1 65 65 SER N N 65 114.730 114.730 116.289 -1.559 17919 74345 1 181 . 1 1 65 65 SER HA H 65 4.640 4.640 4.421 0.219 17919 74346 1 181 . 1 1 65 65 SER C C 65 172.160 172.160 174.343 -2.183 17919 74347 1 181 . 1 1 65 65 SER CA C 65 60.890 60.890 60.498 0.392 17919 74348 1 181 . 1 1 65 65 SER CB C 65 64.910 64.910 63.815 1.095 17919 74349 1 181 . 1 1 65 65 SER H H 65 7.670 7.670 7.287 0.383 17919 74350 1 181 . 1 1 66 66 THR N N 66 117.110 117.110 119.568 -2.458 17919 74351 1 181 . 1 1 66 66 THR HA H 66 5.270 5.270 5.286 -0.016 17919 74352 1 181 . 1 1 66 66 THR C C 66 173.950 173.950 174.319 -0.369 17919 74353 1 181 . 1 1 66 66 THR CA C 66 62.340 62.340 61.907 0.433 17919 74354 1 181 . 1 1 66 66 THR CB C 66 70.080 70.080 70.282 -0.202 17919 74355 1 181 . 1 1 66 66 THR H H 66 8.730 8.730 8.491 0.239 17919 74356 1 181 . 1 1 67 67 LEU N N 67 127.110 127.110 127.332 -0.222 17919 74357 1 181 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.903 0.157 17919 74358 1 181 . 1 1 67 67 LEU C C 67 175.770 175.770 175.306 0.464 17919 74359 1 181 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.581 0.319 17919 74360 1 181 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.210 0.050 17919 74361 1 181 . 1 1 67 67 LEU H H 67 9.410 9.410 9.305 0.105 17919 74362 1 181 . 1 1 68 68 HIS N N 68 118.380 118.380 122.037 -3.657 17919 74363 1 181 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.463 -0.223 17919 74364 1 181 . 1 1 68 68 HIS C C 68 173.150 173.150 173.627 -0.477 17919 74365 1 181 . 1 1 68 68 HIS CA C 68 55.000 55.000 53.888 1.112 17919 74366 1 181 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.039 -1.509 17919 74367 1 181 . 1 1 68 68 HIS H H 68 9.230 9.230 9.186 0.044 17919 74368 1 181 . 1 1 69 69 LEU N N 69 124.460 124.460 130.941 -6.481 17919 74369 1 181 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.217 -0.027 17919 74370 1 181 . 1 1 69 69 LEU C C 69 175.270 175.270 174.180 1.090 17919 74371 1 181 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.333 0.557 17919 74372 1 181 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.254 0.126 17919 74373 1 181 . 1 1 69 69 LEU H H 69 8.340 8.340 9.152 -0.812 17919 74374 1 181 . 1 1 70 70 VAL N N 70 126.940 126.940 127.449 -0.509 17919 74375 1 181 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.282 0.068 17919 74376 1 181 . 1 1 70 70 VAL C C 70 174.000 174.000 174.637 -0.637 17919 74377 1 181 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.679 0.121 17919 74378 1 181 . 1 1 70 70 VAL CB C 70 34.910 34.910 33.770 1.140 17919 74379 1 181 . 1 1 70 70 VAL H H 70 9.200 9.200 8.658 0.542 17919 74380 1 181 . 1 1 71 71 LEU N N 71 123.130 123.130 124.836 -1.706 17919 74381 1 181 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.945 0.115 17919 74382 1 181 . 1 1 71 71 LEU C C 71 177.830 177.830 177.967 -0.137 17919 74383 1 181 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.817 0.123 17919 74384 1 181 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.069 -0.219 17919 74385 1 181 . 1 1 71 71 LEU H H 71 8.120 8.120 8.534 -0.414 17919 74386 1 181 . 1 1 72 72 ARG N N 72 123.490 123.490 123.984 -0.494 17919 74387 1 181 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.253 0.048 17919 74388 1 181 . 1 1 72 72 ARG C C 72 175.350 175.350 175.894 -0.544 17919 74389 1 181 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.562 0.048 17919 74390 1 181 . 1 1 72 72 ARG CB C 72 31.350 31.350 28.005 3.345 17919 74391 1 181 . 1 1 72 72 ARG H H 72 8.580 8.580 8.286 0.294 17919 74392 1 182 . 1 1 2 2 GLN N N 2 123.220 123.220 122.266 0.954 17919 74393 1 182 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.162 0.087 17919 74394 1 182 . 1 1 2 2 GLN C C 2 175.920 175.920 175.989 -0.069 17919 74395 1 182 . 1 1 2 2 GLN CA C 2 55.080 55.080 55.025 0.055 17919 74396 1 182 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.005 0.755 17919 74397 1 182 . 1 1 2 2 GLN H H 2 8.900 8.900 8.431 0.469 17919 74398 1 182 . 1 1 3 3 ILE N N 3 115.340 115.340 114.925 0.415 17919 74399 1 182 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.445 -0.232 17919 74400 1 182 . 1 1 3 3 ILE C C 3 172.450 172.450 173.784 -1.334 17919 74401 1 182 . 1 1 3 3 ILE CA C 3 59.570 59.570 58.524 1.046 17919 74402 1 182 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.879 0.331 17919 74403 1 182 . 1 1 3 3 ILE H H 3 8.320 8.320 8.146 0.174 17919 74404 1 182 . 1 1 4 4 PHE N N 4 118.110 118.110 118.365 -0.255 17919 74405 1 182 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.154 0.476 17919 74406 1 182 . 1 1 4 4 PHE C C 4 175.320 175.320 174.764 0.556 17919 74407 1 182 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.758 -0.548 17919 74408 1 182 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.381 0.099 17919 74409 1 182 . 1 1 4 4 PHE H H 4 8.610 8.610 8.072 0.538 17919 74410 1 182 . 1 1 5 5 VAL N N 5 121.000 121.000 122.846 -1.846 17919 74411 1 182 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.663 0.062 17919 74412 1 182 . 1 1 5 5 VAL C C 5 174.870 174.870 174.348 0.522 17919 74413 1 182 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.549 -0.929 17919 74414 1 182 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.346 -0.116 17919 74415 1 182 . 1 1 5 5 VAL H H 5 9.300 9.300 9.270 0.030 17919 74416 1 182 . 1 1 6 6 LYS N N 6 127.520 127.520 129.304 -1.784 17919 74417 1 182 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.403 -0.036 17919 74418 1 182 . 1 1 6 6 LYS C C 6 177.140 177.140 176.125 1.015 17919 74419 1 182 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.298 0.222 17919 74420 1 182 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.913 -0.862 17919 74421 1 182 . 1 1 6 6 LYS H H 6 8.820 8.820 9.179 -0.359 17919 74422 1 182 . 1 1 7 7 THR N N 7 115.400 115.400 119.124 -3.724 17919 74423 1 182 . 1 1 7 7 THR HA H 7 4.970 4.970 4.504 0.466 17919 74424 1 182 . 1 1 7 7 THR C C 7 176.910 176.910 176.034 0.876 17919 74425 1 182 . 1 1 7 7 THR CA C 7 60.470 60.470 61.583 -1.113 17919 74426 1 182 . 1 1 7 7 THR CB C 7 70.630 70.630 70.191 0.439 17919 74427 1 182 . 1 1 7 7 THR H H 7 8.730 8.730 9.106 -0.376 17919 74428 1 182 . 1 1 8 8 LEU N N 8 121.330 121.330 122.949 -1.619 17919 74429 1 182 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.406 -0.096 17919 74430 1 182 . 1 1 8 8 LEU C C 8 178.800 178.800 176.960 1.840 17919 74431 1 182 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.303 0.277 17919 74432 1 182 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.199 -0.229 17919 74433 1 182 . 1 1 8 8 LEU H H 8 9.100 9.100 8.481 0.619 17919 74434 1 182 . 1 1 9 9 THR N N 9 105.590 105.590 109.073 -3.483 17919 74435 1 182 . 1 1 9 9 THR HA H 9 4.428 4.428 4.467 -0.039 17919 74436 1 182 . 1 1 9 9 THR C C 9 175.520 175.520 175.222 0.298 17919 74437 1 182 . 1 1 9 9 THR CA C 9 61.400 61.400 60.961 0.439 17919 74438 1 182 . 1 1 9 9 THR CB C 9 69.140 69.140 69.104 0.036 17919 74439 1 182 . 1 1 9 9 THR H H 9 7.630 7.630 7.559 0.071 17919 74440 1 182 . 1 1 10 10 GLY N N 10 108.890 108.890 110.472 -1.582 17919 74441 1 182 . 1 1 10 10 GLY C C 10 174.070 174.070 173.862 0.208 17919 74442 1 182 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.287 0.173 17919 74443 1 182 . 1 1 10 10 GLY H H 10 7.810 7.810 7.765 0.045 17919 74444 1 182 . 1 1 11 11 LYS N N 11 121.600 121.600 121.753 -0.153 17919 74445 1 182 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.627 -0.266 17919 74446 1 182 . 1 1 11 11 LYS C C 11 175.940 175.940 175.188 0.752 17919 74447 1 182 . 1 1 11 11 LYS CA C 11 56.280 56.280 55.231 1.049 17919 74448 1 182 . 1 1 11 11 LYS CB C 11 33.200 33.200 34.095 -0.895 17919 74449 1 182 . 1 1 11 11 LYS H H 11 7.280 7.280 7.873 -0.593 17919 74450 1 182 . 1 1 12 12 THR N N 12 120.440 120.440 121.394 -0.954 17919 74451 1 182 . 1 1 12 12 THR HA H 12 5.046 5.046 5.031 0.015 17919 74452 1 182 . 1 1 12 12 THR C C 12 174.320 174.320 174.344 -0.024 17919 74453 1 182 . 1 1 12 12 THR CA C 12 62.390 62.390 61.677 0.713 17919 74454 1 182 . 1 1 12 12 THR CB C 12 69.910 69.910 68.980 0.930 17919 74455 1 182 . 1 1 12 12 THR H H 12 8.650 8.650 8.417 0.233 17919 74456 1 182 . 1 1 13 13 ILE N N 13 127.110 127.110 124.475 2.635 17919 74457 1 182 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.755 -0.210 17919 74458 1 182 . 1 1 13 13 ILE C C 13 175.220 175.220 175.181 0.039 17919 74459 1 182 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.381 0.599 17919 74460 1 182 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.080 -0.130 17919 74461 1 182 . 1 1 13 13 ILE H H 13 9.450 9.450 9.130 0.320 17919 74462 1 182 . 1 1 14 14 THR N N 14 121.520 121.520 122.499 -0.979 17919 74463 1 182 . 1 1 14 14 THR HA H 14 4.964 4.964 5.054 -0.090 17919 74464 1 182 . 1 1 14 14 THR C C 14 173.790 173.790 173.363 0.427 17919 74465 1 182 . 1 1 14 14 THR CA C 14 61.940 61.940 62.711 -0.771 17919 74466 1 182 . 1 1 14 14 THR CB C 14 69.650 69.650 70.109 -0.459 17919 74467 1 182 . 1 1 14 14 THR H H 14 8.710 8.710 8.462 0.248 17919 74468 1 182 . 1 1 15 15 LEU N N 15 124.800 124.800 125.060 -0.260 17919 74469 1 182 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.717 0.063 17919 74470 1 182 . 1 1 15 15 LEU C C 15 174.670 174.670 174.650 0.020 17919 74471 1 182 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.517 -0.686 17919 74472 1 182 . 1 1 15 15 LEU CB C 15 47.070 47.070 46.310 0.760 17919 74473 1 182 . 1 1 15 15 LEU H H 15 8.710 8.710 8.696 0.014 17919 74474 1 182 . 1 1 16 16 GLU N N 16 122.160 122.160 123.750 -1.590 17919 74475 1 182 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.890 0.027 17919 74476 1 182 . 1 1 16 16 GLU C C 16 175.860 175.860 175.722 0.138 17919 74477 1 182 . 1 1 16 16 GLU CA C 16 54.820 54.820 54.925 -0.105 17919 74478 1 182 . 1 1 16 16 GLU CB C 16 29.450 29.450 29.848 -0.397 17919 74479 1 182 . 1 1 16 16 GLU H H 16 8.140 8.140 8.534 -0.394 17919 74480 1 182 . 1 1 17 17 VAL N N 17 117.210 117.210 118.923 -1.713 17919 74481 1 182 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.689 0.025 17919 74482 1 182 . 1 1 17 17 VAL C C 17 174.160 174.160 174.310 -0.150 17919 74483 1 182 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.385 -0.955 17919 74484 1 182 . 1 1 17 17 VAL CB C 17 36.400 36.400 34.974 1.425 17919 74485 1 182 . 1 1 17 17 VAL H H 17 8.900 8.900 8.680 0.220 17919 74486 1 182 . 1 1 18 18 GLU N N 18 118.990 118.990 120.731 -1.741 17919 74487 1 182 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.810 0.269 17919 74488 1 182 . 1 1 18 18 GLU C C 18 176.160 176.160 175.589 0.571 17919 74489 1 182 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.993 -0.273 17919 74490 1 182 . 1 1 18 18 GLU CB C 18 30.310 30.310 31.178 -0.868 17919 74491 1 182 . 1 1 18 18 GLU H H 18 8.640 8.640 8.997 -0.357 17919 74492 1 182 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.352 -0.211 17919 74493 1 182 . 1 1 19 19 PRO C C 19 175.310 175.310 177.321 -2.011 17919 74494 1 182 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.255 0.214 17919 74495 1 182 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.907 0.043 17919 74496 1 182 . 1 1 20 20 SER N N 20 103.400 103.400 111.714 -8.314 17919 74497 1 182 . 1 1 20 20 SER HA H 20 4.370 4.370 4.402 -0.032 17919 74498 1 182 . 1 1 20 20 SER C C 20 174.660 174.660 174.125 0.535 17919 74499 1 182 . 1 1 20 20 SER CA C 20 57.400 57.400 58.811 -1.411 17919 74500 1 182 . 1 1 20 20 SER CB C 20 63.370 63.370 62.533 0.837 17919 74501 1 182 . 1 1 20 20 SER H H 20 7.040 7.040 8.329 -1.289 17919 74502 1 182 . 1 1 21 21 ASP N N 21 123.480 123.480 122.905 0.575 17919 74503 1 182 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.707 -0.012 17919 74504 1 182 . 1 1 21 21 ASP C C 21 176.360 176.360 175.972 0.388 17919 74505 1 182 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.039 0.661 17919 74506 1 182 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.366 -0.566 17919 74507 1 182 . 1 1 21 21 ASP H H 21 8.030 8.030 7.642 0.388 17919 74508 1 182 . 1 1 22 22 THR N N 22 108.800 108.800 113.458 -4.658 17919 74509 1 182 . 1 1 22 22 THR HA H 22 4.920 4.920 4.668 0.252 17919 74510 1 182 . 1 1 22 22 THR C C 22 176.750 176.750 175.992 0.758 17919 74511 1 182 . 1 1 22 22 THR CA C 22 59.690 59.690 61.085 -1.395 17919 74512 1 182 . 1 1 22 22 THR CB C 22 71.200 71.200 70.877 0.323 17919 74513 1 182 . 1 1 22 22 THR H H 22 7.900 7.900 8.123 -0.223 17919 74514 1 182 . 1 1 23 23 ILE N N 23 121.190 121.190 122.725 -1.535 17919 74515 1 182 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.746 -0.089 17919 74516 1 182 . 1 1 23 23 ILE C C 23 179.040 179.040 177.987 1.053 17919 74517 1 182 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.032 -0.773 17919 74518 1 182 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.282 -1.932 17919 74519 1 182 . 1 1 23 23 ILE H H 23 8.560 8.560 9.021 -0.461 17919 74520 1 182 . 1 1 24 24 GLU N N 24 120.830 120.830 119.920 0.910 17919 74521 1 182 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.828 0.089 17919 74522 1 182 . 1 1 24 24 GLU C C 24 178.640 178.640 178.697 -0.057 17919 74523 1 182 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.944 0.276 17919 74524 1 182 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.077 -0.797 17919 74525 1 182 . 1 1 24 24 GLU H H 24 9.760 9.760 7.993 1.767 17919 74526 1 182 . 1 1 25 25 ASN N N 25 120.570 120.570 117.797 2.773 17919 74527 1 182 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.516 0.009 17919 74528 1 182 . 1 1 25 25 ASN C C 25 178.380 178.380 177.837 0.543 17919 74529 1 182 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.997 0.063 17919 74530 1 182 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.787 -0.337 17919 74531 1 182 . 1 1 25 25 ASN H H 25 7.920 7.920 7.802 0.118 17919 74532 1 182 . 1 1 26 26 VAL N N 26 121.710 121.710 121.189 0.521 17919 74533 1 182 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.569 -0.172 17919 74534 1 182 . 1 1 26 26 VAL C C 26 177.950 177.950 177.877 0.073 17919 74535 1 182 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.898 0.762 17919 74536 1 182 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.438 -0.598 17919 74537 1 182 . 1 1 26 26 VAL H H 26 8.070 8.070 8.578 -0.508 17919 74538 1 182 . 1 1 27 27 LYS N N 27 118.860 118.860 120.135 -1.275 17919 74539 1 182 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.192 0.388 17919 74540 1 182 . 1 1 27 27 LYS C C 27 180.550 180.550 179.161 1.389 17919 74541 1 182 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.688 -0.438 17919 74542 1 182 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.266 1.464 17919 74543 1 182 . 1 1 27 27 LYS H H 27 8.560 8.560 8.047 0.513 17919 74544 1 182 . 1 1 28 28 ALA N N 28 123.440 123.440 121.944 1.496 17919 74545 1 182 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.168 -0.008 17919 74546 1 182 . 1 1 28 28 ALA C C 28 180.300 180.300 179.681 0.619 17919 74547 1 182 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.857 0.513 17919 74548 1 182 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.433 -0.723 17919 74549 1 182 . 1 1 28 28 ALA H H 28 8.060 8.060 8.107 -0.047 17919 74550 1 182 . 1 1 29 29 LYS N N 29 119.940 119.940 119.525 0.415 17919 74551 1 182 . 1 1 29 29 LYS HA H 29 4.207 4.207 3.997 0.210 17919 74552 1 182 . 1 1 29 29 LYS C C 29 180.320 180.320 179.304 1.016 17919 74553 1 182 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.304 0.346 17919 74554 1 182 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.372 0.918 17919 74555 1 182 . 1 1 29 29 LYS H H 29 7.850 7.850 7.785 0.065 17919 74556 1 182 . 1 1 30 30 ILE N N 30 121.080 121.080 120.178 0.902 17919 74557 1 182 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.647 -0.140 17919 74558 1 182 . 1 1 30 30 ILE C C 30 178.310 178.310 177.343 0.967 17919 74559 1 182 . 1 1 30 30 ILE CA C 30 66.150 66.150 64.750 1.400 17919 74560 1 182 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.761 -0.961 17919 74561 1 182 . 1 1 30 30 ILE H H 30 8.280 8.280 8.224 0.056 17919 74562 1 182 . 1 1 31 31 GLN N N 31 123.490 123.490 120.806 2.684 17919 74563 1 182 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.106 -0.277 17919 74564 1 182 . 1 1 31 31 GLN C C 31 178.890 178.890 178.204 0.686 17919 74565 1 182 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.194 0.805 17919 74566 1 182 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.528 -0.808 17919 74567 1 182 . 1 1 31 31 GLN H H 31 8.580 8.580 8.383 0.197 17919 74568 1 182 . 1 1 32 32 ASP N N 32 119.360 119.360 119.175 0.185 17919 74569 1 182 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.422 -0.068 17919 74570 1 182 . 1 1 32 32 ASP C C 32 177.250 177.250 177.986 -0.736 17919 74571 1 182 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.703 0.487 17919 74572 1 182 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.786 -0.206 17919 74573 1 182 . 1 1 32 32 ASP H H 32 8.010 8.010 7.818 0.192 17919 74574 1 182 . 1 1 33 33 LYS N N 33 115.130 115.130 118.225 -3.095 17919 74575 1 182 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.192 0.145 17919 74576 1 182 . 1 1 33 33 LYS C C 33 177.870 177.870 178.118 -0.248 17919 74577 1 182 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.705 -0.655 17919 74578 1 182 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.266 0.904 17919 74579 1 182 . 1 1 33 33 LYS H H 33 7.430 7.430 7.520 -0.090 17919 74580 1 182 . 1 1 34 34 GLU N N 34 113.870 113.870 113.991 -0.121 17919 74581 1 182 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.498 0.127 17919 74582 1 182 . 1 1 34 34 GLU C C 34 177.840 177.840 177.411 0.429 17919 74583 1 182 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.498 -0.328 17919 74584 1 182 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.047 1.613 17919 74585 1 182 . 1 1 34 34 GLU H H 34 8.740 8.740 8.092 0.648 17919 74586 1 182 . 1 1 35 35 GLY N N 35 108.650 108.650 109.250 -0.600 17919 74587 1 182 . 1 1 35 35 GLY C C 35 173.960 173.960 174.123 -0.163 17919 74588 1 182 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.850 0.230 17919 74589 1 182 . 1 1 35 35 GLY H H 35 8.530 8.530 8.306 0.224 17919 74590 1 182 . 1 1 36 36 ILE N N 36 119.880 119.880 122.451 -2.571 17919 74591 1 182 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.404 0.041 17919 74592 1 182 . 1 1 36 36 ILE C C 36 173.590 173.590 174.260 -0.670 17919 74593 1 182 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.522 0.228 17919 74594 1 182 . 1 1 36 36 ILE CB C 36 40.580 40.580 39.547 1.033 17919 74595 1 182 . 1 1 36 36 ILE H H 36 6.150 6.150 7.590 -1.440 17919 74596 1 182 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.918 -0.284 17919 74597 1 182 . 1 1 37 37 PRO C C 37 176.940 176.940 176.070 0.870 17919 74598 1 182 . 1 1 37 37 PRO CA C 37 61.660 61.660 60.964 0.696 17919 74599 1 182 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.377 0.473 17919 74600 1 182 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.150 -0.033 17919 74601 1 182 . 1 1 38 38 PRO C C 38 178.320 178.320 178.656 -0.336 17919 74602 1 182 . 1 1 38 38 PRO CA C 38 66.260 66.260 66.112 0.148 17919 74603 1 182 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.823 1.067 17919 74604 1 182 . 1 1 39 39 ASP N N 39 113.380 113.380 115.937 -2.557 17919 74605 1 182 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.352 0.078 17919 74606 1 182 . 1 1 39 39 ASP C C 39 177.090 177.090 177.802 -0.712 17919 74607 1 182 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.980 -1.340 17919 74608 1 182 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.367 -0.827 17919 74609 1 182 . 1 1 39 39 ASP H H 39 8.550 8.550 8.586 -0.036 17919 74610 1 182 . 1 1 40 40 GLN N N 40 116.780 116.780 115.968 0.812 17919 74611 1 182 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.347 0.117 17919 74612 1 182 . 1 1 40 40 GLN C C 40 175.380 175.380 176.023 -0.643 17919 74613 1 182 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.588 0.052 17919 74614 1 182 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.035 1.105 17919 74615 1 182 . 1 1 40 40 GLN H H 40 7.820 7.820 8.253 -0.433 17919 74616 1 182 . 1 1 41 41 GLN N N 41 117.720 117.720 119.603 -1.883 17919 74617 1 182 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.741 -0.497 17919 74618 1 182 . 1 1 41 41 GLN C C 41 176.300 176.300 175.195 1.105 17919 74619 1 182 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.824 0.646 17919 74620 1 182 . 1 1 41 41 GLN CB C 41 31.650 31.650 30.216 1.434 17919 74621 1 182 . 1 1 41 41 GLN H H 41 7.480 7.480 7.462 0.018 17919 74622 1 182 . 1 1 42 42 ARG N N 42 122.680 122.680 122.839 -0.159 17919 74623 1 182 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.670 -0.170 17919 74624 1 182 . 1 1 42 42 ARG C C 42 174.050 174.050 174.500 -0.450 17919 74625 1 182 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.883 0.167 17919 74626 1 182 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.112 -1.362 17919 74627 1 182 . 1 1 42 42 ARG H H 42 8.530 8.530 8.897 -0.367 17919 74628 1 182 . 1 1 43 43 LEU N N 43 124.040 124.040 126.673 -2.633 17919 74629 1 182 . 1 1 43 43 LEU C C 43 175.290 175.290 175.473 -0.183 17919 74630 1 182 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.900 -0.920 17919 74631 1 182 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.495 2.295 17919 74632 1 182 . 1 1 43 43 LEU H H 43 8.820 8.820 8.884 -0.064 17919 74633 1 182 . 1 1 44 44 ILE N N 44 121.920 121.920 123.614 -1.694 17919 74634 1 182 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.867 0.125 17919 74635 1 182 . 1 1 44 44 ILE C C 44 176.060 176.060 174.309 1.751 17919 74636 1 182 . 1 1 44 44 ILE CA C 44 58.980 58.980 58.697 0.283 17919 74637 1 182 . 1 1 44 44 ILE CB C 44 41.420 41.420 39.039 2.381 17919 74638 1 182 . 1 1 44 44 ILE H H 44 9.030 9.030 8.786 0.244 17919 74639 1 182 . 1 1 45 45 PHE N N 45 125.390 125.390 128.125 -2.735 17919 74640 1 182 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.977 0.068 17919 74641 1 182 . 1 1 45 45 PHE C C 45 174.470 174.470 174.336 0.134 17919 74642 1 182 . 1 1 45 45 PHE CA C 45 57.020 57.020 55.645 1.375 17919 74643 1 182 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.750 1.010 17919 74644 1 182 . 1 1 45 45 PHE H H 45 8.830 8.830 9.027 -0.197 17919 74645 1 182 . 1 1 46 46 ALA N N 46 132.200 132.200 130.427 1.773 17919 74646 1 182 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.777 -0.087 17919 74647 1 182 . 1 1 46 46 ALA C C 46 177.290 177.290 177.828 -0.538 17919 74648 1 182 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.444 0.096 17919 74649 1 182 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.399 0.171 17919 74650 1 182 . 1 1 46 46 ALA H H 46 8.810 8.810 9.088 -0.278 17919 74651 1 182 . 1 1 47 47 GLY N N 47 102.340 102.340 104.083 -1.743 17919 74652 1 182 . 1 1 47 47 GLY C C 47 173.810 173.810 174.152 -0.342 17919 74653 1 182 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.808 0.542 17919 74654 1 182 . 1 1 47 47 GLY H H 47 8.130 8.130 8.476 -0.346 17919 74655 1 182 . 1 1 48 48 LYS N N 48 121.570 121.570 121.880 -0.310 17919 74656 1 182 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.593 0.029 17919 74657 1 182 . 1 1 48 48 LYS C C 48 174.700 174.700 175.112 -0.412 17919 74658 1 182 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.935 -0.385 17919 74659 1 182 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.587 -0.057 17919 74660 1 182 . 1 1 48 48 LYS H H 48 7.980 7.980 7.914 0.066 17919 74661 1 182 . 1 1 49 49 GLN N N 49 122.410 122.410 125.479 -3.069 17919 74662 1 182 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.682 -0.122 17919 74663 1 182 . 1 1 49 49 GLN C C 49 175.670 175.670 175.558 0.112 17919 74664 1 182 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.160 -0.420 17919 74665 1 182 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.590 -0.591 17919 74666 1 182 . 1 1 49 49 GLN H H 49 8.600 8.600 8.613 -0.013 17919 74667 1 182 . 1 1 50 50 LEU N N 50 125.520 125.520 128.008 -2.488 17919 74668 1 182 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.373 -0.283 17919 74669 1 182 . 1 1 50 50 LEU C C 50 176.660 176.660 176.159 0.501 17919 74670 1 182 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.828 0.412 17919 74671 1 182 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.782 -1.212 17919 74672 1 182 . 1 1 50 50 LEU H H 50 8.530 8.530 8.801 -0.271 17919 74673 1 182 . 1 1 51 51 GLU N N 51 122.940 122.940 121.458 1.482 17919 74674 1 182 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.574 -0.086 17919 74675 1 182 . 1 1 51 51 GLU C C 51 175.870 175.870 177.268 -1.398 17919 74676 1 182 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.021 0.939 17919 74677 1 182 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.085 -0.515 17919 74678 1 182 . 1 1 51 51 GLU H H 51 8.400 8.400 8.145 0.255 17919 74679 1 182 . 1 1 52 52 ASP N N 52 120.030 120.030 124.002 -3.972 17919 74680 1 182 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.473 -0.114 17919 74681 1 182 . 1 1 52 52 ASP C C 52 177.330 177.330 178.212 -0.882 17919 74682 1 182 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.671 -0.711 17919 74683 1 182 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.730 0.120 17919 74684 1 182 . 1 1 52 52 ASP H H 52 8.160 8.160 8.937 -0.777 17919 74685 1 182 . 1 1 53 53 GLY N N 53 106.660 106.660 105.881 0.779 17919 74686 1 182 . 1 1 53 53 GLY C C 53 174.870 174.870 174.341 0.529 17919 74687 1 182 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.960 0.210 17919 74688 1 182 . 1 1 53 53 GLY H H 53 9.390 9.390 8.398 0.992 17919 74689 1 182 . 1 1 54 54 ARG N N 54 119.050 119.050 120.694 -1.644 17919 74690 1 182 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.628 0.067 17919 74691 1 182 . 1 1 54 54 ARG C C 54 175.350 175.350 175.373 -0.023 17919 74692 1 182 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.709 -0.320 17919 74693 1 182 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.579 0.071 17919 74694 1 182 . 1 1 54 54 ARG H H 54 7.460 7.460 7.453 0.007 17919 74695 1 182 . 1 1 55 55 THR N N 55 108.400 108.400 112.279 -3.879 17919 74696 1 182 . 1 1 55 55 THR HA H 55 5.240 5.240 4.924 0.316 17919 74697 1 182 . 1 1 55 55 THR C C 55 176.560 176.560 176.044 0.516 17919 74698 1 182 . 1 1 55 55 THR CA C 55 59.690 59.690 60.593 -0.903 17919 74699 1 182 . 1 1 55 55 THR CB C 55 72.260 72.260 70.632 1.628 17919 74700 1 182 . 1 1 55 55 THR H H 55 8.730 8.730 9.016 -0.286 17919 74701 1 182 . 1 1 56 56 LEU N N 56 117.920 117.920 123.446 -5.526 17919 74702 1 182 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.876 0.184 17919 74703 1 182 . 1 1 56 56 LEU C C 56 180.810 180.810 178.875 1.935 17919 74704 1 182 . 1 1 56 56 LEU CA C 56 58.710 58.710 59.421 -0.711 17919 74705 1 182 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.620 -1.250 17919 74706 1 182 . 1 1 56 56 LEU H H 56 8.140 8.140 8.609 -0.469 17919 74707 1 182 . 1 1 57 57 SER N N 57 113.330 113.330 114.837 -1.507 17919 74708 1 182 . 1 1 57 57 SER HA H 57 4.370 4.370 4.093 0.277 17919 74709 1 182 . 1 1 57 57 SER C C 57 178.310 178.310 176.961 1.349 17919 74710 1 182 . 1 1 57 57 SER CA C 57 61.080 61.080 62.161 -1.081 17919 74711 1 182 . 1 1 57 57 SER CB C 57 62.530 62.530 62.767 -0.237 17919 74712 1 182 . 1 1 57 57 SER H H 57 8.470 8.470 8.018 0.452 17919 74713 1 182 . 1 1 58 58 ASP N N 58 124.190 124.190 122.591 1.599 17919 74714 1 182 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.354 -0.058 17919 74715 1 182 . 1 1 58 58 ASP C C 58 177.400 177.400 177.563 -0.163 17919 74716 1 182 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.730 0.450 17919 74717 1 182 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.479 -0.379 17919 74718 1 182 . 1 1 58 58 ASP H H 58 7.930 7.930 7.710 0.220 17919 74719 1 182 . 1 1 59 59 TYR N N 59 115.510 115.510 116.019 -0.509 17919 74720 1 182 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.561 0.109 17919 74721 1 182 . 1 1 59 59 TYR C C 59 174.700 174.700 175.157 -0.457 17919 74722 1 182 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.563 0.687 17919 74723 1 182 . 1 1 59 59 TYR CB C 59 40.070 40.070 37.977 2.093 17919 74724 1 182 . 1 1 59 59 TYR H H 59 7.250 7.250 7.555 -0.305 17919 74725 1 182 . 1 1 60 60 ASN N N 60 115.900 115.900 114.881 1.019 17919 74726 1 182 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.403 -0.048 17919 74727 1 182 . 1 1 60 60 ASN C C 60 174.340 174.340 174.542 -0.202 17919 74728 1 182 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.656 -0.535 17919 74729 1 182 . 1 1 60 60 ASN CB C 60 37.410 37.410 36.756 0.654 17919 74730 1 182 . 1 1 60 60 ASN H H 60 8.150 8.150 7.944 0.206 17919 74731 1 182 . 1 1 61 61 ILE N N 61 118.600 118.600 119.608 -1.008 17919 74732 1 182 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.937 -0.544 17919 74733 1 182 . 1 1 61 61 ILE C C 61 174.610 174.610 175.020 -0.410 17919 74734 1 182 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.157 0.263 17919 74735 1 182 . 1 1 61 61 ILE CB C 61 36.740 36.740 38.472 -1.732 17919 74736 1 182 . 1 1 61 61 ILE H H 61 7.250 7.250 7.973 -0.723 17919 74737 1 182 . 1 1 62 62 GLN N N 62 124.740 124.740 125.136 -0.396 17919 74738 1 182 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.842 -0.336 17919 74739 1 182 . 1 1 62 62 GLN C C 62 175.970 175.970 175.312 0.658 17919 74740 1 182 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.443 0.217 17919 74741 1 182 . 1 1 62 62 GLN CB C 62 31.650 31.650 32.561 -0.911 17919 74742 1 182 . 1 1 62 62 GLN H H 62 7.610 7.610 8.043 -0.433 17919 74743 1 182 . 1 1 63 63 LYS N N 63 120.300 120.300 120.876 -0.576 17919 74744 1 182 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.046 -0.045 17919 74745 1 182 . 1 1 63 63 LYS C C 63 175.810 175.810 177.003 -1.193 17919 74746 1 182 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.601 0.189 17919 74747 1 182 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.982 0.668 17919 74748 1 182 . 1 1 63 63 LYS H H 63 8.490 8.490 8.514 -0.024 17919 74749 1 182 . 1 1 64 64 GLU N N 64 113.950 113.950 119.274 -5.324 17919 74750 1 182 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.732 -0.267 17919 74751 1 182 . 1 1 64 64 GLU C C 64 175.250 175.250 176.260 -1.010 17919 74752 1 182 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.627 0.263 17919 74753 1 182 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.935 -3.035 17919 74754 1 182 . 1 1 64 64 GLU H H 64 9.280 9.280 8.778 0.502 17919 74755 1 182 . 1 1 65 65 SER N N 65 114.730 114.730 115.941 -1.211 17919 74756 1 182 . 1 1 65 65 SER HA H 65 4.640 4.640 4.358 0.282 17919 74757 1 182 . 1 1 65 65 SER C C 65 172.160 172.160 173.639 -1.479 17919 74758 1 182 . 1 1 65 65 SER CA C 65 60.890 60.890 60.118 0.772 17919 74759 1 182 . 1 1 65 65 SER CB C 65 64.910 64.910 64.150 0.760 17919 74760 1 182 . 1 1 65 65 SER H H 65 7.670 7.670 7.234 0.436 17919 74761 1 182 . 1 1 66 66 THR N N 66 117.110 117.110 119.087 -1.977 17919 74762 1 182 . 1 1 66 66 THR HA H 66 5.270 5.270 5.214 0.056 17919 74763 1 182 . 1 1 66 66 THR C C 66 173.950 173.950 174.092 -0.142 17919 74764 1 182 . 1 1 66 66 THR CA C 66 62.340 62.340 61.212 1.128 17919 74765 1 182 . 1 1 66 66 THR CB C 66 70.080 70.080 70.296 -0.216 17919 74766 1 182 . 1 1 66 66 THR H H 66 8.730 8.730 8.467 0.263 17919 74767 1 182 . 1 1 67 67 LEU N N 67 127.110 127.110 126.546 0.564 17919 74768 1 182 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.816 0.244 17919 74769 1 182 . 1 1 67 67 LEU C C 67 175.770 175.770 175.130 0.640 17919 74770 1 182 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.319 0.581 17919 74771 1 182 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.282 -0.023 17919 74772 1 182 . 1 1 67 67 LEU H H 67 9.410 9.410 8.987 0.423 17919 74773 1 182 . 1 1 68 68 HIS N N 68 118.380 118.380 120.933 -2.553 17919 74774 1 182 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.561 -0.321 17919 74775 1 182 . 1 1 68 68 HIS C C 68 173.150 173.150 173.628 -0.478 17919 74776 1 182 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.272 0.729 17919 74777 1 182 . 1 1 68 68 HIS CB C 68 30.530 30.530 33.322 -2.792 17919 74778 1 182 . 1 1 68 68 HIS H H 68 9.230 9.230 8.296 0.934 17919 74779 1 182 . 1 1 69 69 LEU N N 69 124.460 124.460 129.863 -5.403 17919 74780 1 182 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.773 0.417 17919 74781 1 182 . 1 1 69 69 LEU C C 69 175.270 175.270 174.000 1.270 17919 74782 1 182 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.483 0.407 17919 74783 1 182 . 1 1 69 69 LEU CB C 69 44.380 44.380 43.694 0.686 17919 74784 1 182 . 1 1 69 69 LEU H H 69 8.340 8.340 8.512 -0.172 17919 74785 1 182 . 1 1 70 70 VAL N N 70 126.940 126.940 127.380 -0.440 17919 74786 1 182 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.336 0.014 17919 74787 1 182 . 1 1 70 70 VAL C C 70 174.000 174.000 174.320 -0.320 17919 74788 1 182 . 1 1 70 70 VAL CA C 70 60.800 60.800 61.109 -0.309 17919 74789 1 182 . 1 1 70 70 VAL CB C 70 34.910 34.910 34.477 0.433 17919 74790 1 182 . 1 1 70 70 VAL H H 70 9.200 9.200 9.093 0.107 17919 74791 1 182 . 1 1 71 71 LEU N N 71 123.130 123.130 124.798 -1.668 17919 74792 1 182 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.012 0.048 17919 74793 1 182 . 1 1 71 71 LEU C C 71 177.830 177.830 177.160 0.670 17919 74794 1 182 . 1 1 71 71 LEU CA C 71 53.940 53.940 52.449 1.491 17919 74795 1 182 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.298 -0.448 17919 74796 1 182 . 1 1 71 71 LEU H H 71 8.120 8.120 8.495 -0.375 17919 74797 1 182 . 1 1 72 72 ARG N N 72 123.490 123.490 122.778 0.712 17919 74798 1 182 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.352 -0.051 17919 74799 1 182 . 1 1 72 72 ARG C C 72 175.350 175.350 175.628 -0.278 17919 74800 1 182 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.800 -1.190 17919 74801 1 182 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.451 0.899 17919 74802 1 182 . 1 1 72 72 ARG H H 72 8.580 8.580 8.359 0.221 17919 74803 1 183 . 1 1 2 2 GLN N N 2 123.220 123.220 120.953 2.267 17919 74804 1 183 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.063 0.186 17919 74805 1 183 . 1 1 2 2 GLN C C 2 175.920 175.920 174.748 1.172 17919 74806 1 183 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.561 0.519 17919 74807 1 183 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.459 0.301 17919 74808 1 183 . 1 1 2 2 GLN H H 2 8.900 8.900 8.200 0.700 17919 74809 1 183 . 1 1 3 3 ILE N N 3 115.340 115.340 117.399 -2.059 17919 74810 1 183 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.316 -0.103 17919 74811 1 183 . 1 1 3 3 ILE C C 3 172.450 172.450 172.835 -0.385 17919 74812 1 183 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.402 0.168 17919 74813 1 183 . 1 1 3 3 ILE CB C 3 42.210 42.210 42.014 0.196 17919 74814 1 183 . 1 1 3 3 ILE H H 3 8.320 8.320 8.637 -0.317 17919 74815 1 183 . 1 1 4 4 PHE N N 4 118.110 118.110 118.896 -0.786 17919 74816 1 183 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.652 -0.022 17919 74817 1 183 . 1 1 4 4 PHE C C 4 175.320 175.320 175.142 0.178 17919 74818 1 183 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.238 -0.028 17919 74819 1 183 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.649 -1.169 17919 74820 1 183 . 1 1 4 4 PHE H H 4 8.610 8.610 8.259 0.351 17919 74821 1 183 . 1 1 5 5 VAL N N 5 121.000 121.000 121.745 -0.745 17919 74822 1 183 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.801 -0.076 17919 74823 1 183 . 1 1 5 5 VAL C C 5 174.870 174.870 174.394 0.476 17919 74824 1 183 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.182 -0.562 17919 74825 1 183 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.661 -0.431 17919 74826 1 183 . 1 1 5 5 VAL H H 5 9.300 9.300 9.375 -0.075 17919 74827 1 183 . 1 1 6 6 LYS N N 6 127.520 127.520 129.522 -2.002 17919 74828 1 183 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.060 0.307 17919 74829 1 183 . 1 1 6 6 LYS C C 6 177.140 177.140 176.356 0.784 17919 74830 1 183 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.815 -0.295 17919 74831 1 183 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.840 0.210 17919 74832 1 183 . 1 1 6 6 LYS H H 6 8.820 8.820 9.424 -0.604 17919 74833 1 183 . 1 1 7 7 THR N N 7 115.400 115.400 117.782 -2.382 17919 74834 1 183 . 1 1 7 7 THR HA H 7 4.970 4.970 4.525 0.445 17919 74835 1 183 . 1 1 7 7 THR C C 7 176.910 176.910 175.418 1.492 17919 74836 1 183 . 1 1 7 7 THR CA C 7 60.470 60.470 61.739 -1.269 17919 74837 1 183 . 1 1 7 7 THR CB C 7 70.630 70.630 70.249 0.381 17919 74838 1 183 . 1 1 7 7 THR H H 7 8.730 8.730 9.051 -0.321 17919 74839 1 183 . 1 1 8 8 LEU N N 8 121.330 121.330 121.173 0.157 17919 74840 1 183 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.490 -0.180 17919 74841 1 183 . 1 1 8 8 LEU C C 8 178.800 178.800 177.541 1.259 17919 74842 1 183 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.098 0.482 17919 74843 1 183 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.388 -0.417 17919 74844 1 183 . 1 1 8 8 LEU H H 8 9.100 9.100 8.359 0.741 17919 74845 1 183 . 1 1 9 9 THR N N 9 105.590 105.590 108.255 -2.665 17919 74846 1 183 . 1 1 9 9 THR HA H 9 4.428 4.428 4.330 0.098 17919 74847 1 183 . 1 1 9 9 THR C C 9 175.520 175.520 175.311 0.209 17919 74848 1 183 . 1 1 9 9 THR CA C 9 61.400 61.400 61.622 -0.222 17919 74849 1 183 . 1 1 9 9 THR CB C 9 69.140 69.140 68.274 0.866 17919 74850 1 183 . 1 1 9 9 THR H H 9 7.630 7.630 7.763 -0.133 17919 74851 1 183 . 1 1 10 10 GLY N N 10 108.890 108.890 111.076 -2.186 17919 74852 1 183 . 1 1 10 10 GLY C C 10 174.070 174.070 173.374 0.696 17919 74853 1 183 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.093 0.367 17919 74854 1 183 . 1 1 10 10 GLY H H 10 7.810 7.810 7.587 0.223 17919 74855 1 183 . 1 1 11 11 LYS N N 11 121.600 121.600 120.582 1.018 17919 74856 1 183 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.695 -0.334 17919 74857 1 183 . 1 1 11 11 LYS C C 11 175.940 175.940 175.633 0.307 17919 74858 1 183 . 1 1 11 11 LYS CA C 11 56.280 56.280 54.539 1.741 17919 74859 1 183 . 1 1 11 11 LYS CB C 11 33.200 33.200 35.043 -1.843 17919 74860 1 183 . 1 1 11 11 LYS H H 11 7.280 7.280 7.946 -0.666 17919 74861 1 183 . 1 1 12 12 THR N N 12 120.440 120.440 120.937 -0.497 17919 74862 1 183 . 1 1 12 12 THR HA H 12 5.046 5.046 5.099 -0.053 17919 74863 1 183 . 1 1 12 12 THR C C 12 174.320 174.320 174.391 -0.071 17919 74864 1 183 . 1 1 12 12 THR CA C 12 62.390 62.390 62.175 0.215 17919 74865 1 183 . 1 1 12 12 THR CB C 12 69.910 69.910 69.595 0.315 17919 74866 1 183 . 1 1 12 12 THR H H 12 8.650 8.650 8.396 0.254 17919 74867 1 183 . 1 1 13 13 ILE N N 13 127.110 127.110 122.791 4.319 17919 74868 1 183 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.792 -0.248 17919 74869 1 183 . 1 1 13 13 ILE C C 13 175.220 175.220 174.821 0.399 17919 74870 1 183 . 1 1 13 13 ILE CA C 13 59.980 59.980 58.957 1.023 17919 74871 1 183 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.330 -0.380 17919 74872 1 183 . 1 1 13 13 ILE H H 13 9.450 9.450 9.123 0.327 17919 74873 1 183 . 1 1 14 14 THR N N 14 121.520 121.520 122.160 -0.640 17919 74874 1 183 . 1 1 14 14 THR HA H 14 4.964 4.964 4.988 -0.024 17919 74875 1 183 . 1 1 14 14 THR C C 14 173.790 173.790 173.949 -0.159 17919 74876 1 183 . 1 1 14 14 THR CA C 14 61.940 61.940 62.342 -0.402 17919 74877 1 183 . 1 1 14 14 THR CB C 14 69.650 69.650 69.574 0.076 17919 74878 1 183 . 1 1 14 14 THR H H 14 8.710 8.710 8.571 0.139 17919 74879 1 183 . 1 1 15 15 LEU N N 15 124.800 124.800 127.268 -2.468 17919 74880 1 183 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.735 0.045 17919 74881 1 183 . 1 1 15 15 LEU C C 15 174.670 174.670 175.796 -1.126 17919 74882 1 183 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.739 -0.909 17919 74883 1 183 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.451 1.619 17919 74884 1 183 . 1 1 15 15 LEU H H 15 8.710 8.710 9.043 -0.333 17919 74885 1 183 . 1 1 16 16 GLU N N 16 122.160 122.160 122.228 -0.068 17919 74886 1 183 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.163 -0.246 17919 74887 1 183 . 1 1 16 16 GLU C C 16 175.860 175.860 175.838 0.022 17919 74888 1 183 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.249 -0.429 17919 74889 1 183 . 1 1 16 16 GLU CB C 16 29.450 29.450 31.110 -1.660 17919 74890 1 183 . 1 1 16 16 GLU H H 16 8.140 8.140 8.650 -0.510 17919 74891 1 183 . 1 1 17 17 VAL N N 17 117.210 117.210 119.193 -1.983 17919 74892 1 183 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.959 -0.245 17919 74893 1 183 . 1 1 17 17 VAL C C 17 174.160 174.160 174.818 -0.658 17919 74894 1 183 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.964 -0.534 17919 74895 1 183 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.738 0.662 17919 74896 1 183 . 1 1 17 17 VAL H H 17 8.900 8.900 8.690 0.210 17919 74897 1 183 . 1 1 18 18 GLU N N 18 118.990 118.990 122.341 -3.351 17919 74898 1 183 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.858 0.221 17919 74899 1 183 . 1 1 18 18 GLU C C 18 176.160 176.160 175.582 0.578 17919 74900 1 183 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.410 0.310 17919 74901 1 183 . 1 1 18 18 GLU CB C 18 30.310 30.310 31.198 -0.888 17919 74902 1 183 . 1 1 18 18 GLU H H 18 8.640 8.640 8.619 0.021 17919 74903 1 183 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.237 -0.096 17919 74904 1 183 . 1 1 19 19 PRO C C 19 175.310 175.310 178.101 -2.791 17919 74905 1 183 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.787 -0.317 17919 74906 1 183 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.989 -0.039 17919 74907 1 183 . 1 1 20 20 SER N N 20 103.400 103.400 110.584 -7.184 17919 74908 1 183 . 1 1 20 20 SER HA H 20 4.370 4.370 4.274 0.096 17919 74909 1 183 . 1 1 20 20 SER C C 20 174.660 174.660 174.119 0.541 17919 74910 1 183 . 1 1 20 20 SER CA C 20 57.400 57.400 58.745 -1.345 17919 74911 1 183 . 1 1 20 20 SER CB C 20 63.370 63.370 62.658 0.712 17919 74912 1 183 . 1 1 20 20 SER H H 20 7.040 7.040 8.145 -1.105 17919 74913 1 183 . 1 1 21 21 ASP N N 21 123.480 123.480 122.796 0.684 17919 74914 1 183 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.722 -0.027 17919 74915 1 183 . 1 1 21 21 ASP C C 21 176.360 176.360 176.104 0.256 17919 74916 1 183 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.866 0.834 17919 74917 1 183 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.267 -0.467 17919 74918 1 183 . 1 1 21 21 ASP H H 21 8.030 8.030 7.633 0.397 17919 74919 1 183 . 1 1 22 22 THR N N 22 108.800 108.800 114.184 -5.384 17919 74920 1 183 . 1 1 22 22 THR HA H 22 4.920 4.920 4.621 0.299 17919 74921 1 183 . 1 1 22 22 THR C C 22 176.750 176.750 176.204 0.546 17919 74922 1 183 . 1 1 22 22 THR CA C 22 59.690 59.690 62.122 -2.432 17919 74923 1 183 . 1 1 22 22 THR CB C 22 71.200 71.200 70.451 0.749 17919 74924 1 183 . 1 1 22 22 THR H H 22 7.900 7.900 8.232 -0.332 17919 74925 1 183 . 1 1 23 23 ILE N N 23 121.190 121.190 122.950 -1.760 17919 74926 1 183 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.809 -0.152 17919 74927 1 183 . 1 1 23 23 ILE C C 23 179.040 179.040 177.914 1.126 17919 74928 1 183 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.682 -0.422 17919 74929 1 183 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.348 -1.998 17919 74930 1 183 . 1 1 23 23 ILE H H 23 8.560 8.560 8.603 -0.043 17919 74931 1 183 . 1 1 24 24 GLU N N 24 120.830 120.830 121.128 -0.298 17919 74932 1 183 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.869 0.048 17919 74933 1 183 . 1 1 24 24 GLU C C 24 178.640 178.640 178.603 0.037 17919 74934 1 183 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.064 0.156 17919 74935 1 183 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.392 -1.112 17919 74936 1 183 . 1 1 24 24 GLU H H 24 9.760 9.760 7.948 1.812 17919 74937 1 183 . 1 1 25 25 ASN N N 25 120.570 120.570 117.913 2.657 17919 74938 1 183 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.494 0.031 17919 74939 1 183 . 1 1 25 25 ASN C C 25 178.380 178.380 177.782 0.598 17919 74940 1 183 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.201 -0.141 17919 74941 1 183 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.615 -0.165 17919 74942 1 183 . 1 1 25 25 ASN H H 25 7.920 7.920 7.811 0.109 17919 74943 1 183 . 1 1 26 26 VAL N N 26 121.710 121.710 120.688 1.022 17919 74944 1 183 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.527 -0.130 17919 74945 1 183 . 1 1 26 26 VAL C C 26 177.950 177.950 177.984 -0.034 17919 74946 1 183 . 1 1 26 26 VAL CA C 26 67.660 67.660 67.013 0.647 17919 74947 1 183 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.453 -0.613 17919 74948 1 183 . 1 1 26 26 VAL H H 26 8.070 8.070 8.201 -0.131 17919 74949 1 183 . 1 1 27 27 LYS N N 27 118.860 118.860 118.981 -0.121 17919 74950 1 183 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.194 0.386 17919 74951 1 183 . 1 1 27 27 LYS C C 27 180.550 180.550 178.882 1.668 17919 74952 1 183 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.258 -0.008 17919 74953 1 183 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.348 1.382 17919 74954 1 183 . 1 1 27 27 LYS H H 27 8.560 8.560 8.276 0.284 17919 74955 1 183 . 1 1 28 28 ALA N N 28 123.440 123.440 121.951 1.489 17919 74956 1 183 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.275 -0.115 17919 74957 1 183 . 1 1 28 28 ALA C C 28 180.300 180.300 178.955 1.345 17919 74958 1 183 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.258 1.112 17919 74959 1 183 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.505 -0.795 17919 74960 1 183 . 1 1 28 28 ALA H H 28 8.060 8.060 7.897 0.163 17919 74961 1 183 . 1 1 29 29 LYS N N 29 119.940 119.940 120.461 -0.521 17919 74962 1 183 . 1 1 29 29 LYS HA H 29 4.207 4.207 3.974 0.233 17919 74963 1 183 . 1 1 29 29 LYS C C 29 180.320 180.320 178.959 1.361 17919 74964 1 183 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.842 -0.192 17919 74965 1 183 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.361 0.929 17919 74966 1 183 . 1 1 29 29 LYS H H 29 7.850 7.850 8.141 -0.291 17919 74967 1 183 . 1 1 30 30 ILE N N 30 121.080 121.080 119.565 1.515 17919 74968 1 183 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.656 -0.149 17919 74969 1 183 . 1 1 30 30 ILE C C 30 178.310 178.310 177.584 0.726 17919 74970 1 183 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.261 0.889 17919 74971 1 183 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.888 -1.088 17919 74972 1 183 . 1 1 30 30 ILE H H 30 8.280 8.280 7.763 0.517 17919 74973 1 183 . 1 1 31 31 GLN N N 31 123.490 123.490 119.929 3.561 17919 74974 1 183 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.932 -0.103 17919 74975 1 183 . 1 1 31 31 GLN C C 31 178.890 178.890 178.277 0.613 17919 74976 1 183 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.293 0.707 17919 74977 1 183 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.409 -0.689 17919 74978 1 183 . 1 1 31 31 GLN H H 31 8.580 8.580 7.961 0.619 17919 74979 1 183 . 1 1 32 32 ASP N N 32 119.360 119.360 119.955 -0.595 17919 74980 1 183 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.428 -0.074 17919 74981 1 183 . 1 1 32 32 ASP C C 32 177.250 177.250 177.994 -0.744 17919 74982 1 183 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.827 0.363 17919 74983 1 183 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.871 -0.291 17919 74984 1 183 . 1 1 32 32 ASP H H 32 8.010 8.010 8.270 -0.260 17919 74985 1 183 . 1 1 33 33 LYS N N 33 115.130 115.130 118.246 -3.116 17919 74986 1 183 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.246 0.091 17919 74987 1 183 . 1 1 33 33 LYS C C 33 177.870 177.870 178.071 -0.201 17919 74988 1 183 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.307 -0.257 17919 74989 1 183 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.554 0.616 17919 74990 1 183 . 1 1 33 33 LYS H H 33 7.430 7.430 7.485 -0.055 17919 74991 1 183 . 1 1 34 34 GLU N N 34 113.870 113.870 114.454 -0.584 17919 74992 1 183 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.485 0.140 17919 74993 1 183 . 1 1 34 34 GLU C C 34 177.840 177.840 176.759 1.081 17919 74994 1 183 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.846 -0.676 17919 74995 1 183 . 1 1 34 34 GLU CB C 34 32.660 32.660 30.938 1.722 17919 74996 1 183 . 1 1 34 34 GLU H H 34 8.740 8.740 7.835 0.905 17919 74997 1 183 . 1 1 35 35 GLY N N 35 108.650 108.650 109.140 -0.490 17919 74998 1 183 . 1 1 35 35 GLY C C 35 173.960 173.960 174.555 -0.595 17919 74999 1 183 . 1 1 35 35 GLY CA C 35 46.080 46.080 46.125 -0.045 17919 75000 1 183 . 1 1 35 35 GLY H H 35 8.530 8.530 8.380 0.150 17919 75001 1 183 . 1 1 36 36 ILE N N 36 119.880 119.880 121.952 -2.072 17919 75002 1 183 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.132 0.313 17919 75003 1 183 . 1 1 36 36 ILE C C 36 173.590 173.590 173.861 -0.271 17919 75004 1 183 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.815 -1.065 17919 75005 1 183 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.199 2.381 17919 75006 1 183 . 1 1 36 36 ILE H H 36 6.150 6.150 7.692 -1.542 17919 75007 1 183 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.587 0.047 17919 75008 1 183 . 1 1 37 37 PRO C C 37 176.940 176.940 176.041 0.899 17919 75009 1 183 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.635 0.025 17919 75010 1 183 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.467 0.383 17919 75011 1 183 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.093 0.024 17919 75012 1 183 . 1 1 38 38 PRO C C 38 178.320 178.320 178.793 -0.473 17919 75013 1 183 . 1 1 38 38 PRO CA C 38 66.260 66.260 66.082 0.179 17919 75014 1 183 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.832 1.058 17919 75015 1 183 . 1 1 39 39 ASP N N 39 113.380 113.380 115.097 -1.717 17919 75016 1 183 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.320 0.110 17919 75017 1 183 . 1 1 39 39 ASP C C 39 177.090 177.090 177.463 -0.373 17919 75018 1 183 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.738 -1.098 17919 75019 1 183 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.341 -0.801 17919 75020 1 183 . 1 1 39 39 ASP H H 39 8.550 8.550 8.558 -0.008 17919 75021 1 183 . 1 1 40 40 GLN N N 40 116.780 116.780 116.192 0.588 17919 75022 1 183 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.197 0.267 17919 75023 1 183 . 1 1 40 40 GLN C C 40 175.380 175.380 176.427 -1.047 17919 75024 1 183 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.156 -0.516 17919 75025 1 183 . 1 1 40 40 GLN CB C 40 30.140 30.140 28.983 1.157 17919 75026 1 183 . 1 1 40 40 GLN H H 40 7.820 7.820 8.154 -0.334 17919 75027 1 183 . 1 1 41 41 GLN N N 41 117.720 117.720 118.759 -1.039 17919 75028 1 183 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.814 -0.570 17919 75029 1 183 . 1 1 41 41 GLN C C 41 176.300 176.300 175.257 1.043 17919 75030 1 183 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.365 1.105 17919 75031 1 183 . 1 1 41 41 GLN CB C 41 31.650 31.650 30.348 1.302 17919 75032 1 183 . 1 1 41 41 GLN H H 41 7.480 7.480 7.499 -0.019 17919 75033 1 183 . 1 1 42 42 ARG N N 42 122.680 122.680 122.395 0.285 17919 75034 1 183 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.586 -0.086 17919 75035 1 183 . 1 1 42 42 ARG C C 42 174.050 174.050 174.489 -0.439 17919 75036 1 183 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.018 0.032 17919 75037 1 183 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.568 -0.818 17919 75038 1 183 . 1 1 42 42 ARG H H 42 8.530 8.530 8.078 0.452 17919 75039 1 183 . 1 1 43 43 LEU N N 43 124.040 124.040 125.785 -1.745 17919 75040 1 183 . 1 1 43 43 LEU C C 43 175.290 175.290 175.653 -0.363 17919 75041 1 183 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.671 -0.691 17919 75042 1 183 . 1 1 43 43 LEU CB C 43 45.790 45.790 42.977 2.813 17919 75043 1 183 . 1 1 43 43 LEU H H 43 8.820 8.820 8.695 0.125 17919 75044 1 183 . 1 1 44 44 ILE N N 44 121.920 121.920 122.614 -0.694 17919 75045 1 183 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.753 0.239 17919 75046 1 183 . 1 1 44 44 ILE C C 44 176.060 176.060 174.226 1.834 17919 75047 1 183 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.670 -0.690 17919 75048 1 183 . 1 1 44 44 ILE CB C 44 41.420 41.420 40.235 1.185 17919 75049 1 183 . 1 1 44 44 ILE H H 44 9.030 9.030 8.691 0.339 17919 75050 1 183 . 1 1 45 45 PHE N N 45 125.390 125.390 126.915 -1.525 17919 75051 1 183 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.979 0.066 17919 75052 1 183 . 1 1 45 45 PHE C C 45 174.470 174.470 174.498 -0.028 17919 75053 1 183 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.059 0.961 17919 75054 1 183 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.458 0.302 17919 75055 1 183 . 1 1 45 45 PHE H H 45 8.830 8.830 8.786 0.044 17919 75056 1 183 . 1 1 46 46 ALA N N 46 132.200 132.200 126.647 5.553 17919 75057 1 183 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.603 0.087 17919 75058 1 183 . 1 1 46 46 ALA C C 46 177.290 177.290 178.002 -0.712 17919 75059 1 183 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.925 -0.385 17919 75060 1 183 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.832 -0.262 17919 75061 1 183 . 1 1 46 46 ALA H H 46 8.810 8.810 8.482 0.328 17919 75062 1 183 . 1 1 47 47 GLY N N 47 102.340 102.340 103.709 -1.369 17919 75063 1 183 . 1 1 47 47 GLY C C 47 173.810 173.810 174.259 -0.449 17919 75064 1 183 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.907 0.443 17919 75065 1 183 . 1 1 47 47 GLY H H 47 8.130 8.130 8.317 -0.187 17919 75066 1 183 . 1 1 48 48 LYS N N 48 121.570 121.570 121.889 -0.319 17919 75067 1 183 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.666 -0.044 17919 75068 1 183 . 1 1 48 48 LYS C C 48 174.700 174.700 175.527 -0.827 17919 75069 1 183 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.691 -0.141 17919 75070 1 183 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.366 0.164 17919 75071 1 183 . 1 1 48 48 LYS H H 48 7.980 7.980 7.974 0.006 17919 75072 1 183 . 1 1 49 49 GLN N N 49 122.410 122.410 123.897 -1.487 17919 75073 1 183 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.432 0.128 17919 75074 1 183 . 1 1 49 49 GLN C C 49 175.670 175.670 175.062 0.608 17919 75075 1 183 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.199 -0.459 17919 75076 1 183 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.122 -0.122 17919 75077 1 183 . 1 1 49 49 GLN H H 49 8.600 8.600 8.606 -0.006 17919 75078 1 183 . 1 1 50 50 LEU N N 50 125.520 125.520 125.505 0.015 17919 75079 1 183 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.258 -0.168 17919 75080 1 183 . 1 1 50 50 LEU C C 50 176.660 176.660 175.487 1.173 17919 75081 1 183 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.896 0.344 17919 75082 1 183 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.662 -1.092 17919 75083 1 183 . 1 1 50 50 LEU H H 50 8.530 8.530 8.596 -0.066 17919 75084 1 183 . 1 1 51 51 GLU N N 51 122.940 122.940 122.006 0.934 17919 75085 1 183 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.633 -0.145 17919 75086 1 183 . 1 1 51 51 GLU C C 51 175.870 175.870 176.801 -0.931 17919 75087 1 183 . 1 1 51 51 GLU CA C 51 55.960 55.960 54.975 0.985 17919 75088 1 183 . 1 1 51 51 GLU CB C 51 31.570 31.570 33.166 -1.596 17919 75089 1 183 . 1 1 51 51 GLU H H 51 8.400 8.400 8.032 0.368 17919 75090 1 183 . 1 1 52 52 ASP N N 52 120.030 120.030 124.743 -4.713 17919 75091 1 183 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.365 -0.006 17919 75092 1 183 . 1 1 52 52 ASP C C 52 177.330 177.330 177.768 -0.438 17919 75093 1 183 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.610 -0.650 17919 75094 1 183 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.664 0.186 17919 75095 1 183 . 1 1 52 52 ASP H H 52 8.160 8.160 8.895 -0.735 17919 75096 1 183 . 1 1 53 53 GLY N N 53 106.660 106.660 105.654 1.006 17919 75097 1 183 . 1 1 53 53 GLY C C 53 174.870 174.870 174.362 0.508 17919 75098 1 183 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.878 0.292 17919 75099 1 183 . 1 1 53 53 GLY H H 53 9.390 9.390 8.458 0.932 17919 75100 1 183 . 1 1 54 54 ARG N N 54 119.050 119.050 121.449 -2.399 17919 75101 1 183 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.643 0.052 17919 75102 1 183 . 1 1 54 54 ARG C C 54 175.350 175.350 175.515 -0.165 17919 75103 1 183 . 1 1 54 54 ARG CA C 54 54.390 54.390 55.084 -0.694 17919 75104 1 183 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.310 0.340 17919 75105 1 183 . 1 1 54 54 ARG H H 54 7.460 7.460 7.598 -0.138 17919 75106 1 183 . 1 1 55 55 THR N N 55 108.400 108.400 110.541 -2.141 17919 75107 1 183 . 1 1 55 55 THR HA H 55 5.240 5.240 5.118 0.122 17919 75108 1 183 . 1 1 55 55 THR C C 55 176.560 176.560 176.063 0.497 17919 75109 1 183 . 1 1 55 55 THR CA C 55 59.690 59.690 59.474 0.216 17919 75110 1 183 . 1 1 55 55 THR CB C 55 72.260 72.260 71.826 0.434 17919 75111 1 183 . 1 1 55 55 THR H H 55 8.730 8.730 8.951 -0.221 17919 75112 1 183 . 1 1 56 56 LEU N N 56 117.920 117.920 121.764 -3.844 17919 75113 1 183 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.952 0.108 17919 75114 1 183 . 1 1 56 56 LEU C C 56 180.810 180.810 179.017 1.793 17919 75115 1 183 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.517 0.193 17919 75116 1 183 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.683 -1.313 17919 75117 1 183 . 1 1 56 56 LEU H H 56 8.140 8.140 8.566 -0.426 17919 75118 1 183 . 1 1 57 57 SER N N 57 113.330 113.330 115.148 -1.818 17919 75119 1 183 . 1 1 57 57 SER HA H 57 4.370 4.370 4.070 0.300 17919 75120 1 183 . 1 1 57 57 SER C C 57 178.310 178.310 176.834 1.476 17919 75121 1 183 . 1 1 57 57 SER CA C 57 61.080 61.080 62.377 -1.297 17919 75122 1 183 . 1 1 57 57 SER CB C 57 62.530 62.530 62.971 -0.441 17919 75123 1 183 . 1 1 57 57 SER H H 57 8.470 8.470 8.330 0.140 17919 75124 1 183 . 1 1 58 58 ASP N N 58 124.190 124.190 121.067 3.123 17919 75125 1 183 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.371 -0.075 17919 75126 1 183 . 1 1 58 58 ASP C C 58 177.400 177.400 177.098 0.302 17919 75127 1 183 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.773 0.407 17919 75128 1 183 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.562 -0.462 17919 75129 1 183 . 1 1 58 58 ASP H H 58 7.930 7.930 7.842 0.088 17919 75130 1 183 . 1 1 59 59 TYR N N 59 115.510 115.510 115.818 -0.308 17919 75131 1 183 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.611 0.059 17919 75132 1 183 . 1 1 59 59 TYR C C 59 174.700 174.700 175.125 -0.425 17919 75133 1 183 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.445 0.805 17919 75134 1 183 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.686 1.384 17919 75135 1 183 . 1 1 59 59 TYR H H 59 7.250 7.250 7.329 -0.079 17919 75136 1 183 . 1 1 60 60 ASN N N 60 115.900 115.900 117.405 -1.505 17919 75137 1 183 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.378 -0.023 17919 75138 1 183 . 1 1 60 60 ASN C C 60 174.340 174.340 174.445 -0.105 17919 75139 1 183 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.511 -0.392 17919 75140 1 183 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.487 -0.077 17919 75141 1 183 . 1 1 60 60 ASN H H 60 8.150 8.150 7.836 0.314 17919 75142 1 183 . 1 1 61 61 ILE N N 61 118.600 118.600 119.975 -1.375 17919 75143 1 183 . 1 1 61 61 ILE HA H 61 3.393 3.393 4.020 -0.627 17919 75144 1 183 . 1 1 61 61 ILE C C 61 174.610 174.610 175.005 -0.395 17919 75145 1 183 . 1 1 61 61 ILE CA C 61 62.420 62.420 60.897 1.524 17919 75146 1 183 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.130 -0.390 17919 75147 1 183 . 1 1 61 61 ILE H H 61 7.250 7.250 7.674 -0.424 17919 75148 1 183 . 1 1 62 62 GLN N N 62 124.740 124.740 123.757 0.983 17919 75149 1 183 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.660 -0.154 17919 75150 1 183 . 1 1 62 62 GLN C C 62 175.970 175.970 174.923 1.047 17919 75151 1 183 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.275 0.385 17919 75152 1 183 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.845 -0.195 17919 75153 1 183 . 1 1 62 62 GLN H H 62 7.610 7.610 8.264 -0.654 17919 75154 1 183 . 1 1 63 63 LYS N N 63 120.300 120.300 118.446 1.854 17919 75155 1 183 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.309 -0.308 17919 75156 1 183 . 1 1 63 63 LYS C C 63 175.810 175.810 177.571 -1.761 17919 75157 1 183 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.696 0.094 17919 75158 1 183 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.545 0.105 17919 75159 1 183 . 1 1 63 63 LYS H H 63 8.490 8.490 8.412 0.078 17919 75160 1 183 . 1 1 64 64 GLU N N 64 113.950 113.950 117.469 -3.519 17919 75161 1 183 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.805 -0.340 17919 75162 1 183 . 1 1 64 64 GLU C C 64 175.250 175.250 176.189 -0.939 17919 75163 1 183 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.809 0.081 17919 75164 1 183 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.896 -2.996 17919 75165 1 183 . 1 1 64 64 GLU H H 64 9.280 9.280 8.831 0.449 17919 75166 1 183 . 1 1 65 65 SER N N 65 114.730 114.730 116.373 -1.643 17919 75167 1 183 . 1 1 65 65 SER HA H 65 4.640 4.640 4.313 0.327 17919 75168 1 183 . 1 1 65 65 SER C C 65 172.160 172.160 174.092 -1.932 17919 75169 1 183 . 1 1 65 65 SER CA C 65 60.890 60.890 60.648 0.242 17919 75170 1 183 . 1 1 65 65 SER CB C 65 64.910 64.910 63.605 1.305 17919 75171 1 183 . 1 1 65 65 SER H H 65 7.670 7.670 7.238 0.432 17919 75172 1 183 . 1 1 66 66 THR N N 66 117.110 117.110 119.876 -2.766 17919 75173 1 183 . 1 1 66 66 THR HA H 66 5.270 5.270 5.010 0.260 17919 75174 1 183 . 1 1 66 66 THR C C 66 173.950 173.950 173.750 0.200 17919 75175 1 183 . 1 1 66 66 THR CA C 66 62.340 62.340 61.433 0.907 17919 75176 1 183 . 1 1 66 66 THR CB C 66 70.080 70.080 70.746 -0.666 17919 75177 1 183 . 1 1 66 66 THR H H 66 8.730 8.730 8.477 0.253 17919 75178 1 183 . 1 1 67 67 LEU N N 67 127.110 127.110 127.634 -0.524 17919 75179 1 183 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.935 0.125 17919 75180 1 183 . 1 1 67 67 LEU C C 67 175.770 175.770 175.136 0.634 17919 75181 1 183 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.309 0.591 17919 75182 1 183 . 1 1 67 67 LEU CB C 67 44.260 44.260 45.221 -0.961 17919 75183 1 183 . 1 1 67 67 LEU H H 67 9.410 9.410 8.760 0.650 17919 75184 1 183 . 1 1 68 68 HIS N N 68 118.380 118.380 122.166 -3.786 17919 75185 1 183 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.518 -0.278 17919 75186 1 183 . 1 1 68 68 HIS C C 68 173.150 173.150 173.908 -0.758 17919 75187 1 183 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.191 0.809 17919 75188 1 183 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.534 -2.004 17919 75189 1 183 . 1 1 68 68 HIS H H 68 9.230 9.230 8.701 0.529 17919 75190 1 183 . 1 1 69 69 LEU N N 69 124.460 124.460 130.021 -5.561 17919 75191 1 183 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.926 0.264 17919 75192 1 183 . 1 1 69 69 LEU C C 69 175.270 175.270 174.037 1.233 17919 75193 1 183 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.192 0.698 17919 75194 1 183 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.213 0.167 17919 75195 1 183 . 1 1 69 69 LEU H H 69 8.340 8.340 8.259 0.081 17919 75196 1 183 . 1 1 70 70 VAL N N 70 126.940 126.940 126.474 0.466 17919 75197 1 183 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.219 0.131 17919 75198 1 183 . 1 1 70 70 VAL C C 70 174.000 174.000 174.869 -0.869 17919 75199 1 183 . 1 1 70 70 VAL CA C 70 60.800 60.800 61.084 -0.284 17919 75200 1 183 . 1 1 70 70 VAL CB C 70 34.910 34.910 33.357 1.553 17919 75201 1 183 . 1 1 70 70 VAL H H 70 9.200 9.200 8.661 0.539 17919 75202 1 183 . 1 1 71 71 LEU N N 71 123.130 123.130 125.321 -2.191 17919 75203 1 183 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.729 0.331 17919 75204 1 183 . 1 1 71 71 LEU C C 71 177.830 177.830 176.711 1.119 17919 75205 1 183 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.314 0.626 17919 75206 1 183 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.856 -0.006 17919 75207 1 183 . 1 1 71 71 LEU H H 71 8.120 8.120 8.493 -0.373 17919 75208 1 183 . 1 1 72 72 ARG N N 72 123.490 123.490 124.852 -1.362 17919 75209 1 183 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.161 0.140 17919 75210 1 183 . 1 1 72 72 ARG C C 72 175.350 175.350 176.034 -0.684 17919 75211 1 183 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.241 -0.631 17919 75212 1 183 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.267 1.083 17919 75213 1 183 . 1 1 72 72 ARG H H 72 8.580 8.580 8.027 0.553 17919 75214 1 184 . 1 1 2 2 GLN N N 2 123.220 123.220 120.676 2.544 17919 75215 1 184 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.212 0.037 17919 75216 1 184 . 1 1 2 2 GLN C C 2 175.920 175.920 174.806 1.114 17919 75217 1 184 . 1 1 2 2 GLN CA C 2 55.080 55.080 55.005 0.075 17919 75218 1 184 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.056 0.704 17919 75219 1 184 . 1 1 2 2 GLN H H 2 8.900 8.900 8.313 0.587 17919 75220 1 184 . 1 1 3 3 ILE N N 3 115.340 115.340 119.323 -3.983 17919 75221 1 184 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.349 -0.136 17919 75222 1 184 . 1 1 3 3 ILE C C 3 172.450 172.450 173.594 -1.144 17919 75223 1 184 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.168 0.402 17919 75224 1 184 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.540 0.670 17919 75225 1 184 . 1 1 3 3 ILE H H 3 8.320 8.320 8.420 -0.100 17919 75226 1 184 . 1 1 4 4 PHE N N 4 118.110 118.110 119.645 -1.535 17919 75227 1 184 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.546 0.084 17919 75228 1 184 . 1 1 4 4 PHE C C 4 175.320 175.320 175.468 -0.148 17919 75229 1 184 . 1 1 4 4 PHE CA C 4 55.210 55.210 54.626 0.584 17919 75230 1 184 . 1 1 4 4 PHE CB C 4 41.480 41.480 40.802 0.678 17919 75231 1 184 . 1 1 4 4 PHE H H 4 8.610 8.610 8.186 0.424 17919 75232 1 184 . 1 1 5 5 VAL N N 5 121.000 121.000 122.880 -1.880 17919 75233 1 184 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.565 0.160 17919 75234 1 184 . 1 1 5 5 VAL C C 5 174.870 174.870 174.615 0.255 17919 75235 1 184 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.467 -0.847 17919 75236 1 184 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.754 0.476 17919 75237 1 184 . 1 1 5 5 VAL H H 5 9.300 9.300 9.399 -0.099 17919 75238 1 184 . 1 1 6 6 LYS N N 6 127.520 127.520 129.417 -1.897 17919 75239 1 184 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.290 0.077 17919 75240 1 184 . 1 1 6 6 LYS C C 6 177.140 177.140 176.574 0.566 17919 75241 1 184 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.555 -0.035 17919 75242 1 184 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.037 0.013 17919 75243 1 184 . 1 1 6 6 LYS H H 6 8.820 8.820 9.266 -0.446 17919 75244 1 184 . 1 1 7 7 THR N N 7 115.400 115.400 118.194 -2.794 17919 75245 1 184 . 1 1 7 7 THR HA H 7 4.970 4.970 4.827 0.143 17919 75246 1 184 . 1 1 7 7 THR C C 7 176.910 176.910 176.082 0.828 17919 75247 1 184 . 1 1 7 7 THR CA C 7 60.470 60.470 61.211 -0.741 17919 75248 1 184 . 1 1 7 7 THR CB C 7 70.630 70.630 70.501 0.129 17919 75249 1 184 . 1 1 7 7 THR H H 7 8.730 8.730 8.821 -0.091 17919 75250 1 184 . 1 1 8 8 LEU N N 8 121.330 121.330 122.736 -1.406 17919 75251 1 184 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.233 0.077 17919 75252 1 184 . 1 1 8 8 LEU C C 8 178.800 178.800 177.748 1.052 17919 75253 1 184 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.876 -0.296 17919 75254 1 184 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.122 -0.152 17919 75255 1 184 . 1 1 8 8 LEU H H 8 9.100 9.100 8.617 0.483 17919 75256 1 184 . 1 1 9 9 THR N N 9 105.590 105.590 110.076 -4.486 17919 75257 1 184 . 1 1 9 9 THR HA H 9 4.428 4.428 4.328 0.100 17919 75258 1 184 . 1 1 9 9 THR C C 9 175.520 175.520 175.441 0.079 17919 75259 1 184 . 1 1 9 9 THR CA C 9 61.400 61.400 61.593 -0.193 17919 75260 1 184 . 1 1 9 9 THR CB C 9 69.140 69.140 68.747 0.393 17919 75261 1 184 . 1 1 9 9 THR H H 9 7.630 7.630 7.615 0.015 17919 75262 1 184 . 1 1 10 10 GLY N N 10 108.890 108.890 110.506 -1.616 17919 75263 1 184 . 1 1 10 10 GLY C C 10 174.070 174.070 174.435 -0.365 17919 75264 1 184 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.309 0.150 17919 75265 1 184 . 1 1 10 10 GLY H H 10 7.810 7.810 8.156 -0.346 17919 75266 1 184 . 1 1 11 11 LYS N N 11 121.600 121.600 121.289 0.311 17919 75267 1 184 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.129 0.232 17919 75268 1 184 . 1 1 11 11 LYS C C 11 175.940 175.940 175.695 0.245 17919 75269 1 184 . 1 1 11 11 LYS CA C 11 56.280 56.280 57.176 -0.896 17919 75270 1 184 . 1 1 11 11 LYS CB C 11 33.200 33.200 32.724 0.476 17919 75271 1 184 . 1 1 11 11 LYS H H 11 7.280 7.280 7.729 -0.449 17919 75272 1 184 . 1 1 12 12 THR N N 12 120.440 120.440 119.877 0.563 17919 75273 1 184 . 1 1 12 12 THR HA H 12 5.046 5.046 5.166 -0.120 17919 75274 1 184 . 1 1 12 12 THR C C 12 174.320 174.320 174.476 -0.156 17919 75275 1 184 . 1 1 12 12 THR CA C 12 62.390 62.390 61.273 1.117 17919 75276 1 184 . 1 1 12 12 THR CB C 12 69.910 69.910 69.834 0.076 17919 75277 1 184 . 1 1 12 12 THR H H 12 8.650 8.650 8.379 0.271 17919 75278 1 184 . 1 1 13 13 ILE N N 13 127.110 127.110 123.201 3.909 17919 75279 1 184 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.739 -0.195 17919 75280 1 184 . 1 1 13 13 ILE C C 13 175.220 175.220 174.918 0.302 17919 75281 1 184 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.009 0.971 17919 75282 1 184 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.072 -0.122 17919 75283 1 184 . 1 1 13 13 ILE H H 13 9.450 9.450 9.024 0.425 17919 75284 1 184 . 1 1 14 14 THR N N 14 121.520 121.520 120.928 0.592 17919 75285 1 184 . 1 1 14 14 THR HA H 14 4.964 4.964 5.361 -0.397 17919 75286 1 184 . 1 1 14 14 THR C C 14 173.790 173.790 174.380 -0.590 17919 75287 1 184 . 1 1 14 14 THR CA C 14 61.940 61.940 61.970 -0.030 17919 75288 1 184 . 1 1 14 14 THR CB C 14 69.650 69.650 69.756 -0.106 17919 75289 1 184 . 1 1 14 14 THR H H 14 8.710 8.710 8.379 0.331 17919 75290 1 184 . 1 1 15 15 LEU N N 15 124.800 124.800 128.047 -3.247 17919 75291 1 184 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.718 0.062 17919 75292 1 184 . 1 1 15 15 LEU C C 15 174.670 174.670 175.897 -1.227 17919 75293 1 184 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.809 -0.979 17919 75294 1 184 . 1 1 15 15 LEU CB C 15 47.070 47.070 43.962 3.108 17919 75295 1 184 . 1 1 15 15 LEU H H 15 8.710 8.710 8.848 -0.138 17919 75296 1 184 . 1 1 16 16 GLU N N 16 122.160 122.160 122.424 -0.264 17919 75297 1 184 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.178 -0.261 17919 75298 1 184 . 1 1 16 16 GLU C C 16 175.860 175.860 175.883 -0.023 17919 75299 1 184 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.686 -0.866 17919 75300 1 184 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.555 -1.105 17919 75301 1 184 . 1 1 16 16 GLU H H 16 8.140 8.140 8.632 -0.492 17919 75302 1 184 . 1 1 17 17 VAL N N 17 117.210 117.210 117.426 -0.216 17919 75303 1 184 . 1 1 17 17 VAL HA H 17 4.714 4.714 5.068 -0.354 17919 75304 1 184 . 1 1 17 17 VAL C C 17 174.160 174.160 174.824 -0.664 17919 75305 1 184 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.158 -0.728 17919 75306 1 184 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.196 1.204 17919 75307 1 184 . 1 1 17 17 VAL H H 17 8.900 8.900 8.277 0.623 17919 75308 1 184 . 1 1 18 18 GLU N N 18 118.990 118.990 122.292 -3.302 17919 75309 1 184 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.909 0.170 17919 75310 1 184 . 1 1 18 18 GLU C C 18 176.160 176.160 176.245 -0.085 17919 75311 1 184 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.319 0.401 17919 75312 1 184 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.799 -0.489 17919 75313 1 184 . 1 1 18 18 GLU H H 18 8.640 8.640 8.924 -0.284 17919 75314 1 184 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.270 -0.129 17919 75315 1 184 . 1 1 19 19 PRO C C 19 175.310 175.310 177.238 -1.928 17919 75316 1 184 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.185 0.285 17919 75317 1 184 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.237 -0.287 17919 75318 1 184 . 1 1 20 20 SER N N 20 103.400 103.400 109.775 -6.375 17919 75319 1 184 . 1 1 20 20 SER HA H 20 4.370 4.370 4.288 0.082 17919 75320 1 184 . 1 1 20 20 SER C C 20 174.660 174.660 174.549 0.111 17919 75321 1 184 . 1 1 20 20 SER CA C 20 57.400 57.400 58.503 -1.103 17919 75322 1 184 . 1 1 20 20 SER CB C 20 63.370 63.370 63.116 0.254 17919 75323 1 184 . 1 1 20 20 SER H H 20 7.040 7.040 7.950 -0.910 17919 75324 1 184 . 1 1 21 21 ASP N N 21 123.480 123.480 124.205 -0.725 17919 75325 1 184 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.723 -0.028 17919 75326 1 184 . 1 1 21 21 ASP C C 21 176.360 176.360 176.000 0.360 17919 75327 1 184 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.378 0.322 17919 75328 1 184 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.754 -0.954 17919 75329 1 184 . 1 1 21 21 ASP H H 21 8.030 8.030 7.623 0.407 17919 75330 1 184 . 1 1 22 22 THR N N 22 108.800 108.800 113.227 -4.427 17919 75331 1 184 . 1 1 22 22 THR HA H 22 4.920 4.920 4.847 0.073 17919 75332 1 184 . 1 1 22 22 THR C C 22 176.750 176.750 176.094 0.656 17919 75333 1 184 . 1 1 22 22 THR CA C 22 59.690 59.690 61.039 -1.349 17919 75334 1 184 . 1 1 22 22 THR CB C 22 71.200 71.200 71.315 -0.115 17919 75335 1 184 . 1 1 22 22 THR H H 22 7.900 7.900 8.235 -0.335 17919 75336 1 184 . 1 1 23 23 ILE N N 23 121.190 121.190 123.124 -1.934 17919 75337 1 184 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.823 -0.166 17919 75338 1 184 . 1 1 23 23 ILE C C 23 179.040 179.040 177.786 1.254 17919 75339 1 184 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.660 -0.400 17919 75340 1 184 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.189 -1.839 17919 75341 1 184 . 1 1 23 23 ILE H H 23 8.560 8.560 8.832 -0.272 17919 75342 1 184 . 1 1 24 24 GLU N N 24 120.830 120.830 121.753 -0.923 17919 75343 1 184 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.867 0.050 17919 75344 1 184 . 1 1 24 24 GLU C C 24 178.640 178.640 178.584 0.056 17919 75345 1 184 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.184 0.037 17919 75346 1 184 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.462 -1.182 17919 75347 1 184 . 1 1 24 24 GLU H H 24 9.760 9.760 8.373 1.387 17919 75348 1 184 . 1 1 25 25 ASN N N 25 120.570 120.570 117.486 3.084 17919 75349 1 184 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.507 0.018 17919 75350 1 184 . 1 1 25 25 ASN C C 25 178.380 178.380 177.651 0.729 17919 75351 1 184 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.722 0.338 17919 75352 1 184 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.122 0.328 17919 75353 1 184 . 1 1 25 25 ASN H H 25 7.920 7.920 7.650 0.270 17919 75354 1 184 . 1 1 26 26 VAL N N 26 121.710 121.710 120.776 0.934 17919 75355 1 184 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.468 -0.071 17919 75356 1 184 . 1 1 26 26 VAL C C 26 177.950 177.950 177.943 0.007 17919 75357 1 184 . 1 1 26 26 VAL CA C 26 67.660 67.660 67.284 0.376 17919 75358 1 184 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.628 -0.787 17919 75359 1 184 . 1 1 26 26 VAL H H 26 8.070 8.070 8.170 -0.100 17919 75360 1 184 . 1 1 27 27 LYS N N 27 118.860 118.860 119.405 -0.545 17919 75361 1 184 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.114 0.466 17919 75362 1 184 . 1 1 27 27 LYS C C 27 180.550 180.550 179.050 1.500 17919 75363 1 184 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.549 -0.299 17919 75364 1 184 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.375 1.355 17919 75365 1 184 . 1 1 27 27 LYS H H 27 8.560 8.560 7.997 0.563 17919 75366 1 184 . 1 1 28 28 ALA N N 28 123.440 123.440 121.735 1.705 17919 75367 1 184 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.383 -0.223 17919 75368 1 184 . 1 1 28 28 ALA C C 28 180.300 180.300 179.504 0.796 17919 75369 1 184 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.794 0.576 17919 75370 1 184 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.550 -0.840 17919 75371 1 184 . 1 1 28 28 ALA H H 28 8.060 8.060 8.512 -0.452 17919 75372 1 184 . 1 1 29 29 LYS N N 29 119.940 119.940 117.469 2.471 17919 75373 1 184 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.136 0.071 17919 75374 1 184 . 1 1 29 29 LYS C C 29 180.320 180.320 178.750 1.570 17919 75375 1 184 . 1 1 29 29 LYS CA C 29 59.650 59.650 58.686 0.964 17919 75376 1 184 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.404 0.886 17919 75377 1 184 . 1 1 29 29 LYS H H 29 7.850 7.850 8.088 -0.238 17919 75378 1 184 . 1 1 30 30 ILE N N 30 121.080 121.080 121.026 0.054 17919 75379 1 184 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.780 -0.273 17919 75380 1 184 . 1 1 30 30 ILE C C 30 178.310 178.310 177.062 1.248 17919 75381 1 184 . 1 1 30 30 ILE CA C 30 66.150 66.150 64.174 1.976 17919 75382 1 184 . 1 1 30 30 ILE CB C 30 36.800 36.800 38.143 -1.343 17919 75383 1 184 . 1 1 30 30 ILE H H 30 8.280 8.280 7.636 0.644 17919 75384 1 184 . 1 1 31 31 GLN N N 31 123.490 123.490 121.825 1.665 17919 75385 1 184 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.087 -0.258 17919 75386 1 184 . 1 1 31 31 GLN C C 31 178.890 178.890 178.333 0.557 17919 75387 1 184 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.385 0.615 17919 75388 1 184 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.486 -0.766 17919 75389 1 184 . 1 1 31 31 GLN H H 31 8.580 8.580 8.473 0.107 17919 75390 1 184 . 1 1 32 32 ASP N N 32 119.360 119.360 118.288 1.072 17919 75391 1 184 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.439 -0.085 17919 75392 1 184 . 1 1 32 32 ASP C C 32 177.250 177.250 177.938 -0.688 17919 75393 1 184 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.702 0.488 17919 75394 1 184 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.828 -0.247 17919 75395 1 184 . 1 1 32 32 ASP H H 32 8.010 8.010 7.858 0.152 17919 75396 1 184 . 1 1 33 33 LYS N N 33 115.130 115.130 117.521 -2.391 17919 75397 1 184 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.357 -0.020 17919 75398 1 184 . 1 1 33 33 LYS C C 33 177.870 177.870 177.797 0.073 17919 75399 1 184 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.785 0.265 17919 75400 1 184 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.837 0.333 17919 75401 1 184 . 1 1 33 33 LYS H H 33 7.430 7.430 7.735 -0.305 17919 75402 1 184 . 1 1 34 34 GLU N N 34 113.870 113.870 115.969 -2.099 17919 75403 1 184 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.465 0.160 17919 75404 1 184 . 1 1 34 34 GLU C C 34 177.840 177.840 177.277 0.563 17919 75405 1 184 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.397 -1.227 17919 75406 1 184 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.254 1.406 17919 75407 1 184 . 1 1 34 34 GLU H H 34 8.740 8.740 8.308 0.432 17919 75408 1 184 . 1 1 35 35 GLY N N 35 108.650 108.650 109.154 -0.504 17919 75409 1 184 . 1 1 35 35 GLY C C 35 173.960 173.960 174.293 -0.333 17919 75410 1 184 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.769 0.311 17919 75411 1 184 . 1 1 35 35 GLY H H 35 8.530 8.530 8.240 0.290 17919 75412 1 184 . 1 1 36 36 ILE N N 36 119.880 119.880 122.712 -2.832 17919 75413 1 184 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.341 0.104 17919 75414 1 184 . 1 1 36 36 ILE C C 36 173.590 173.590 174.247 -0.657 17919 75415 1 184 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.077 -0.327 17919 75416 1 184 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.396 2.184 17919 75417 1 184 . 1 1 36 36 ILE H H 36 6.150 6.150 7.583 -1.433 17919 75418 1 184 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.802 -0.168 17919 75419 1 184 . 1 1 37 37 PRO C C 37 176.940 176.940 175.981 0.959 17919 75420 1 184 . 1 1 37 37 PRO CA C 37 61.660 61.660 60.916 0.744 17919 75421 1 184 . 1 1 37 37 PRO CB C 37 31.850 31.850 30.963 0.887 17919 75422 1 184 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.166 -0.049 17919 75423 1 184 . 1 1 38 38 PRO C C 38 178.320 178.320 178.474 -0.154 17919 75424 1 184 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.814 0.446 17919 75425 1 184 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.828 1.062 17919 75426 1 184 . 1 1 39 39 ASP N N 39 113.380 113.380 117.507 -4.127 17919 75427 1 184 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.313 0.117 17919 75428 1 184 . 1 1 39 39 ASP C C 39 177.090 177.090 178.345 -1.255 17919 75429 1 184 . 1 1 39 39 ASP CA C 39 55.640 55.640 57.430 -1.790 17919 75430 1 184 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.390 -0.850 17919 75431 1 184 . 1 1 39 39 ASP H H 39 8.550 8.550 8.789 -0.239 17919 75432 1 184 . 1 1 40 40 GLN N N 40 116.780 116.780 117.502 -0.722 17919 75433 1 184 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.206 0.258 17919 75434 1 184 . 1 1 40 40 GLN C C 40 175.380 175.380 175.210 0.170 17919 75435 1 184 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.761 -1.121 17919 75436 1 184 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.480 0.660 17919 75437 1 184 . 1 1 40 40 GLN H H 40 7.820 7.820 7.797 0.023 17919 75438 1 184 . 1 1 41 41 GLN N N 41 117.720 117.720 118.648 -0.928 17919 75439 1 184 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.640 -0.396 17919 75440 1 184 . 1 1 41 41 GLN C C 41 176.300 176.300 174.575 1.725 17919 75441 1 184 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.350 1.120 17919 75442 1 184 . 1 1 41 41 GLN CB C 41 31.650 31.650 30.622 1.028 17919 75443 1 184 . 1 1 41 41 GLN H H 41 7.480 7.480 7.382 0.098 17919 75444 1 184 . 1 1 42 42 ARG N N 42 122.680 122.680 124.171 -1.491 17919 75445 1 184 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.634 -0.134 17919 75446 1 184 . 1 1 42 42 ARG C C 42 174.050 174.050 173.739 0.311 17919 75447 1 184 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.087 -0.036 17919 75448 1 184 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.804 -1.054 17919 75449 1 184 . 1 1 42 42 ARG H H 42 8.530 8.530 8.389 0.141 17919 75450 1 184 . 1 1 43 43 LEU N N 43 124.040 124.040 127.969 -3.929 17919 75451 1 184 . 1 1 43 43 LEU C C 43 175.290 175.290 175.840 -0.550 17919 75452 1 184 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.268 -1.288 17919 75453 1 184 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.612 2.178 17919 75454 1 184 . 1 1 43 43 LEU H H 43 8.820 8.820 8.812 0.008 17919 75455 1 184 . 1 1 44 44 ILE N N 44 121.920 121.920 117.852 4.068 17919 75456 1 184 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.253 -0.261 17919 75457 1 184 . 1 1 44 44 ILE C C 44 176.060 176.060 173.785 2.275 17919 75458 1 184 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.377 -0.397 17919 75459 1 184 . 1 1 44 44 ILE CB C 44 41.420 41.420 42.106 -0.686 17919 75460 1 184 . 1 1 44 44 ILE H H 44 9.030 9.030 8.394 0.636 17919 75461 1 184 . 1 1 45 45 PHE N N 45 125.390 125.390 126.292 -0.902 17919 75462 1 184 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.917 0.128 17919 75463 1 184 . 1 1 45 45 PHE C C 45 174.470 174.470 174.204 0.266 17919 75464 1 184 . 1 1 45 45 PHE CA C 45 57.020 57.020 58.003 -0.983 17919 75465 1 184 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.836 0.924 17919 75466 1 184 . 1 1 45 45 PHE H H 45 8.830 8.830 8.716 0.114 17919 75467 1 184 . 1 1 46 46 ALA N N 46 132.200 132.200 128.900 3.300 17919 75468 1 184 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.485 0.205 17919 75469 1 184 . 1 1 46 46 ALA C C 46 177.290 177.290 177.758 -0.468 17919 75470 1 184 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.676 -0.136 17919 75471 1 184 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.682 -0.112 17919 75472 1 184 . 1 1 46 46 ALA H H 46 8.810 8.810 8.315 0.495 17919 75473 1 184 . 1 1 47 47 GLY N N 47 102.340 102.340 103.658 -1.318 17919 75474 1 184 . 1 1 47 47 GLY C C 47 173.810 173.810 174.308 -0.498 17919 75475 1 184 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.913 0.437 17919 75476 1 184 . 1 1 47 47 GLY H H 47 8.130 8.130 8.346 -0.216 17919 75477 1 184 . 1 1 48 48 LYS N N 48 121.570 121.570 121.792 -0.222 17919 75478 1 184 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.449 0.173 17919 75479 1 184 . 1 1 48 48 LYS C C 48 174.700 174.700 175.694 -0.994 17919 75480 1 184 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.227 -0.678 17919 75481 1 184 . 1 1 48 48 LYS CB C 48 34.530 34.530 33.407 1.123 17919 75482 1 184 . 1 1 48 48 LYS H H 48 7.980 7.980 7.917 0.063 17919 75483 1 184 . 1 1 49 49 GLN N N 49 122.410 122.410 124.462 -2.052 17919 75484 1 184 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.264 0.296 17919 75485 1 184 . 1 1 49 49 GLN C C 49 175.670 175.670 175.325 0.345 17919 75486 1 184 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.019 -0.279 17919 75487 1 184 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.568 -0.568 17919 75488 1 184 . 1 1 49 49 GLN H H 49 8.600 8.600 8.641 -0.041 17919 75489 1 184 . 1 1 50 50 LEU N N 50 125.520 125.520 126.880 -1.360 17919 75490 1 184 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.016 0.074 17919 75491 1 184 . 1 1 50 50 LEU C C 50 176.660 176.660 175.548 1.112 17919 75492 1 184 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.419 0.821 17919 75493 1 184 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.544 0.026 17919 75494 1 184 . 1 1 50 50 LEU H H 50 8.530 8.530 8.394 0.136 17919 75495 1 184 . 1 1 51 51 GLU N N 51 122.940 122.940 123.678 -0.738 17919 75496 1 184 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.509 -0.021 17919 75497 1 184 . 1 1 51 51 GLU C C 51 175.870 175.870 176.670 -0.800 17919 75498 1 184 . 1 1 51 51 GLU CA C 51 55.960 55.960 54.817 1.143 17919 75499 1 184 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.330 0.240 17919 75500 1 184 . 1 1 51 51 GLU H H 51 8.400 8.400 8.427 -0.027 17919 75501 1 184 . 1 1 52 52 ASP N N 52 120.030 120.030 121.514 -1.484 17919 75502 1 184 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.533 -0.174 17919 75503 1 184 . 1 1 52 52 ASP C C 52 177.330 177.330 178.241 -0.911 17919 75504 1 184 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.350 -0.390 17919 75505 1 184 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.663 0.187 17919 75506 1 184 . 1 1 52 52 ASP H H 52 8.160 8.160 8.780 -0.620 17919 75507 1 184 . 1 1 53 53 GLY N N 53 106.660 106.660 105.892 0.768 17919 75508 1 184 . 1 1 53 53 GLY C C 53 174.870 174.870 174.087 0.783 17919 75509 1 184 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.117 0.053 17919 75510 1 184 . 1 1 53 53 GLY H H 53 9.390 9.390 8.580 0.810 17919 75511 1 184 . 1 1 54 54 ARG N N 54 119.050 119.050 119.511 -0.461 17919 75512 1 184 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.594 0.101 17919 75513 1 184 . 1 1 54 54 ARG C C 54 175.350 175.350 175.462 -0.112 17919 75514 1 184 . 1 1 54 54 ARG CA C 54 54.390 54.390 53.612 0.778 17919 75515 1 184 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.945 -0.295 17919 75516 1 184 . 1 1 54 54 ARG H H 54 7.460 7.460 7.241 0.219 17919 75517 1 184 . 1 1 55 55 THR N N 55 108.400 108.400 112.877 -4.477 17919 75518 1 184 . 1 1 55 55 THR HA H 55 5.240 5.240 4.797 0.443 17919 75519 1 184 . 1 1 55 55 THR C C 55 176.560 176.560 176.524 0.036 17919 75520 1 184 . 1 1 55 55 THR CA C 55 59.690 59.690 61.032 -1.342 17919 75521 1 184 . 1 1 55 55 THR CB C 55 72.260 72.260 70.712 1.548 17919 75522 1 184 . 1 1 55 55 THR H H 55 8.730 8.730 9.120 -0.390 17919 75523 1 184 . 1 1 56 56 LEU N N 56 117.920 117.920 122.956 -5.036 17919 75524 1 184 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.996 0.064 17919 75525 1 184 . 1 1 56 56 LEU C C 56 180.810 180.810 178.882 1.928 17919 75526 1 184 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.770 -0.060 17919 75527 1 184 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.049 -0.679 17919 75528 1 184 . 1 1 56 56 LEU H H 56 8.140 8.140 9.144 -1.004 17919 75529 1 184 . 1 1 57 57 SER N N 57 113.330 113.330 113.143 0.187 17919 75530 1 184 . 1 1 57 57 SER HA H 57 4.370 4.370 4.273 0.097 17919 75531 1 184 . 1 1 57 57 SER C C 57 178.310 178.310 177.186 1.124 17919 75532 1 184 . 1 1 57 57 SER CA C 57 61.080 61.080 60.858 0.222 17919 75533 1 184 . 1 1 57 57 SER CB C 57 62.530 62.530 62.211 0.319 17919 75534 1 184 . 1 1 57 57 SER H H 57 8.470 8.470 7.931 0.539 17919 75535 1 184 . 1 1 58 58 ASP N N 58 124.190 124.190 123.910 0.280 17919 75536 1 184 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.248 0.048 17919 75537 1 184 . 1 1 58 58 ASP C C 58 177.400 177.400 177.033 0.367 17919 75538 1 184 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.792 0.388 17919 75539 1 184 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.172 -0.072 17919 75540 1 184 . 1 1 58 58 ASP H H 58 7.930 7.930 7.872 0.058 17919 75541 1 184 . 1 1 59 59 TYR N N 59 115.510 115.510 115.572 -0.062 17919 75542 1 184 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.653 0.017 17919 75543 1 184 . 1 1 59 59 TYR C C 59 174.700 174.700 174.434 0.266 17919 75544 1 184 . 1 1 59 59 TYR CA C 59 58.250 58.250 56.996 1.254 17919 75545 1 184 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.061 2.009 17919 75546 1 184 . 1 1 59 59 TYR H H 59 7.250 7.250 7.257 -0.007 17919 75547 1 184 . 1 1 60 60 ASN N N 60 115.900 115.900 115.760 0.140 17919 75548 1 184 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.391 -0.036 17919 75549 1 184 . 1 1 60 60 ASN C C 60 174.340 174.340 174.424 -0.084 17919 75550 1 184 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.299 -0.179 17919 75551 1 184 . 1 1 60 60 ASN CB C 60 37.410 37.410 36.441 0.969 17919 75552 1 184 . 1 1 60 60 ASN H H 60 8.150 8.150 8.246 -0.096 17919 75553 1 184 . 1 1 61 61 ILE N N 61 118.600 118.600 119.818 -1.218 17919 75554 1 184 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.880 -0.487 17919 75555 1 184 . 1 1 61 61 ILE C C 61 174.610 174.610 175.180 -0.570 17919 75556 1 184 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.023 0.397 17919 75557 1 184 . 1 1 61 61 ILE CB C 61 36.740 36.740 38.315 -1.575 17919 75558 1 184 . 1 1 61 61 ILE H H 61 7.250 7.250 7.706 -0.456 17919 75559 1 184 . 1 1 62 62 GLN N N 62 124.740 124.740 124.763 -0.023 17919 75560 1 184 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.707 -0.201 17919 75561 1 184 . 1 1 62 62 GLN C C 62 175.970 175.970 174.616 1.354 17919 75562 1 184 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.818 -0.158 17919 75563 1 184 . 1 1 62 62 GLN CB C 62 31.650 31.650 32.678 -1.028 17919 75564 1 184 . 1 1 62 62 GLN H H 62 7.610 7.610 8.276 -0.666 17919 75565 1 184 . 1 1 63 63 LYS N N 63 120.300 120.300 121.339 -1.039 17919 75566 1 184 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.806 0.195 17919 75567 1 184 . 1 1 63 63 LYS C C 63 175.810 175.810 176.493 -0.683 17919 75568 1 184 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.298 -0.508 17919 75569 1 184 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.390 1.260 17919 75570 1 184 . 1 1 63 63 LYS H H 63 8.490 8.490 8.750 -0.260 17919 75571 1 184 . 1 1 64 64 GLU N N 64 113.950 113.950 115.927 -1.977 17919 75572 1 184 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.674 -0.209 17919 75573 1 184 . 1 1 64 64 GLU C C 64 175.250 175.250 175.501 -0.251 17919 75574 1 184 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.639 0.251 17919 75575 1 184 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.525 -2.625 17919 75576 1 184 . 1 1 64 64 GLU H H 64 9.280 9.280 8.761 0.519 17919 75577 1 184 . 1 1 65 65 SER N N 65 114.730 114.730 117.162 -2.432 17919 75578 1 184 . 1 1 65 65 SER HA H 65 4.640 4.640 4.244 0.396 17919 75579 1 184 . 1 1 65 65 SER C C 65 172.160 172.160 173.700 -1.540 17919 75580 1 184 . 1 1 65 65 SER CA C 65 60.890 60.890 60.385 0.505 17919 75581 1 184 . 1 1 65 65 SER CB C 65 64.910 64.910 63.431 1.478 17919 75582 1 184 . 1 1 65 65 SER H H 65 7.670 7.670 7.585 0.085 17919 75583 1 184 . 1 1 66 66 THR N N 66 117.110 117.110 120.302 -3.192 17919 75584 1 184 . 1 1 66 66 THR HA H 66 5.270 5.270 4.956 0.314 17919 75585 1 184 . 1 1 66 66 THR C C 66 173.950 173.950 173.994 -0.044 17919 75586 1 184 . 1 1 66 66 THR CA C 66 62.340 62.340 61.992 0.348 17919 75587 1 184 . 1 1 66 66 THR CB C 66 70.080 70.080 70.193 -0.113 17919 75588 1 184 . 1 1 66 66 THR H H 66 8.730 8.730 8.213 0.517 17919 75589 1 184 . 1 1 67 67 LEU N N 67 127.110 127.110 125.822 1.288 17919 75590 1 184 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.644 0.416 17919 75591 1 184 . 1 1 67 67 LEU C C 67 175.770 175.770 175.175 0.595 17919 75592 1 184 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.442 0.458 17919 75593 1 184 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.806 -0.546 17919 75594 1 184 . 1 1 67 67 LEU H H 67 9.410 9.410 8.988 0.422 17919 75595 1 184 . 1 1 68 68 HIS N N 68 118.380 118.380 119.354 -0.974 17919 75596 1 184 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.252 -0.012 17919 75597 1 184 . 1 1 68 68 HIS C C 68 173.150 173.150 174.363 -1.213 17919 75598 1 184 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.041 0.959 17919 75599 1 184 . 1 1 68 68 HIS CB C 68 30.530 30.530 31.474 -0.945 17919 75600 1 184 . 1 1 68 68 HIS H H 68 9.230 9.230 8.336 0.894 17919 75601 1 184 . 1 1 69 69 LEU N N 69 124.460 124.460 128.752 -4.292 17919 75602 1 184 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.591 0.599 17919 75603 1 184 . 1 1 69 69 LEU C C 69 175.270 175.270 174.429 0.841 17919 75604 1 184 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.447 -0.557 17919 75605 1 184 . 1 1 69 69 LEU CB C 69 44.380 44.380 43.666 0.714 17919 75606 1 184 . 1 1 69 69 LEU H H 69 8.340 8.340 9.072 -0.732 17919 75607 1 184 . 1 1 70 70 VAL N N 70 126.940 126.940 123.473 3.467 17919 75608 1 184 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.618 -0.268 17919 75609 1 184 . 1 1 70 70 VAL C C 70 174.000 174.000 173.585 0.415 17919 75610 1 184 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.419 1.381 17919 75611 1 184 . 1 1 70 70 VAL CB C 70 34.910 34.910 34.972 -0.062 17919 75612 1 184 . 1 1 70 70 VAL H H 70 9.200 9.200 8.880 0.320 17919 75613 1 184 . 1 1 71 71 LEU N N 71 123.130 123.130 123.359 -0.229 17919 75614 1 184 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.217 -0.157 17919 75615 1 184 . 1 1 71 71 LEU C C 71 177.830 177.830 177.939 -0.109 17919 75616 1 184 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.143 0.797 17919 75617 1 184 . 1 1 71 71 LEU CB C 71 42.850 42.850 44.415 -1.565 17919 75618 1 184 . 1 1 71 71 LEU H H 71 8.120 8.120 8.363 -0.243 17919 75619 1 184 . 1 1 72 72 ARG N N 72 123.490 123.490 122.523 0.967 17919 75620 1 184 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.378 -0.077 17919 75621 1 184 . 1 1 72 72 ARG C C 72 175.350 175.350 176.819 -1.469 17919 75622 1 184 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.244 -0.634 17919 75623 1 184 . 1 1 72 72 ARG CB C 72 31.350 31.350 28.499 2.851 17919 75624 1 184 . 1 1 72 72 ARG H H 72 8.580 8.580 8.799 -0.219 17919 75625 1 185 . 1 1 2 2 GLN N N 2 123.220 123.220 120.480 2.740 17919 75626 1 185 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.089 0.160 17919 75627 1 185 . 1 1 2 2 GLN C C 2 175.920 175.920 175.333 0.587 17919 75628 1 185 . 1 1 2 2 GLN CA C 2 55.080 55.080 55.443 -0.363 17919 75629 1 185 . 1 1 2 2 GLN CB C 2 30.760 30.760 29.561 1.199 17919 75630 1 185 . 1 1 2 2 GLN H H 2 8.900 8.900 8.310 0.590 17919 75631 1 185 . 1 1 3 3 ILE N N 3 115.340 115.340 118.375 -3.035 17919 75632 1 185 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.618 -0.405 17919 75633 1 185 . 1 1 3 3 ILE C C 3 172.450 172.450 173.758 -1.308 17919 75634 1 185 . 1 1 3 3 ILE CA C 3 59.570 59.570 58.914 0.656 17919 75635 1 185 . 1 1 3 3 ILE CB C 3 42.210 42.210 42.089 0.121 17919 75636 1 185 . 1 1 3 3 ILE H H 3 8.320 8.320 8.270 0.050 17919 75637 1 185 . 1 1 4 4 PHE N N 4 118.110 118.110 118.225 -0.115 17919 75638 1 185 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.330 0.300 17919 75639 1 185 . 1 1 4 4 PHE C C 4 175.320 175.320 174.798 0.522 17919 75640 1 185 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.996 -0.786 17919 75641 1 185 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.830 -0.350 17919 75642 1 185 . 1 1 4 4 PHE H H 4 8.610 8.610 8.108 0.502 17919 75643 1 185 . 1 1 5 5 VAL N N 5 121.000 121.000 122.594 -1.594 17919 75644 1 185 . 1 1 5 5 VAL HA H 5 4.725 4.725 5.100 -0.375 17919 75645 1 185 . 1 1 5 5 VAL C C 5 174.870 174.870 175.028 -0.158 17919 75646 1 185 . 1 1 5 5 VAL CA C 5 60.620 60.620 60.750 -0.130 17919 75647 1 185 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.473 -0.243 17919 75648 1 185 . 1 1 5 5 VAL H H 5 9.300 9.300 9.321 -0.021 17919 75649 1 185 . 1 1 6 6 LYS N N 6 127.520 127.520 128.404 -0.884 17919 75650 1 185 . 1 1 6 6 LYS HA H 6 5.367 5.367 4.921 0.446 17919 75651 1 185 . 1 1 6 6 LYS C C 6 177.140 177.140 176.538 0.602 17919 75652 1 185 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.748 -0.228 17919 75653 1 185 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.403 0.647 17919 75654 1 185 . 1 1 6 6 LYS H H 6 8.820 8.820 8.987 -0.167 17919 75655 1 185 . 1 1 7 7 THR N N 7 115.400 115.400 118.433 -3.033 17919 75656 1 185 . 1 1 7 7 THR HA H 7 4.970 4.970 4.379 0.591 17919 75657 1 185 . 1 1 7 7 THR C C 7 176.910 176.910 176.050 0.860 17919 75658 1 185 . 1 1 7 7 THR CA C 7 60.470 60.470 61.532 -1.062 17919 75659 1 185 . 1 1 7 7 THR CB C 7 70.630 70.630 69.996 0.634 17919 75660 1 185 . 1 1 7 7 THR H H 7 8.730 8.730 8.681 0.049 17919 75661 1 185 . 1 1 8 8 LEU N N 8 121.330 121.330 122.444 -1.114 17919 75662 1 185 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.452 -0.142 17919 75663 1 185 . 1 1 8 8 LEU C C 8 178.800 178.800 177.052 1.748 17919 75664 1 185 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.058 0.522 17919 75665 1 185 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.541 -0.571 17919 75666 1 185 . 1 1 8 8 LEU H H 8 9.100 9.100 8.304 0.796 17919 75667 1 185 . 1 1 9 9 THR N N 9 105.590 105.590 108.115 -2.525 17919 75668 1 185 . 1 1 9 9 THR HA H 9 4.428 4.428 4.393 0.035 17919 75669 1 185 . 1 1 9 9 THR C C 9 175.520 175.520 175.313 0.207 17919 75670 1 185 . 1 1 9 9 THR CA C 9 61.400 61.400 61.408 -0.008 17919 75671 1 185 . 1 1 9 9 THR CB C 9 69.140 69.140 68.212 0.928 17919 75672 1 185 . 1 1 9 9 THR H H 9 7.630 7.630 7.649 -0.019 17919 75673 1 185 . 1 1 10 10 GLY N N 10 108.890 108.890 111.076 -2.186 17919 75674 1 185 . 1 1 10 10 GLY C C 10 174.070 174.070 173.806 0.264 17919 75675 1 185 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.115 0.345 17919 75676 1 185 . 1 1 10 10 GLY H H 10 7.810 7.810 7.820 -0.010 17919 75677 1 185 . 1 1 11 11 LYS N N 11 121.600 121.600 121.216 0.384 17919 75678 1 185 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.596 -0.235 17919 75679 1 185 . 1 1 11 11 LYS C C 11 175.940 175.940 175.428 0.512 17919 75680 1 185 . 1 1 11 11 LYS CA C 11 56.280 56.280 55.257 1.023 17919 75681 1 185 . 1 1 11 11 LYS CB C 11 33.200 33.200 34.336 -1.136 17919 75682 1 185 . 1 1 11 11 LYS H H 11 7.280 7.280 7.865 -0.585 17919 75683 1 185 . 1 1 12 12 THR N N 12 120.440 120.440 118.384 2.056 17919 75684 1 185 . 1 1 12 12 THR HA H 12 5.046 5.046 5.388 -0.342 17919 75685 1 185 . 1 1 12 12 THR C C 12 174.320 174.320 174.301 0.019 17919 75686 1 185 . 1 1 12 12 THR CA C 12 62.390 62.390 61.502 0.888 17919 75687 1 185 . 1 1 12 12 THR CB C 12 69.910 69.910 69.814 0.096 17919 75688 1 185 . 1 1 12 12 THR H H 12 8.650 8.650 8.328 0.322 17919 75689 1 185 . 1 1 13 13 ILE N N 13 127.110 127.110 123.080 4.030 17919 75690 1 185 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.766 -0.222 17919 75691 1 185 . 1 1 13 13 ILE C C 13 175.220 175.220 174.397 0.823 17919 75692 1 185 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.613 0.367 17919 75693 1 185 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.823 0.127 17919 75694 1 185 . 1 1 13 13 ILE H H 13 9.450 9.450 9.157 0.293 17919 75695 1 185 . 1 1 14 14 THR N N 14 121.520 121.520 124.257 -2.737 17919 75696 1 185 . 1 1 14 14 THR HA H 14 4.964 4.964 4.912 0.052 17919 75697 1 185 . 1 1 14 14 THR C C 14 173.790 173.790 174.135 -0.345 17919 75698 1 185 . 1 1 14 14 THR CA C 14 61.940 61.940 62.290 -0.350 17919 75699 1 185 . 1 1 14 14 THR CB C 14 69.650 69.650 69.518 0.132 17919 75700 1 185 . 1 1 14 14 THR H H 14 8.710 8.710 8.655 0.055 17919 75701 1 185 . 1 1 15 15 LEU N N 15 124.800 124.800 125.587 -0.787 17919 75702 1 185 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.727 0.053 17919 75703 1 185 . 1 1 15 15 LEU C C 15 174.670 174.670 174.716 -0.046 17919 75704 1 185 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.479 -0.649 17919 75705 1 185 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.798 1.272 17919 75706 1 185 . 1 1 15 15 LEU H H 15 8.710 8.710 8.199 0.511 17919 75707 1 185 . 1 1 16 16 GLU N N 16 122.160 122.160 122.135 0.025 17919 75708 1 185 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.302 -0.385 17919 75709 1 185 . 1 1 16 16 GLU C C 16 175.860 175.860 176.220 -0.360 17919 75710 1 185 . 1 1 16 16 GLU CA C 16 54.820 54.820 53.807 1.012 17919 75711 1 185 . 1 1 16 16 GLU CB C 16 29.450 29.450 29.372 0.078 17919 75712 1 185 . 1 1 16 16 GLU H H 16 8.140 8.140 8.551 -0.411 17919 75713 1 185 . 1 1 17 17 VAL N N 17 117.210 117.210 119.936 -2.726 17919 75714 1 185 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.773 -0.059 17919 75715 1 185 . 1 1 17 17 VAL C C 17 174.160 174.160 174.970 -0.810 17919 75716 1 185 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.708 -1.278 17919 75717 1 185 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.583 0.817 17919 75718 1 185 . 1 1 17 17 VAL H H 17 8.900 8.900 8.240 0.660 17919 75719 1 185 . 1 1 18 18 GLU N N 18 118.990 118.990 120.650 -1.660 17919 75720 1 185 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.760 0.319 17919 75721 1 185 . 1 1 18 18 GLU C C 18 176.160 176.160 175.400 0.760 17919 75722 1 185 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.833 -0.113 17919 75723 1 185 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.687 -0.377 17919 75724 1 185 . 1 1 18 18 GLU H H 18 8.640 8.640 8.440 0.200 17919 75725 1 185 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.203 -0.062 17919 75726 1 185 . 1 1 19 19 PRO C C 19 175.310 175.310 177.772 -2.462 17919 75727 1 185 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.693 -0.223 17919 75728 1 185 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.895 0.055 17919 75729 1 185 . 1 1 20 20 SER N N 20 103.400 103.400 110.571 -7.171 17919 75730 1 185 . 1 1 20 20 SER HA H 20 4.370 4.370 4.262 0.108 17919 75731 1 185 . 1 1 20 20 SER C C 20 174.660 174.660 174.555 0.105 17919 75732 1 185 . 1 1 20 20 SER CA C 20 57.400 57.400 58.761 -1.361 17919 75733 1 185 . 1 1 20 20 SER CB C 20 63.370 63.370 62.739 0.631 17919 75734 1 185 . 1 1 20 20 SER H H 20 7.040 7.040 8.027 -0.987 17919 75735 1 185 . 1 1 21 21 ASP N N 21 123.480 123.480 123.941 -0.461 17919 75736 1 185 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.693 0.002 17919 75737 1 185 . 1 1 21 21 ASP C C 21 176.360 176.360 175.873 0.487 17919 75738 1 185 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.285 0.415 17919 75739 1 185 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.242 -0.442 17919 75740 1 185 . 1 1 21 21 ASP H H 21 8.030 8.030 7.978 0.052 17919 75741 1 185 . 1 1 22 22 THR N N 22 108.800 108.800 112.256 -3.456 17919 75742 1 185 . 1 1 22 22 THR HA H 22 4.920 4.920 4.969 -0.049 17919 75743 1 185 . 1 1 22 22 THR C C 22 176.750 176.750 176.232 0.518 17919 75744 1 185 . 1 1 22 22 THR CA C 22 59.690 59.690 60.856 -1.166 17919 75745 1 185 . 1 1 22 22 THR CB C 22 71.200 71.200 70.547 0.653 17919 75746 1 185 . 1 1 22 22 THR H H 22 7.900 7.900 8.204 -0.304 17919 75747 1 185 . 1 1 23 23 ILE N N 23 121.190 121.190 122.006 -0.816 17919 75748 1 185 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.811 -0.154 17919 75749 1 185 . 1 1 23 23 ILE C C 23 179.040 179.040 177.600 1.440 17919 75750 1 185 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.672 -0.412 17919 75751 1 185 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.346 -1.996 17919 75752 1 185 . 1 1 23 23 ILE H H 23 8.560 8.560 8.446 0.114 17919 75753 1 185 . 1 1 24 24 GLU N N 24 120.830 120.830 121.427 -0.597 17919 75754 1 185 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.825 0.092 17919 75755 1 185 . 1 1 24 24 GLU C C 24 178.640 178.640 178.350 0.290 17919 75756 1 185 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.379 -0.159 17919 75757 1 185 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.366 -1.086 17919 75758 1 185 . 1 1 24 24 GLU H H 24 9.760 9.760 8.625 1.135 17919 75759 1 185 . 1 1 25 25 ASN N N 25 120.570 120.570 117.802 2.768 17919 75760 1 185 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.506 0.019 17919 75761 1 185 . 1 1 25 25 ASN C C 25 178.380 178.380 177.840 0.540 17919 75762 1 185 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.094 -0.034 17919 75763 1 185 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.670 -0.220 17919 75764 1 185 . 1 1 25 25 ASN H H 25 7.920 7.920 7.531 0.389 17919 75765 1 185 . 1 1 26 26 VAL N N 26 121.710 121.710 120.627 1.083 17919 75766 1 185 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.516 -0.119 17919 75767 1 185 . 1 1 26 26 VAL C C 26 177.950 177.950 177.990 -0.040 17919 75768 1 185 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.710 0.951 17919 75769 1 185 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.529 -0.689 17919 75770 1 185 . 1 1 26 26 VAL H H 26 8.070 8.070 8.034 0.036 17919 75771 1 185 . 1 1 27 27 LYS N N 27 118.860 118.860 119.059 -0.199 17919 75772 1 185 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.228 0.352 17919 75773 1 185 . 1 1 27 27 LYS C C 27 180.550 180.550 178.957 1.593 17919 75774 1 185 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.302 -0.052 17919 75775 1 185 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.188 1.542 17919 75776 1 185 . 1 1 27 27 LYS H H 27 8.560 8.560 8.470 0.090 17919 75777 1 185 . 1 1 28 28 ALA N N 28 123.440 123.440 122.594 0.846 17919 75778 1 185 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.088 0.072 17919 75779 1 185 . 1 1 28 28 ALA C C 28 180.300 180.300 178.860 1.440 17919 75780 1 185 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.917 0.452 17919 75781 1 185 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.459 -0.749 17919 75782 1 185 . 1 1 28 28 ALA H H 28 8.060 8.060 8.252 -0.192 17919 75783 1 185 . 1 1 29 29 LYS N N 29 119.940 119.940 119.627 0.313 17919 75784 1 185 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.063 0.144 17919 75785 1 185 . 1 1 29 29 LYS C C 29 180.320 180.320 179.153 1.167 17919 75786 1 185 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.349 0.301 17919 75787 1 185 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.413 0.877 17919 75788 1 185 . 1 1 29 29 LYS H H 29 7.850 7.850 8.019 -0.169 17919 75789 1 185 . 1 1 30 30 ILE N N 30 121.080 121.080 120.740 0.340 17919 75790 1 185 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.599 -0.092 17919 75791 1 185 . 1 1 30 30 ILE C C 30 178.310 178.310 177.173 1.137 17919 75792 1 185 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.303 0.847 17919 75793 1 185 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.787 -0.987 17919 75794 1 185 . 1 1 30 30 ILE H H 30 8.280 8.280 8.052 0.228 17919 75795 1 185 . 1 1 31 31 GLN N N 31 123.490 123.490 120.525 2.965 17919 75796 1 185 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.079 -0.250 17919 75797 1 185 . 1 1 31 31 GLN C C 31 178.890 178.890 178.452 0.438 17919 75798 1 185 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.016 0.984 17919 75799 1 185 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.555 -0.835 17919 75800 1 185 . 1 1 31 31 GLN H H 31 8.580 8.580 7.730 0.850 17919 75801 1 185 . 1 1 32 32 ASP N N 32 119.360 119.360 119.939 -0.579 17919 75802 1 185 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.391 -0.037 17919 75803 1 185 . 1 1 32 32 ASP C C 32 177.250 177.250 177.897 -0.647 17919 75804 1 185 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.861 0.329 17919 75805 1 185 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.735 -0.155 17919 75806 1 185 . 1 1 32 32 ASP H H 32 8.010 8.010 8.049 -0.039 17919 75807 1 185 . 1 1 33 33 LYS N N 33 115.130 115.130 118.960 -3.830 17919 75808 1 185 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.154 0.183 17919 75809 1 185 . 1 1 33 33 LYS C C 33 177.870 177.870 178.345 -0.475 17919 75810 1 185 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.291 -0.241 17919 75811 1 185 . 1 1 33 33 LYS CB C 33 34.170 34.170 32.758 1.412 17919 75812 1 185 . 1 1 33 33 LYS H H 33 7.430 7.430 7.630 -0.200 17919 75813 1 185 . 1 1 34 34 GLU N N 34 113.870 113.870 115.076 -1.206 17919 75814 1 185 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.454 0.171 17919 75815 1 185 . 1 1 34 34 GLU C C 34 177.840 177.840 177.517 0.323 17919 75816 1 185 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.879 -0.709 17919 75817 1 185 . 1 1 34 34 GLU CB C 34 32.660 32.660 30.256 2.404 17919 75818 1 185 . 1 1 34 34 GLU H H 34 8.740 8.740 8.169 0.571 17919 75819 1 185 . 1 1 35 35 GLY N N 35 108.650 108.650 108.752 -0.102 17919 75820 1 185 . 1 1 35 35 GLY C C 35 173.960 173.960 174.014 -0.054 17919 75821 1 185 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.717 0.363 17919 75822 1 185 . 1 1 35 35 GLY H H 35 8.530 8.530 8.151 0.379 17919 75823 1 185 . 1 1 36 36 ILE N N 36 119.880 119.880 122.568 -2.688 17919 75824 1 185 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.405 0.040 17919 75825 1 185 . 1 1 36 36 ILE C C 36 173.590 173.590 174.325 -0.735 17919 75826 1 185 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.519 0.231 17919 75827 1 185 . 1 1 36 36 ILE CB C 36 40.580 40.580 39.699 0.881 17919 75828 1 185 . 1 1 36 36 ILE H H 36 6.150 6.150 7.633 -1.483 17919 75829 1 185 . 1 1 37 37 PRO HA H 37 4.634 4.634 5.089 -0.455 17919 75830 1 185 . 1 1 37 37 PRO C C 37 176.940 176.940 176.327 0.613 17919 75831 1 185 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.065 0.595 17919 75832 1 185 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.170 0.680 17919 75833 1 185 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.153 -0.036 17919 75834 1 185 . 1 1 38 38 PRO C C 38 178.320 178.320 178.531 -0.211 17919 75835 1 185 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.955 0.305 17919 75836 1 185 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.759 1.131 17919 75837 1 185 . 1 1 39 39 ASP N N 39 113.380 113.380 114.863 -1.483 17919 75838 1 185 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.362 0.068 17919 75839 1 185 . 1 1 39 39 ASP C C 39 177.090 177.090 177.469 -0.379 17919 75840 1 185 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.685 -1.045 17919 75841 1 185 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.298 -0.758 17919 75842 1 185 . 1 1 39 39 ASP H H 39 8.550 8.550 8.810 -0.260 17919 75843 1 185 . 1 1 40 40 GLN N N 40 116.780 116.780 116.254 0.526 17919 75844 1 185 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.304 0.160 17919 75845 1 185 . 1 1 40 40 GLN C C 40 175.380 175.380 176.144 -0.764 17919 75846 1 185 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.649 -0.009 17919 75847 1 185 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.010 1.130 17919 75848 1 185 . 1 1 40 40 GLN H H 40 7.820 7.820 7.777 0.043 17919 75849 1 185 . 1 1 41 41 GLN N N 41 117.720 117.720 119.138 -1.418 17919 75850 1 185 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.616 -0.372 17919 75851 1 185 . 1 1 41 41 GLN C C 41 176.300 176.300 175.027 1.273 17919 75852 1 185 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.918 0.552 17919 75853 1 185 . 1 1 41 41 GLN CB C 41 31.650 31.650 30.556 1.094 17919 75854 1 185 . 1 1 41 41 GLN H H 41 7.480 7.480 7.802 -0.322 17919 75855 1 185 . 1 1 42 42 ARG N N 42 122.680 122.680 121.765 0.915 17919 75856 1 185 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.750 -0.250 17919 75857 1 185 . 1 1 42 42 ARG C C 42 174.050 174.050 174.394 -0.344 17919 75858 1 185 . 1 1 42 42 ARG CA C 42 55.050 55.050 53.381 1.669 17919 75859 1 185 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.702 -1.952 17919 75860 1 185 . 1 1 42 42 ARG H H 42 8.530 8.530 8.654 -0.124 17919 75861 1 185 . 1 1 43 43 LEU N N 43 124.040 124.040 122.809 1.231 17919 75862 1 185 . 1 1 43 43 LEU C C 43 175.290 175.290 175.326 -0.036 17919 75863 1 185 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.657 -0.677 17919 75864 1 185 . 1 1 43 43 LEU CB C 43 45.790 45.790 45.609 0.181 17919 75865 1 185 . 1 1 43 43 LEU H H 43 8.820 8.820 8.729 0.091 17919 75866 1 185 . 1 1 44 44 ILE N N 44 121.920 121.920 121.157 0.763 17919 75867 1 185 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.168 -0.176 17919 75868 1 185 . 1 1 44 44 ILE C C 44 176.060 176.060 174.429 1.631 17919 75869 1 185 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.476 -0.496 17919 75870 1 185 . 1 1 44 44 ILE CB C 44 41.420 41.420 39.775 1.645 17919 75871 1 185 . 1 1 44 44 ILE H H 44 9.030 9.030 9.074 -0.044 17919 75872 1 185 . 1 1 45 45 PHE N N 45 125.390 125.390 128.023 -2.633 17919 75873 1 185 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.967 0.078 17919 75874 1 185 . 1 1 45 45 PHE C C 45 174.470 174.470 174.504 -0.034 17919 75875 1 185 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.041 0.979 17919 75876 1 185 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.304 1.456 17919 75877 1 185 . 1 1 45 45 PHE H H 45 8.830 8.830 9.098 -0.268 17919 75878 1 185 . 1 1 46 46 ALA N N 46 132.200 132.200 130.585 1.615 17919 75879 1 185 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.723 -0.033 17919 75880 1 185 . 1 1 46 46 ALA C C 46 177.290 177.290 177.813 -0.523 17919 75881 1 185 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.062 0.478 17919 75882 1 185 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.383 0.187 17919 75883 1 185 . 1 1 46 46 ALA H H 46 8.810 8.810 8.868 -0.058 17919 75884 1 185 . 1 1 47 47 GLY N N 47 102.340 102.340 104.621 -2.281 17919 75885 1 185 . 1 1 47 47 GLY C C 47 173.810 173.810 174.306 -0.496 17919 75886 1 185 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.100 0.250 17919 75887 1 185 . 1 1 47 47 GLY H H 47 8.130 8.130 8.614 -0.484 17919 75888 1 185 . 1 1 48 48 LYS N N 48 121.570 121.570 121.058 0.512 17919 75889 1 185 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.609 0.013 17919 75890 1 185 . 1 1 48 48 LYS C C 48 174.700 174.700 175.071 -0.371 17919 75891 1 185 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.073 -0.523 17919 75892 1 185 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.543 -0.013 17919 75893 1 185 . 1 1 48 48 LYS H H 48 7.980 7.980 7.795 0.185 17919 75894 1 185 . 1 1 49 49 GLN N N 49 122.410 122.410 123.669 -1.259 17919 75895 1 185 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.685 -0.125 17919 75896 1 185 . 1 1 49 49 GLN C C 49 175.670 175.670 175.992 -0.322 17919 75897 1 185 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.652 0.088 17919 75898 1 185 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.603 -0.603 17919 75899 1 185 . 1 1 49 49 GLN H H 49 8.600 8.600 8.571 0.029 17919 75900 1 185 . 1 1 50 50 LEU N N 50 125.520 125.520 129.957 -4.437 17919 75901 1 185 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.307 -0.217 17919 75902 1 185 . 1 1 50 50 LEU C C 50 176.660 176.660 176.293 0.367 17919 75903 1 185 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.484 -0.244 17919 75904 1 185 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.285 0.284 17919 75905 1 185 . 1 1 50 50 LEU H H 50 8.530 8.530 8.595 -0.065 17919 75906 1 185 . 1 1 51 51 GLU N N 51 122.940 122.940 124.395 -1.455 17919 75907 1 185 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.493 -0.005 17919 75908 1 185 . 1 1 51 51 GLU C C 51 175.870 175.870 177.093 -1.223 17919 75909 1 185 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.602 0.358 17919 75910 1 185 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.851 -0.281 17919 75911 1 185 . 1 1 51 51 GLU H H 51 8.400 8.400 8.108 0.292 17919 75912 1 185 . 1 1 52 52 ASP N N 52 120.030 120.030 122.940 -2.910 17919 75913 1 185 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.470 -0.111 17919 75914 1 185 . 1 1 52 52 ASP C C 52 177.330 177.330 177.905 -0.575 17919 75915 1 185 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.317 -0.357 17919 75916 1 185 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.635 0.215 17919 75917 1 185 . 1 1 52 52 ASP H H 52 8.160 8.160 8.829 -0.669 17919 75918 1 185 . 1 1 53 53 GLY N N 53 106.660 106.660 105.313 1.347 17919 75919 1 185 . 1 1 53 53 GLY C C 53 174.870 174.870 174.156 0.714 17919 75920 1 185 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.666 0.504 17919 75921 1 185 . 1 1 53 53 GLY H H 53 9.390 9.390 8.442 0.948 17919 75922 1 185 . 1 1 54 54 ARG N N 54 119.050 119.050 121.327 -2.277 17919 75923 1 185 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.651 0.044 17919 75924 1 185 . 1 1 54 54 ARG C C 54 175.350 175.350 175.584 -0.234 17919 75925 1 185 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.806 -0.416 17919 75926 1 185 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.981 -0.331 17919 75927 1 185 . 1 1 54 54 ARG H H 54 7.460 7.460 7.469 -0.009 17919 75928 1 185 . 1 1 55 55 THR N N 55 108.400 108.400 112.425 -4.025 17919 75929 1 185 . 1 1 55 55 THR HA H 55 5.240 5.240 5.071 0.169 17919 75930 1 185 . 1 1 55 55 THR C C 55 176.560 176.560 176.454 0.106 17919 75931 1 185 . 1 1 55 55 THR CA C 55 59.690 59.690 60.643 -0.953 17919 75932 1 185 . 1 1 55 55 THR CB C 55 72.260 72.260 70.806 1.454 17919 75933 1 185 . 1 1 55 55 THR H H 55 8.730 8.730 8.709 0.021 17919 75934 1 185 . 1 1 56 56 LEU N N 56 117.920 117.920 123.087 -5.167 17919 75935 1 185 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.964 0.096 17919 75936 1 185 . 1 1 56 56 LEU C C 56 180.810 180.810 178.875 1.935 17919 75937 1 185 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.297 0.412 17919 75938 1 185 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.362 -0.992 17919 75939 1 185 . 1 1 56 56 LEU H H 56 8.140 8.140 8.535 -0.395 17919 75940 1 185 . 1 1 57 57 SER N N 57 113.330 113.330 115.409 -2.079 17919 75941 1 185 . 1 1 57 57 SER HA H 57 4.370 4.370 4.074 0.296 17919 75942 1 185 . 1 1 57 57 SER C C 57 178.310 178.310 176.673 1.637 17919 75943 1 185 . 1 1 57 57 SER CA C 57 61.080 61.080 62.411 -1.331 17919 75944 1 185 . 1 1 57 57 SER CB C 57 62.530 62.530 62.814 -0.284 17919 75945 1 185 . 1 1 57 57 SER H H 57 8.470 8.470 8.222 0.248 17919 75946 1 185 . 1 1 58 58 ASP N N 58 124.190 124.190 121.065 3.125 17919 75947 1 185 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.336 -0.040 17919 75948 1 185 . 1 1 58 58 ASP C C 58 177.400 177.400 176.853 0.547 17919 75949 1 185 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.698 0.482 17919 75950 1 185 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.553 -0.453 17919 75951 1 185 . 1 1 58 58 ASP H H 58 7.930 7.930 7.770 0.160 17919 75952 1 185 . 1 1 59 59 TYR N N 59 115.510 115.510 115.656 -0.146 17919 75953 1 185 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.637 0.033 17919 75954 1 185 . 1 1 59 59 TYR C C 59 174.700 174.700 175.091 -0.391 17919 75955 1 185 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.518 0.732 17919 75956 1 185 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.857 1.213 17919 75957 1 185 . 1 1 59 59 TYR H H 59 7.250 7.250 7.166 0.084 17919 75958 1 185 . 1 1 60 60 ASN N N 60 115.900 115.900 117.598 -1.698 17919 75959 1 185 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.427 -0.072 17919 75960 1 185 . 1 1 60 60 ASN C C 60 174.340 174.340 174.808 -0.468 17919 75961 1 185 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.292 -0.172 17919 75962 1 185 . 1 1 60 60 ASN CB C 60 37.410 37.410 36.999 0.410 17919 75963 1 185 . 1 1 60 60 ASN H H 60 8.150 8.150 8.314 -0.164 17919 75964 1 185 . 1 1 61 61 ILE N N 61 118.600 118.600 119.200 -0.600 17919 75965 1 185 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.890 -0.497 17919 75966 1 185 . 1 1 61 61 ILE C C 61 174.610 174.610 175.064 -0.454 17919 75967 1 185 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.832 0.588 17919 75968 1 185 . 1 1 61 61 ILE CB C 61 36.740 36.740 38.390 -1.650 17919 75969 1 185 . 1 1 61 61 ILE H H 61 7.250 7.250 7.477 -0.227 17919 75970 1 185 . 1 1 62 62 GLN N N 62 124.740 124.740 124.463 0.277 17919 75971 1 185 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.681 -0.175 17919 75972 1 185 . 1 1 62 62 GLN C C 62 175.970 175.970 175.334 0.636 17919 75973 1 185 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.678 -0.018 17919 75974 1 185 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.188 0.463 17919 75975 1 185 . 1 1 62 62 GLN H H 62 7.610 7.610 8.182 -0.572 17919 75976 1 185 . 1 1 63 63 LYS N N 63 120.300 120.300 122.874 -2.574 17919 75977 1 185 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.742 0.259 17919 75978 1 185 . 1 1 63 63 LYS C C 63 175.810 175.810 176.913 -1.103 17919 75979 1 185 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.567 -0.777 17919 75980 1 185 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.069 0.581 17919 75981 1 185 . 1 1 63 63 LYS H H 63 8.490 8.490 8.556 -0.066 17919 75982 1 185 . 1 1 64 64 GLU N N 64 113.950 113.950 119.177 -5.227 17919 75983 1 185 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.623 -0.158 17919 75984 1 185 . 1 1 64 64 GLU C C 64 175.250 175.250 175.769 -0.519 17919 75985 1 185 . 1 1 64 64 GLU CA C 64 57.890 57.890 58.001 -0.111 17919 75986 1 185 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.961 -3.061 17919 75987 1 185 . 1 1 64 64 GLU H H 64 9.280 9.280 8.732 0.548 17919 75988 1 185 . 1 1 65 65 SER N N 65 114.730 114.730 115.904 -1.174 17919 75989 1 185 . 1 1 65 65 SER HA H 65 4.640 4.640 4.465 0.175 17919 75990 1 185 . 1 1 65 65 SER C C 65 172.160 172.160 173.670 -1.510 17919 75991 1 185 . 1 1 65 65 SER CA C 65 60.890 60.890 61.054 -0.164 17919 75992 1 185 . 1 1 65 65 SER CB C 65 64.910 64.910 63.938 0.972 17919 75993 1 185 . 1 1 65 65 SER H H 65 7.670 7.670 7.665 0.005 17919 75994 1 185 . 1 1 66 66 THR N N 66 117.110 117.110 117.941 -0.831 17919 75995 1 185 . 1 1 66 66 THR HA H 66 5.270 5.270 5.348 -0.078 17919 75996 1 185 . 1 1 66 66 THR C C 66 173.950 173.950 174.130 -0.180 17919 75997 1 185 . 1 1 66 66 THR CA C 66 62.340 62.340 61.916 0.424 17919 75998 1 185 . 1 1 66 66 THR CB C 66 70.080 70.080 70.329 -0.249 17919 75999 1 185 . 1 1 66 66 THR H H 66 8.730 8.730 8.214 0.516 17919 76000 1 185 . 1 1 67 67 LEU N N 67 127.110 127.110 127.115 -0.005 17919 76001 1 185 . 1 1 67 67 LEU HA H 67 5.060 5.060 5.173 -0.113 17919 76002 1 185 . 1 1 67 67 LEU C C 67 175.770 175.770 175.273 0.497 17919 76003 1 185 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.827 0.073 17919 76004 1 185 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.424 -0.164 17919 76005 1 185 . 1 1 67 67 LEU H H 67 9.410 9.410 9.062 0.348 17919 76006 1 185 . 1 1 68 68 HIS N N 68 118.380 118.380 121.200 -2.820 17919 76007 1 185 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.237 0.003 17919 76008 1 185 . 1 1 68 68 HIS C C 68 173.150 173.150 173.472 -0.322 17919 76009 1 185 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.414 0.586 17919 76010 1 185 . 1 1 68 68 HIS CB C 68 30.530 30.530 33.271 -2.741 17919 76011 1 185 . 1 1 68 68 HIS H H 68 9.230 9.230 9.081 0.149 17919 76012 1 185 . 1 1 69 69 LEU N N 69 124.460 124.460 128.697 -4.237 17919 76013 1 185 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.835 0.355 17919 76014 1 185 . 1 1 69 69 LEU C C 69 175.270 175.270 174.373 0.897 17919 76015 1 185 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.405 0.485 17919 76016 1 185 . 1 1 69 69 LEU CB C 69 44.380 44.380 43.681 0.699 17919 76017 1 185 . 1 1 69 69 LEU H H 69 8.340 8.340 7.893 0.447 17919 76018 1 185 . 1 1 70 70 VAL N N 70 126.940 126.940 128.332 -1.392 17919 76019 1 185 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.393 -0.043 17919 76020 1 185 . 1 1 70 70 VAL C C 70 174.000 174.000 174.506 -0.506 17919 76021 1 185 . 1 1 70 70 VAL CA C 70 60.800 60.800 61.890 -1.090 17919 76022 1 185 . 1 1 70 70 VAL CB C 70 34.910 34.910 32.602 2.308 17919 76023 1 185 . 1 1 70 70 VAL H H 70 9.200 9.200 9.009 0.191 17919 76024 1 185 . 1 1 71 71 LEU N N 71 123.130 123.130 127.249 -4.119 17919 76025 1 185 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.793 0.267 17919 76026 1 185 . 1 1 71 71 LEU C C 71 177.830 177.830 177.350 0.480 17919 76027 1 185 . 1 1 71 71 LEU CA C 71 53.940 53.940 52.387 1.553 17919 76028 1 185 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.173 0.677 17919 76029 1 185 . 1 1 71 71 LEU H H 71 8.120 8.120 8.544 -0.424 17919 76030 1 185 . 1 1 72 72 ARG N N 72 123.490 123.490 124.570 -1.080 17919 76031 1 185 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.149 0.152 17919 76032 1 185 . 1 1 72 72 ARG C C 72 175.350 175.350 175.249 0.101 17919 76033 1 185 . 1 1 72 72 ARG CA C 72 55.610 55.610 57.144 -1.534 17919 76034 1 185 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.115 1.235 17919 76035 1 185 . 1 1 72 72 ARG H H 72 8.580 8.580 8.379 0.201 17919 76036 1 186 . 1 1 2 2 GLN N N 2 123.220 123.220 119.894 3.326 17919 76037 1 186 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.169 0.080 17919 76038 1 186 . 1 1 2 2 GLN C C 2 175.920 175.920 175.881 0.039 17919 76039 1 186 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.989 0.091 17919 76040 1 186 . 1 1 2 2 GLN CB C 2 30.760 30.760 29.566 1.194 17919 76041 1 186 . 1 1 2 2 GLN H H 2 8.900 8.900 8.369 0.531 17919 76042 1 186 . 1 1 3 3 ILE N N 3 115.340 115.340 117.994 -2.654 17919 76043 1 186 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.900 -0.687 17919 76044 1 186 . 1 1 3 3 ILE C C 3 172.450 172.450 174.065 -1.615 17919 76045 1 186 . 1 1 3 3 ILE CA C 3 59.570 59.570 58.914 0.656 17919 76046 1 186 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.539 0.671 17919 76047 1 186 . 1 1 3 3 ILE H H 3 8.320 8.320 8.385 -0.065 17919 76048 1 186 . 1 1 4 4 PHE N N 4 118.110 118.110 118.927 -0.817 17919 76049 1 186 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.156 0.474 17919 76050 1 186 . 1 1 4 4 PHE C C 4 175.320 175.320 174.495 0.825 17919 76051 1 186 . 1 1 4 4 PHE CA C 4 55.210 55.210 56.383 -1.173 17919 76052 1 186 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.537 -0.057 17919 76053 1 186 . 1 1 4 4 PHE H H 4 8.610 8.610 8.221 0.389 17919 76054 1 186 . 1 1 5 5 VAL N N 5 121.000 121.000 123.866 -2.866 17919 76055 1 186 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.606 0.119 17919 76056 1 186 . 1 1 5 5 VAL C C 5 174.870 174.870 175.722 -0.852 17919 76057 1 186 . 1 1 5 5 VAL CA C 5 60.620 60.620 60.616 0.004 17919 76058 1 186 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.437 -0.207 17919 76059 1 186 . 1 1 5 5 VAL H H 5 9.300 9.300 9.348 -0.048 17919 76060 1 186 . 1 1 6 6 LYS N N 6 127.520 127.520 127.712 -0.192 17919 76061 1 186 . 1 1 6 6 LYS HA H 6 5.367 5.367 4.827 0.540 17919 76062 1 186 . 1 1 6 6 LYS C C 6 177.140 177.140 177.278 -0.138 17919 76063 1 186 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.837 -0.317 17919 76064 1 186 . 1 1 6 6 LYS CB C 6 35.050 35.050 32.567 2.483 17919 76065 1 186 . 1 1 6 6 LYS H H 6 8.820 8.820 9.262 -0.442 17919 76066 1 186 . 1 1 7 7 THR N N 7 115.400 115.400 115.671 -0.271 17919 76067 1 186 . 1 1 7 7 THR HA H 7 4.970 4.970 4.469 0.501 17919 76068 1 186 . 1 1 7 7 THR C C 7 176.910 176.910 176.076 0.834 17919 76069 1 186 . 1 1 7 7 THR CA C 7 60.470 60.470 61.373 -0.903 17919 76070 1 186 . 1 1 7 7 THR CB C 7 70.630 70.630 70.233 0.397 17919 76071 1 186 . 1 1 7 7 THR H H 7 8.730 8.730 8.693 0.037 17919 76072 1 186 . 1 1 8 8 LEU N N 8 121.330 121.330 123.002 -1.672 17919 76073 1 186 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.056 0.254 17919 76074 1 186 . 1 1 8 8 LEU C C 8 178.800 178.800 177.209 1.591 17919 76075 1 186 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.714 -0.134 17919 76076 1 186 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.084 -0.114 17919 76077 1 186 . 1 1 8 8 LEU H H 8 9.100 9.100 8.856 0.244 17919 76078 1 186 . 1 1 9 9 THR N N 9 105.590 105.590 107.918 -2.328 17919 76079 1 186 . 1 1 9 9 THR HA H 9 4.428 4.428 4.230 0.198 17919 76080 1 186 . 1 1 9 9 THR C C 9 175.520 175.520 175.944 -0.424 17919 76081 1 186 . 1 1 9 9 THR CA C 9 61.400 61.400 61.880 -0.480 17919 76082 1 186 . 1 1 9 9 THR CB C 9 69.140 69.140 68.007 1.133 17919 76083 1 186 . 1 1 9 9 THR H H 9 7.630 7.630 7.561 0.069 17919 76084 1 186 . 1 1 10 10 GLY N N 10 108.890 108.890 112.469 -3.579 17919 76085 1 186 . 1 1 10 10 GLY C C 10 174.070 174.070 174.223 -0.153 17919 76086 1 186 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.991 -0.531 17919 76087 1 186 . 1 1 10 10 GLY H H 10 7.810 7.810 8.370 -0.560 17919 76088 1 186 . 1 1 11 11 LYS N N 11 121.600 121.600 120.879 0.721 17919 76089 1 186 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.268 0.093 17919 76090 1 186 . 1 1 11 11 LYS C C 11 175.940 175.940 175.779 0.161 17919 76091 1 186 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.682 -0.403 17919 76092 1 186 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.137 0.063 17919 76093 1 186 . 1 1 11 11 LYS H H 11 7.280 7.280 7.408 -0.128 17919 76094 1 186 . 1 1 12 12 THR N N 12 120.440 120.440 117.170 3.270 17919 76095 1 186 . 1 1 12 12 THR HA H 12 5.046 5.046 5.080 -0.034 17919 76096 1 186 . 1 1 12 12 THR C C 12 174.320 174.320 174.567 -0.247 17919 76097 1 186 . 1 1 12 12 THR CA C 12 62.390 62.390 62.185 0.205 17919 76098 1 186 . 1 1 12 12 THR CB C 12 69.910 69.910 69.825 0.085 17919 76099 1 186 . 1 1 12 12 THR H H 12 8.650 8.650 8.300 0.350 17919 76100 1 186 . 1 1 13 13 ILE N N 13 127.110 127.110 123.489 3.621 17919 76101 1 186 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.663 -0.119 17919 76102 1 186 . 1 1 13 13 ILE C C 13 175.220 175.220 174.302 0.918 17919 76103 1 186 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.755 0.225 17919 76104 1 186 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.266 0.684 17919 76105 1 186 . 1 1 13 13 ILE H H 13 9.450 9.450 9.263 0.187 17919 76106 1 186 . 1 1 14 14 THR N N 14 121.520 121.520 122.689 -1.169 17919 76107 1 186 . 1 1 14 14 THR HA H 14 4.964 4.964 4.582 0.382 17919 76108 1 186 . 1 1 14 14 THR C C 14 173.790 173.790 173.380 0.410 17919 76109 1 186 . 1 1 14 14 THR CA C 14 61.940 61.940 62.374 -0.434 17919 76110 1 186 . 1 1 14 14 THR CB C 14 69.650 69.650 69.597 0.054 17919 76111 1 186 . 1 1 14 14 THR H H 14 8.710 8.710 8.424 0.286 17919 76112 1 186 . 1 1 15 15 LEU N N 15 124.800 124.800 126.008 -1.208 17919 76113 1 186 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.670 0.110 17919 76114 1 186 . 1 1 15 15 LEU C C 15 174.670 174.670 175.028 -0.358 17919 76115 1 186 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.149 -0.319 17919 76116 1 186 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.699 1.371 17919 76117 1 186 . 1 1 15 15 LEU H H 15 8.710 8.710 8.083 0.627 17919 76118 1 186 . 1 1 16 16 GLU N N 16 122.160 122.160 123.078 -0.918 17919 76119 1 186 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.139 -0.222 17919 76120 1 186 . 1 1 16 16 GLU C C 16 175.860 175.860 175.878 -0.018 17919 76121 1 186 . 1 1 16 16 GLU CA C 16 54.820 54.820 54.450 0.370 17919 76122 1 186 . 1 1 16 16 GLU CB C 16 29.450 29.450 29.300 0.150 17919 76123 1 186 . 1 1 16 16 GLU H H 16 8.140 8.140 8.267 -0.127 17919 76124 1 186 . 1 1 17 17 VAL N N 17 117.210 117.210 117.267 -0.057 17919 76125 1 186 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.858 -0.144 17919 76126 1 186 . 1 1 17 17 VAL C C 17 174.160 174.160 175.155 -0.995 17919 76127 1 186 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.668 -0.238 17919 76128 1 186 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.870 0.530 17919 76129 1 186 . 1 1 17 17 VAL H H 17 8.900 8.900 8.685 0.215 17919 76130 1 186 . 1 1 18 18 GLU N N 18 118.990 118.990 120.014 -1.024 17919 76131 1 186 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.784 0.295 17919 76132 1 186 . 1 1 18 18 GLU C C 18 176.160 176.160 175.117 1.043 17919 76133 1 186 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.953 -0.233 17919 76134 1 186 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.647 -0.337 17919 76135 1 186 . 1 1 18 18 GLU H H 18 8.640 8.640 8.969 -0.329 17919 76136 1 186 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.330 -0.189 17919 76137 1 186 . 1 1 19 19 PRO C C 19 175.310 175.310 177.966 -2.656 17919 76138 1 186 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.326 0.144 17919 76139 1 186 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.933 0.017 17919 76140 1 186 . 1 1 20 20 SER N N 20 103.400 103.400 110.176 -6.776 17919 76141 1 186 . 1 1 20 20 SER HA H 20 4.370 4.370 4.304 0.066 17919 76142 1 186 . 1 1 20 20 SER C C 20 174.660 174.660 174.722 -0.062 17919 76143 1 186 . 1 1 20 20 SER CA C 20 57.400 57.400 58.559 -1.159 17919 76144 1 186 . 1 1 20 20 SER CB C 20 63.370 63.370 62.921 0.449 17919 76145 1 186 . 1 1 20 20 SER H H 20 7.040 7.040 8.118 -1.078 17919 76146 1 186 . 1 1 21 21 ASP N N 21 123.480 123.480 123.785 -0.305 17919 76147 1 186 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.725 -0.030 17919 76148 1 186 . 1 1 21 21 ASP C C 21 176.360 176.360 176.316 0.044 17919 76149 1 186 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.647 1.053 17919 76150 1 186 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.743 -0.943 17919 76151 1 186 . 1 1 21 21 ASP H H 21 8.030 8.030 7.547 0.483 17919 76152 1 186 . 1 1 22 22 THR N N 22 108.800 108.800 112.261 -3.461 17919 76153 1 186 . 1 1 22 22 THR HA H 22 4.920 4.920 4.953 -0.033 17919 76154 1 186 . 1 1 22 22 THR C C 22 176.750 176.750 176.220 0.530 17919 76155 1 186 . 1 1 22 22 THR CA C 22 59.690 59.690 60.805 -1.115 17919 76156 1 186 . 1 1 22 22 THR CB C 22 71.200 71.200 70.901 0.299 17919 76157 1 186 . 1 1 22 22 THR H H 22 7.900 7.900 8.465 -0.565 17919 76158 1 186 . 1 1 23 23 ILE N N 23 121.190 121.190 122.180 -0.990 17919 76159 1 186 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.883 -0.226 17919 76160 1 186 . 1 1 23 23 ILE C C 23 179.040 179.040 177.584 1.456 17919 76161 1 186 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.822 -0.562 17919 76162 1 186 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.577 -2.227 17919 76163 1 186 . 1 1 23 23 ILE H H 23 8.560 8.560 8.455 0.105 17919 76164 1 186 . 1 1 24 24 GLU N N 24 120.830 120.830 121.580 -0.750 17919 76165 1 186 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.829 0.088 17919 76166 1 186 . 1 1 24 24 GLU C C 24 178.640 178.640 178.560 0.080 17919 76167 1 186 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.562 -0.341 17919 76168 1 186 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.248 -0.968 17919 76169 1 186 . 1 1 24 24 GLU H H 24 9.760 9.760 8.178 1.582 17919 76170 1 186 . 1 1 25 25 ASN N N 25 120.570 120.570 117.688 2.882 17919 76171 1 186 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.444 0.081 17919 76172 1 186 . 1 1 25 25 ASN C C 25 178.380 178.380 178.077 0.303 17919 76173 1 186 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.007 0.053 17919 76174 1 186 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.402 0.048 17919 76175 1 186 . 1 1 25 25 ASN H H 25 7.920 7.920 7.661 0.259 17919 76176 1 186 . 1 1 26 26 VAL N N 26 121.710 121.710 120.270 1.440 17919 76177 1 186 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.591 -0.194 17919 76178 1 186 . 1 1 26 26 VAL C C 26 177.950 177.950 177.761 0.189 17919 76179 1 186 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.097 1.563 17919 76180 1 186 . 1 1 26 26 VAL CB C 26 30.840 30.840 30.852 -0.013 17919 76181 1 186 . 1 1 26 26 VAL H H 26 8.070 8.070 7.652 0.418 17919 76182 1 186 . 1 1 27 27 LYS N N 27 118.860 118.860 120.437 -1.577 17919 76183 1 186 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.151 0.429 17919 76184 1 186 . 1 1 27 27 LYS C C 27 180.550 180.550 179.070 1.480 17919 76185 1 186 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.885 -0.635 17919 76186 1 186 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.164 1.566 17919 76187 1 186 . 1 1 27 27 LYS H H 27 8.560 8.560 8.522 0.038 17919 76188 1 186 . 1 1 28 28 ALA N N 28 123.440 123.440 121.716 1.724 17919 76189 1 186 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.170 -0.010 17919 76190 1 186 . 1 1 28 28 ALA C C 28 180.300 180.300 179.193 1.107 17919 76191 1 186 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.849 0.521 17919 76192 1 186 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.336 -0.626 17919 76193 1 186 . 1 1 28 28 ALA H H 28 8.060 8.060 8.093 -0.033 17919 76194 1 186 . 1 1 29 29 LYS N N 29 119.940 119.940 119.273 0.667 17919 76195 1 186 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.061 0.146 17919 76196 1 186 . 1 1 29 29 LYS C C 29 180.320 180.320 179.106 1.214 17919 76197 1 186 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.572 0.078 17919 76198 1 186 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.271 1.019 17919 76199 1 186 . 1 1 29 29 LYS H H 29 7.850 7.850 7.503 0.347 17919 76200 1 186 . 1 1 30 30 ILE N N 30 121.080 121.080 121.020 0.060 17919 76201 1 186 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.624 -0.117 17919 76202 1 186 . 1 1 30 30 ILE C C 30 178.310 178.310 177.321 0.989 17919 76203 1 186 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.179 0.971 17919 76204 1 186 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.714 -0.914 17919 76205 1 186 . 1 1 30 30 ILE H H 30 8.280 8.280 7.928 0.352 17919 76206 1 186 . 1 1 31 31 GLN N N 31 123.490 123.490 121.018 2.472 17919 76207 1 186 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.998 -0.169 17919 76208 1 186 . 1 1 31 31 GLN C C 31 178.890 178.890 178.560 0.330 17919 76209 1 186 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.217 0.783 17919 76210 1 186 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.505 -0.785 17919 76211 1 186 . 1 1 31 31 GLN H H 31 8.580 8.580 8.401 0.179 17919 76212 1 186 . 1 1 32 32 ASP N N 32 119.360 119.360 119.565 -0.205 17919 76213 1 186 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.422 -0.068 17919 76214 1 186 . 1 1 32 32 ASP C C 32 177.250 177.250 177.976 -0.726 17919 76215 1 186 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.606 0.584 17919 76216 1 186 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.769 -0.189 17919 76217 1 186 . 1 1 32 32 ASP H H 32 8.010 8.010 8.285 -0.275 17919 76218 1 186 . 1 1 33 33 LYS N N 33 115.130 115.130 117.880 -2.750 17919 76219 1 186 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.291 0.046 17919 76220 1 186 . 1 1 33 33 LYS C C 33 177.870 177.870 178.165 -0.295 17919 76221 1 186 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.817 -0.767 17919 76222 1 186 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.746 0.424 17919 76223 1 186 . 1 1 33 33 LYS H H 33 7.430 7.430 7.533 -0.103 17919 76224 1 186 . 1 1 34 34 GLU N N 34 113.870 113.870 113.841 0.029 17919 76225 1 186 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.495 0.130 17919 76226 1 186 . 1 1 34 34 GLU C C 34 177.840 177.840 176.888 0.952 17919 76227 1 186 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.598 -0.428 17919 76228 1 186 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.579 1.081 17919 76229 1 186 . 1 1 34 34 GLU H H 34 8.740 8.740 8.152 0.588 17919 76230 1 186 . 1 1 35 35 GLY N N 35 108.650 108.650 109.141 -0.491 17919 76231 1 186 . 1 1 35 35 GLY C C 35 173.960 173.960 174.422 -0.462 17919 76232 1 186 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.814 0.266 17919 76233 1 186 . 1 1 35 35 GLY H H 35 8.530 8.530 7.960 0.570 17919 76234 1 186 . 1 1 36 36 ILE N N 36 119.880 119.880 122.342 -2.462 17919 76235 1 186 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.347 0.098 17919 76236 1 186 . 1 1 36 36 ILE C C 36 173.590 173.590 174.371 -0.781 17919 76237 1 186 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.835 -0.085 17919 76238 1 186 . 1 1 36 36 ILE CB C 36 40.580 40.580 39.090 1.490 17919 76239 1 186 . 1 1 36 36 ILE H H 36 6.150 6.150 7.608 -1.458 17919 76240 1 186 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.658 -0.024 17919 76241 1 186 . 1 1 37 37 PRO C C 37 176.940 176.940 175.938 1.002 17919 76242 1 186 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.288 0.372 17919 76243 1 186 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.169 0.681 17919 76244 1 186 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.201 -0.084 17919 76245 1 186 . 1 1 38 38 PRO C C 38 178.320 178.320 178.453 -0.133 17919 76246 1 186 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.519 0.741 17919 76247 1 186 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.829 1.060 17919 76248 1 186 . 1 1 39 39 ASP N N 39 113.380 113.380 116.008 -2.628 17919 76249 1 186 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.424 0.006 17919 76250 1 186 . 1 1 39 39 ASP C C 39 177.090 177.090 176.763 0.327 17919 76251 1 186 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.175 -0.535 17919 76252 1 186 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.512 -0.972 17919 76253 1 186 . 1 1 39 39 ASP H H 39 8.550 8.550 8.533 0.017 17919 76254 1 186 . 1 1 40 40 GLN N N 40 116.780 116.780 116.611 0.169 17919 76255 1 186 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.307 0.157 17919 76256 1 186 . 1 1 40 40 GLN C C 40 175.380 175.380 175.574 -0.194 17919 76257 1 186 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.377 0.263 17919 76258 1 186 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.648 0.492 17919 76259 1 186 . 1 1 40 40 GLN H H 40 7.820 7.820 7.861 -0.041 17919 76260 1 186 . 1 1 41 41 GLN N N 41 117.720 117.720 120.061 -2.341 17919 76261 1 186 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.745 -0.501 17919 76262 1 186 . 1 1 41 41 GLN C C 41 176.300 176.300 174.906 1.394 17919 76263 1 186 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.666 0.804 17919 76264 1 186 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.957 1.693 17919 76265 1 186 . 1 1 41 41 GLN H H 41 7.480 7.480 7.449 0.031 17919 76266 1 186 . 1 1 42 42 ARG N N 42 122.680 122.680 122.664 0.016 17919 76267 1 186 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.712 -0.212 17919 76268 1 186 . 1 1 42 42 ARG C C 42 174.050 174.050 173.831 0.219 17919 76269 1 186 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.626 0.424 17919 76270 1 186 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.324 -0.574 17919 76271 1 186 . 1 1 42 42 ARG H H 42 8.530 8.530 8.816 -0.286 17919 76272 1 186 . 1 1 43 43 LEU N N 43 124.040 124.040 126.781 -2.741 17919 76273 1 186 . 1 1 43 43 LEU C C 43 175.290 175.290 175.052 0.238 17919 76274 1 186 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.769 -0.789 17919 76275 1 186 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.555 1.235 17919 76276 1 186 . 1 1 43 43 LEU H H 43 8.820 8.820 8.850 -0.030 17919 76277 1 186 . 1 1 44 44 ILE N N 44 121.920 121.920 124.779 -2.859 17919 76278 1 186 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.732 0.260 17919 76279 1 186 . 1 1 44 44 ILE C C 44 176.060 176.060 174.139 1.921 17919 76280 1 186 . 1 1 44 44 ILE CA C 44 58.980 58.980 58.574 0.406 17919 76281 1 186 . 1 1 44 44 ILE CB C 44 41.420 41.420 39.082 2.338 17919 76282 1 186 . 1 1 44 44 ILE H H 44 9.030 9.030 8.853 0.177 17919 76283 1 186 . 1 1 45 45 PHE N N 45 125.390 125.390 127.421 -2.031 17919 76284 1 186 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.932 0.113 17919 76285 1 186 . 1 1 45 45 PHE C C 45 174.470 174.470 174.744 -0.274 17919 76286 1 186 . 1 1 45 45 PHE CA C 45 57.020 57.020 55.038 1.982 17919 76287 1 186 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.420 1.340 17919 76288 1 186 . 1 1 45 45 PHE H H 45 8.830 8.830 8.559 0.271 17919 76289 1 186 . 1 1 46 46 ALA N N 46 132.200 132.200 131.293 0.907 17919 76290 1 186 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.884 -0.194 17919 76291 1 186 . 1 1 46 46 ALA C C 46 177.290 177.290 177.604 -0.314 17919 76292 1 186 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.903 -0.363 17919 76293 1 186 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.512 0.058 17919 76294 1 186 . 1 1 46 46 ALA H H 46 8.810 8.810 9.244 -0.434 17919 76295 1 186 . 1 1 47 47 GLY N N 47 102.340 102.340 104.056 -1.716 17919 76296 1 186 . 1 1 47 47 GLY C C 47 173.810 173.810 174.221 -0.411 17919 76297 1 186 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.148 0.202 17919 76298 1 186 . 1 1 47 47 GLY H H 47 8.130 8.130 8.535 -0.405 17919 76299 1 186 . 1 1 48 48 LYS N N 48 121.570 121.570 121.805 -0.235 17919 76300 1 186 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.546 0.076 17919 76301 1 186 . 1 1 48 48 LYS C C 48 174.700 174.700 175.175 -0.475 17919 76302 1 186 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.169 -0.619 17919 76303 1 186 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.394 0.136 17919 76304 1 186 . 1 1 48 48 LYS H H 48 7.980 7.980 7.952 0.028 17919 76305 1 186 . 1 1 49 49 GLN N N 49 122.410 122.410 126.548 -4.138 17919 76306 1 186 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.507 0.053 17919 76307 1 186 . 1 1 49 49 GLN C C 49 175.670 175.670 175.389 0.281 17919 76308 1 186 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.071 -0.331 17919 76309 1 186 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.269 -0.269 17919 76310 1 186 . 1 1 49 49 GLN H H 49 8.600 8.600 8.589 0.011 17919 76311 1 186 . 1 1 50 50 LEU N N 50 125.520 125.520 127.288 -1.768 17919 76312 1 186 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.470 -0.380 17919 76313 1 186 . 1 1 50 50 LEU C C 50 176.660 176.660 176.199 0.461 17919 76314 1 186 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.628 0.612 17919 76315 1 186 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.737 -1.167 17919 76316 1 186 . 1 1 50 50 LEU H H 50 8.530 8.530 7.876 0.654 17919 76317 1 186 . 1 1 51 51 GLU N N 51 122.940 122.940 122.977 -0.037 17919 76318 1 186 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.534 -0.046 17919 76319 1 186 . 1 1 51 51 GLU C C 51 175.870 175.870 176.885 -1.015 17919 76320 1 186 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.163 0.798 17919 76321 1 186 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.926 -0.356 17919 76322 1 186 . 1 1 51 51 GLU H H 51 8.400 8.400 8.521 -0.121 17919 76323 1 186 . 1 1 52 52 ASP N N 52 120.030 120.030 126.934 -6.904 17919 76324 1 186 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.425 -0.066 17919 76325 1 186 . 1 1 52 52 ASP C C 52 177.330 177.330 177.571 -0.241 17919 76326 1 186 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.100 -0.140 17919 76327 1 186 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.604 0.246 17919 76328 1 186 . 1 1 52 52 ASP H H 52 8.160 8.160 8.800 -0.640 17919 76329 1 186 . 1 1 53 53 GLY N N 53 106.660 106.660 104.884 1.776 17919 76330 1 186 . 1 1 53 53 GLY C C 53 174.870 174.870 174.162 0.708 17919 76331 1 186 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.624 0.546 17919 76332 1 186 . 1 1 53 53 GLY H H 53 9.390 9.390 8.354 1.036 17919 76333 1 186 . 1 1 54 54 ARG N N 54 119.050 119.050 121.534 -2.484 17919 76334 1 186 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.682 0.013 17919 76335 1 186 . 1 1 54 54 ARG C C 54 175.350 175.350 175.659 -0.309 17919 76336 1 186 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.646 -0.256 17919 76337 1 186 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.880 -0.230 17919 76338 1 186 . 1 1 54 54 ARG H H 54 7.460 7.460 7.511 -0.051 17919 76339 1 186 . 1 1 55 55 THR N N 55 108.400 108.400 113.568 -5.168 17919 76340 1 186 . 1 1 55 55 THR HA H 55 5.240 5.240 4.785 0.455 17919 76341 1 186 . 1 1 55 55 THR C C 55 176.560 176.560 176.146 0.414 17919 76342 1 186 . 1 1 55 55 THR CA C 55 59.690 59.690 61.694 -2.004 17919 76343 1 186 . 1 1 55 55 THR CB C 55 72.260 72.260 70.101 2.159 17919 76344 1 186 . 1 1 55 55 THR H H 55 8.730 8.730 9.113 -0.383 17919 76345 1 186 . 1 1 56 56 LEU N N 56 117.920 117.920 123.371 -5.451 17919 76346 1 186 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.061 -0.001 17919 76347 1 186 . 1 1 56 56 LEU C C 56 180.810 180.810 178.969 1.841 17919 76348 1 186 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.618 0.092 17919 76349 1 186 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.139 -0.769 17919 76350 1 186 . 1 1 56 56 LEU H H 56 8.140 8.140 8.593 -0.453 17919 76351 1 186 . 1 1 57 57 SER N N 57 113.330 113.330 115.375 -2.045 17919 76352 1 186 . 1 1 57 57 SER HA H 57 4.370 4.370 4.201 0.169 17919 76353 1 186 . 1 1 57 57 SER C C 57 178.310 178.310 176.668 1.642 17919 76354 1 186 . 1 1 57 57 SER CA C 57 61.080 61.080 62.380 -1.300 17919 76355 1 186 . 1 1 57 57 SER CB C 57 62.530 62.530 62.796 -0.266 17919 76356 1 186 . 1 1 57 57 SER H H 57 8.470 8.470 8.336 0.134 17919 76357 1 186 . 1 1 58 58 ASP N N 58 124.190 124.190 120.647 3.543 17919 76358 1 186 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.319 -0.023 17919 76359 1 186 . 1 1 58 58 ASP C C 58 177.400 177.400 176.734 0.666 17919 76360 1 186 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.207 0.973 17919 76361 1 186 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.154 -0.054 17919 76362 1 186 . 1 1 58 58 ASP H H 58 7.930 7.930 7.827 0.103 17919 76363 1 186 . 1 1 59 59 TYR N N 59 115.510 115.510 114.824 0.686 17919 76364 1 186 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.668 0.002 17919 76365 1 186 . 1 1 59 59 TYR C C 59 174.700 174.700 175.171 -0.471 17919 76366 1 186 . 1 1 59 59 TYR CA C 59 58.250 58.250 56.941 1.309 17919 76367 1 186 . 1 1 59 59 TYR CB C 59 40.070 40.070 39.077 0.993 17919 76368 1 186 . 1 1 59 59 TYR H H 59 7.250 7.250 7.258 -0.008 17919 76369 1 186 . 1 1 60 60 ASN N N 60 115.900 115.900 118.627 -2.727 17919 76370 1 186 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.395 -0.040 17919 76371 1 186 . 1 1 60 60 ASN C C 60 174.340 174.340 174.679 -0.339 17919 76372 1 186 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.139 -0.019 17919 76373 1 186 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.138 0.272 17919 76374 1 186 . 1 1 60 60 ASN H H 60 8.150 8.150 8.203 -0.053 17919 76375 1 186 . 1 1 61 61 ILE N N 61 118.600 118.600 120.237 -1.637 17919 76376 1 186 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.909 -0.516 17919 76377 1 186 . 1 1 61 61 ILE C C 61 174.610 174.610 175.589 -0.979 17919 76378 1 186 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.346 0.073 17919 76379 1 186 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.410 -0.670 17919 76380 1 186 . 1 1 61 61 ILE H H 61 7.250 7.250 8.088 -0.838 17919 76381 1 186 . 1 1 62 62 GLN N N 62 124.740 124.740 126.989 -2.249 17919 76382 1 186 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.845 -0.339 17919 76383 1 186 . 1 1 62 62 GLN C C 62 175.970 175.970 175.383 0.587 17919 76384 1 186 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.056 0.604 17919 76385 1 186 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.995 -0.345 17919 76386 1 186 . 1 1 62 62 GLN H H 62 7.610 7.610 8.380 -0.770 17919 76387 1 186 . 1 1 63 63 LYS N N 63 120.300 120.300 119.666 0.634 17919 76388 1 186 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.085 -0.084 17919 76389 1 186 . 1 1 63 63 LYS C C 63 175.810 175.810 177.107 -1.297 17919 76390 1 186 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.202 -0.412 17919 76391 1 186 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.368 0.282 17919 76392 1 186 . 1 1 63 63 LYS H H 63 8.490 8.490 8.507 -0.017 17919 76393 1 186 . 1 1 64 64 GLU N N 64 113.950 113.950 119.321 -5.371 17919 76394 1 186 . 1 1 64 64 GLU HA H 64 3.465 3.465 4.083 -0.618 17919 76395 1 186 . 1 1 64 64 GLU C C 64 175.250 175.250 175.981 -0.731 17919 76396 1 186 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.759 0.131 17919 76397 1 186 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.939 -3.039 17919 76398 1 186 . 1 1 64 64 GLU H H 64 9.280 9.280 8.779 0.501 17919 76399 1 186 . 1 1 65 65 SER N N 65 114.730 114.730 115.335 -0.605 17919 76400 1 186 . 1 1 65 65 SER HA H 65 4.640 4.640 4.595 0.045 17919 76401 1 186 . 1 1 65 65 SER C C 65 172.160 172.160 173.878 -1.718 17919 76402 1 186 . 1 1 65 65 SER CA C 65 60.890 60.890 59.949 0.941 17919 76403 1 186 . 1 1 65 65 SER CB C 65 64.910 64.910 64.072 0.838 17919 76404 1 186 . 1 1 65 65 SER H H 65 7.670 7.670 7.664 0.006 17919 76405 1 186 . 1 1 66 66 THR N N 66 117.110 117.110 118.924 -1.814 17919 76406 1 186 . 1 1 66 66 THR HA H 66 5.270 5.270 5.379 -0.109 17919 76407 1 186 . 1 1 66 66 THR C C 66 173.950 173.950 173.834 0.116 17919 76408 1 186 . 1 1 66 66 THR CA C 66 62.340 62.340 61.587 0.753 17919 76409 1 186 . 1 1 66 66 THR CB C 66 70.080 70.080 70.805 -0.725 17919 76410 1 186 . 1 1 66 66 THR H H 66 8.730 8.730 8.282 0.448 17919 76411 1 186 . 1 1 67 67 LEU N N 67 127.110 127.110 125.931 1.179 17919 76412 1 186 . 1 1 67 67 LEU HA H 67 5.060 5.060 5.256 -0.196 17919 76413 1 186 . 1 1 67 67 LEU C C 67 175.770 175.770 175.201 0.569 17919 76414 1 186 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.109 0.791 17919 76415 1 186 . 1 1 67 67 LEU CB C 67 44.260 44.260 45.469 -1.209 17919 76416 1 186 . 1 1 67 67 LEU H H 67 9.410 9.410 9.250 0.160 17919 76417 1 186 . 1 1 68 68 HIS N N 68 118.380 118.380 116.511 1.869 17919 76418 1 186 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.530 -0.290 17919 76419 1 186 . 1 1 68 68 HIS C C 68 173.150 173.150 173.282 -0.132 17919 76420 1 186 . 1 1 68 68 HIS CA C 68 55.000 55.000 53.866 1.134 17919 76421 1 186 . 1 1 68 68 HIS CB C 68 30.530 30.530 33.157 -2.627 17919 76422 1 186 . 1 1 68 68 HIS H H 68 9.230 9.230 9.015 0.215 17919 76423 1 186 . 1 1 69 69 LEU N N 69 124.460 124.460 126.462 -2.002 17919 76424 1 186 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.032 0.158 17919 76425 1 186 . 1 1 69 69 LEU C C 69 175.270 175.270 174.906 0.364 17919 76426 1 186 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.169 -0.279 17919 76427 1 186 . 1 1 69 69 LEU CB C 69 44.380 44.380 43.350 1.030 17919 76428 1 186 . 1 1 69 69 LEU H H 69 8.340 8.340 8.367 -0.027 17919 76429 1 186 . 1 1 70 70 VAL N N 70 126.940 126.940 125.460 1.480 17919 76430 1 186 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.466 -0.116 17919 76431 1 186 . 1 1 70 70 VAL C C 70 174.000 174.000 174.735 -0.735 17919 76432 1 186 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.259 0.541 17919 76433 1 186 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.497 -0.587 17919 76434 1 186 . 1 1 70 70 VAL H H 70 9.200 9.200 9.031 0.169 17919 76435 1 186 . 1 1 71 71 LEU N N 71 123.130 123.130 122.529 0.601 17919 76436 1 186 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.128 -0.068 17919 76437 1 186 . 1 1 71 71 LEU C C 71 177.830 177.830 177.609 0.221 17919 76438 1 186 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.046 0.894 17919 76439 1 186 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.116 -0.266 17919 76440 1 186 . 1 1 71 71 LEU H H 71 8.120 8.120 8.386 -0.266 17919 76441 1 186 . 1 1 72 72 ARG N N 72 123.490 123.490 123.612 -0.122 17919 76442 1 186 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.158 0.143 17919 76443 1 186 . 1 1 72 72 ARG C C 72 175.350 175.350 175.137 0.213 17919 76444 1 186 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.974 -1.364 17919 76445 1 186 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.413 0.937 17919 76446 1 186 . 1 1 72 72 ARG H H 72 8.580 8.580 8.201 0.379 17919 76447 1 187 . 1 1 2 2 GLN N N 2 123.220 123.220 118.884 4.336 17919 76448 1 187 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.361 -0.112 17919 76449 1 187 . 1 1 2 2 GLN C C 2 175.920 175.920 175.996 -0.076 17919 76450 1 187 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.763 0.317 17919 76451 1 187 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.293 0.467 17919 76452 1 187 . 1 1 2 2 GLN H H 2 8.900 8.900 8.287 0.613 17919 76453 1 187 . 1 1 3 3 ILE N N 3 115.340 115.340 115.576 -0.236 17919 76454 1 187 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.686 -0.473 17919 76455 1 187 . 1 1 3 3 ILE C C 3 172.450 172.450 173.400 -0.950 17919 76456 1 187 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.035 0.535 17919 76457 1 187 . 1 1 3 3 ILE CB C 3 42.210 42.210 42.386 -0.176 17919 76458 1 187 . 1 1 3 3 ILE H H 3 8.320 8.320 8.402 -0.082 17919 76459 1 187 . 1 1 4 4 PHE N N 4 118.110 118.110 117.903 0.207 17919 76460 1 187 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.377 0.253 17919 76461 1 187 . 1 1 4 4 PHE C C 4 175.320 175.320 174.723 0.597 17919 76462 1 187 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.485 -0.275 17919 76463 1 187 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.342 -0.862 17919 76464 1 187 . 1 1 4 4 PHE H H 4 8.610 8.610 8.695 -0.085 17919 76465 1 187 . 1 1 5 5 VAL N N 5 121.000 121.000 122.300 -1.300 17919 76466 1 187 . 1 1 5 5 VAL HA H 5 4.725 4.725 5.202 -0.477 17919 76467 1 187 . 1 1 5 5 VAL C C 5 174.870 174.870 175.514 -0.644 17919 76468 1 187 . 1 1 5 5 VAL CA C 5 60.620 60.620 60.884 -0.264 17919 76469 1 187 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.249 -0.019 17919 76470 1 187 . 1 1 5 5 VAL H H 5 9.300 9.300 9.159 0.141 17919 76471 1 187 . 1 1 6 6 LYS N N 6 127.520 127.520 128.086 -0.566 17919 76472 1 187 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.264 0.103 17919 76473 1 187 . 1 1 6 6 LYS C C 6 177.140 177.140 176.843 0.297 17919 76474 1 187 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.090 0.430 17919 76475 1 187 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.359 0.691 17919 76476 1 187 . 1 1 6 6 LYS H H 6 8.820 8.820 9.215 -0.395 17919 76477 1 187 . 1 1 7 7 THR N N 7 115.400 115.400 114.584 0.816 17919 76478 1 187 . 1 1 7 7 THR HA H 7 4.970 4.970 4.919 0.051 17919 76479 1 187 . 1 1 7 7 THR C C 7 176.910 176.910 177.079 -0.169 17919 76480 1 187 . 1 1 7 7 THR CA C 7 60.470 60.470 60.104 0.366 17919 76481 1 187 . 1 1 7 7 THR CB C 7 70.630 70.630 71.050 -0.420 17919 76482 1 187 . 1 1 7 7 THR H H 7 8.730 8.730 8.999 -0.269 17919 76483 1 187 . 1 1 8 8 LEU N N 8 121.330 121.330 118.478 2.852 17919 76484 1 187 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.351 -0.041 17919 76485 1 187 . 1 1 8 8 LEU C C 8 178.800 178.800 176.772 2.028 17919 76486 1 187 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.153 0.427 17919 76487 1 187 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.731 0.239 17919 76488 1 187 . 1 1 8 8 LEU H H 8 9.100 9.100 8.443 0.657 17919 76489 1 187 . 1 1 9 9 THR N N 9 105.590 105.590 108.601 -3.011 17919 76490 1 187 . 1 1 9 9 THR HA H 9 4.428 4.428 4.466 -0.038 17919 76491 1 187 . 1 1 9 9 THR C C 9 175.520 175.520 175.395 0.125 17919 76492 1 187 . 1 1 9 9 THR CA C 9 61.400 61.400 61.443 -0.043 17919 76493 1 187 . 1 1 9 9 THR CB C 9 69.140 69.140 68.986 0.154 17919 76494 1 187 . 1 1 9 9 THR H H 9 7.630 7.630 7.365 0.265 17919 76495 1 187 . 1 1 10 10 GLY N N 10 108.890 108.890 111.071 -2.181 17919 76496 1 187 . 1 1 10 10 GLY C C 10 174.070 174.070 173.852 0.218 17919 76497 1 187 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.607 -0.147 17919 76498 1 187 . 1 1 10 10 GLY H H 10 7.810 7.810 8.494 -0.684 17919 76499 1 187 . 1 1 11 11 LYS N N 11 121.600 121.600 120.259 1.341 17919 76500 1 187 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.436 -0.075 17919 76501 1 187 . 1 1 11 11 LYS C C 11 175.940 175.940 175.474 0.466 17919 76502 1 187 . 1 1 11 11 LYS CA C 11 56.280 56.280 55.896 0.384 17919 76503 1 187 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.012 0.188 17919 76504 1 187 . 1 1 11 11 LYS H H 11 7.280 7.280 7.701 -0.421 17919 76505 1 187 . 1 1 12 12 THR N N 12 120.440 120.440 117.622 2.818 17919 76506 1 187 . 1 1 12 12 THR HA H 12 5.046 5.046 5.188 -0.142 17919 76507 1 187 . 1 1 12 12 THR C C 12 174.320 174.320 174.328 -0.008 17919 76508 1 187 . 1 1 12 12 THR CA C 12 62.390 62.390 61.395 0.995 17919 76509 1 187 . 1 1 12 12 THR CB C 12 69.910 69.910 70.235 -0.325 17919 76510 1 187 . 1 1 12 12 THR H H 12 8.650 8.650 8.180 0.470 17919 76511 1 187 . 1 1 13 13 ILE N N 13 127.110 127.110 126.222 0.888 17919 76512 1 187 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.489 0.055 17919 76513 1 187 . 1 1 13 13 ILE C C 13 175.220 175.220 175.156 0.064 17919 76514 1 187 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.238 -0.258 17919 76515 1 187 . 1 1 13 13 ILE CB C 13 40.950 40.950 42.322 -1.372 17919 76516 1 187 . 1 1 13 13 ILE H H 13 9.450 9.450 9.224 0.226 17919 76517 1 187 . 1 1 14 14 THR N N 14 121.520 121.520 121.949 -0.429 17919 76518 1 187 . 1 1 14 14 THR HA H 14 4.964 4.964 5.039 -0.075 17919 76519 1 187 . 1 1 14 14 THR C C 14 173.790 173.790 174.083 -0.293 17919 76520 1 187 . 1 1 14 14 THR CA C 14 61.940 61.940 62.398 -0.458 17919 76521 1 187 . 1 1 14 14 THR CB C 14 69.650 69.650 69.583 0.067 17919 76522 1 187 . 1 1 14 14 THR H H 14 8.710 8.710 8.481 0.229 17919 76523 1 187 . 1 1 15 15 LEU N N 15 124.800 124.800 126.981 -2.181 17919 76524 1 187 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.760 0.020 17919 76525 1 187 . 1 1 15 15 LEU C C 15 174.670 174.670 175.385 -0.715 17919 76526 1 187 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.612 -0.782 17919 76527 1 187 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.650 1.420 17919 76528 1 187 . 1 1 15 15 LEU H H 15 8.710 8.710 8.726 -0.016 17919 76529 1 187 . 1 1 16 16 GLU N N 16 122.160 122.160 124.278 -2.118 17919 76530 1 187 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.381 -0.464 17919 76531 1 187 . 1 1 16 16 GLU C C 16 175.860 175.860 175.822 0.038 17919 76532 1 187 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.196 -0.376 17919 76533 1 187 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.916 -1.466 17919 76534 1 187 . 1 1 16 16 GLU H H 16 8.140 8.140 8.652 -0.512 17919 76535 1 187 . 1 1 17 17 VAL N N 17 117.210 117.210 120.749 -3.539 17919 76536 1 187 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.934 -0.220 17919 76537 1 187 . 1 1 17 17 VAL C C 17 174.160 174.160 174.480 -0.320 17919 76538 1 187 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.953 -0.523 17919 76539 1 187 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.803 0.597 17919 76540 1 187 . 1 1 17 17 VAL H H 17 8.900 8.900 9.079 -0.179 17919 76541 1 187 . 1 1 18 18 GLU N N 18 118.990 118.990 122.298 -3.308 17919 76542 1 187 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.841 0.238 17919 76543 1 187 . 1 1 18 18 GLU C C 18 176.160 176.160 175.456 0.704 17919 76544 1 187 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.584 0.136 17919 76545 1 187 . 1 1 18 18 GLU CB C 18 30.310 30.310 29.765 0.545 17919 76546 1 187 . 1 1 18 18 GLU H H 18 8.640 8.640 8.690 -0.050 17919 76547 1 187 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.267 -0.126 17919 76548 1 187 . 1 1 19 19 PRO C C 19 175.310 175.310 177.548 -2.238 17919 76549 1 187 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.550 -0.080 17919 76550 1 187 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.008 -0.057 17919 76551 1 187 . 1 1 20 20 SER N N 20 103.400 103.400 111.245 -7.845 17919 76552 1 187 . 1 1 20 20 SER HA H 20 4.370 4.370 4.475 -0.105 17919 76553 1 187 . 1 1 20 20 SER C C 20 174.660 174.660 174.201 0.459 17919 76554 1 187 . 1 1 20 20 SER CA C 20 57.400 57.400 59.017 -1.617 17919 76555 1 187 . 1 1 20 20 SER CB C 20 63.370 63.370 63.078 0.292 17919 76556 1 187 . 1 1 20 20 SER H H 20 7.040 7.040 8.215 -1.175 17919 76557 1 187 . 1 1 21 21 ASP N N 21 123.480 123.480 123.765 -0.285 17919 76558 1 187 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.664 0.031 17919 76559 1 187 . 1 1 21 21 ASP C C 21 176.360 176.360 175.751 0.609 17919 76560 1 187 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.439 0.261 17919 76561 1 187 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.358 -0.558 17919 76562 1 187 . 1 1 21 21 ASP H H 21 8.030 8.030 7.694 0.336 17919 76563 1 187 . 1 1 22 22 THR N N 22 108.800 108.800 113.100 -4.300 17919 76564 1 187 . 1 1 22 22 THR HA H 22 4.920 4.920 4.666 0.254 17919 76565 1 187 . 1 1 22 22 THR C C 22 176.750 176.750 176.341 0.409 17919 76566 1 187 . 1 1 22 22 THR CA C 22 59.690 59.690 61.911 -2.221 17919 76567 1 187 . 1 1 22 22 THR CB C 22 71.200 71.200 70.576 0.624 17919 76568 1 187 . 1 1 22 22 THR H H 22 7.900 7.900 8.237 -0.337 17919 76569 1 187 . 1 1 23 23 ILE N N 23 121.190 121.190 123.593 -2.403 17919 76570 1 187 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.760 -0.103 17919 76571 1 187 . 1 1 23 23 ILE C C 23 179.040 179.040 177.245 1.795 17919 76572 1 187 . 1 1 23 23 ILE CA C 23 62.260 62.260 65.248 -2.988 17919 76573 1 187 . 1 1 23 23 ILE CB C 23 34.350 34.350 38.006 -3.656 17919 76574 1 187 . 1 1 23 23 ILE H H 23 8.560 8.560 8.328 0.232 17919 76575 1 187 . 1 1 24 24 GLU N N 24 120.830 120.830 121.400 -0.570 17919 76576 1 187 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.784 0.133 17919 76577 1 187 . 1 1 24 24 GLU C C 24 178.640 178.640 178.455 0.185 17919 76578 1 187 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.058 0.162 17919 76579 1 187 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.354 -1.074 17919 76580 1 187 . 1 1 24 24 GLU H H 24 9.760 9.760 8.046 1.714 17919 76581 1 187 . 1 1 25 25 ASN N N 25 120.570 120.570 117.373 3.197 17919 76582 1 187 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.474 0.051 17919 76583 1 187 . 1 1 25 25 ASN C C 25 178.380 178.380 178.022 0.358 17919 76584 1 187 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.171 -0.111 17919 76585 1 187 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.707 -0.257 17919 76586 1 187 . 1 1 25 25 ASN H H 25 7.920 7.920 7.632 0.288 17919 76587 1 187 . 1 1 26 26 VAL N N 26 121.710 121.710 120.240 1.470 17919 76588 1 187 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.724 -0.327 17919 76589 1 187 . 1 1 26 26 VAL C C 26 177.950 177.950 177.704 0.246 17919 76590 1 187 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.178 1.482 17919 76591 1 187 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.549 -0.709 17919 76592 1 187 . 1 1 26 26 VAL H H 26 8.070 8.070 8.260 -0.190 17919 76593 1 187 . 1 1 27 27 LYS N N 27 118.860 118.860 121.053 -2.193 17919 76594 1 187 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.131 0.449 17919 76595 1 187 . 1 1 27 27 LYS C C 27 180.550 180.550 178.940 1.610 17919 76596 1 187 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.909 -0.659 17919 76597 1 187 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.194 1.536 17919 76598 1 187 . 1 1 27 27 LYS H H 27 8.560 8.560 8.581 -0.021 17919 76599 1 187 . 1 1 28 28 ALA N N 28 123.440 123.440 121.442 1.998 17919 76600 1 187 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.126 0.034 17919 76601 1 187 . 1 1 28 28 ALA C C 28 180.300 180.300 179.210 1.090 17919 76602 1 187 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.026 0.344 17919 76603 1 187 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.523 -0.813 17919 76604 1 187 . 1 1 28 28 ALA H H 28 8.060 8.060 8.144 -0.084 17919 76605 1 187 . 1 1 29 29 LYS N N 29 119.940 119.940 117.384 2.556 17919 76606 1 187 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.203 0.004 17919 76607 1 187 . 1 1 29 29 LYS C C 29 180.320 180.320 178.096 2.224 17919 76608 1 187 . 1 1 29 29 LYS CA C 29 59.650 59.650 58.470 1.180 17919 76609 1 187 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.602 0.688 17919 76610 1 187 . 1 1 29 29 LYS H H 29 7.850 7.850 7.682 0.168 17919 76611 1 187 . 1 1 30 30 ILE N N 30 121.080 121.080 119.642 1.438 17919 76612 1 187 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.815 -0.308 17919 76613 1 187 . 1 1 30 30 ILE C C 30 178.310 178.310 177.259 1.051 17919 76614 1 187 . 1 1 30 30 ILE CA C 30 66.150 66.150 63.933 2.217 17919 76615 1 187 . 1 1 30 30 ILE CB C 30 36.800 36.800 38.201 -1.401 17919 76616 1 187 . 1 1 30 30 ILE H H 30 8.280 8.280 7.964 0.316 17919 76617 1 187 . 1 1 31 31 GLN N N 31 123.490 123.490 120.368 3.122 17919 76618 1 187 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.940 -0.111 17919 76619 1 187 . 1 1 31 31 GLN C C 31 178.890 178.890 178.328 0.562 17919 76620 1 187 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.601 0.399 17919 76621 1 187 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.516 -0.796 17919 76622 1 187 . 1 1 31 31 GLN H H 31 8.580 8.580 8.471 0.109 17919 76623 1 187 . 1 1 32 32 ASP N N 32 119.360 119.360 119.225 0.135 17919 76624 1 187 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.390 -0.036 17919 76625 1 187 . 1 1 32 32 ASP C C 32 177.250 177.250 177.765 -0.515 17919 76626 1 187 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.829 0.361 17919 76627 1 187 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.838 -0.258 17919 76628 1 187 . 1 1 32 32 ASP H H 32 8.010 8.010 8.003 0.007 17919 76629 1 187 . 1 1 33 33 LYS N N 33 115.130 115.130 118.651 -3.521 17919 76630 1 187 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.238 0.099 17919 76631 1 187 . 1 1 33 33 LYS C C 33 177.870 177.870 178.020 -0.150 17919 76632 1 187 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.074 -0.024 17919 76633 1 187 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.242 0.928 17919 76634 1 187 . 1 1 33 33 LYS H H 33 7.430 7.430 7.339 0.091 17919 76635 1 187 . 1 1 34 34 GLU N N 34 113.870 113.870 114.691 -0.821 17919 76636 1 187 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.480 0.145 17919 76637 1 187 . 1 1 34 34 GLU C C 34 177.840 177.840 176.958 0.882 17919 76638 1 187 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.251 -1.081 17919 76639 1 187 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.829 0.831 17919 76640 1 187 . 1 1 34 34 GLU H H 34 8.740 8.740 8.157 0.583 17919 76641 1 187 . 1 1 35 35 GLY N N 35 108.650 108.650 109.804 -1.154 17919 76642 1 187 . 1 1 35 35 GLY C C 35 173.960 173.960 174.069 -0.109 17919 76643 1 187 . 1 1 35 35 GLY CA C 35 46.080 46.080 46.012 0.068 17919 76644 1 187 . 1 1 35 35 GLY H H 35 8.530 8.530 8.362 0.168 17919 76645 1 187 . 1 1 36 36 ILE N N 36 119.880 119.880 120.394 -0.514 17919 76646 1 187 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.244 0.201 17919 76647 1 187 . 1 1 36 36 ILE C C 36 173.590 173.590 173.934 -0.344 17919 76648 1 187 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.768 -0.018 17919 76649 1 187 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.459 2.121 17919 76650 1 187 . 1 1 36 36 ILE H H 36 6.150 6.150 7.460 -1.310 17919 76651 1 187 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.430 0.204 17919 76652 1 187 . 1 1 37 37 PRO C C 37 176.940 176.940 176.537 0.403 17919 76653 1 187 . 1 1 37 37 PRO CA C 37 61.660 61.660 62.077 -0.417 17919 76654 1 187 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.469 0.381 17919 76655 1 187 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.164 -0.047 17919 76656 1 187 . 1 1 38 38 PRO C C 38 178.320 178.320 178.375 -0.055 17919 76657 1 187 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.869 0.391 17919 76658 1 187 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.723 1.167 17919 76659 1 187 . 1 1 39 39 ASP N N 39 113.380 113.380 115.987 -2.607 17919 76660 1 187 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.333 0.097 17919 76661 1 187 . 1 1 39 39 ASP C C 39 177.090 177.090 177.514 -0.424 17919 76662 1 187 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.939 -1.299 17919 76663 1 187 . 1 1 39 39 ASP CB C 39 39.540 39.540 39.675 -0.135 17919 76664 1 187 . 1 1 39 39 ASP H H 39 8.550 8.550 8.753 -0.203 17919 76665 1 187 . 1 1 40 40 GLN N N 40 116.780 116.780 117.718 -0.938 17919 76666 1 187 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.357 0.107 17919 76667 1 187 . 1 1 40 40 GLN C C 40 175.380 175.380 175.294 0.086 17919 76668 1 187 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.796 -0.156 17919 76669 1 187 . 1 1 40 40 GLN CB C 40 30.140 30.140 30.177 -0.037 17919 76670 1 187 . 1 1 40 40 GLN H H 40 7.820 7.820 7.748 0.072 17919 76671 1 187 . 1 1 41 41 GLN N N 41 117.720 117.720 119.964 -2.244 17919 76672 1 187 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.312 -0.068 17919 76673 1 187 . 1 1 41 41 GLN C C 41 176.300 176.300 175.132 1.168 17919 76674 1 187 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.398 0.073 17919 76675 1 187 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.603 2.047 17919 76676 1 187 . 1 1 41 41 GLN H H 41 7.480 7.480 7.369 0.111 17919 76677 1 187 . 1 1 42 42 ARG N N 42 122.680 122.680 124.396 -1.716 17919 76678 1 187 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.613 -0.113 17919 76679 1 187 . 1 1 42 42 ARG C C 42 174.050 174.050 174.459 -0.409 17919 76680 1 187 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.754 0.296 17919 76681 1 187 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.062 -0.312 17919 76682 1 187 . 1 1 42 42 ARG H H 42 8.530 8.530 8.775 -0.245 17919 76683 1 187 . 1 1 43 43 LEU N N 43 124.040 124.040 127.204 -3.164 17919 76684 1 187 . 1 1 43 43 LEU C C 43 175.290 175.290 175.886 -0.596 17919 76685 1 187 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.287 -1.307 17919 76686 1 187 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.187 2.603 17919 76687 1 187 . 1 1 43 43 LEU H H 43 8.820 8.820 8.831 -0.011 17919 76688 1 187 . 1 1 44 44 ILE N N 44 121.920 121.920 120.849 1.071 17919 76689 1 187 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.731 0.261 17919 76690 1 187 . 1 1 44 44 ILE C C 44 176.060 176.060 175.282 0.778 17919 76691 1 187 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.464 -1.484 17919 76692 1 187 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.860 -0.440 17919 76693 1 187 . 1 1 44 44 ILE H H 44 9.030 9.030 8.957 0.073 17919 76694 1 187 . 1 1 45 45 PHE N N 45 125.390 125.390 129.222 -3.832 17919 76695 1 187 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.227 0.818 17919 76696 1 187 . 1 1 45 45 PHE C C 45 174.470 174.470 175.564 -1.094 17919 76697 1 187 . 1 1 45 45 PHE CA C 45 57.020 57.020 61.340 -4.319 17919 76698 1 187 . 1 1 45 45 PHE CB C 45 43.760 43.760 39.825 3.935 17919 76699 1 187 . 1 1 45 45 PHE H H 45 8.830 8.830 8.455 0.375 17919 76700 1 187 . 1 1 46 46 ALA N N 46 132.200 132.200 117.917 14.283 17919 76701 1 187 . 1 1 46 46 ALA HA H 46 3.690 3.690 4.267 -0.577 17919 76702 1 187 . 1 1 46 46 ALA C C 46 177.290 177.290 177.667 -0.377 17919 76703 1 187 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.495 0.045 17919 76704 1 187 . 1 1 46 46 ALA CB C 46 16.570 16.570 19.802 -3.232 17919 76705 1 187 . 1 1 46 46 ALA H H 46 8.810 8.810 8.417 0.393 17919 76706 1 187 . 1 1 47 47 GLY N N 47 102.340 102.340 106.382 -4.042 17919 76707 1 187 . 1 1 47 47 GLY C C 47 173.810 173.810 173.435 0.375 17919 76708 1 187 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.055 0.295 17919 76709 1 187 . 1 1 47 47 GLY H H 47 8.130 8.130 8.139 -0.009 17919 76710 1 187 . 1 1 48 48 LYS N N 48 121.570 121.570 120.975 0.595 17919 76711 1 187 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.614 0.008 17919 76712 1 187 . 1 1 48 48 LYS C C 48 174.700 174.700 175.019 -0.319 17919 76713 1 187 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.313 -0.763 17919 76714 1 187 . 1 1 48 48 LYS CB C 48 34.530 34.530 35.534 -1.004 17919 76715 1 187 . 1 1 48 48 LYS H H 48 7.980 7.980 7.846 0.134 17919 76716 1 187 . 1 1 49 49 GLN N N 49 122.410 122.410 123.655 -1.245 17919 76717 1 187 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.545 0.015 17919 76718 1 187 . 1 1 49 49 GLN C C 49 175.670 175.670 175.170 0.500 17919 76719 1 187 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.513 0.227 17919 76720 1 187 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.351 -0.351 17919 76721 1 187 . 1 1 49 49 GLN H H 49 8.600 8.600 8.457 0.143 17919 76722 1 187 . 1 1 50 50 LEU N N 50 125.520 125.520 126.624 -1.104 17919 76723 1 187 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.363 -0.273 17919 76724 1 187 . 1 1 50 50 LEU C C 50 176.660 176.660 176.510 0.150 17919 76725 1 187 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.684 -0.444 17919 76726 1 187 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.031 -0.461 17919 76727 1 187 . 1 1 50 50 LEU H H 50 8.530 8.530 8.700 -0.170 17919 76728 1 187 . 1 1 51 51 GLU N N 51 122.940 122.940 121.152 1.788 17919 76729 1 187 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.681 -0.193 17919 76730 1 187 . 1 1 51 51 GLU C C 51 175.870 175.870 176.849 -0.979 17919 76731 1 187 . 1 1 51 51 GLU CA C 51 55.960 55.960 54.546 1.414 17919 76732 1 187 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.940 -1.370 17919 76733 1 187 . 1 1 51 51 GLU H H 51 8.400 8.400 8.301 0.099 17919 76734 1 187 . 1 1 52 52 ASP N N 52 120.030 120.030 124.177 -4.147 17919 76735 1 187 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.396 -0.037 17919 76736 1 187 . 1 1 52 52 ASP C C 52 177.330 177.330 177.774 -0.444 17919 76737 1 187 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.409 -0.449 17919 76738 1 187 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.761 0.089 17919 76739 1 187 . 1 1 52 52 ASP H H 52 8.160 8.160 8.870 -0.710 17919 76740 1 187 . 1 1 53 53 GLY N N 53 106.660 106.660 105.254 1.406 17919 76741 1 187 . 1 1 53 53 GLY C C 53 174.870 174.870 174.422 0.448 17919 76742 1 187 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.870 0.300 17919 76743 1 187 . 1 1 53 53 GLY H H 53 9.390 9.390 8.489 0.901 17919 76744 1 187 . 1 1 54 54 ARG N N 54 119.050 119.050 120.598 -1.548 17919 76745 1 187 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.519 0.176 17919 76746 1 187 . 1 1 54 54 ARG C C 54 175.350 175.350 175.842 -0.492 17919 76747 1 187 . 1 1 54 54 ARG CA C 54 54.390 54.390 55.086 -0.696 17919 76748 1 187 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.175 0.475 17919 76749 1 187 . 1 1 54 54 ARG H H 54 7.460 7.460 7.368 0.092 17919 76750 1 187 . 1 1 55 55 THR N N 55 108.400 108.400 112.480 -4.080 17919 76751 1 187 . 1 1 55 55 THR HA H 55 5.240 5.240 5.016 0.224 17919 76752 1 187 . 1 1 55 55 THR C C 55 176.560 176.560 176.141 0.419 17919 76753 1 187 . 1 1 55 55 THR CA C 55 59.690 59.690 60.696 -1.006 17919 76754 1 187 . 1 1 55 55 THR CB C 55 72.260 72.260 70.440 1.820 17919 76755 1 187 . 1 1 55 55 THR H H 55 8.730 8.730 8.750 -0.020 17919 76756 1 187 . 1 1 56 56 LEU N N 56 117.920 117.920 122.046 -4.126 17919 76757 1 187 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.154 -0.094 17919 76758 1 187 . 1 1 56 56 LEU C C 56 180.810 180.810 178.875 1.935 17919 76759 1 187 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.086 0.625 17919 76760 1 187 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.554 -1.184 17919 76761 1 187 . 1 1 56 56 LEU H H 56 8.140 8.140 8.473 -0.333 17919 76762 1 187 . 1 1 57 57 SER N N 57 113.330 113.330 115.153 -1.823 17919 76763 1 187 . 1 1 57 57 SER HA H 57 4.370 4.370 4.128 0.242 17919 76764 1 187 . 1 1 57 57 SER C C 57 178.310 178.310 177.040 1.270 17919 76765 1 187 . 1 1 57 57 SER CA C 57 61.080 61.080 61.996 -0.916 17919 76766 1 187 . 1 1 57 57 SER CB C 57 62.530 62.530 62.680 -0.150 17919 76767 1 187 . 1 1 57 57 SER H H 57 8.470 8.470 8.609 -0.139 17919 76768 1 187 . 1 1 58 58 ASP N N 58 124.190 124.190 121.581 2.609 17919 76769 1 187 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.318 -0.022 17919 76770 1 187 . 1 1 58 58 ASP C C 58 177.400 177.400 178.093 -0.693 17919 76771 1 187 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.948 0.232 17919 76772 1 187 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.248 -0.149 17919 76773 1 187 . 1 1 58 58 ASP H H 58 7.930 7.930 7.859 0.071 17919 76774 1 187 . 1 1 59 59 TYR N N 59 115.510 115.510 116.696 -1.186 17919 76775 1 187 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.347 0.323 17919 76776 1 187 . 1 1 59 59 TYR C C 59 174.700 174.700 174.454 0.246 17919 76777 1 187 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.679 0.571 17919 76778 1 187 . 1 1 59 59 TYR CB C 59 40.070 40.070 37.588 2.482 17919 76779 1 187 . 1 1 59 59 TYR H H 59 7.250 7.250 7.207 0.043 17919 76780 1 187 . 1 1 60 60 ASN N N 60 115.900 115.900 114.689 1.211 17919 76781 1 187 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.337 0.018 17919 76782 1 187 . 1 1 60 60 ASN C C 60 174.340 174.340 174.488 -0.148 17919 76783 1 187 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.114 0.006 17919 76784 1 187 . 1 1 60 60 ASN CB C 60 37.410 37.410 36.321 1.089 17919 76785 1 187 . 1 1 60 60 ASN H H 60 8.150 8.150 7.849 0.301 17919 76786 1 187 . 1 1 61 61 ILE N N 61 118.600 118.600 119.516 -0.916 17919 76787 1 187 . 1 1 61 61 ILE HA H 61 3.393 3.393 4.029 -0.636 17919 76788 1 187 . 1 1 61 61 ILE C C 61 174.610 174.610 175.798 -1.188 17919 76789 1 187 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.666 0.754 17919 76790 1 187 . 1 1 61 61 ILE CB C 61 36.740 36.740 38.239 -1.499 17919 76791 1 187 . 1 1 61 61 ILE H H 61 7.250 7.250 7.837 -0.587 17919 76792 1 187 . 1 1 62 62 GLN N N 62 124.740 124.740 125.798 -1.058 17919 76793 1 187 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.605 -0.099 17919 76794 1 187 . 1 1 62 62 GLN C C 62 175.970 175.970 175.072 0.898 17919 76795 1 187 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.781 -0.121 17919 76796 1 187 . 1 1 62 62 GLN CB C 62 31.650 31.650 30.642 1.008 17919 76797 1 187 . 1 1 62 62 GLN H H 62 7.610 7.610 8.413 -0.803 17919 76798 1 187 . 1 1 63 63 LYS N N 63 120.300 120.300 120.639 -0.339 17919 76799 1 187 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.243 -0.242 17919 76800 1 187 . 1 1 63 63 LYS C C 63 175.810 175.810 176.758 -0.948 17919 76801 1 187 . 1 1 63 63 LYS CA C 63 57.790 57.790 56.890 0.900 17919 76802 1 187 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.313 0.337 17919 76803 1 187 . 1 1 63 63 LYS H H 63 8.490 8.490 8.434 0.056 17919 76804 1 187 . 1 1 64 64 GLU N N 64 113.950 113.950 119.518 -5.568 17919 76805 1 187 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.261 0.204 17919 76806 1 187 . 1 1 64 64 GLU C C 64 175.250 175.250 176.361 -1.111 17919 76807 1 187 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.962 -0.072 17919 76808 1 187 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.415 -2.514 17919 76809 1 187 . 1 1 64 64 GLU H H 64 9.280 9.280 8.889 0.391 17919 76810 1 187 . 1 1 65 65 SER N N 65 114.730 114.730 116.019 -1.289 17919 76811 1 187 . 1 1 65 65 SER HA H 65 4.640 4.640 4.319 0.321 17919 76812 1 187 . 1 1 65 65 SER C C 65 172.160 172.160 173.292 -1.132 17919 76813 1 187 . 1 1 65 65 SER CA C 65 60.890 60.890 59.501 1.389 17919 76814 1 187 . 1 1 65 65 SER CB C 65 64.910 64.910 64.269 0.641 17919 76815 1 187 . 1 1 65 65 SER H H 65 7.670 7.670 7.361 0.309 17919 76816 1 187 . 1 1 66 66 THR N N 66 117.110 117.110 119.306 -2.196 17919 76817 1 187 . 1 1 66 66 THR HA H 66 5.270 5.270 5.295 -0.025 17919 76818 1 187 . 1 1 66 66 THR C C 66 173.950 173.950 174.164 -0.214 17919 76819 1 187 . 1 1 66 66 THR CA C 66 62.340 62.340 61.690 0.650 17919 76820 1 187 . 1 1 66 66 THR CB C 66 70.080 70.080 70.707 -0.627 17919 76821 1 187 . 1 1 66 66 THR H H 66 8.730 8.730 8.426 0.304 17919 76822 1 187 . 1 1 67 67 LEU N N 67 127.110 127.110 126.997 0.113 17919 76823 1 187 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.754 0.306 17919 76824 1 187 . 1 1 67 67 LEU C C 67 175.770 175.770 175.320 0.450 17919 76825 1 187 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.978 -0.078 17919 76826 1 187 . 1 1 67 67 LEU CB C 67 44.260 44.260 45.214 -0.954 17919 76827 1 187 . 1 1 67 67 LEU H H 67 9.410 9.410 9.189 0.221 17919 76828 1 187 . 1 1 68 68 HIS N N 68 118.380 118.380 121.682 -3.302 17919 76829 1 187 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.339 -0.099 17919 76830 1 187 . 1 1 68 68 HIS C C 68 173.150 173.150 173.953 -0.803 17919 76831 1 187 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.381 0.619 17919 76832 1 187 . 1 1 68 68 HIS CB C 68 30.530 30.530 31.898 -1.368 17919 76833 1 187 . 1 1 68 68 HIS H H 68 9.230 9.230 9.307 -0.077 17919 76834 1 187 . 1 1 69 69 LEU N N 69 124.460 124.460 129.501 -5.041 17919 76835 1 187 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.875 0.315 17919 76836 1 187 . 1 1 69 69 LEU C C 69 175.270 175.270 174.079 1.191 17919 76837 1 187 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.610 0.280 17919 76838 1 187 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.033 0.347 17919 76839 1 187 . 1 1 69 69 LEU H H 69 8.340 8.340 8.997 -0.657 17919 76840 1 187 . 1 1 70 70 VAL N N 70 126.940 126.940 126.296 0.644 17919 76841 1 187 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.230 0.120 17919 76842 1 187 . 1 1 70 70 VAL C C 70 174.000 174.000 174.533 -0.533 17919 76843 1 187 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.375 0.425 17919 76844 1 187 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.105 -0.195 17919 76845 1 187 . 1 1 70 70 VAL H H 70 9.200 9.200 8.935 0.265 17919 76846 1 187 . 1 1 71 71 LEU N N 71 123.130 123.130 125.949 -2.819 17919 76847 1 187 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.896 0.164 17919 76848 1 187 . 1 1 71 71 LEU C C 71 177.830 177.830 177.063 0.767 17919 76849 1 187 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.809 0.132 17919 76850 1 187 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.129 0.721 17919 76851 1 187 . 1 1 71 71 LEU H H 71 8.120 8.120 8.392 -0.272 17919 76852 1 187 . 1 1 72 72 ARG N N 72 123.490 123.490 125.520 -2.030 17919 76853 1 187 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.364 -0.063 17919 76854 1 187 . 1 1 72 72 ARG C C 72 175.350 175.350 175.422 -0.072 17919 76855 1 187 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.809 -0.199 17919 76856 1 187 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.596 0.754 17919 76857 1 187 . 1 1 72 72 ARG H H 72 8.580 8.580 8.509 0.071 17919 76858 1 188 . 1 1 2 2 GLN N N 2 123.220 123.220 120.985 2.235 17919 76859 1 188 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.442 -0.193 17919 76860 1 188 . 1 1 2 2 GLN C C 2 175.920 175.920 176.078 -0.158 17919 76861 1 188 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.995 0.085 17919 76862 1 188 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.219 0.541 17919 76863 1 188 . 1 1 2 2 GLN H H 2 8.900 8.900 8.773 0.127 17919 76864 1 188 . 1 1 3 3 ILE N N 3 115.340 115.340 115.896 -0.556 17919 76865 1 188 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.390 -0.177 17919 76866 1 188 . 1 1 3 3 ILE C C 3 172.450 172.450 173.493 -1.043 17919 76867 1 188 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.346 0.224 17919 76868 1 188 . 1 1 3 3 ILE CB C 3 42.210 42.210 42.035 0.175 17919 76869 1 188 . 1 1 3 3 ILE H H 3 8.320 8.320 8.379 -0.059 17919 76870 1 188 . 1 1 4 4 PHE N N 4 118.110 118.110 119.978 -1.868 17919 76871 1 188 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.547 0.083 17919 76872 1 188 . 1 1 4 4 PHE C C 4 175.320 175.320 174.989 0.331 17919 76873 1 188 . 1 1 4 4 PHE CA C 4 55.210 55.210 54.502 0.708 17919 76874 1 188 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.591 -0.111 17919 76875 1 188 . 1 1 4 4 PHE H H 4 8.610 8.610 8.652 -0.042 17919 76876 1 188 . 1 1 5 5 VAL N N 5 121.000 121.000 122.544 -1.544 17919 76877 1 188 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.534 0.191 17919 76878 1 188 . 1 1 5 5 VAL C C 5 174.870 174.870 174.436 0.434 17919 76879 1 188 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.336 -0.716 17919 76880 1 188 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.508 -0.278 17919 76881 1 188 . 1 1 5 5 VAL H H 5 9.300 9.300 9.363 -0.063 17919 76882 1 188 . 1 1 6 6 LYS N N 6 127.520 127.520 128.294 -0.774 17919 76883 1 188 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.181 0.186 17919 76884 1 188 . 1 1 6 6 LYS C C 6 177.140 177.140 175.941 1.199 17919 76885 1 188 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.447 0.073 17919 76886 1 188 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.531 -0.481 17919 76887 1 188 . 1 1 6 6 LYS H H 6 8.820 8.820 9.191 -0.371 17919 76888 1 188 . 1 1 7 7 THR N N 7 115.400 115.400 118.001 -2.601 17919 76889 1 188 . 1 1 7 7 THR HA H 7 4.970 4.970 4.931 0.039 17919 76890 1 188 . 1 1 7 7 THR C C 7 176.910 176.910 176.126 0.784 17919 76891 1 188 . 1 1 7 7 THR CA C 7 60.470 60.470 60.556 -0.085 17919 76892 1 188 . 1 1 7 7 THR CB C 7 70.630 70.630 70.577 0.053 17919 76893 1 188 . 1 1 7 7 THR H H 7 8.730 8.730 8.495 0.235 17919 76894 1 188 . 1 1 8 8 LEU N N 8 121.330 121.330 122.243 -0.913 17919 76895 1 188 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.423 -0.113 17919 76896 1 188 . 1 1 8 8 LEU C C 8 178.800 178.800 177.274 1.526 17919 76897 1 188 . 1 1 8 8 LEU CA C 8 57.580 57.580 56.740 0.840 17919 76898 1 188 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.179 -0.209 17919 76899 1 188 . 1 1 8 8 LEU H H 8 9.100 9.100 8.528 0.572 17919 76900 1 188 . 1 1 9 9 THR N N 9 105.590 105.590 108.380 -2.790 17919 76901 1 188 . 1 1 9 9 THR HA H 9 4.428 4.428 4.371 0.057 17919 76902 1 188 . 1 1 9 9 THR C C 9 175.520 175.520 175.354 0.166 17919 76903 1 188 . 1 1 9 9 THR CA C 9 61.400 61.400 61.577 -0.177 17919 76904 1 188 . 1 1 9 9 THR CB C 9 69.140 69.140 69.321 -0.181 17919 76905 1 188 . 1 1 9 9 THR H H 9 7.630 7.630 7.426 0.204 17919 76906 1 188 . 1 1 10 10 GLY N N 10 108.890 108.890 111.273 -2.383 17919 76907 1 188 . 1 1 10 10 GLY C C 10 174.070 174.070 173.758 0.312 17919 76908 1 188 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.088 0.372 17919 76909 1 188 . 1 1 10 10 GLY H H 10 7.810 7.810 7.908 -0.098 17919 76910 1 188 . 1 1 11 11 LYS N N 11 121.600 121.600 121.789 -0.189 17919 76911 1 188 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.552 -0.191 17919 76912 1 188 . 1 1 11 11 LYS C C 11 175.940 175.940 176.043 -0.103 17919 76913 1 188 . 1 1 11 11 LYS CA C 11 56.280 56.280 54.683 1.597 17919 76914 1 188 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.415 -0.215 17919 76915 1 188 . 1 1 11 11 LYS H H 11 7.280 7.280 8.003 -0.723 17919 76916 1 188 . 1 1 12 12 THR N N 12 120.440 120.440 121.691 -1.251 17919 76917 1 188 . 1 1 12 12 THR HA H 12 5.046 5.046 4.772 0.274 17919 76918 1 188 . 1 1 12 12 THR C C 12 174.320 174.320 174.679 -0.359 17919 76919 1 188 . 1 1 12 12 THR CA C 12 62.390 62.390 63.140 -0.750 17919 76920 1 188 . 1 1 12 12 THR CB C 12 69.910 69.910 69.323 0.587 17919 76921 1 188 . 1 1 12 12 THR H H 12 8.650 8.650 8.495 0.155 17919 76922 1 188 . 1 1 13 13 ILE N N 13 127.110 127.110 123.680 3.430 17919 76923 1 188 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.766 -0.222 17919 76924 1 188 . 1 1 13 13 ILE C C 13 175.220 175.220 174.719 0.501 17919 76925 1 188 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.365 0.615 17919 76926 1 188 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.872 -0.922 17919 76927 1 188 . 1 1 13 13 ILE H H 13 9.450 9.450 9.000 0.450 17919 76928 1 188 . 1 1 14 14 THR N N 14 121.520 121.520 120.387 1.133 17919 76929 1 188 . 1 1 14 14 THR HA H 14 4.964 4.964 5.503 -0.539 17919 76930 1 188 . 1 1 14 14 THR C C 14 173.790 173.790 174.207 -0.417 17919 76931 1 188 . 1 1 14 14 THR CA C 14 61.940 61.940 61.456 0.484 17919 76932 1 188 . 1 1 14 14 THR CB C 14 69.650 69.650 70.329 -0.679 17919 76933 1 188 . 1 1 14 14 THR H H 14 8.710 8.710 8.268 0.442 17919 76934 1 188 . 1 1 15 15 LEU N N 15 124.800 124.800 126.779 -1.979 17919 76935 1 188 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.789 -0.009 17919 76936 1 188 . 1 1 15 15 LEU C C 15 174.670 174.670 175.593 -0.923 17919 76937 1 188 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.542 -0.712 17919 76938 1 188 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.221 1.849 17919 76939 1 188 . 1 1 15 15 LEU H H 15 8.710 8.710 8.762 -0.052 17919 76940 1 188 . 1 1 16 16 GLU N N 16 122.160 122.160 121.634 0.526 17919 76941 1 188 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.254 -0.337 17919 76942 1 188 . 1 1 16 16 GLU C C 16 175.860 175.860 176.231 -0.371 17919 76943 1 188 . 1 1 16 16 GLU CA C 16 54.820 54.820 56.107 -1.287 17919 76944 1 188 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.880 -1.430 17919 76945 1 188 . 1 1 16 16 GLU H H 16 8.140 8.140 8.741 -0.601 17919 76946 1 188 . 1 1 17 17 VAL N N 17 117.210 117.210 118.490 -1.280 17919 76947 1 188 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.936 -0.222 17919 76948 1 188 . 1 1 17 17 VAL C C 17 174.160 174.160 174.797 -0.637 17919 76949 1 188 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.121 -0.691 17919 76950 1 188 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.900 0.500 17919 76951 1 188 . 1 1 17 17 VAL H H 17 8.900 8.900 8.844 0.056 17919 76952 1 188 . 1 1 18 18 GLU N N 18 118.990 118.990 120.647 -1.657 17919 76953 1 188 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.774 0.305 17919 76954 1 188 . 1 1 18 18 GLU C C 18 176.160 176.160 175.619 0.541 17919 76955 1 188 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.728 -0.008 17919 76956 1 188 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.026 0.284 17919 76957 1 188 . 1 1 18 18 GLU H H 18 8.640 8.640 8.882 -0.242 17919 76958 1 188 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.359 -0.218 17919 76959 1 188 . 1 1 19 19 PRO C C 19 175.310 175.310 177.529 -2.219 17919 76960 1 188 . 1 1 19 19 PRO CA C 19 65.470 65.470 64.882 0.588 17919 76961 1 188 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.761 0.189 17919 76962 1 188 . 1 1 20 20 SER N N 20 103.400 103.400 112.714 -9.314 17919 76963 1 188 . 1 1 20 20 SER HA H 20 4.370 4.370 4.292 0.078 17919 76964 1 188 . 1 1 20 20 SER C C 20 174.660 174.660 174.369 0.291 17919 76965 1 188 . 1 1 20 20 SER CA C 20 57.400 57.400 58.681 -1.281 17919 76966 1 188 . 1 1 20 20 SER CB C 20 63.370 63.370 62.402 0.968 17919 76967 1 188 . 1 1 20 20 SER H H 20 7.040 7.040 8.056 -1.016 17919 76968 1 188 . 1 1 21 21 ASP N N 21 123.480 123.480 123.431 0.049 17919 76969 1 188 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.871 -0.176 17919 76970 1 188 . 1 1 21 21 ASP C C 21 176.360 176.360 175.837 0.523 17919 76971 1 188 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.057 1.643 17919 76972 1 188 . 1 1 21 21 ASP CB C 21 40.800 40.800 42.617 -1.817 17919 76973 1 188 . 1 1 21 21 ASP H H 21 8.030 8.030 7.993 0.037 17919 76974 1 188 . 1 1 22 22 THR N N 22 108.800 108.800 112.568 -3.768 17919 76975 1 188 . 1 1 22 22 THR HA H 22 4.920 4.920 5.030 -0.110 17919 76976 1 188 . 1 1 22 22 THR C C 22 176.750 176.750 176.181 0.569 17919 76977 1 188 . 1 1 22 22 THR CA C 22 59.690 59.690 60.649 -0.959 17919 76978 1 188 . 1 1 22 22 THR CB C 22 71.200 71.200 70.953 0.247 17919 76979 1 188 . 1 1 22 22 THR H H 22 7.900 7.900 8.255 -0.355 17919 76980 1 188 . 1 1 23 23 ILE N N 23 121.190 121.190 123.623 -2.433 17919 76981 1 188 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.771 -0.114 17919 76982 1 188 . 1 1 23 23 ILE C C 23 179.040 179.040 177.799 1.241 17919 76983 1 188 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.807 -0.548 17919 76984 1 188 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.296 -1.946 17919 76985 1 188 . 1 1 23 23 ILE H H 23 8.560 8.560 8.943 -0.383 17919 76986 1 188 . 1 1 24 24 GLU N N 24 120.830 120.830 120.887 -0.057 17919 76987 1 188 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.874 0.043 17919 76988 1 188 . 1 1 24 24 GLU C C 24 178.640 178.640 178.545 0.095 17919 76989 1 188 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.254 -0.034 17919 76990 1 188 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.414 -1.134 17919 76991 1 188 . 1 1 24 24 GLU H H 24 9.760 9.760 8.601 1.159 17919 76992 1 188 . 1 1 25 25 ASN N N 25 120.570 120.570 118.224 2.346 17919 76993 1 188 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.449 0.076 17919 76994 1 188 . 1 1 25 25 ASN C C 25 178.380 178.380 177.787 0.593 17919 76995 1 188 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.236 -0.176 17919 76996 1 188 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.663 -0.213 17919 76997 1 188 . 1 1 25 25 ASN H H 25 7.920 7.920 7.857 0.063 17919 76998 1 188 . 1 1 26 26 VAL N N 26 121.710 121.710 120.963 0.747 17919 76999 1 188 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.487 -0.090 17919 77000 1 188 . 1 1 26 26 VAL C C 26 177.950 177.950 177.720 0.230 17919 77001 1 188 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.925 0.735 17919 77002 1 188 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.688 -0.848 17919 77003 1 188 . 1 1 26 26 VAL H H 26 8.070 8.070 8.392 -0.322 17919 77004 1 188 . 1 1 27 27 LYS N N 27 118.860 118.860 119.610 -0.750 17919 77005 1 188 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.063 0.517 17919 77006 1 188 . 1 1 27 27 LYS C C 27 180.550 180.550 179.290 1.260 17919 77007 1 188 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.665 -0.415 17919 77008 1 188 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.150 1.581 17919 77009 1 188 . 1 1 27 27 LYS H H 27 8.560 8.560 8.491 0.069 17919 77010 1 188 . 1 1 28 28 ALA N N 28 123.440 123.440 121.551 1.889 17919 77011 1 188 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.152 0.008 17919 77012 1 188 . 1 1 28 28 ALA C C 28 180.300 180.300 179.425 0.875 17919 77013 1 188 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.833 0.537 17919 77014 1 188 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.552 -0.843 17919 77015 1 188 . 1 1 28 28 ALA H H 28 8.060 8.060 8.538 -0.478 17919 77016 1 188 . 1 1 29 29 LYS N N 29 119.940 119.940 119.469 0.471 17919 77017 1 188 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.060 0.147 17919 77018 1 188 . 1 1 29 29 LYS C C 29 180.320 180.320 179.292 1.028 17919 77019 1 188 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.242 0.409 17919 77020 1 188 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.472 0.818 17919 77021 1 188 . 1 1 29 29 LYS H H 29 7.850 7.850 7.836 0.014 17919 77022 1 188 . 1 1 30 30 ILE N N 30 121.080 121.080 120.602 0.478 17919 77023 1 188 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.632 -0.125 17919 77024 1 188 . 1 1 30 30 ILE C C 30 178.310 178.310 177.301 1.009 17919 77025 1 188 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.184 0.966 17919 77026 1 188 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.797 -0.997 17919 77027 1 188 . 1 1 30 30 ILE H H 30 8.280 8.280 8.525 -0.245 17919 77028 1 188 . 1 1 31 31 GLN N N 31 123.490 123.490 120.530 2.960 17919 77029 1 188 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.113 -0.284 17919 77030 1 188 . 1 1 31 31 GLN C C 31 178.890 178.890 178.407 0.483 17919 77031 1 188 . 1 1 31 31 GLN CA C 31 60.000 60.000 58.882 1.118 17919 77032 1 188 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.574 -0.854 17919 77033 1 188 . 1 1 31 31 GLN H H 31 8.580 8.580 8.127 0.453 17919 77034 1 188 . 1 1 32 32 ASP N N 32 119.360 119.360 119.975 -0.615 17919 77035 1 188 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.416 -0.062 17919 77036 1 188 . 1 1 32 32 ASP C C 32 177.250 177.250 177.576 -0.326 17919 77037 1 188 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.793 0.397 17919 77038 1 188 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.723 -0.143 17919 77039 1 188 . 1 1 32 32 ASP H H 32 8.010 8.010 8.034 -0.024 17919 77040 1 188 . 1 1 33 33 LYS N N 33 115.130 115.130 117.917 -2.787 17919 77041 1 188 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.365 -0.028 17919 77042 1 188 . 1 1 33 33 LYS C C 33 177.870 177.870 178.120 -0.250 17919 77043 1 188 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.629 0.421 17919 77044 1 188 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.494 0.676 17919 77045 1 188 . 1 1 33 33 LYS H H 33 7.430 7.430 7.638 -0.208 17919 77046 1 188 . 1 1 34 34 GLU N N 34 113.870 113.870 114.702 -0.832 17919 77047 1 188 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.504 0.121 17919 77048 1 188 . 1 1 34 34 GLU C C 34 177.840 177.840 177.162 0.678 17919 77049 1 188 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.898 -0.728 17919 77050 1 188 . 1 1 34 34 GLU CB C 34 32.660 32.660 32.192 0.468 17919 77051 1 188 . 1 1 34 34 GLU H H 34 8.740 8.740 8.206 0.534 17919 77052 1 188 . 1 1 35 35 GLY N N 35 108.650 108.650 109.903 -1.253 17919 77053 1 188 . 1 1 35 35 GLY C C 35 173.960 173.960 174.168 -0.208 17919 77054 1 188 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.923 0.157 17919 77055 1 188 . 1 1 35 35 GLY H H 35 8.530 8.530 8.596 -0.066 17919 77056 1 188 . 1 1 36 36 ILE N N 36 119.880 119.880 117.304 2.576 17919 77057 1 188 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.545 -0.100 17919 77058 1 188 . 1 1 36 36 ILE C C 36 173.590 173.590 174.063 -0.473 17919 77059 1 188 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.520 0.230 17919 77060 1 188 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.742 1.838 17919 77061 1 188 . 1 1 36 36 ILE H H 36 6.150 6.150 7.422 -1.272 17919 77062 1 188 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.611 0.023 17919 77063 1 188 . 1 1 37 37 PRO C C 37 176.940 176.940 176.026 0.914 17919 77064 1 188 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.638 0.022 17919 77065 1 188 . 1 1 37 37 PRO CB C 37 31.850 31.850 30.871 0.979 17919 77066 1 188 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.185 -0.068 17919 77067 1 188 . 1 1 38 38 PRO C C 38 178.320 178.320 178.460 -0.140 17919 77068 1 188 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.702 0.558 17919 77069 1 188 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.728 1.162 17919 77070 1 188 . 1 1 39 39 ASP N N 39 113.380 113.380 114.889 -1.509 17919 77071 1 188 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.452 -0.022 17919 77072 1 188 . 1 1 39 39 ASP C C 39 177.090 177.090 177.054 0.036 17919 77073 1 188 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.797 -1.157 17919 77074 1 188 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.049 -0.509 17919 77075 1 188 . 1 1 39 39 ASP H H 39 8.550 8.550 8.724 -0.174 17919 77076 1 188 . 1 1 40 40 GLN N N 40 116.780 116.780 115.789 0.991 17919 77077 1 188 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.404 0.060 17919 77078 1 188 . 1 1 40 40 GLN C C 40 175.380 175.380 175.152 0.228 17919 77079 1 188 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.590 0.050 17919 77080 1 188 . 1 1 40 40 GLN CB C 40 30.140 30.140 30.244 -0.104 17919 77081 1 188 . 1 1 40 40 GLN H H 40 7.820 7.820 7.634 0.186 17919 77082 1 188 . 1 1 41 41 GLN N N 41 117.720 117.720 120.133 -2.413 17919 77083 1 188 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.585 -0.341 17919 77084 1 188 . 1 1 41 41 GLN C C 41 176.300 176.300 175.133 1.167 17919 77085 1 188 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.507 -0.037 17919 77086 1 188 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.978 1.672 17919 77087 1 188 . 1 1 41 41 GLN H H 41 7.480 7.480 7.414 0.066 17919 77088 1 188 . 1 1 42 42 ARG N N 42 122.680 122.680 123.313 -0.633 17919 77089 1 188 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.637 -0.137 17919 77090 1 188 . 1 1 42 42 ARG C C 42 174.050 174.050 173.689 0.361 17919 77091 1 188 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.923 0.127 17919 77092 1 188 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.418 -1.668 17919 77093 1 188 . 1 1 42 42 ARG H H 42 8.530 8.530 8.670 -0.140 17919 77094 1 188 . 1 1 43 43 LEU N N 43 124.040 124.040 126.245 -2.205 17919 77095 1 188 . 1 1 43 43 LEU C C 43 175.290 175.290 176.002 -0.712 17919 77096 1 188 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.324 -1.344 17919 77097 1 188 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.806 1.984 17919 77098 1 188 . 1 1 43 43 LEU H H 43 8.820 8.820 8.747 0.073 17919 77099 1 188 . 1 1 44 44 ILE N N 44 121.920 121.920 120.850 1.070 17919 77100 1 188 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.776 0.216 17919 77101 1 188 . 1 1 44 44 ILE C C 44 176.060 176.060 174.077 1.983 17919 77102 1 188 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.642 -1.662 17919 77103 1 188 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.318 0.102 17919 77104 1 188 . 1 1 44 44 ILE H H 44 9.030 9.030 9.151 -0.121 17919 77105 1 188 . 1 1 45 45 PHE N N 45 125.390 125.390 127.272 -1.882 17919 77106 1 188 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.046 -0.001 17919 77107 1 188 . 1 1 45 45 PHE C C 45 174.470 174.470 174.565 -0.095 17919 77108 1 188 . 1 1 45 45 PHE CA C 45 57.020 57.020 55.846 1.174 17919 77109 1 188 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.418 0.342 17919 77110 1 188 . 1 1 45 45 PHE H H 45 8.830 8.830 8.859 -0.029 17919 77111 1 188 . 1 1 46 46 ALA N N 46 132.200 132.200 128.160 4.040 17919 77112 1 188 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.559 0.131 17919 77113 1 188 . 1 1 46 46 ALA C C 46 177.290 177.290 177.768 -0.478 17919 77114 1 188 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.324 0.216 17919 77115 1 188 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.294 0.275 17919 77116 1 188 . 1 1 46 46 ALA H H 46 8.810 8.810 8.497 0.313 17919 77117 1 188 . 1 1 47 47 GLY N N 47 102.340 102.340 104.423 -2.083 17919 77118 1 188 . 1 1 47 47 GLY C C 47 173.810 173.810 174.240 -0.430 17919 77119 1 188 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.039 0.311 17919 77120 1 188 . 1 1 47 47 GLY H H 47 8.130 8.130 8.384 -0.254 17919 77121 1 188 . 1 1 48 48 LYS N N 48 121.570 121.570 121.298 0.272 17919 77122 1 188 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.624 -0.002 17919 77123 1 188 . 1 1 48 48 LYS C C 48 174.700 174.700 175.187 -0.487 17919 77124 1 188 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.335 0.215 17919 77125 1 188 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.133 0.397 17919 77126 1 188 . 1 1 48 48 LYS H H 48 7.980 7.980 8.038 -0.058 17919 77127 1 188 . 1 1 49 49 GLN N N 49 122.410 122.410 125.348 -2.938 17919 77128 1 188 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.205 0.355 17919 77129 1 188 . 1 1 49 49 GLN C C 49 175.670 175.670 175.237 0.433 17919 77130 1 188 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.540 -0.800 17919 77131 1 188 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.033 -0.033 17919 77132 1 188 . 1 1 49 49 GLN H H 49 8.600 8.600 8.558 0.042 17919 77133 1 188 . 1 1 50 50 LEU N N 50 125.520 125.520 128.475 -2.955 17919 77134 1 188 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.400 -0.310 17919 77135 1 188 . 1 1 50 50 LEU C C 50 176.660 176.660 175.661 0.999 17919 77136 1 188 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.473 0.767 17919 77137 1 188 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.920 -1.350 17919 77138 1 188 . 1 1 50 50 LEU H H 50 8.530 8.530 8.617 -0.087 17919 77139 1 188 . 1 1 51 51 GLU N N 51 122.940 122.940 120.827 2.113 17919 77140 1 188 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.679 -0.191 17919 77141 1 188 . 1 1 51 51 GLU C C 51 175.870 175.870 176.514 -0.644 17919 77142 1 188 . 1 1 51 51 GLU CA C 51 55.960 55.960 54.892 1.067 17919 77143 1 188 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.053 -0.483 17919 77144 1 188 . 1 1 51 51 GLU H H 51 8.400 8.400 8.807 -0.407 17919 77145 1 188 . 1 1 52 52 ASP N N 52 120.030 120.030 125.678 -5.648 17919 77146 1 188 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.394 -0.035 17919 77147 1 188 . 1 1 52 52 ASP C C 52 177.330 177.330 177.582 -0.252 17919 77148 1 188 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.151 -0.191 17919 77149 1 188 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.607 0.243 17919 77150 1 188 . 1 1 52 52 ASP H H 52 8.160 8.160 8.837 -0.677 17919 77151 1 188 . 1 1 53 53 GLY N N 53 106.660 106.660 105.855 0.805 17919 77152 1 188 . 1 1 53 53 GLY C C 53 174.870 174.870 173.994 0.876 17919 77153 1 188 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.946 0.224 17919 77154 1 188 . 1 1 53 53 GLY H H 53 9.390 9.390 8.544 0.846 17919 77155 1 188 . 1 1 54 54 ARG N N 54 119.050 119.050 120.196 -1.146 17919 77156 1 188 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.717 -0.022 17919 77157 1 188 . 1 1 54 54 ARG C C 54 175.350 175.350 175.252 0.098 17919 77158 1 188 . 1 1 54 54 ARG CA C 54 54.390 54.390 53.765 0.625 17919 77159 1 188 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.210 -0.560 17919 77160 1 188 . 1 1 54 54 ARG H H 54 7.460 7.460 7.444 0.016 17919 77161 1 188 . 1 1 55 55 THR N N 55 108.400 108.400 112.625 -4.225 17919 77162 1 188 . 1 1 55 55 THR HA H 55 5.240 5.240 5.115 0.125 17919 77163 1 188 . 1 1 55 55 THR C C 55 176.560 176.560 176.189 0.371 17919 77164 1 188 . 1 1 55 55 THR CA C 55 59.690 59.690 60.046 -0.356 17919 77165 1 188 . 1 1 55 55 THR CB C 55 72.260 72.260 71.133 1.127 17919 77166 1 188 . 1 1 55 55 THR H H 55 8.730 8.730 9.073 -0.343 17919 77167 1 188 . 1 1 56 56 LEU N N 56 117.920 117.920 122.585 -4.665 17919 77168 1 188 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.886 0.174 17919 77169 1 188 . 1 1 56 56 LEU C C 56 180.810 180.810 178.909 1.901 17919 77170 1 188 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.618 0.092 17919 77171 1 188 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.286 -0.916 17919 77172 1 188 . 1 1 56 56 LEU H H 56 8.140 8.140 8.918 -0.778 17919 77173 1 188 . 1 1 57 57 SER N N 57 113.330 113.330 114.257 -0.927 17919 77174 1 188 . 1 1 57 57 SER HA H 57 4.370 4.370 4.174 0.196 17919 77175 1 188 . 1 1 57 57 SER C C 57 178.310 178.310 176.818 1.492 17919 77176 1 188 . 1 1 57 57 SER CA C 57 61.080 61.080 62.127 -1.047 17919 77177 1 188 . 1 1 57 57 SER CB C 57 62.530 62.530 62.646 -0.116 17919 77178 1 188 . 1 1 57 57 SER H H 57 8.470 8.470 8.025 0.445 17919 77179 1 188 . 1 1 58 58 ASP N N 58 124.190 124.190 122.241 1.949 17919 77180 1 188 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.280 0.016 17919 77181 1 188 . 1 1 58 58 ASP C C 58 177.400 177.400 177.460 -0.060 17919 77182 1 188 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.951 0.229 17919 77183 1 188 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.472 -0.372 17919 77184 1 188 . 1 1 58 58 ASP H H 58 7.930 7.930 7.624 0.306 17919 77185 1 188 . 1 1 59 59 TYR N N 59 115.510 115.510 115.994 -0.484 17919 77186 1 188 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.594 0.076 17919 77187 1 188 . 1 1 59 59 TYR C C 59 174.700 174.700 174.634 0.066 17919 77188 1 188 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.223 1.027 17919 77189 1 188 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.002 2.068 17919 77190 1 188 . 1 1 59 59 TYR H H 59 7.250 7.250 7.293 -0.043 17919 77191 1 188 . 1 1 60 60 ASN N N 60 115.900 115.900 114.603 1.297 17919 77192 1 188 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.364 -0.009 17919 77193 1 188 . 1 1 60 60 ASN C C 60 174.340 174.340 174.723 -0.383 17919 77194 1 188 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.157 -0.037 17919 77195 1 188 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.049 0.361 17919 77196 1 188 . 1 1 60 60 ASN H H 60 8.150 8.150 8.083 0.067 17919 77197 1 188 . 1 1 61 61 ILE N N 61 118.600 118.600 118.463 0.137 17919 77198 1 188 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.848 -0.455 17919 77199 1 188 . 1 1 61 61 ILE C C 61 174.610 174.610 176.018 -1.408 17919 77200 1 188 . 1 1 61 61 ILE CA C 61 62.420 62.420 60.732 1.688 17919 77201 1 188 . 1 1 61 61 ILE CB C 61 36.740 36.740 36.816 -0.076 17919 77202 1 188 . 1 1 61 61 ILE H H 61 7.250 7.250 7.669 -0.419 17919 77203 1 188 . 1 1 62 62 GLN N N 62 124.740 124.740 126.731 -1.991 17919 77204 1 188 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.543 -0.037 17919 77205 1 188 . 1 1 62 62 GLN C C 62 175.970 175.970 175.916 0.054 17919 77206 1 188 . 1 1 62 62 GLN CA C 62 53.660 53.660 54.497 -0.837 17919 77207 1 188 . 1 1 62 62 GLN CB C 62 31.650 31.650 30.587 1.063 17919 77208 1 188 . 1 1 62 62 GLN H H 62 7.610 7.610 8.176 -0.566 17919 77209 1 188 . 1 1 63 63 LYS N N 63 120.300 120.300 120.176 0.124 17919 77210 1 188 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.096 -0.095 17919 77211 1 188 . 1 1 63 63 LYS C C 63 175.810 175.810 176.751 -0.941 17919 77212 1 188 . 1 1 63 63 LYS CA C 63 57.790 57.790 56.955 0.835 17919 77213 1 188 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.323 0.327 17919 77214 1 188 . 1 1 63 63 LYS H H 63 8.490 8.490 8.557 -0.067 17919 77215 1 188 . 1 1 64 64 GLU N N 64 113.950 113.950 117.599 -3.649 17919 77216 1 188 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.084 0.381 17919 77217 1 188 . 1 1 64 64 GLU C C 64 175.250 175.250 175.740 -0.490 17919 77218 1 188 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.689 0.201 17919 77219 1 188 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.253 -2.353 17919 77220 1 188 . 1 1 64 64 GLU H H 64 9.280 9.280 8.564 0.716 17919 77221 1 188 . 1 1 65 65 SER N N 65 114.730 114.730 114.995 -0.265 17919 77222 1 188 . 1 1 65 65 SER HA H 65 4.640 4.640 4.441 0.199 17919 77223 1 188 . 1 1 65 65 SER C C 65 172.160 172.160 174.034 -1.874 17919 77224 1 188 . 1 1 65 65 SER CA C 65 60.890 60.890 59.249 1.641 17919 77225 1 188 . 1 1 65 65 SER CB C 65 64.910 64.910 63.862 1.048 17919 77226 1 188 . 1 1 65 65 SER H H 65 7.670 7.670 7.662 0.008 17919 77227 1 188 . 1 1 66 66 THR N N 66 117.110 117.110 118.539 -1.429 17919 77228 1 188 . 1 1 66 66 THR HA H 66 5.270 5.270 5.112 0.158 17919 77229 1 188 . 1 1 66 66 THR C C 66 173.950 173.950 174.248 -0.298 17919 77230 1 188 . 1 1 66 66 THR CA C 66 62.340 62.340 61.925 0.415 17919 77231 1 188 . 1 1 66 66 THR CB C 66 70.080 70.080 69.875 0.205 17919 77232 1 188 . 1 1 66 66 THR H H 66 8.730 8.730 8.370 0.360 17919 77233 1 188 . 1 1 67 67 LEU N N 67 127.110 127.110 126.800 0.310 17919 77234 1 188 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.695 0.365 17919 77235 1 188 . 1 1 67 67 LEU C C 67 175.770 175.770 175.468 0.302 17919 77236 1 188 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.582 0.318 17919 77237 1 188 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.680 0.580 17919 77238 1 188 . 1 1 67 67 LEU H H 67 9.410 9.410 9.083 0.327 17919 77239 1 188 . 1 1 68 68 HIS N N 68 118.380 118.380 120.781 -2.401 17919 77240 1 188 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.590 -0.350 17919 77241 1 188 . 1 1 68 68 HIS C C 68 173.150 173.150 173.432 -0.282 17919 77242 1 188 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.025 0.975 17919 77243 1 188 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.264 -1.734 17919 77244 1 188 . 1 1 68 68 HIS H H 68 9.230 9.230 8.708 0.522 17919 77245 1 188 . 1 1 69 69 LEU N N 69 124.460 124.460 129.319 -4.859 17919 77246 1 188 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.237 -0.047 17919 77247 1 188 . 1 1 69 69 LEU C C 69 175.270 175.270 173.887 1.383 17919 77248 1 188 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.211 0.680 17919 77249 1 188 . 1 1 69 69 LEU CB C 69 44.380 44.380 45.834 -1.454 17919 77250 1 188 . 1 1 69 69 LEU H H 69 8.340 8.340 8.790 -0.450 17919 77251 1 188 . 1 1 70 70 VAL N N 70 126.940 126.940 120.513 6.427 17919 77252 1 188 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.575 -0.225 17919 77253 1 188 . 1 1 70 70 VAL C C 70 174.000 174.000 173.491 0.509 17919 77254 1 188 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.640 1.160 17919 77255 1 188 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.434 -0.524 17919 77256 1 188 . 1 1 70 70 VAL H H 70 9.200 9.200 8.814 0.386 17919 77257 1 188 . 1 1 71 71 LEU N N 71 123.130 123.130 125.339 -2.209 17919 77258 1 188 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.805 0.255 17919 77259 1 188 . 1 1 71 71 LEU C C 71 177.830 177.830 176.776 1.054 17919 77260 1 188 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.686 0.254 17919 77261 1 188 . 1 1 71 71 LEU CB C 71 42.850 42.850 44.246 -1.396 17919 77262 1 188 . 1 1 71 71 LEU H H 71 8.120 8.120 8.481 -0.361 17919 77263 1 188 . 1 1 72 72 ARG N N 72 123.490 123.490 124.061 -0.571 17919 77264 1 188 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.422 -0.121 17919 77265 1 188 . 1 1 72 72 ARG C C 72 175.350 175.350 175.199 0.151 17919 77266 1 188 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.200 0.410 17919 77267 1 188 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.013 1.337 17919 77268 1 188 . 1 1 72 72 ARG H H 72 8.580 8.580 8.398 0.182 17919 77269 1 189 . 1 1 2 2 GLN N N 2 123.220 123.220 121.679 1.541 17919 77270 1 189 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.393 -0.144 17919 77271 1 189 . 1 1 2 2 GLN C C 2 175.920 175.920 175.801 0.119 17919 77272 1 189 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.566 0.514 17919 77273 1 189 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.867 -0.107 17919 77274 1 189 . 1 1 2 2 GLN H H 2 8.900 8.900 8.382 0.518 17919 77275 1 189 . 1 1 3 3 ILE N N 3 115.340 115.340 114.734 0.606 17919 77276 1 189 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.468 -0.255 17919 77277 1 189 . 1 1 3 3 ILE C C 3 172.450 172.450 173.379 -0.929 17919 77278 1 189 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.127 0.443 17919 77279 1 189 . 1 1 3 3 ILE CB C 3 42.210 42.210 42.133 0.077 17919 77280 1 189 . 1 1 3 3 ILE H H 3 8.320 8.320 8.739 -0.419 17919 77281 1 189 . 1 1 4 4 PHE N N 4 118.110 118.110 118.281 -0.171 17919 77282 1 189 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.474 0.156 17919 77283 1 189 . 1 1 4 4 PHE C C 4 175.320 175.320 175.304 0.016 17919 77284 1 189 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.518 -0.308 17919 77285 1 189 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.113 -0.633 17919 77286 1 189 . 1 1 4 4 PHE H H 4 8.610 8.610 8.646 -0.036 17919 77287 1 189 . 1 1 5 5 VAL N N 5 121.000 121.000 121.264 -0.264 17919 77288 1 189 . 1 1 5 5 VAL HA H 5 4.725 4.725 5.021 -0.296 17919 77289 1 189 . 1 1 5 5 VAL C C 5 174.870 174.870 174.589 0.281 17919 77290 1 189 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.166 -0.547 17919 77291 1 189 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.879 -0.649 17919 77292 1 189 . 1 1 5 5 VAL H H 5 9.300 9.300 9.325 -0.025 17919 77293 1 189 . 1 1 6 6 LYS N N 6 127.520 127.520 127.737 -0.217 17919 77294 1 189 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.625 -0.258 17919 77295 1 189 . 1 1 6 6 LYS C C 6 177.140 177.140 176.312 0.828 17919 77296 1 189 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.286 0.234 17919 77297 1 189 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.278 -0.228 17919 77298 1 189 . 1 1 6 6 LYS H H 6 8.820 8.820 9.396 -0.576 17919 77299 1 189 . 1 1 7 7 THR N N 7 115.400 115.400 114.423 0.977 17919 77300 1 189 . 1 1 7 7 THR HA H 7 4.970 4.970 4.826 0.144 17919 77301 1 189 . 1 1 7 7 THR C C 7 176.910 176.910 176.618 0.292 17919 77302 1 189 . 1 1 7 7 THR CA C 7 60.470 60.470 59.678 0.792 17919 77303 1 189 . 1 1 7 7 THR CB C 7 70.630 70.630 71.624 -0.994 17919 77304 1 189 . 1 1 7 7 THR H H 7 8.730 8.730 8.744 -0.014 17919 77305 1 189 . 1 1 8 8 LEU N N 8 121.330 121.330 120.450 0.880 17919 77306 1 189 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.376 -0.066 17919 77307 1 189 . 1 1 8 8 LEU C C 8 178.800 178.800 177.851 0.949 17919 77308 1 189 . 1 1 8 8 LEU CA C 8 57.580 57.580 56.882 0.698 17919 77309 1 189 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.853 0.117 17919 77310 1 189 . 1 1 8 8 LEU H H 8 9.100 9.100 9.085 0.015 17919 77311 1 189 . 1 1 9 9 THR N N 9 105.590 105.590 108.610 -3.020 17919 77312 1 189 . 1 1 9 9 THR HA H 9 4.428 4.428 4.440 -0.012 17919 77313 1 189 . 1 1 9 9 THR C C 9 175.520 175.520 175.360 0.160 17919 77314 1 189 . 1 1 9 9 THR CA C 9 61.400 61.400 61.469 -0.069 17919 77315 1 189 . 1 1 9 9 THR CB C 9 69.140 69.140 69.471 -0.331 17919 77316 1 189 . 1 1 9 9 THR H H 9 7.630 7.630 7.648 -0.018 17919 77317 1 189 . 1 1 10 10 GLY N N 10 108.890 108.890 110.232 -1.342 17919 77318 1 189 . 1 1 10 10 GLY C C 10 174.070 174.070 173.798 0.272 17919 77319 1 189 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.773 0.687 17919 77320 1 189 . 1 1 10 10 GLY H H 10 7.810 7.810 7.643 0.167 17919 77321 1 189 . 1 1 11 11 LYS N N 11 121.600 121.600 121.342 0.258 17919 77322 1 189 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.518 -0.157 17919 77323 1 189 . 1 1 11 11 LYS C C 11 175.940 175.940 175.616 0.324 17919 77324 1 189 . 1 1 11 11 LYS CA C 11 56.280 56.280 55.667 0.613 17919 77325 1 189 . 1 1 11 11 LYS CB C 11 33.200 33.200 34.022 -0.822 17919 77326 1 189 . 1 1 11 11 LYS H H 11 7.280 7.280 8.002 -0.722 17919 77327 1 189 . 1 1 12 12 THR N N 12 120.440 120.440 119.963 0.477 17919 77328 1 189 . 1 1 12 12 THR HA H 12 5.046 5.046 5.168 -0.122 17919 77329 1 189 . 1 1 12 12 THR C C 12 174.320 174.320 174.223 0.097 17919 77330 1 189 . 1 1 12 12 THR CA C 12 62.390 62.390 61.258 1.133 17919 77331 1 189 . 1 1 12 12 THR CB C 12 69.910 69.910 70.270 -0.360 17919 77332 1 189 . 1 1 12 12 THR H H 12 8.650 8.650 8.414 0.236 17919 77333 1 189 . 1 1 13 13 ILE N N 13 127.110 127.110 122.808 4.302 17919 77334 1 189 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.662 -0.118 17919 77335 1 189 . 1 1 13 13 ILE C C 13 175.220 175.220 174.745 0.475 17919 77336 1 189 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.305 0.675 17919 77337 1 189 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.604 0.346 17919 77338 1 189 . 1 1 13 13 ILE H H 13 9.450 9.450 9.289 0.161 17919 77339 1 189 . 1 1 14 14 THR N N 14 121.520 121.520 120.416 1.104 17919 77340 1 189 . 1 1 14 14 THR HA H 14 4.964 4.964 5.126 -0.162 17919 77341 1 189 . 1 1 14 14 THR C C 14 173.790 173.790 173.629 0.161 17919 77342 1 189 . 1 1 14 14 THR CA C 14 61.940 61.940 62.336 -0.396 17919 77343 1 189 . 1 1 14 14 THR CB C 14 69.650 69.650 69.757 -0.107 17919 77344 1 189 . 1 1 14 14 THR H H 14 8.710 8.710 8.647 0.063 17919 77345 1 189 . 1 1 15 15 LEU N N 15 124.800 124.800 126.619 -1.819 17919 77346 1 189 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.737 0.043 17919 77347 1 189 . 1 1 15 15 LEU C C 15 174.670 174.670 174.722 -0.052 17919 77348 1 189 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.620 -0.789 17919 77349 1 189 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.322 1.748 17919 77350 1 189 . 1 1 15 15 LEU H H 15 8.710 8.710 8.895 -0.185 17919 77351 1 189 . 1 1 16 16 GLU N N 16 122.160 122.160 124.183 -2.023 17919 77352 1 189 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.133 -0.216 17919 77353 1 189 . 1 1 16 16 GLU C C 16 175.860 175.860 175.878 -0.018 17919 77354 1 189 . 1 1 16 16 GLU CA C 16 54.820 54.820 54.117 0.703 17919 77355 1 189 . 1 1 16 16 GLU CB C 16 29.450 29.450 29.233 0.218 17919 77356 1 189 . 1 1 16 16 GLU H H 16 8.140 8.140 8.577 -0.437 17919 77357 1 189 . 1 1 17 17 VAL N N 17 117.210 117.210 118.544 -1.334 17919 77358 1 189 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.899 -0.184 17919 77359 1 189 . 1 1 17 17 VAL C C 17 174.160 174.160 174.917 -0.757 17919 77360 1 189 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.954 -0.524 17919 77361 1 189 . 1 1 17 17 VAL CB C 17 36.400 36.400 34.941 1.459 17919 77362 1 189 . 1 1 17 17 VAL H H 17 8.900 8.900 8.835 0.065 17919 77363 1 189 . 1 1 18 18 GLU N N 18 118.990 118.990 124.497 -5.507 17919 77364 1 189 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.750 0.329 17919 77365 1 189 . 1 1 18 18 GLU C C 18 176.160 176.160 175.577 0.583 17919 77366 1 189 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.566 0.154 17919 77367 1 189 . 1 1 18 18 GLU CB C 18 30.310 30.310 31.426 -1.116 17919 77368 1 189 . 1 1 18 18 GLU H H 18 8.640 8.640 9.285 -0.645 17919 77369 1 189 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.395 -0.254 17919 77370 1 189 . 1 1 19 19 PRO C C 19 175.310 175.310 177.502 -2.192 17919 77371 1 189 . 1 1 19 19 PRO CA C 19 65.470 65.470 64.709 0.761 17919 77372 1 189 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.750 0.200 17919 77373 1 189 . 1 1 20 20 SER N N 20 103.400 103.400 112.370 -8.970 17919 77374 1 189 . 1 1 20 20 SER HA H 20 4.370 4.370 4.254 0.116 17919 77375 1 189 . 1 1 20 20 SER C C 20 174.660 174.660 174.689 -0.029 17919 77376 1 189 . 1 1 20 20 SER CA C 20 57.400 57.400 59.486 -2.086 17919 77377 1 189 . 1 1 20 20 SER CB C 20 63.370 63.370 62.771 0.599 17919 77378 1 189 . 1 1 20 20 SER H H 20 7.040 7.040 8.231 -1.191 17919 77379 1 189 . 1 1 21 21 ASP N N 21 123.480 123.480 122.475 1.005 17919 77380 1 189 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.786 -0.091 17919 77381 1 189 . 1 1 21 21 ASP C C 21 176.360 176.360 176.137 0.223 17919 77382 1 189 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.233 1.467 17919 77383 1 189 . 1 1 21 21 ASP CB C 21 40.800 40.800 42.199 -1.399 17919 77384 1 189 . 1 1 21 21 ASP H H 21 8.030 8.030 7.542 0.488 17919 77385 1 189 . 1 1 22 22 THR N N 22 108.800 108.800 112.816 -4.016 17919 77386 1 189 . 1 1 22 22 THR HA H 22 4.920 4.920 4.561 0.359 17919 77387 1 189 . 1 1 22 22 THR C C 22 176.750 176.750 176.286 0.464 17919 77388 1 189 . 1 1 22 22 THR CA C 22 59.690 59.690 62.295 -2.605 17919 77389 1 189 . 1 1 22 22 THR CB C 22 71.200 71.200 70.980 0.220 17919 77390 1 189 . 1 1 22 22 THR H H 22 7.900 7.900 8.248 -0.348 17919 77391 1 189 . 1 1 23 23 ILE N N 23 121.190 121.190 123.349 -2.159 17919 77392 1 189 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.790 -0.133 17919 77393 1 189 . 1 1 23 23 ILE C C 23 179.040 179.040 177.773 1.267 17919 77394 1 189 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.178 -0.918 17919 77395 1 189 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.653 -2.303 17919 77396 1 189 . 1 1 23 23 ILE H H 23 8.560 8.560 8.721 -0.161 17919 77397 1 189 . 1 1 24 24 GLU N N 24 120.830 120.830 120.418 0.412 17919 77398 1 189 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.864 0.053 17919 77399 1 189 . 1 1 24 24 GLU C C 24 178.640 178.640 178.508 0.132 17919 77400 1 189 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.061 0.159 17919 77401 1 189 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.462 -1.182 17919 77402 1 189 . 1 1 24 24 GLU H H 24 9.760 9.760 8.509 1.251 17919 77403 1 189 . 1 1 25 25 ASN N N 25 120.570 120.570 117.795 2.775 17919 77404 1 189 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.535 -0.010 17919 77405 1 189 . 1 1 25 25 ASN C C 25 178.380 178.380 177.701 0.679 17919 77406 1 189 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.125 -0.065 17919 77407 1 189 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.773 -0.323 17919 77408 1 189 . 1 1 25 25 ASN H H 25 7.920 7.920 7.644 0.276 17919 77409 1 189 . 1 1 26 26 VAL N N 26 121.710 121.710 119.207 2.503 17919 77410 1 189 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.800 -0.403 17919 77411 1 189 . 1 1 26 26 VAL C C 26 177.950 177.950 177.847 0.103 17919 77412 1 189 . 1 1 26 26 VAL CA C 26 67.660 67.660 65.082 2.578 17919 77413 1 189 . 1 1 26 26 VAL CB C 26 30.840 30.840 30.651 0.189 17919 77414 1 189 . 1 1 26 26 VAL H H 26 8.070 8.070 8.048 0.022 17919 77415 1 189 . 1 1 27 27 LYS N N 27 118.860 118.860 121.087 -2.227 17919 77416 1 189 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.262 0.318 17919 77417 1 189 . 1 1 27 27 LYS C C 27 180.550 180.550 179.026 1.524 17919 77418 1 189 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.648 -0.398 17919 77419 1 189 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.125 1.605 17919 77420 1 189 . 1 1 27 27 LYS H H 27 8.560 8.560 7.993 0.567 17919 77421 1 189 . 1 1 28 28 ALA N N 28 123.440 123.440 122.271 1.169 17919 77422 1 189 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.067 0.093 17919 77423 1 189 . 1 1 28 28 ALA C C 28 180.300 180.300 179.387 0.913 17919 77424 1 189 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.038 0.332 17919 77425 1 189 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.176 -0.466 17919 77426 1 189 . 1 1 28 28 ALA H H 28 8.060 8.060 7.593 0.467 17919 77427 1 189 . 1 1 29 29 LYS N N 29 119.940 119.940 118.653 1.287 17919 77428 1 189 . 1 1 29 29 LYS HA H 29 4.207 4.207 3.992 0.215 17919 77429 1 189 . 1 1 29 29 LYS C C 29 180.320 180.320 179.158 1.162 17919 77430 1 189 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.377 0.273 17919 77431 1 189 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.287 1.003 17919 77432 1 189 . 1 1 29 29 LYS H H 29 7.850 7.850 7.866 -0.016 17919 77433 1 189 . 1 1 30 30 ILE N N 30 121.080 121.080 120.349 0.731 17919 77434 1 189 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.640 -0.133 17919 77435 1 189 . 1 1 30 30 ILE C C 30 178.310 178.310 177.402 0.908 17919 77436 1 189 . 1 1 30 30 ILE CA C 30 66.150 66.150 64.969 1.181 17919 77437 1 189 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.694 -0.894 17919 77438 1 189 . 1 1 30 30 ILE H H 30 8.280 8.280 7.621 0.659 17919 77439 1 189 . 1 1 31 31 GLN N N 31 123.490 123.490 121.309 2.181 17919 77440 1 189 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.032 -0.203 17919 77441 1 189 . 1 1 31 31 GLN C C 31 178.890 178.890 178.296 0.594 17919 77442 1 189 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.433 0.567 17919 77443 1 189 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.475 -0.755 17919 77444 1 189 . 1 1 31 31 GLN H H 31 8.580 8.580 8.216 0.364 17919 77445 1 189 . 1 1 32 32 ASP N N 32 119.360 119.360 118.669 0.691 17919 77446 1 189 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.450 -0.096 17919 77447 1 189 . 1 1 32 32 ASP C C 32 177.250 177.250 178.106 -0.856 17919 77448 1 189 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.631 0.559 17919 77449 1 189 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.769 -0.189 17919 77450 1 189 . 1 1 32 32 ASP H H 32 8.010 8.010 8.007 0.003 17919 77451 1 189 . 1 1 33 33 LYS N N 33 115.130 115.130 117.659 -2.529 17919 77452 1 189 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.252 0.085 17919 77453 1 189 . 1 1 33 33 LYS C C 33 177.870 177.870 177.892 -0.022 17919 77454 1 189 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.486 -0.436 17919 77455 1 189 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.330 0.840 17919 77456 1 189 . 1 1 33 33 LYS H H 33 7.430 7.430 7.425 0.005 17919 77457 1 189 . 1 1 34 34 GLU N N 34 113.870 113.870 114.344 -0.474 17919 77458 1 189 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.472 0.153 17919 77459 1 189 . 1 1 34 34 GLU C C 34 177.840 177.840 177.225 0.615 17919 77460 1 189 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.059 -0.889 17919 77461 1 189 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.806 0.854 17919 77462 1 189 . 1 1 34 34 GLU H H 34 8.740 8.740 8.155 0.584 17919 77463 1 189 . 1 1 35 35 GLY N N 35 108.650 108.650 109.712 -1.062 17919 77464 1 189 . 1 1 35 35 GLY C C 35 173.960 173.960 174.116 -0.156 17919 77465 1 189 . 1 1 35 35 GLY CA C 35 46.080 46.080 46.062 0.018 17919 77466 1 189 . 1 1 35 35 GLY H H 35 8.530 8.530 8.520 0.010 17919 77467 1 189 . 1 1 36 36 ILE N N 36 119.880 119.880 122.074 -2.194 17919 77468 1 189 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.391 0.054 17919 77469 1 189 . 1 1 36 36 ILE C C 36 173.590 173.590 174.459 -0.869 17919 77470 1 189 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.488 0.262 17919 77471 1 189 . 1 1 36 36 ILE CB C 36 40.580 40.580 39.332 1.248 17919 77472 1 189 . 1 1 36 36 ILE H H 36 6.150 6.150 7.582 -1.432 17919 77473 1 189 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.634 -0.000 17919 77474 1 189 . 1 1 37 37 PRO C C 37 176.940 176.940 176.097 0.843 17919 77475 1 189 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.545 0.115 17919 77476 1 189 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.080 0.770 17919 77477 1 189 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.165 -0.048 17919 77478 1 189 . 1 1 38 38 PRO C C 38 178.320 178.320 178.408 -0.088 17919 77479 1 189 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.661 0.599 17919 77480 1 189 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.786 1.104 17919 77481 1 189 . 1 1 39 39 ASP N N 39 113.380 113.380 116.070 -2.690 17919 77482 1 189 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.488 -0.058 17919 77483 1 189 . 1 1 39 39 ASP C C 39 177.090 177.090 177.884 -0.794 17919 77484 1 189 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.487 -0.847 17919 77485 1 189 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.345 -0.805 17919 77486 1 189 . 1 1 39 39 ASP H H 39 8.550 8.550 8.566 -0.016 17919 77487 1 189 . 1 1 40 40 GLN N N 40 116.780 116.780 117.695 -0.915 17919 77488 1 189 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.412 0.052 17919 77489 1 189 . 1 1 40 40 GLN C C 40 175.380 175.380 175.245 0.135 17919 77490 1 189 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.027 0.613 17919 77491 1 189 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.327 0.813 17919 77492 1 189 . 1 1 40 40 GLN H H 40 7.820 7.820 7.818 0.002 17919 77493 1 189 . 1 1 41 41 GLN N N 41 117.720 117.720 119.399 -1.679 17919 77494 1 189 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.560 -0.316 17919 77495 1 189 . 1 1 41 41 GLN C C 41 176.300 176.300 175.320 0.980 17919 77496 1 189 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.574 0.896 17919 77497 1 189 . 1 1 41 41 GLN CB C 41 31.650 31.650 30.599 1.051 17919 77498 1 189 . 1 1 41 41 GLN H H 41 7.480 7.480 7.399 0.081 17919 77499 1 189 . 1 1 42 42 ARG N N 42 122.680 122.680 121.603 1.077 17919 77500 1 189 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.720 -0.220 17919 77501 1 189 . 1 1 42 42 ARG C C 42 174.050 174.050 174.822 -0.772 17919 77502 1 189 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.709 0.341 17919 77503 1 189 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.840 -2.090 17919 77504 1 189 . 1 1 42 42 ARG H H 42 8.530 8.530 8.655 -0.125 17919 77505 1 189 . 1 1 43 43 LEU N N 43 124.040 124.040 122.626 1.414 17919 77506 1 189 . 1 1 43 43 LEU C C 43 175.290 175.290 175.622 -0.332 17919 77507 1 189 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.680 -0.700 17919 77508 1 189 . 1 1 43 43 LEU CB C 43 45.790 45.790 45.455 0.335 17919 77509 1 189 . 1 1 43 43 LEU H H 43 8.820 8.820 8.752 0.068 17919 77510 1 189 . 1 1 44 44 ILE N N 44 121.920 121.920 121.670 0.250 17919 77511 1 189 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.036 -0.044 17919 77512 1 189 . 1 1 44 44 ILE C C 44 176.060 176.060 174.407 1.653 17919 77513 1 189 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.428 -1.448 17919 77514 1 189 . 1 1 44 44 ILE CB C 44 41.420 41.420 40.966 0.454 17919 77515 1 189 . 1 1 44 44 ILE H H 44 9.030 9.030 9.109 -0.079 17919 77516 1 189 . 1 1 45 45 PHE N N 45 125.390 125.390 128.097 -2.707 17919 77517 1 189 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.029 0.016 17919 77518 1 189 . 1 1 45 45 PHE C C 45 174.470 174.470 174.504 -0.034 17919 77519 1 189 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.191 0.829 17919 77520 1 189 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.358 0.402 17919 77521 1 189 . 1 1 45 45 PHE H H 45 8.830 8.830 8.475 0.355 17919 77522 1 189 . 1 1 46 46 ALA N N 46 132.200 132.200 130.726 1.474 17919 77523 1 189 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.725 -0.035 17919 77524 1 189 . 1 1 46 46 ALA C C 46 177.290 177.290 177.755 -0.465 17919 77525 1 189 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.681 -0.141 17919 77526 1 189 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.564 0.006 17919 77527 1 189 . 1 1 46 46 ALA H H 46 8.810 8.810 8.664 0.146 17919 77528 1 189 . 1 1 47 47 GLY N N 47 102.340 102.340 105.566 -3.226 17919 77529 1 189 . 1 1 47 47 GLY C C 47 173.810 173.810 174.730 -0.920 17919 77530 1 189 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.422 -0.072 17919 77531 1 189 . 1 1 47 47 GLY H H 47 8.130 8.130 8.508 -0.378 17919 77532 1 189 . 1 1 48 48 LYS N N 48 121.570 121.570 121.806 -0.236 17919 77533 1 189 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.492 0.131 17919 77534 1 189 . 1 1 48 48 LYS C C 48 174.700 174.700 175.358 -0.658 17919 77535 1 189 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.368 -0.818 17919 77536 1 189 . 1 1 48 48 LYS CB C 48 34.530 34.530 33.857 0.673 17919 77537 1 189 . 1 1 48 48 LYS H H 48 7.980 7.980 7.799 0.181 17919 77538 1 189 . 1 1 49 49 GLN N N 49 122.410 122.410 123.253 -0.843 17919 77539 1 189 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.485 0.075 17919 77540 1 189 . 1 1 49 49 GLN C C 49 175.670 175.670 175.893 -0.223 17919 77541 1 189 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.872 -0.132 17919 77542 1 189 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.255 -0.255 17919 77543 1 189 . 1 1 49 49 GLN H H 49 8.600 8.600 8.501 0.099 17919 77544 1 189 . 1 1 50 50 LEU N N 50 125.520 125.520 127.463 -1.943 17919 77545 1 189 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.359 -0.269 17919 77546 1 189 . 1 1 50 50 LEU C C 50 176.660 176.660 176.415 0.245 17919 77547 1 189 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.309 -0.068 17919 77548 1 189 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.343 -0.773 17919 77549 1 189 . 1 1 50 50 LEU H H 50 8.530 8.530 8.662 -0.132 17919 77550 1 189 . 1 1 51 51 GLU N N 51 122.940 122.940 121.770 1.170 17919 77551 1 189 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.528 -0.040 17919 77552 1 189 . 1 1 51 51 GLU C C 51 175.870 175.870 176.654 -0.784 17919 77553 1 189 . 1 1 51 51 GLU CA C 51 55.960 55.960 54.854 1.106 17919 77554 1 189 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.161 -0.591 17919 77555 1 189 . 1 1 51 51 GLU H H 51 8.400 8.400 8.692 -0.292 17919 77556 1 189 . 1 1 52 52 ASP N N 52 120.030 120.030 126.808 -6.778 17919 77557 1 189 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.570 -0.211 17919 77558 1 189 . 1 1 52 52 ASP C C 52 177.330 177.330 177.412 -0.082 17919 77559 1 189 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.174 -0.214 17919 77560 1 189 . 1 1 52 52 ASP CB C 52 40.850 40.850 41.217 -0.367 17919 77561 1 189 . 1 1 52 52 ASP H H 52 8.160 8.160 8.867 -0.707 17919 77562 1 189 . 1 1 53 53 GLY N N 53 106.660 106.660 106.332 0.328 17919 77563 1 189 . 1 1 53 53 GLY C C 53 174.870 174.870 174.733 0.137 17919 77564 1 189 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.930 0.240 17919 77565 1 189 . 1 1 53 53 GLY H H 53 9.390 9.390 8.526 0.864 17919 77566 1 189 . 1 1 54 54 ARG N N 54 119.050 119.050 121.813 -2.763 17919 77567 1 189 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.264 0.431 17919 77568 1 189 . 1 1 54 54 ARG C C 54 175.350 175.350 176.390 -1.040 17919 77569 1 189 . 1 1 54 54 ARG CA C 54 54.390 54.390 56.838 -2.448 17919 77570 1 189 . 1 1 54 54 ARG CB C 54 32.650 32.650 30.618 2.032 17919 77571 1 189 . 1 1 54 54 ARG H H 54 7.460 7.460 7.964 -0.504 17919 77572 1 189 . 1 1 55 55 THR N N 55 108.400 108.400 112.590 -4.190 17919 77573 1 189 . 1 1 55 55 THR HA H 55 5.240 5.240 4.986 0.254 17919 77574 1 189 . 1 1 55 55 THR C C 55 176.560 176.560 176.269 0.291 17919 77575 1 189 . 1 1 55 55 THR CA C 55 59.690 59.690 60.404 -0.715 17919 77576 1 189 . 1 1 55 55 THR CB C 55 72.260 72.260 70.259 2.001 17919 77577 1 189 . 1 1 55 55 THR H H 55 8.730 8.730 9.057 -0.327 17919 77578 1 189 . 1 1 56 56 LEU N N 56 117.920 117.920 121.069 -3.149 17919 77579 1 189 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.962 0.098 17919 77580 1 189 . 1 1 56 56 LEU C C 56 180.810 180.810 178.990 1.820 17919 77581 1 189 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.787 -0.077 17919 77582 1 189 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.295 -0.925 17919 77583 1 189 . 1 1 56 56 LEU H H 56 8.140 8.140 8.710 -0.570 17919 77584 1 189 . 1 1 57 57 SER N N 57 113.330 113.330 115.142 -1.812 17919 77585 1 189 . 1 1 57 57 SER HA H 57 4.370 4.370 4.178 0.192 17919 77586 1 189 . 1 1 57 57 SER C C 57 178.310 178.310 176.926 1.384 17919 77587 1 189 . 1 1 57 57 SER CA C 57 61.080 61.080 62.226 -1.146 17919 77588 1 189 . 1 1 57 57 SER CB C 57 62.530 62.530 62.821 -0.291 17919 77589 1 189 . 1 1 57 57 SER H H 57 8.470 8.470 8.106 0.364 17919 77590 1 189 . 1 1 58 58 ASP N N 58 124.190 124.190 121.320 2.870 17919 77591 1 189 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.367 -0.071 17919 77592 1 189 . 1 1 58 58 ASP C C 58 177.400 177.400 177.067 0.333 17919 77593 1 189 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.429 0.751 17919 77594 1 189 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.320 -0.220 17919 77595 1 189 . 1 1 58 58 ASP H H 58 7.930 7.930 8.103 -0.173 17919 77596 1 189 . 1 1 59 59 TYR N N 59 115.510 115.510 116.305 -0.795 17919 77597 1 189 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.573 0.097 17919 77598 1 189 . 1 1 59 59 TYR C C 59 174.700 174.700 175.247 -0.547 17919 77599 1 189 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.535 0.716 17919 77600 1 189 . 1 1 59 59 TYR CB C 59 40.070 40.070 39.179 0.891 17919 77601 1 189 . 1 1 59 59 TYR H H 59 7.250 7.250 7.349 -0.099 17919 77602 1 189 . 1 1 60 60 ASN N N 60 115.900 115.900 118.220 -2.320 17919 77603 1 189 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.451 -0.096 17919 77604 1 189 . 1 1 60 60 ASN C C 60 174.340 174.340 174.803 -0.463 17919 77605 1 189 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.321 -0.201 17919 77606 1 189 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.298 0.112 17919 77607 1 189 . 1 1 60 60 ASN H H 60 8.150 8.150 7.834 0.316 17919 77608 1 189 . 1 1 61 61 ILE N N 61 118.600 118.600 119.737 -1.137 17919 77609 1 189 . 1 1 61 61 ILE HA H 61 3.393 3.393 4.137 -0.744 17919 77610 1 189 . 1 1 61 61 ILE C C 61 174.610 174.610 175.378 -0.768 17919 77611 1 189 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.427 0.993 17919 77612 1 189 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.995 -1.256 17919 77613 1 189 . 1 1 61 61 ILE H H 61 7.250 7.250 7.783 -0.533 17919 77614 1 189 . 1 1 62 62 GLN N N 62 124.740 124.740 127.036 -2.296 17919 77615 1 189 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.556 -0.050 17919 77616 1 189 . 1 1 62 62 GLN C C 62 175.970 175.970 175.083 0.887 17919 77617 1 189 . 1 1 62 62 GLN CA C 62 53.660 53.660 54.321 -0.661 17919 77618 1 189 . 1 1 62 62 GLN CB C 62 31.650 31.650 30.938 0.712 17919 77619 1 189 . 1 1 62 62 GLN H H 62 7.610 7.610 8.179 -0.569 17919 77620 1 189 . 1 1 63 63 LYS N N 63 120.300 120.300 118.733 1.567 17919 77621 1 189 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.361 -0.360 17919 77622 1 189 . 1 1 63 63 LYS C C 63 175.810 175.810 177.155 -1.345 17919 77623 1 189 . 1 1 63 63 LYS CA C 63 57.790 57.790 56.234 1.556 17919 77624 1 189 . 1 1 63 63 LYS CB C 63 32.650 32.650 33.128 -0.478 17919 77625 1 189 . 1 1 63 63 LYS H H 63 8.490 8.490 8.225 0.265 17919 77626 1 189 . 1 1 64 64 GLU N N 64 113.950 113.950 118.606 -4.656 17919 77627 1 189 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.537 -0.072 17919 77628 1 189 . 1 1 64 64 GLU C C 64 175.250 175.250 176.339 -1.089 17919 77629 1 189 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.724 0.166 17919 77630 1 189 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.873 -2.973 17919 77631 1 189 . 1 1 64 64 GLU H H 64 9.280 9.280 8.705 0.575 17919 77632 1 189 . 1 1 65 65 SER N N 65 114.730 114.730 116.208 -1.478 17919 77633 1 189 . 1 1 65 65 SER HA H 65 4.640 4.640 4.484 0.157 17919 77634 1 189 . 1 1 65 65 SER C C 65 172.160 172.160 173.779 -1.619 17919 77635 1 189 . 1 1 65 65 SER CA C 65 60.890 60.890 60.582 0.308 17919 77636 1 189 . 1 1 65 65 SER CB C 65 64.910 64.910 63.694 1.216 17919 77637 1 189 . 1 1 65 65 SER H H 65 7.670 7.670 7.547 0.123 17919 77638 1 189 . 1 1 66 66 THR N N 66 117.110 117.110 119.945 -2.835 17919 77639 1 189 . 1 1 66 66 THR HA H 66 5.270 5.270 5.139 0.131 17919 77640 1 189 . 1 1 66 66 THR C C 66 173.950 173.950 174.297 -0.347 17919 77641 1 189 . 1 1 66 66 THR CA C 66 62.340 62.340 62.158 0.182 17919 77642 1 189 . 1 1 66 66 THR CB C 66 70.080 70.080 70.040 0.040 17919 77643 1 189 . 1 1 66 66 THR H H 66 8.730 8.730 8.396 0.334 17919 77644 1 189 . 1 1 67 67 LEU N N 67 127.110 127.110 127.704 -0.594 17919 77645 1 189 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.717 0.343 17919 77646 1 189 . 1 1 67 67 LEU C C 67 175.770 175.770 175.221 0.549 17919 77647 1 189 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.964 -0.063 17919 77648 1 189 . 1 1 67 67 LEU CB C 67 44.260 44.260 45.293 -1.033 17919 77649 1 189 . 1 1 67 67 LEU H H 67 9.410 9.410 9.153 0.257 17919 77650 1 189 . 1 1 68 68 HIS N N 68 118.380 118.380 121.874 -3.494 17919 77651 1 189 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.328 -0.088 17919 77652 1 189 . 1 1 68 68 HIS C C 68 173.150 173.150 173.776 -0.626 17919 77653 1 189 . 1 1 68 68 HIS CA C 68 55.000 55.000 53.977 1.023 17919 77654 1 189 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.326 -1.796 17919 77655 1 189 . 1 1 68 68 HIS H H 68 9.230 9.230 9.153 0.077 17919 77656 1 189 . 1 1 69 69 LEU N N 69 124.460 124.460 129.876 -5.416 17919 77657 1 189 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.831 0.359 17919 77658 1 189 . 1 1 69 69 LEU C C 69 175.270 175.270 174.656 0.614 17919 77659 1 189 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.835 0.055 17919 77660 1 189 . 1 1 69 69 LEU CB C 69 44.380 44.380 43.582 0.798 17919 77661 1 189 . 1 1 69 69 LEU H H 69 8.340 8.340 8.032 0.308 17919 77662 1 189 . 1 1 70 70 VAL N N 70 126.940 126.940 122.361 4.579 17919 77663 1 189 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.526 -0.176 17919 77664 1 189 . 1 1 70 70 VAL C C 70 174.000 174.000 173.833 0.167 17919 77665 1 189 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.712 1.088 17919 77666 1 189 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.793 -0.883 17919 77667 1 189 . 1 1 70 70 VAL H H 70 9.200 9.200 8.659 0.540 17919 77668 1 189 . 1 1 71 71 LEU N N 71 123.130 123.130 121.132 1.998 17919 77669 1 189 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.137 -0.077 17919 77670 1 189 . 1 1 71 71 LEU C C 71 177.830 177.830 177.520 0.310 17919 77671 1 189 . 1 1 71 71 LEU CA C 71 53.940 53.940 52.440 1.500 17919 77672 1 189 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.294 -0.444 17919 77673 1 189 . 1 1 71 71 LEU H H 71 8.120 8.120 8.291 -0.171 17919 77674 1 189 . 1 1 72 72 ARG N N 72 123.490 123.490 124.190 -0.700 17919 77675 1 189 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.217 0.084 17919 77676 1 189 . 1 1 72 72 ARG C C 72 175.350 175.350 175.191 0.159 17919 77677 1 189 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.949 -1.339 17919 77678 1 189 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.985 0.365 17919 77679 1 189 . 1 1 72 72 ARG H H 72 8.580 8.580 8.242 0.338 17919 77680 1 190 . 1 1 2 2 GLN N N 2 123.220 123.220 120.214 3.006 17919 77681 1 190 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.320 -0.071 17919 77682 1 190 . 1 1 2 2 GLN C C 2 175.920 175.920 175.104 0.816 17919 77683 1 190 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.201 0.879 17919 77684 1 190 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.311 0.449 17919 77685 1 190 . 1 1 2 2 GLN H H 2 8.900 8.900 8.275 0.625 17919 77686 1 190 . 1 1 3 3 ILE N N 3 115.340 115.340 115.533 -0.193 17919 77687 1 190 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.373 -0.160 17919 77688 1 190 . 1 1 3 3 ILE C C 3 172.450 172.450 173.545 -1.095 17919 77689 1 190 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.210 0.360 17919 77690 1 190 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.782 0.428 17919 77691 1 190 . 1 1 3 3 ILE H H 3 8.320 8.320 8.670 -0.350 17919 77692 1 190 . 1 1 4 4 PHE N N 4 118.110 118.110 121.304 -3.194 17919 77693 1 190 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.619 0.011 17919 77694 1 190 . 1 1 4 4 PHE C C 4 175.320 175.320 175.455 -0.135 17919 77695 1 190 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.061 0.149 17919 77696 1 190 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.211 0.269 17919 77697 1 190 . 1 1 4 4 PHE H H 4 8.610 8.610 8.570 0.040 17919 77698 1 190 . 1 1 5 5 VAL N N 5 121.000 121.000 122.726 -1.726 17919 77699 1 190 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.847 -0.122 17919 77700 1 190 . 1 1 5 5 VAL C C 5 174.870 174.870 174.674 0.196 17919 77701 1 190 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.496 -0.876 17919 77702 1 190 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.006 0.224 17919 77703 1 190 . 1 1 5 5 VAL H H 5 9.300 9.300 9.242 0.058 17919 77704 1 190 . 1 1 6 6 LYS N N 6 127.520 127.520 127.857 -0.337 17919 77705 1 190 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.608 -0.241 17919 77706 1 190 . 1 1 6 6 LYS C C 6 177.140 177.140 175.894 1.246 17919 77707 1 190 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.282 0.238 17919 77708 1 190 . 1 1 6 6 LYS CB C 6 35.050 35.050 36.523 -1.473 17919 77709 1 190 . 1 1 6 6 LYS H H 6 8.820 8.820 9.220 -0.400 17919 77710 1 190 . 1 1 7 7 THR N N 7 115.400 115.400 117.685 -2.285 17919 77711 1 190 . 1 1 7 7 THR HA H 7 4.970 4.970 4.990 -0.020 17919 77712 1 190 . 1 1 7 7 THR C C 7 176.910 176.910 176.202 0.708 17919 77713 1 190 . 1 1 7 7 THR CA C 7 60.470 60.470 59.836 0.634 17919 77714 1 190 . 1 1 7 7 THR CB C 7 70.630 70.630 70.920 -0.290 17919 77715 1 190 . 1 1 7 7 THR H H 7 8.730 8.730 8.773 -0.043 17919 77716 1 190 . 1 1 8 8 LEU N N 8 121.330 121.330 120.621 0.709 17919 77717 1 190 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.411 -0.101 17919 77718 1 190 . 1 1 8 8 LEU C C 8 178.800 178.800 177.490 1.310 17919 77719 1 190 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.420 0.160 17919 77720 1 190 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.062 -0.092 17919 77721 1 190 . 1 1 8 8 LEU H H 8 9.100 9.100 8.670 0.430 17919 77722 1 190 . 1 1 9 9 THR N N 9 105.590 105.590 109.016 -3.426 17919 77723 1 190 . 1 1 9 9 THR HA H 9 4.428 4.428 4.406 0.022 17919 77724 1 190 . 1 1 9 9 THR C C 9 175.520 175.520 175.187 0.333 17919 77725 1 190 . 1 1 9 9 THR CA C 9 61.400 61.400 61.610 -0.210 17919 77726 1 190 . 1 1 9 9 THR CB C 9 69.140 69.140 68.552 0.588 17919 77727 1 190 . 1 1 9 9 THR H H 9 7.630 7.630 7.742 -0.112 17919 77728 1 190 . 1 1 10 10 GLY N N 10 108.890 108.890 110.599 -1.709 17919 77729 1 190 . 1 1 10 10 GLY C C 10 174.070 174.070 173.963 0.107 17919 77730 1 190 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.029 0.431 17919 77731 1 190 . 1 1 10 10 GLY H H 10 7.810 7.810 7.603 0.207 17919 77732 1 190 . 1 1 11 11 LYS N N 11 121.600 121.600 120.314 1.286 17919 77733 1 190 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.267 0.094 17919 77734 1 190 . 1 1 11 11 LYS C C 11 175.940 175.940 175.499 0.441 17919 77735 1 190 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.833 -0.553 17919 77736 1 190 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.443 -0.243 17919 77737 1 190 . 1 1 11 11 LYS H H 11 7.280 7.280 7.847 -0.567 17919 77738 1 190 . 1 1 12 12 THR N N 12 120.440 120.440 120.986 -0.546 17919 77739 1 190 . 1 1 12 12 THR HA H 12 5.046 5.046 5.167 -0.121 17919 77740 1 190 . 1 1 12 12 THR C C 12 174.320 174.320 174.165 0.155 17919 77741 1 190 . 1 1 12 12 THR CA C 12 62.390 62.390 61.043 1.347 17919 77742 1 190 . 1 1 12 12 THR CB C 12 69.910 69.910 70.174 -0.264 17919 77743 1 190 . 1 1 12 12 THR H H 12 8.650 8.650 8.359 0.291 17919 77744 1 190 . 1 1 13 13 ILE N N 13 127.110 127.110 121.862 5.248 17919 77745 1 190 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.758 -0.214 17919 77746 1 190 . 1 1 13 13 ILE C C 13 175.220 175.220 174.987 0.233 17919 77747 1 190 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.020 0.960 17919 77748 1 190 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.424 -0.474 17919 77749 1 190 . 1 1 13 13 ILE H H 13 9.450 9.450 8.871 0.579 17919 77750 1 190 . 1 1 14 14 THR N N 14 121.520 121.520 120.782 0.738 17919 77751 1 190 . 1 1 14 14 THR HA H 14 4.964 4.964 5.321 -0.357 17919 77752 1 190 . 1 1 14 14 THR C C 14 173.790 173.790 173.530 0.260 17919 77753 1 190 . 1 1 14 14 THR CA C 14 61.940 61.940 62.708 -0.768 17919 77754 1 190 . 1 1 14 14 THR CB C 14 69.650 69.650 69.957 -0.307 17919 77755 1 190 . 1 1 14 14 THR H H 14 8.710 8.710 8.409 0.301 17919 77756 1 190 . 1 1 15 15 LEU N N 15 124.800 124.800 126.989 -2.189 17919 77757 1 190 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.727 0.053 17919 77758 1 190 . 1 1 15 15 LEU C C 15 174.670 174.670 174.907 -0.237 17919 77759 1 190 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.869 -1.039 17919 77760 1 190 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.265 1.805 17919 77761 1 190 . 1 1 15 15 LEU H H 15 8.710 8.710 9.001 -0.291 17919 77762 1 190 . 1 1 16 16 GLU N N 16 122.160 122.160 123.070 -0.910 17919 77763 1 190 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.301 -0.384 17919 77764 1 190 . 1 1 16 16 GLU C C 16 175.860 175.860 175.747 0.113 17919 77765 1 190 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.475 -0.655 17919 77766 1 190 . 1 1 16 16 GLU CB C 16 29.450 29.450 31.361 -1.911 17919 77767 1 190 . 1 1 16 16 GLU H H 16 8.140 8.140 8.722 -0.582 17919 77768 1 190 . 1 1 17 17 VAL N N 17 117.210 117.210 119.052 -1.842 17919 77769 1 190 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.964 -0.250 17919 77770 1 190 . 1 1 17 17 VAL C C 17 174.160 174.160 174.979 -0.819 17919 77771 1 190 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.854 -0.424 17919 77772 1 190 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.633 0.768 17919 77773 1 190 . 1 1 17 17 VAL H H 17 8.900 8.900 8.875 0.025 17919 77774 1 190 . 1 1 18 18 GLU N N 18 118.990 118.990 121.568 -2.578 17919 77775 1 190 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.779 0.300 17919 77776 1 190 . 1 1 18 18 GLU C C 18 176.160 176.160 175.627 0.533 17919 77777 1 190 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.870 -0.150 17919 77778 1 190 . 1 1 18 18 GLU CB C 18 30.310 30.310 29.902 0.408 17919 77779 1 190 . 1 1 18 18 GLU H H 18 8.640 8.640 8.962 -0.322 17919 77780 1 190 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.285 -0.144 17919 77781 1 190 . 1 1 19 19 PRO C C 19 175.310 175.310 178.248 -2.938 17919 77782 1 190 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.591 -0.120 17919 77783 1 190 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.883 0.067 17919 77784 1 190 . 1 1 20 20 SER N N 20 103.400 103.400 111.125 -7.725 17919 77785 1 190 . 1 1 20 20 SER HA H 20 4.370 4.370 4.308 0.062 17919 77786 1 190 . 1 1 20 20 SER C C 20 174.660 174.660 174.064 0.596 17919 77787 1 190 . 1 1 20 20 SER CA C 20 57.400 57.400 59.219 -1.819 17919 77788 1 190 . 1 1 20 20 SER CB C 20 63.370 63.370 62.816 0.555 17919 77789 1 190 . 1 1 20 20 SER H H 20 7.040 7.040 8.116 -1.076 17919 77790 1 190 . 1 1 21 21 ASP N N 21 123.480 123.480 122.799 0.681 17919 77791 1 190 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.779 -0.084 17919 77792 1 190 . 1 1 21 21 ASP C C 21 176.360 176.360 175.904 0.456 17919 77793 1 190 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.745 0.955 17919 77794 1 190 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.752 -0.952 17919 77795 1 190 . 1 1 21 21 ASP H H 21 8.030 8.030 7.737 0.293 17919 77796 1 190 . 1 1 22 22 THR N N 22 108.800 108.800 111.879 -3.079 17919 77797 1 190 . 1 1 22 22 THR HA H 22 4.920 4.920 4.876 0.044 17919 77798 1 190 . 1 1 22 22 THR C C 22 176.750 176.750 176.074 0.676 17919 77799 1 190 . 1 1 22 22 THR CA C 22 59.690 59.690 60.703 -1.014 17919 77800 1 190 . 1 1 22 22 THR CB C 22 71.200 71.200 71.022 0.178 17919 77801 1 190 . 1 1 22 22 THR H H 22 7.900 7.900 8.213 -0.313 17919 77802 1 190 . 1 1 23 23 ILE N N 23 121.190 121.190 122.864 -1.674 17919 77803 1 190 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.733 -0.076 17919 77804 1 190 . 1 1 23 23 ILE C C 23 179.040 179.040 177.726 1.314 17919 77805 1 190 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.968 -0.708 17919 77806 1 190 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.361 -2.011 17919 77807 1 190 . 1 1 23 23 ILE H H 23 8.560 8.560 9.186 -0.626 17919 77808 1 190 . 1 1 24 24 GLU N N 24 120.830 120.830 119.769 1.061 17919 77809 1 190 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.992 -0.075 17919 77810 1 190 . 1 1 24 24 GLU C C 24 178.640 178.640 178.407 0.233 17919 77811 1 190 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.355 0.865 17919 77812 1 190 . 1 1 24 24 GLU CB C 24 28.280 28.280 28.904 -0.624 17919 77813 1 190 . 1 1 24 24 GLU H H 24 9.760 9.760 8.547 1.213 17919 77814 1 190 . 1 1 25 25 ASN N N 25 120.570 120.570 119.097 1.473 17919 77815 1 190 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.491 0.034 17919 77816 1 190 . 1 1 25 25 ASN C C 25 178.380 178.380 177.614 0.766 17919 77817 1 190 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.255 -0.195 17919 77818 1 190 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.785 -0.335 17919 77819 1 190 . 1 1 25 25 ASN H H 25 7.920 7.920 7.564 0.356 17919 77820 1 190 . 1 1 26 26 VAL N N 26 121.710 121.710 120.574 1.136 17919 77821 1 190 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.595 -0.198 17919 77822 1 190 . 1 1 26 26 VAL C C 26 177.950 177.950 177.774 0.176 17919 77823 1 190 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.933 0.727 17919 77824 1 190 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.557 -0.717 17919 77825 1 190 . 1 1 26 26 VAL H H 26 8.070 8.070 8.033 0.037 17919 77826 1 190 . 1 1 27 27 LYS N N 27 118.860 118.860 119.593 -0.733 17919 77827 1 190 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.183 0.397 17919 77828 1 190 . 1 1 27 27 LYS C C 27 180.550 180.550 179.028 1.522 17919 77829 1 190 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.356 -0.106 17919 77830 1 190 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.200 1.530 17919 77831 1 190 . 1 1 27 27 LYS H H 27 8.560 8.560 8.258 0.302 17919 77832 1 190 . 1 1 28 28 ALA N N 28 123.440 123.440 122.670 0.770 17919 77833 1 190 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.191 -0.031 17919 77834 1 190 . 1 1 28 28 ALA C C 28 180.300 180.300 179.006 1.294 17919 77835 1 190 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.662 0.708 17919 77836 1 190 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.543 -0.833 17919 77837 1 190 . 1 1 28 28 ALA H H 28 8.060 8.060 8.398 -0.338 17919 77838 1 190 . 1 1 29 29 LYS N N 29 119.940 119.940 119.478 0.462 17919 77839 1 190 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.073 0.134 17919 77840 1 190 . 1 1 29 29 LYS C C 29 180.320 180.320 178.907 1.413 17919 77841 1 190 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.290 0.360 17919 77842 1 190 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.381 0.909 17919 77843 1 190 . 1 1 29 29 LYS H H 29 7.850 7.850 8.147 -0.297 17919 77844 1 190 . 1 1 30 30 ILE N N 30 121.080 121.080 120.927 0.153 17919 77845 1 190 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.637 -0.130 17919 77846 1 190 . 1 1 30 30 ILE C C 30 178.310 178.310 177.230 1.080 17919 77847 1 190 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.473 0.677 17919 77848 1 190 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.811 -1.011 17919 77849 1 190 . 1 1 30 30 ILE H H 30 8.280 8.280 8.189 0.091 17919 77850 1 190 . 1 1 31 31 GLN N N 31 123.490 123.490 120.771 2.719 17919 77851 1 190 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.228 -0.399 17919 77852 1 190 . 1 1 31 31 GLN C C 31 178.890 178.890 178.567 0.323 17919 77853 1 190 . 1 1 31 31 GLN CA C 31 60.000 60.000 58.967 1.033 17919 77854 1 190 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.590 -0.870 17919 77855 1 190 . 1 1 31 31 GLN H H 31 8.580 8.580 7.742 0.838 17919 77856 1 190 . 1 1 32 32 ASP N N 32 119.360 119.360 120.180 -0.820 17919 77857 1 190 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.406 -0.052 17919 77858 1 190 . 1 1 32 32 ASP C C 32 177.250 177.250 178.054 -0.804 17919 77859 1 190 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.733 0.457 17919 77860 1 190 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.936 -0.356 17919 77861 1 190 . 1 1 32 32 ASP H H 32 8.010 8.010 8.051 -0.041 17919 77862 1 190 . 1 1 33 33 LYS N N 33 115.130 115.130 117.963 -2.833 17919 77863 1 190 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.240 0.097 17919 77864 1 190 . 1 1 33 33 LYS C C 33 177.870 177.870 178.106 -0.236 17919 77865 1 190 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.194 -0.144 17919 77866 1 190 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.099 1.071 17919 77867 1 190 . 1 1 33 33 LYS H H 33 7.430 7.430 7.813 -0.383 17919 77868 1 190 . 1 1 34 34 GLU N N 34 113.870 113.870 115.260 -1.390 17919 77869 1 190 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.517 0.108 17919 77870 1 190 . 1 1 34 34 GLU C C 34 177.840 177.840 176.605 1.235 17919 77871 1 190 . 1 1 34 34 GLU CA C 34 55.170 55.170 54.785 0.385 17919 77872 1 190 . 1 1 34 34 GLU CB C 34 32.660 32.660 30.728 1.932 17919 77873 1 190 . 1 1 34 34 GLU H H 34 8.740 8.740 8.215 0.525 17919 77874 1 190 . 1 1 35 35 GLY N N 35 108.650 108.650 107.355 1.295 17919 77875 1 190 . 1 1 35 35 GLY C C 35 173.960 173.960 174.427 -0.467 17919 77876 1 190 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.371 0.709 17919 77877 1 190 . 1 1 35 35 GLY H H 35 8.530 8.530 7.930 0.600 17919 77878 1 190 . 1 1 36 36 ILE N N 36 119.880 119.880 117.420 2.460 17919 77879 1 190 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.657 -0.212 17919 77880 1 190 . 1 1 36 36 ILE C C 36 173.590 173.590 173.346 0.244 17919 77881 1 190 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.674 0.076 17919 77882 1 190 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.836 1.744 17919 77883 1 190 . 1 1 36 36 ILE H H 36 6.150 6.150 7.396 -1.246 17919 77884 1 190 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.947 -0.313 17919 77885 1 190 . 1 1 37 37 PRO C C 37 176.940 176.940 175.952 0.988 17919 77886 1 190 . 1 1 37 37 PRO CA C 37 61.660 61.660 60.755 0.905 17919 77887 1 190 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.656 0.194 17919 77888 1 190 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.254 -0.137 17919 77889 1 190 . 1 1 38 38 PRO C C 38 178.320 178.320 178.058 0.262 17919 77890 1 190 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.332 0.928 17919 77891 1 190 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.836 1.054 17919 77892 1 190 . 1 1 39 39 ASP N N 39 113.380 113.380 116.022 -2.642 17919 77893 1 190 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.409 0.021 17919 77894 1 190 . 1 1 39 39 ASP C C 39 177.090 177.090 177.047 0.043 17919 77895 1 190 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.157 -0.517 17919 77896 1 190 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.789 -1.249 17919 77897 1 190 . 1 1 39 39 ASP H H 39 8.550 8.550 8.460 0.090 17919 77898 1 190 . 1 1 40 40 GLN N N 40 116.780 116.780 117.281 -0.501 17919 77899 1 190 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.249 0.215 17919 77900 1 190 . 1 1 40 40 GLN C C 40 175.380 175.380 175.803 -0.423 17919 77901 1 190 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.848 -0.208 17919 77902 1 190 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.393 0.747 17919 77903 1 190 . 1 1 40 40 GLN H H 40 7.820 7.820 7.579 0.241 17919 77904 1 190 . 1 1 41 41 GLN N N 41 117.720 117.720 118.786 -1.066 17919 77905 1 190 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.444 -0.200 17919 77906 1 190 . 1 1 41 41 GLN C C 41 176.300 176.300 175.144 1.156 17919 77907 1 190 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.657 0.813 17919 77908 1 190 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.485 2.165 17919 77909 1 190 . 1 1 41 41 GLN H H 41 7.480 7.480 7.302 0.178 17919 77910 1 190 . 1 1 42 42 ARG N N 42 122.680 122.680 126.789 -4.109 17919 77911 1 190 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.539 -0.039 17919 77912 1 190 . 1 1 42 42 ARG C C 42 174.050 174.050 173.977 0.073 17919 77913 1 190 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.630 0.419 17919 77914 1 190 . 1 1 42 42 ARG CB C 42 31.750 31.750 31.197 0.553 17919 77915 1 190 . 1 1 42 42 ARG H H 42 8.530 8.530 9.003 -0.473 17919 77916 1 190 . 1 1 43 43 LEU N N 43 124.040 124.040 129.129 -5.089 17919 77917 1 190 . 1 1 43 43 LEU C C 43 175.290 175.290 174.926 0.364 17919 77918 1 190 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.959 -0.979 17919 77919 1 190 . 1 1 43 43 LEU CB C 43 45.790 45.790 45.398 0.392 17919 77920 1 190 . 1 1 43 43 LEU H H 43 8.820 8.820 8.733 0.087 17919 77921 1 190 . 1 1 44 44 ILE N N 44 121.920 121.920 121.056 0.864 17919 77922 1 190 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.029 -0.036 17919 77923 1 190 . 1 1 44 44 ILE C C 44 176.060 176.060 173.247 2.813 17919 77924 1 190 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.474 -0.494 17919 77925 1 190 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.533 -0.113 17919 77926 1 190 . 1 1 44 44 ILE H H 44 9.030 9.030 8.935 0.095 17919 77927 1 190 . 1 1 45 45 PHE N N 45 125.390 125.390 127.874 -2.484 17919 77928 1 190 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.021 0.024 17919 77929 1 190 . 1 1 45 45 PHE C C 45 174.470 174.470 175.407 -0.937 17919 77930 1 190 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.418 0.602 17919 77931 1 190 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.728 1.032 17919 77932 1 190 . 1 1 45 45 PHE H H 45 8.830 8.830 7.998 0.832 17919 77933 1 190 . 1 1 46 46 ALA N N 46 132.200 132.200 130.151 2.049 17919 77934 1 190 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.610 0.080 17919 77935 1 190 . 1 1 46 46 ALA C C 46 177.290 177.290 177.262 0.028 17919 77936 1 190 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.639 -0.098 17919 77937 1 190 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.609 -0.039 17919 77938 1 190 . 1 1 46 46 ALA H H 46 8.810 8.810 8.584 0.226 17919 77939 1 190 . 1 1 47 47 GLY N N 47 102.340 102.340 103.276 -0.936 17919 77940 1 190 . 1 1 47 47 GLY C C 47 173.810 173.810 174.528 -0.718 17919 77941 1 190 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.556 -0.207 17919 77942 1 190 . 1 1 47 47 GLY H H 47 8.130 8.130 8.532 -0.402 17919 77943 1 190 . 1 1 48 48 LYS N N 48 121.570 121.570 121.155 0.415 17919 77944 1 190 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.577 0.045 17919 77945 1 190 . 1 1 48 48 LYS C C 48 174.700 174.700 175.262 -0.562 17919 77946 1 190 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.102 0.448 17919 77947 1 190 . 1 1 48 48 LYS CB C 48 34.530 34.530 33.551 0.979 17919 77948 1 190 . 1 1 48 48 LYS H H 48 7.980 7.980 7.904 0.076 17919 77949 1 190 . 1 1 49 49 GLN N N 49 122.410 122.410 125.832 -3.422 17919 77950 1 190 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.199 0.361 17919 77951 1 190 . 1 1 49 49 GLN C C 49 175.670 175.670 175.402 0.268 17919 77952 1 190 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.776 -0.035 17919 77953 1 190 . 1 1 49 49 GLN CB C 49 29.000 29.000 28.613 0.388 17919 77954 1 190 . 1 1 49 49 GLN H H 49 8.600 8.600 8.586 0.014 17919 77955 1 190 . 1 1 50 50 LEU N N 50 125.520 125.520 126.857 -1.337 17919 77956 1 190 . 1 1 50 50 LEU HA H 50 4.090 4.090 3.809 0.281 17919 77957 1 190 . 1 1 50 50 LEU C C 50 176.660 176.660 176.664 -0.004 17919 77958 1 190 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.852 0.389 17919 77959 1 190 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.943 -0.373 17919 77960 1 190 . 1 1 50 50 LEU H H 50 8.530 8.530 8.243 0.287 17919 77961 1 190 . 1 1 51 51 GLU N N 51 122.940 122.940 123.041 -0.101 17919 77962 1 190 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.437 0.051 17919 77963 1 190 . 1 1 51 51 GLU C C 51 175.870 175.870 176.669 -0.799 17919 77964 1 190 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.768 0.192 17919 77965 1 190 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.611 -0.041 17919 77966 1 190 . 1 1 51 51 GLU H H 51 8.400 8.400 8.312 0.088 17919 77967 1 190 . 1 1 52 52 ASP N N 52 120.030 120.030 126.362 -6.332 17919 77968 1 190 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.486 -0.127 17919 77969 1 190 . 1 1 52 52 ASP C C 52 177.330 177.330 177.617 -0.287 17919 77970 1 190 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.536 -0.576 17919 77971 1 190 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.706 0.144 17919 77972 1 190 . 1 1 52 52 ASP H H 52 8.160 8.160 8.790 -0.630 17919 77973 1 190 . 1 1 53 53 GLY N N 53 106.660 106.660 105.222 1.438 17919 77974 1 190 . 1 1 53 53 GLY C C 53 174.870 174.870 173.917 0.953 17919 77975 1 190 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.647 0.523 17919 77976 1 190 . 1 1 53 53 GLY H H 53 9.390 9.390 8.457 0.933 17919 77977 1 190 . 1 1 54 54 ARG N N 54 119.050 119.050 120.535 -1.485 17919 77978 1 190 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.692 0.003 17919 77979 1 190 . 1 1 54 54 ARG C C 54 175.350 175.350 174.868 0.482 17919 77980 1 190 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.285 0.105 17919 77981 1 190 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.892 -1.242 17919 77982 1 190 . 1 1 54 54 ARG H H 54 7.460 7.460 7.415 0.045 17919 77983 1 190 . 1 1 55 55 THR N N 55 108.400 108.400 112.601 -4.201 17919 77984 1 190 . 1 1 55 55 THR HA H 55 5.240 5.240 5.110 0.130 17919 77985 1 190 . 1 1 55 55 THR C C 55 176.560 176.560 176.355 0.205 17919 77986 1 190 . 1 1 55 55 THR CA C 55 59.690 59.690 59.934 -0.244 17919 77987 1 190 . 1 1 55 55 THR CB C 55 72.260 72.260 71.232 1.028 17919 77988 1 190 . 1 1 55 55 THR H H 55 8.730 8.730 9.048 -0.318 17919 77989 1 190 . 1 1 56 56 LEU N N 56 117.920 117.920 121.680 -3.760 17919 77990 1 190 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.839 0.221 17919 77991 1 190 . 1 1 56 56 LEU C C 56 180.810 180.810 178.768 2.042 17919 77992 1 190 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.688 0.022 17919 77993 1 190 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.375 -1.005 17919 77994 1 190 . 1 1 56 56 LEU H H 56 8.140 8.140 8.956 -0.816 17919 77995 1 190 . 1 1 57 57 SER N N 57 113.330 113.330 112.481 0.849 17919 77996 1 190 . 1 1 57 57 SER HA H 57 4.370 4.370 4.363 0.007 17919 77997 1 190 . 1 1 57 57 SER C C 57 178.310 178.310 175.991 2.319 17919 77998 1 190 . 1 1 57 57 SER CA C 57 61.080 61.080 61.218 -0.138 17919 77999 1 190 . 1 1 57 57 SER CB C 57 62.530 62.530 63.059 -0.529 17919 78000 1 190 . 1 1 57 57 SER H H 57 8.470 8.470 7.850 0.620 17919 78001 1 190 . 1 1 58 58 ASP N N 58 124.190 124.190 123.379 0.811 17919 78002 1 190 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.451 -0.155 17919 78003 1 190 . 1 1 58 58 ASP C C 58 177.400 177.400 177.398 0.002 17919 78004 1 190 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.524 0.656 17919 78005 1 190 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.780 -0.680 17919 78006 1 190 . 1 1 58 58 ASP H H 58 7.930 7.930 7.624 0.306 17919 78007 1 190 . 1 1 59 59 TYR N N 59 115.510 115.510 117.311 -1.801 17919 78008 1 190 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.590 0.080 17919 78009 1 190 . 1 1 59 59 TYR C C 59 174.700 174.700 174.564 0.136 17919 78010 1 190 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.474 0.776 17919 78011 1 190 . 1 1 59 59 TYR CB C 59 40.070 40.070 37.857 2.213 17919 78012 1 190 . 1 1 59 59 TYR H H 59 7.250 7.250 7.596 -0.346 17919 78013 1 190 . 1 1 60 60 ASN N N 60 115.900 115.900 117.213 -1.313 17919 78014 1 190 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.422 -0.067 17919 78015 1 190 . 1 1 60 60 ASN C C 60 174.340 174.340 174.947 -0.607 17919 78016 1 190 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.104 0.016 17919 78017 1 190 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.103 0.307 17919 78018 1 190 . 1 1 60 60 ASN H H 60 8.150 8.150 7.525 0.625 17919 78019 1 190 . 1 1 61 61 ILE N N 61 118.600 118.600 119.072 -0.472 17919 78020 1 190 . 1 1 61 61 ILE HA H 61 3.393 3.393 4.082 -0.689 17919 78021 1 190 . 1 1 61 61 ILE C C 61 174.610 174.610 175.220 -0.610 17919 78022 1 190 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.568 0.852 17919 78023 1 190 . 1 1 61 61 ILE CB C 61 36.740 36.740 38.296 -1.556 17919 78024 1 190 . 1 1 61 61 ILE H H 61 7.250 7.250 8.329 -1.079 17919 78025 1 190 . 1 1 62 62 GLN N N 62 124.740 124.740 125.730 -0.990 17919 78026 1 190 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.640 -0.134 17919 78027 1 190 . 1 1 62 62 GLN C C 62 175.970 175.970 175.616 0.354 17919 78028 1 190 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.801 -0.141 17919 78029 1 190 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.350 0.300 17919 78030 1 190 . 1 1 62 62 GLN H H 62 7.610 7.610 8.157 -0.547 17919 78031 1 190 . 1 1 63 63 LYS N N 63 120.300 120.300 122.227 -1.927 17919 78032 1 190 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.037 -0.036 17919 78033 1 190 . 1 1 63 63 LYS C C 63 175.810 175.810 176.903 -1.093 17919 78034 1 190 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.613 0.177 17919 78035 1 190 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.996 0.654 17919 78036 1 190 . 1 1 63 63 LYS H H 63 8.490 8.490 8.649 -0.159 17919 78037 1 190 . 1 1 64 64 GLU N N 64 113.950 113.950 117.930 -3.980 17919 78038 1 190 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.471 -0.006 17919 78039 1 190 . 1 1 64 64 GLU C C 64 175.250 175.250 175.679 -0.429 17919 78040 1 190 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.727 0.163 17919 78041 1 190 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.852 -2.952 17919 78042 1 190 . 1 1 64 64 GLU H H 64 9.280 9.280 8.585 0.695 17919 78043 1 190 . 1 1 65 65 SER N N 65 114.730 114.730 115.869 -1.139 17919 78044 1 190 . 1 1 65 65 SER HA H 65 4.640 4.640 4.447 0.193 17919 78045 1 190 . 1 1 65 65 SER C C 65 172.160 172.160 173.763 -1.603 17919 78046 1 190 . 1 1 65 65 SER CA C 65 60.890 60.890 60.321 0.569 17919 78047 1 190 . 1 1 65 65 SER CB C 65 64.910 64.910 63.960 0.950 17919 78048 1 190 . 1 1 65 65 SER H H 65 7.670 7.670 7.575 0.095 17919 78049 1 190 . 1 1 66 66 THR N N 66 117.110 117.110 119.310 -2.200 17919 78050 1 190 . 1 1 66 66 THR HA H 66 5.270 5.270 5.075 0.195 17919 78051 1 190 . 1 1 66 66 THR C C 66 173.950 173.950 173.876 0.074 17919 78052 1 190 . 1 1 66 66 THR CA C 66 62.340 62.340 61.920 0.420 17919 78053 1 190 . 1 1 66 66 THR CB C 66 70.080 70.080 70.825 -0.745 17919 78054 1 190 . 1 1 66 66 THR H H 66 8.730 8.730 8.586 0.144 17919 78055 1 190 . 1 1 67 67 LEU N N 67 127.110 127.110 126.621 0.489 17919 78056 1 190 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.973 0.087 17919 78057 1 190 . 1 1 67 67 LEU C C 67 175.770 175.770 175.418 0.352 17919 78058 1 190 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.761 0.139 17919 78059 1 190 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.762 0.498 17919 78060 1 190 . 1 1 67 67 LEU H H 67 9.410 9.410 8.973 0.437 17919 78061 1 190 . 1 1 68 68 HIS N N 68 118.380 118.380 122.406 -4.026 17919 78062 1 190 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.362 -0.122 17919 78063 1 190 . 1 1 68 68 HIS C C 68 173.150 173.150 173.643 -0.493 17919 78064 1 190 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.891 0.109 17919 78065 1 190 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.487 -1.957 17919 78066 1 190 . 1 1 68 68 HIS H H 68 9.230 9.230 9.035 0.195 17919 78067 1 190 . 1 1 69 69 LEU N N 69 124.460 124.460 128.698 -4.238 17919 78068 1 190 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.257 -0.067 17919 78069 1 190 . 1 1 69 69 LEU C C 69 175.270 175.270 174.417 0.853 17919 78070 1 190 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.117 0.773 17919 78071 1 190 . 1 1 69 69 LEU CB C 69 44.380 44.380 45.253 -0.873 17919 78072 1 190 . 1 1 69 69 LEU H H 69 8.340 8.340 8.583 -0.243 17919 78073 1 190 . 1 1 70 70 VAL N N 70 126.940 126.940 121.908 5.032 17919 78074 1 190 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.534 -0.184 17919 78075 1 190 . 1 1 70 70 VAL C C 70 174.000 174.000 173.583 0.417 17919 78076 1 190 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.103 0.697 17919 78077 1 190 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.953 -1.043 17919 78078 1 190 . 1 1 70 70 VAL H H 70 9.200 9.200 9.206 -0.006 17919 78079 1 190 . 1 1 71 71 LEU N N 71 123.130 123.130 122.405 0.725 17919 78080 1 190 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.082 -0.022 17919 78081 1 190 . 1 1 71 71 LEU C C 71 177.830 177.830 177.604 0.226 17919 78082 1 190 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.299 0.641 17919 78083 1 190 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.925 -0.075 17919 78084 1 190 . 1 1 71 71 LEU H H 71 8.120 8.120 8.371 -0.251 17919 78085 1 190 . 1 1 72 72 ARG N N 72 123.490 123.490 123.553 -0.063 17919 78086 1 190 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.308 -0.007 17919 78087 1 190 . 1 1 72 72 ARG C C 72 175.350 175.350 175.325 0.025 17919 78088 1 190 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.650 -0.040 17919 78089 1 190 . 1 1 72 72 ARG CB C 72 31.350 31.350 29.943 1.407 17919 78090 1 190 . 1 1 72 72 ARG H H 72 8.580 8.580 7.998 0.582 17919 78091 1 191 . 1 1 2 2 GLN N N 2 123.220 123.220 120.920 2.300 17919 78092 1 191 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.368 -0.119 17919 78093 1 191 . 1 1 2 2 GLN C C 2 175.920 175.920 175.106 0.814 17919 78094 1 191 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.688 0.392 17919 78095 1 191 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.875 -0.115 17919 78096 1 191 . 1 1 2 2 GLN H H 2 8.900 8.900 8.361 0.539 17919 78097 1 191 . 1 1 3 3 ILE N N 3 115.340 115.340 118.427 -3.087 17919 78098 1 191 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.505 -0.292 17919 78099 1 191 . 1 1 3 3 ILE C C 3 172.450 172.450 173.525 -1.075 17919 78100 1 191 . 1 1 3 3 ILE CA C 3 59.570 59.570 58.846 0.724 17919 78101 1 191 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.886 0.324 17919 78102 1 191 . 1 1 3 3 ILE H H 3 8.320 8.320 8.607 -0.287 17919 78103 1 191 . 1 1 4 4 PHE N N 4 118.110 118.110 119.066 -0.956 17919 78104 1 191 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.347 0.283 17919 78105 1 191 . 1 1 4 4 PHE C C 4 175.320 175.320 175.320 0.000 17919 78106 1 191 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.352 -0.142 17919 78107 1 191 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.396 0.084 17919 78108 1 191 . 1 1 4 4 PHE H H 4 8.610 8.610 8.291 0.319 17919 78109 1 191 . 1 1 5 5 VAL N N 5 121.000 121.000 123.966 -2.966 17919 78110 1 191 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.929 -0.204 17919 78111 1 191 . 1 1 5 5 VAL C C 5 174.870 174.870 175.064 -0.194 17919 78112 1 191 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.049 -0.429 17919 78113 1 191 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.497 0.733 17919 78114 1 191 . 1 1 5 5 VAL H H 5 9.300 9.300 9.306 -0.006 17919 78115 1 191 . 1 1 6 6 LYS N N 6 127.520 127.520 127.382 0.138 17919 78116 1 191 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.283 0.084 17919 78117 1 191 . 1 1 6 6 LYS C C 6 177.140 177.140 176.791 0.349 17919 78118 1 191 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.401 0.119 17919 78119 1 191 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.935 0.115 17919 78120 1 191 . 1 1 6 6 LYS H H 6 8.820 8.820 9.430 -0.610 17919 78121 1 191 . 1 1 7 7 THR N N 7 115.400 115.400 116.342 -0.942 17919 78122 1 191 . 1 1 7 7 THR HA H 7 4.970 4.970 4.818 0.152 17919 78123 1 191 . 1 1 7 7 THR C C 7 176.910 176.910 177.212 -0.302 17919 78124 1 191 . 1 1 7 7 THR CA C 7 60.470 60.470 60.887 -0.417 17919 78125 1 191 . 1 1 7 7 THR CB C 7 70.630 70.630 70.844 -0.214 17919 78126 1 191 . 1 1 7 7 THR H H 7 8.730 8.730 8.871 -0.141 17919 78127 1 191 . 1 1 8 8 LEU N N 8 121.330 121.330 118.574 2.756 17919 78128 1 191 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.366 -0.056 17919 78129 1 191 . 1 1 8 8 LEU C C 8 178.800 178.800 176.683 2.117 17919 78130 1 191 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.964 -0.383 17919 78131 1 191 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.457 0.513 17919 78132 1 191 . 1 1 8 8 LEU H H 8 9.100 9.100 8.580 0.520 17919 78133 1 191 . 1 1 9 9 THR N N 9 105.590 105.590 107.597 -2.007 17919 78134 1 191 . 1 1 9 9 THR HA H 9 4.428 4.428 4.396 0.032 17919 78135 1 191 . 1 1 9 9 THR C C 9 175.520 175.520 175.424 0.096 17919 78136 1 191 . 1 1 9 9 THR CA C 9 61.400 61.400 61.114 0.286 17919 78137 1 191 . 1 1 9 9 THR CB C 9 69.140 69.140 68.684 0.456 17919 78138 1 191 . 1 1 9 9 THR H H 9 7.630 7.630 7.522 0.108 17919 78139 1 191 . 1 1 10 10 GLY N N 10 108.890 108.890 110.132 -1.242 17919 78140 1 191 . 1 1 10 10 GLY C C 10 174.070 174.070 174.159 -0.089 17919 78141 1 191 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.143 0.317 17919 78142 1 191 . 1 1 10 10 GLY H H 10 7.810 7.810 7.574 0.236 17919 78143 1 191 . 1 1 11 11 LYS N N 11 121.600 121.600 121.618 -0.018 17919 78144 1 191 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.416 -0.055 17919 78145 1 191 . 1 1 11 11 LYS C C 11 175.940 175.940 176.156 -0.216 17919 78146 1 191 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.310 -0.030 17919 78147 1 191 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.424 -0.224 17919 78148 1 191 . 1 1 11 11 LYS H H 11 7.280 7.280 7.852 -0.572 17919 78149 1 191 . 1 1 12 12 THR N N 12 120.440 120.440 120.385 0.055 17919 78150 1 191 . 1 1 12 12 THR HA H 12 5.046 5.046 5.041 0.005 17919 78151 1 191 . 1 1 12 12 THR C C 12 174.320 174.320 174.507 -0.187 17919 78152 1 191 . 1 1 12 12 THR CA C 12 62.390 62.390 61.810 0.580 17919 78153 1 191 . 1 1 12 12 THR CB C 12 69.910 69.910 69.833 0.077 17919 78154 1 191 . 1 1 12 12 THR H H 12 8.650 8.650 8.388 0.262 17919 78155 1 191 . 1 1 13 13 ILE N N 13 127.110 127.110 127.412 -0.302 17919 78156 1 191 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.498 0.046 17919 78157 1 191 . 1 1 13 13 ILE C C 13 175.220 175.220 174.634 0.586 17919 78158 1 191 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.622 -0.642 17919 78159 1 191 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.010 -0.060 17919 78160 1 191 . 1 1 13 13 ILE H H 13 9.450 9.450 8.854 0.596 17919 78161 1 191 . 1 1 14 14 THR N N 14 121.520 121.520 123.480 -1.960 17919 78162 1 191 . 1 1 14 14 THR HA H 14 4.964 4.964 5.100 -0.136 17919 78163 1 191 . 1 1 14 14 THR C C 14 173.790 173.790 173.929 -0.139 17919 78164 1 191 . 1 1 14 14 THR CA C 14 61.940 61.940 62.054 -0.114 17919 78165 1 191 . 1 1 14 14 THR CB C 14 69.650 69.650 69.839 -0.189 17919 78166 1 191 . 1 1 14 14 THR H H 14 8.710 8.710 8.407 0.303 17919 78167 1 191 . 1 1 15 15 LEU N N 15 124.800 124.800 127.913 -3.113 17919 78168 1 191 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.735 0.045 17919 78169 1 191 . 1 1 15 15 LEU C C 15 174.670 174.670 175.373 -0.703 17919 78170 1 191 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.639 -0.809 17919 78171 1 191 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.353 1.717 17919 78172 1 191 . 1 1 15 15 LEU H H 15 8.710 8.710 8.630 0.080 17919 78173 1 191 . 1 1 16 16 GLU N N 16 122.160 122.160 123.271 -1.111 17919 78174 1 191 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.409 -0.492 17919 78175 1 191 . 1 1 16 16 GLU C C 16 175.860 175.860 176.022 -0.162 17919 78176 1 191 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.603 -0.784 17919 78177 1 191 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.749 -1.299 17919 78178 1 191 . 1 1 16 16 GLU H H 16 8.140 8.140 8.760 -0.620 17919 78179 1 191 . 1 1 17 17 VAL N N 17 117.210 117.210 119.026 -1.816 17919 78180 1 191 . 1 1 17 17 VAL HA H 17 4.714 4.714 5.090 -0.376 17919 78181 1 191 . 1 1 17 17 VAL C C 17 174.160 174.160 174.554 -0.394 17919 78182 1 191 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.735 -0.305 17919 78183 1 191 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.724 0.676 17919 78184 1 191 . 1 1 17 17 VAL H H 17 8.900 8.900 8.938 -0.038 17919 78185 1 191 . 1 1 18 18 GLU N N 18 118.990 118.990 121.631 -2.641 17919 78186 1 191 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.884 0.195 17919 78187 1 191 . 1 1 18 18 GLU C C 18 176.160 176.160 175.294 0.866 17919 78188 1 191 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.464 0.256 17919 78189 1 191 . 1 1 18 18 GLU CB C 18 30.310 30.310 29.992 0.318 17919 78190 1 191 . 1 1 18 18 GLU H H 18 8.640 8.640 9.343 -0.703 17919 78191 1 191 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.141 0.000 17919 78192 1 191 . 1 1 19 19 PRO C C 19 175.310 175.310 177.596 -2.286 17919 78193 1 191 . 1 1 19 19 PRO CA C 19 65.470 65.470 66.013 -0.542 17919 78194 1 191 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.725 0.225 17919 78195 1 191 . 1 1 20 20 SER N N 20 103.400 103.400 111.695 -8.295 17919 78196 1 191 . 1 1 20 20 SER HA H 20 4.370 4.370 4.318 0.052 17919 78197 1 191 . 1 1 20 20 SER C C 20 174.660 174.660 174.935 -0.275 17919 78198 1 191 . 1 1 20 20 SER CA C 20 57.400 57.400 59.719 -2.319 17919 78199 1 191 . 1 1 20 20 SER CB C 20 63.370 63.370 62.716 0.654 17919 78200 1 191 . 1 1 20 20 SER H H 20 7.040 7.040 8.433 -1.393 17919 78201 1 191 . 1 1 21 21 ASP N N 21 123.480 123.480 123.412 0.068 17919 78202 1 191 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.734 -0.039 17919 78203 1 191 . 1 1 21 21 ASP C C 21 176.360 176.360 175.752 0.608 17919 78204 1 191 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.302 0.398 17919 78205 1 191 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.612 -0.812 17919 78206 1 191 . 1 1 21 21 ASP H H 21 8.030 8.030 7.923 0.107 17919 78207 1 191 . 1 1 22 22 THR N N 22 108.800 108.800 111.840 -3.040 17919 78208 1 191 . 1 1 22 22 THR HA H 22 4.920 4.920 4.927 -0.007 17919 78209 1 191 . 1 1 22 22 THR C C 22 176.750 176.750 176.223 0.527 17919 78210 1 191 . 1 1 22 22 THR CA C 22 59.690 59.690 60.337 -0.646 17919 78211 1 191 . 1 1 22 22 THR CB C 22 71.200 71.200 71.254 -0.054 17919 78212 1 191 . 1 1 22 22 THR H H 22 7.900 7.900 8.153 -0.253 17919 78213 1 191 . 1 1 23 23 ILE N N 23 121.190 121.190 122.338 -1.148 17919 78214 1 191 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.774 -0.117 17919 78215 1 191 . 1 1 23 23 ILE C C 23 179.040 179.040 177.801 1.239 17919 78216 1 191 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.730 -0.470 17919 78217 1 191 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.203 -1.853 17919 78218 1 191 . 1 1 23 23 ILE H H 23 8.560 8.560 8.825 -0.265 17919 78219 1 191 . 1 1 24 24 GLU N N 24 120.830 120.830 120.610 0.220 17919 78220 1 191 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.859 0.058 17919 78221 1 191 . 1 1 24 24 GLU C C 24 178.640 178.640 178.374 0.266 17919 78222 1 191 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.679 0.541 17919 78223 1 191 . 1 1 24 24 GLU CB C 24 28.280 28.280 28.614 -0.334 17919 78224 1 191 . 1 1 24 24 GLU H H 24 9.760 9.760 8.460 1.300 17919 78225 1 191 . 1 1 25 25 ASN N N 25 120.570 120.570 118.881 1.689 17919 78226 1 191 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.465 0.060 17919 78227 1 191 . 1 1 25 25 ASN C C 25 178.380 178.380 177.787 0.593 17919 78228 1 191 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.079 -0.019 17919 78229 1 191 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.824 -0.374 17919 78230 1 191 . 1 1 25 25 ASN H H 25 7.920 7.920 7.520 0.400 17919 78231 1 191 . 1 1 26 26 VAL N N 26 121.710 121.710 120.799 0.911 17919 78232 1 191 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.523 -0.126 17919 78233 1 191 . 1 1 26 26 VAL C C 26 177.950 177.950 177.746 0.204 17919 78234 1 191 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.973 0.687 17919 78235 1 191 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.538 -0.698 17919 78236 1 191 . 1 1 26 26 VAL H H 26 8.070 8.070 8.327 -0.257 17919 78237 1 191 . 1 1 27 27 LYS N N 27 118.860 118.860 119.533 -0.673 17919 78238 1 191 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.168 0.412 17919 78239 1 191 . 1 1 27 27 LYS C C 27 180.550 180.550 179.161 1.389 17919 78240 1 191 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.626 -0.376 17919 78241 1 191 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.145 1.585 17919 78242 1 191 . 1 1 27 27 LYS H H 27 8.560 8.560 8.406 0.154 17919 78243 1 191 . 1 1 28 28 ALA N N 28 123.440 123.440 122.226 1.214 17919 78244 1 191 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.228 -0.068 17919 78245 1 191 . 1 1 28 28 ALA C C 28 180.300 180.300 179.149 1.151 17919 78246 1 191 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.609 0.761 17919 78247 1 191 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.525 -0.815 17919 78248 1 191 . 1 1 28 28 ALA H H 28 8.060 8.060 8.126 -0.066 17919 78249 1 191 . 1 1 29 29 LYS N N 29 119.940 119.940 120.013 -0.073 17919 78250 1 191 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.009 0.198 17919 78251 1 191 . 1 1 29 29 LYS C C 29 180.320 180.320 179.049 1.271 17919 78252 1 191 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.508 0.142 17919 78253 1 191 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.383 0.907 17919 78254 1 191 . 1 1 29 29 LYS H H 29 7.850 7.850 8.129 -0.279 17919 78255 1 191 . 1 1 30 30 ILE N N 30 121.080 121.080 120.473 0.607 17919 78256 1 191 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.624 -0.117 17919 78257 1 191 . 1 1 30 30 ILE C C 30 178.310 178.310 177.369 0.941 17919 78258 1 191 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.455 0.695 17919 78259 1 191 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.726 -0.926 17919 78260 1 191 . 1 1 30 30 ILE H H 30 8.280 8.280 8.596 -0.316 17919 78261 1 191 . 1 1 31 31 GLN N N 31 123.490 123.490 121.023 2.467 17919 78262 1 191 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.059 -0.230 17919 78263 1 191 . 1 1 31 31 GLN C C 31 178.890 178.890 178.319 0.571 17919 78264 1 191 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.068 0.932 17919 78265 1 191 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.525 -0.805 17919 78266 1 191 . 1 1 31 31 GLN H H 31 8.580 8.580 8.063 0.517 17919 78267 1 191 . 1 1 32 32 ASP N N 32 119.360 119.360 119.021 0.339 17919 78268 1 191 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.401 -0.047 17919 78269 1 191 . 1 1 32 32 ASP C C 32 177.250 177.250 178.159 -0.909 17919 78270 1 191 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.663 0.527 17919 78271 1 191 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.742 -0.162 17919 78272 1 191 . 1 1 32 32 ASP H H 32 8.010 8.010 8.131 -0.121 17919 78273 1 191 . 1 1 33 33 LYS N N 33 115.130 115.130 118.272 -3.142 17919 78274 1 191 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.352 -0.015 17919 78275 1 191 . 1 1 33 33 LYS C C 33 177.870 177.870 178.285 -0.415 17919 78276 1 191 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.942 0.108 17919 78277 1 191 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.410 0.760 17919 78278 1 191 . 1 1 33 33 LYS H H 33 7.430 7.430 7.572 -0.142 17919 78279 1 191 . 1 1 34 34 GLU N N 34 113.870 113.870 115.272 -1.402 17919 78280 1 191 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.504 0.121 17919 78281 1 191 . 1 1 34 34 GLU C C 34 177.840 177.840 177.098 0.742 17919 78282 1 191 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.623 -0.453 17919 78283 1 191 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.596 1.064 17919 78284 1 191 . 1 1 34 34 GLU H H 34 8.740 8.740 8.351 0.389 17919 78285 1 191 . 1 1 35 35 GLY N N 35 108.650 108.650 109.143 -0.493 17919 78286 1 191 . 1 1 35 35 GLY C C 35 173.960 173.960 174.325 -0.365 17919 78287 1 191 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.828 0.252 17919 78288 1 191 . 1 1 35 35 GLY H H 35 8.530 8.530 8.017 0.513 17919 78289 1 191 . 1 1 36 36 ILE N N 36 119.880 119.880 121.872 -1.992 17919 78290 1 191 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.332 0.113 17919 78291 1 191 . 1 1 36 36 ILE C C 36 173.590 173.590 174.635 -1.045 17919 78292 1 191 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.534 0.216 17919 78293 1 191 . 1 1 36 36 ILE CB C 36 40.580 40.580 39.043 1.537 17919 78294 1 191 . 1 1 36 36 ILE H H 36 6.150 6.150 7.564 -1.414 17919 78295 1 191 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.774 -0.140 17919 78296 1 191 . 1 1 37 37 PRO C C 37 176.940 176.940 176.136 0.804 17919 78297 1 191 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.400 0.260 17919 78298 1 191 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.341 0.509 17919 78299 1 191 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.160 -0.043 17919 78300 1 191 . 1 1 38 38 PRO C C 38 178.320 178.320 178.760 -0.440 17919 78301 1 191 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.856 0.405 17919 78302 1 191 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.847 1.043 17919 78303 1 191 . 1 1 39 39 ASP N N 39 113.380 113.380 115.360 -1.980 17919 78304 1 191 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.437 -0.007 17919 78305 1 191 . 1 1 39 39 ASP C C 39 177.090 177.090 177.508 -0.418 17919 78306 1 191 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.235 -0.595 17919 78307 1 191 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.371 -0.831 17919 78308 1 191 . 1 1 39 39 ASP H H 39 8.550 8.550 8.477 0.073 17919 78309 1 191 . 1 1 40 40 GLN N N 40 116.780 116.780 116.541 0.239 17919 78310 1 191 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.266 0.198 17919 78311 1 191 . 1 1 40 40 GLN C C 40 175.380 175.380 175.995 -0.615 17919 78312 1 191 . 1 1 40 40 GLN CA C 40 55.640 55.640 57.111 -1.471 17919 78313 1 191 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.671 0.469 17919 78314 1 191 . 1 1 40 40 GLN H H 40 7.820 7.820 7.704 0.116 17919 78315 1 191 . 1 1 41 41 GLN N N 41 117.720 117.720 119.079 -1.359 17919 78316 1 191 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.648 -0.404 17919 78317 1 191 . 1 1 41 41 GLN C C 41 176.300 176.300 175.318 0.982 17919 78318 1 191 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.788 0.682 17919 78319 1 191 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.008 2.642 17919 78320 1 191 . 1 1 41 41 GLN H H 41 7.480 7.480 7.398 0.082 17919 78321 1 191 . 1 1 42 42 ARG N N 42 122.680 122.680 124.122 -1.442 17919 78322 1 191 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.578 -0.078 17919 78323 1 191 . 1 1 42 42 ARG C C 42 174.050 174.050 174.798 -0.748 17919 78324 1 191 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.983 0.067 17919 78325 1 191 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.418 -0.668 17919 78326 1 191 . 1 1 42 42 ARG H H 42 8.530 8.530 8.274 0.256 17919 78327 1 191 . 1 1 43 43 LEU N N 43 124.040 124.040 124.393 -0.353 17919 78328 1 191 . 1 1 43 43 LEU C C 43 175.290 175.290 175.936 -0.646 17919 78329 1 191 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.762 -0.782 17919 78330 1 191 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.223 1.567 17919 78331 1 191 . 1 1 43 43 LEU H H 43 8.820 8.820 8.727 0.093 17919 78332 1 191 . 1 1 44 44 ILE N N 44 121.920 121.920 120.711 1.209 17919 78333 1 191 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.072 -0.080 17919 78334 1 191 . 1 1 44 44 ILE C C 44 176.060 176.060 174.253 1.807 17919 78335 1 191 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.122 -1.142 17919 78336 1 191 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.831 -0.411 17919 78337 1 191 . 1 1 44 44 ILE H H 44 9.030 9.030 8.902 0.128 17919 78338 1 191 . 1 1 45 45 PHE N N 45 125.390 125.390 127.208 -1.818 17919 78339 1 191 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.001 0.044 17919 78340 1 191 . 1 1 45 45 PHE C C 45 174.470 174.470 174.242 0.228 17919 78341 1 191 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.284 0.736 17919 78342 1 191 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.037 0.723 17919 78343 1 191 . 1 1 45 45 PHE H H 45 8.830 8.830 8.192 0.638 17919 78344 1 191 . 1 1 46 46 ALA N N 46 132.200 132.200 128.646 3.554 17919 78345 1 191 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.597 0.093 17919 78346 1 191 . 1 1 46 46 ALA C C 46 177.290 177.290 177.736 -0.446 17919 78347 1 191 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.428 0.112 17919 78348 1 191 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.424 0.146 17919 78349 1 191 . 1 1 46 46 ALA H H 46 8.810 8.810 8.768 0.042 17919 78350 1 191 . 1 1 47 47 GLY N N 47 102.340 102.340 106.736 -4.396 17919 78351 1 191 . 1 1 47 47 GLY C C 47 173.810 173.810 174.166 -0.356 17919 78352 1 191 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.876 0.474 17919 78353 1 191 . 1 1 47 47 GLY H H 47 8.130 8.130 8.575 -0.445 17919 78354 1 191 . 1 1 48 48 LYS N N 48 121.570 121.570 121.782 -0.212 17919 78355 1 191 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.681 -0.059 17919 78356 1 191 . 1 1 48 48 LYS C C 48 174.700 174.700 175.546 -0.846 17919 78357 1 191 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.895 -0.345 17919 78358 1 191 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.611 -0.081 17919 78359 1 191 . 1 1 48 48 LYS H H 48 7.980 7.980 7.912 0.068 17919 78360 1 191 . 1 1 49 49 GLN N N 49 122.410 122.410 120.988 1.422 17919 78361 1 191 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.465 0.095 17919 78362 1 191 . 1 1 49 49 GLN C C 49 175.670 175.670 176.197 -0.527 17919 78363 1 191 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.249 -0.509 17919 78364 1 191 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.415 -0.415 17919 78365 1 191 . 1 1 49 49 GLN H H 49 8.600 8.600 8.391 0.209 17919 78366 1 191 . 1 1 50 50 LEU N N 50 125.520 125.520 126.761 -1.241 17919 78367 1 191 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.310 -0.220 17919 78368 1 191 . 1 1 50 50 LEU C C 50 176.660 176.660 176.884 -0.224 17919 78369 1 191 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.841 -0.601 17919 78370 1 191 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.942 -0.372 17919 78371 1 191 . 1 1 50 50 LEU H H 50 8.530 8.530 8.170 0.360 17919 78372 1 191 . 1 1 51 51 GLU N N 51 122.940 122.940 124.868 -1.928 17919 78373 1 191 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.388 0.100 17919 78374 1 191 . 1 1 51 51 GLU C C 51 175.870 175.870 177.269 -1.399 17919 78375 1 191 . 1 1 51 51 GLU CA C 51 55.960 55.960 56.403 -0.443 17919 78376 1 191 . 1 1 51 51 GLU CB C 51 31.570 31.570 30.466 1.104 17919 78377 1 191 . 1 1 51 51 GLU H H 51 8.400 8.400 8.495 -0.095 17919 78378 1 191 . 1 1 52 52 ASP N N 52 120.030 120.030 125.474 -5.444 17919 78379 1 191 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.408 -0.049 17919 78380 1 191 . 1 1 52 52 ASP C C 52 177.330 177.330 177.834 -0.504 17919 78381 1 191 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.753 -0.793 17919 78382 1 191 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.892 -0.042 17919 78383 1 191 . 1 1 52 52 ASP H H 52 8.160 8.160 8.894 -0.734 17919 78384 1 191 . 1 1 53 53 GLY N N 53 106.660 106.660 105.512 1.148 17919 78385 1 191 . 1 1 53 53 GLY C C 53 174.870 174.870 174.229 0.641 17919 78386 1 191 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.652 0.518 17919 78387 1 191 . 1 1 53 53 GLY H H 53 9.390 9.390 8.254 1.136 17919 78388 1 191 . 1 1 54 54 ARG N N 54 119.050 119.050 119.844 -0.794 17919 78389 1 191 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.681 0.014 17919 78390 1 191 . 1 1 54 54 ARG C C 54 175.350 175.350 175.746 -0.396 17919 78391 1 191 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.540 -0.150 17919 78392 1 191 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.203 0.447 17919 78393 1 191 . 1 1 54 54 ARG H H 54 7.460 7.460 7.299 0.161 17919 78394 1 191 . 1 1 55 55 THR N N 55 108.400 108.400 112.965 -4.565 17919 78395 1 191 . 1 1 55 55 THR HA H 55 5.240 5.240 4.937 0.303 17919 78396 1 191 . 1 1 55 55 THR C C 55 176.560 176.560 176.162 0.398 17919 78397 1 191 . 1 1 55 55 THR CA C 55 59.690 59.690 60.370 -0.680 17919 78398 1 191 . 1 1 55 55 THR CB C 55 72.260 72.260 70.436 1.824 17919 78399 1 191 . 1 1 55 55 THR H H 55 8.730 8.730 9.280 -0.550 17919 78400 1 191 . 1 1 56 56 LEU N N 56 117.920 117.920 120.771 -2.851 17919 78401 1 191 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.153 -0.093 17919 78402 1 191 . 1 1 56 56 LEU C C 56 180.810 180.810 178.969 1.841 17919 78403 1 191 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.111 0.599 17919 78404 1 191 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.447 -1.077 17919 78405 1 191 . 1 1 56 56 LEU H H 56 8.140 8.140 8.590 -0.450 17919 78406 1 191 . 1 1 57 57 SER N N 57 113.330 113.330 114.518 -1.188 17919 78407 1 191 . 1 1 57 57 SER HA H 57 4.370 4.370 4.151 0.219 17919 78408 1 191 . 1 1 57 57 SER C C 57 178.310 178.310 176.963 1.347 17919 78409 1 191 . 1 1 57 57 SER CA C 57 61.080 61.080 61.555 -0.475 17919 78410 1 191 . 1 1 57 57 SER CB C 57 62.530 62.530 62.782 -0.252 17919 78411 1 191 . 1 1 57 57 SER H H 57 8.470 8.470 8.425 0.045 17919 78412 1 191 . 1 1 58 58 ASP N N 58 124.190 124.190 122.020 2.170 17919 78413 1 191 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.373 -0.077 17919 78414 1 191 . 1 1 58 58 ASP C C 58 177.400 177.400 177.039 0.361 17919 78415 1 191 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.471 0.709 17919 78416 1 191 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.367 -0.267 17919 78417 1 191 . 1 1 58 58 ASP H H 58 7.930 7.930 7.999 -0.069 17919 78418 1 191 . 1 1 59 59 TYR N N 59 115.510 115.510 115.713 -0.203 17919 78419 1 191 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.654 0.016 17919 78420 1 191 . 1 1 59 59 TYR C C 59 174.700 174.700 174.814 -0.114 17919 78421 1 191 . 1 1 59 59 TYR CA C 59 58.250 58.250 56.947 1.303 17919 78422 1 191 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.271 1.799 17919 78423 1 191 . 1 1 59 59 TYR H H 59 7.250 7.250 7.429 -0.179 17919 78424 1 191 . 1 1 60 60 ASN N N 60 115.900 115.900 117.503 -1.603 17919 78425 1 191 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.369 -0.014 17919 78426 1 191 . 1 1 60 60 ASN C C 60 174.340 174.340 175.197 -0.857 17919 78427 1 191 . 1 1 60 60 ASN CA C 60 54.120 54.120 53.946 0.174 17919 78428 1 191 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.404 0.006 17919 78429 1 191 . 1 1 60 60 ASN H H 60 8.150 8.150 7.527 0.623 17919 78430 1 191 . 1 1 61 61 ILE N N 61 118.600 118.600 117.536 1.064 17919 78431 1 191 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.693 -0.300 17919 78432 1 191 . 1 1 61 61 ILE C C 61 174.610 174.610 176.257 -1.647 17919 78433 1 191 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.944 0.476 17919 78434 1 191 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.319 -0.579 17919 78435 1 191 . 1 1 61 61 ILE H H 61 7.250 7.250 7.449 -0.199 17919 78436 1 191 . 1 1 62 62 GLN N N 62 124.740 124.740 122.761 1.979 17919 78437 1 191 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.699 -0.193 17919 78438 1 191 . 1 1 62 62 GLN C C 62 175.970 175.970 175.611 0.359 17919 78439 1 191 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.990 -0.330 17919 78440 1 191 . 1 1 62 62 GLN CB C 62 31.650 31.650 32.164 -0.514 17919 78441 1 191 . 1 1 62 62 GLN H H 62 7.610 7.610 7.981 -0.371 17919 78442 1 191 . 1 1 63 63 LYS N N 63 120.300 120.300 121.033 -0.733 17919 78443 1 191 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.096 -0.095 17919 78444 1 191 . 1 1 63 63 LYS C C 63 175.810 175.810 177.155 -1.345 17919 78445 1 191 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.427 0.363 17919 78446 1 191 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.268 0.382 17919 78447 1 191 . 1 1 63 63 LYS H H 63 8.490 8.490 8.691 -0.201 17919 78448 1 191 . 1 1 64 64 GLU N N 64 113.950 113.950 119.735 -5.785 17919 78449 1 191 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.480 -0.015 17919 78450 1 191 . 1 1 64 64 GLU C C 64 175.250 175.250 176.286 -1.036 17919 78451 1 191 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.697 0.194 17919 78452 1 191 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.596 -2.696 17919 78453 1 191 . 1 1 64 64 GLU H H 64 9.280 9.280 9.029 0.251 17919 78454 1 191 . 1 1 65 65 SER N N 65 114.730 114.730 116.504 -1.774 17919 78455 1 191 . 1 1 65 65 SER HA H 65 4.640 4.640 4.355 0.285 17919 78456 1 191 . 1 1 65 65 SER C C 65 172.160 172.160 173.922 -1.762 17919 78457 1 191 . 1 1 65 65 SER CA C 65 60.890 60.890 60.799 0.091 17919 78458 1 191 . 1 1 65 65 SER CB C 65 64.910 64.910 63.642 1.268 17919 78459 1 191 . 1 1 65 65 SER H H 65 7.670 7.670 7.570 0.100 17919 78460 1 191 . 1 1 66 66 THR N N 66 117.110 117.110 120.099 -2.989 17919 78461 1 191 . 1 1 66 66 THR HA H 66 5.270 5.270 5.146 0.124 17919 78462 1 191 . 1 1 66 66 THR C C 66 173.950 173.950 174.239 -0.289 17919 78463 1 191 . 1 1 66 66 THR CA C 66 62.340 62.340 62.287 0.053 17919 78464 1 191 . 1 1 66 66 THR CB C 66 70.080 70.080 69.830 0.250 17919 78465 1 191 . 1 1 66 66 THR H H 66 8.730 8.730 8.302 0.428 17919 78466 1 191 . 1 1 67 67 LEU N N 67 127.110 127.110 127.155 -0.045 17919 78467 1 191 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.780 0.280 17919 78468 1 191 . 1 1 67 67 LEU C C 67 175.770 175.770 174.955 0.815 17919 78469 1 191 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.948 -0.048 17919 78470 1 191 . 1 1 67 67 LEU CB C 67 44.260 44.260 45.584 -1.324 17919 78471 1 191 . 1 1 67 67 LEU H H 67 9.410 9.410 8.976 0.434 17919 78472 1 191 . 1 1 68 68 HIS N N 68 118.380 118.380 123.479 -5.099 17919 78473 1 191 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.210 0.030 17919 78474 1 191 . 1 1 68 68 HIS C C 68 173.150 173.150 173.763 -0.613 17919 78475 1 191 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.283 0.717 17919 78476 1 191 . 1 1 68 68 HIS CB C 68 30.530 30.530 31.284 -0.754 17919 78477 1 191 . 1 1 68 68 HIS H H 68 9.230 9.230 9.260 -0.030 17919 78478 1 191 . 1 1 69 69 LEU N N 69 124.460 124.460 129.814 -5.354 17919 78479 1 191 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.967 0.223 17919 78480 1 191 . 1 1 69 69 LEU C C 69 175.270 175.270 174.295 0.975 17919 78481 1 191 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.311 0.579 17919 78482 1 191 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.284 0.096 17919 78483 1 191 . 1 1 69 69 LEU H H 69 8.340 8.340 8.712 -0.372 17919 78484 1 191 . 1 1 70 70 VAL N N 70 126.940 126.940 127.232 -0.292 17919 78485 1 191 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.379 -0.029 17919 78486 1 191 . 1 1 70 70 VAL C C 70 174.000 174.000 174.335 -0.335 17919 78487 1 191 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.835 -0.035 17919 78488 1 191 . 1 1 70 70 VAL CB C 70 34.910 34.910 34.303 0.607 17919 78489 1 191 . 1 1 70 70 VAL H H 70 9.200 9.200 8.922 0.278 17919 78490 1 191 . 1 1 71 71 LEU N N 71 123.130 123.130 123.448 -0.318 17919 78491 1 191 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.435 -0.375 17919 78492 1 191 . 1 1 71 71 LEU C C 71 177.830 177.830 176.678 1.152 17919 78493 1 191 . 1 1 71 71 LEU CA C 71 53.940 53.940 51.823 2.117 17919 78494 1 191 . 1 1 71 71 LEU CB C 71 42.850 42.850 44.689 -1.839 17919 78495 1 191 . 1 1 71 71 LEU H H 71 8.120 8.120 8.410 -0.290 17919 78496 1 191 . 1 1 72 72 ARG N N 72 123.490 123.490 118.200 5.290 17919 78497 1 191 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.588 -0.287 17919 78498 1 191 . 1 1 72 72 ARG C C 72 175.350 175.350 175.589 -0.239 17919 78499 1 191 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.184 0.426 17919 78500 1 191 . 1 1 72 72 ARG CB C 72 31.350 31.350 32.683 -1.333 17919 78501 1 191 . 1 1 72 72 ARG H H 72 8.580 8.580 8.467 0.113 17919 78502 1 192 . 1 1 2 2 GLN N N 2 123.220 123.220 121.373 1.847 17919 78503 1 192 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.158 0.091 17919 78504 1 192 . 1 1 2 2 GLN C C 2 175.920 175.920 175.079 0.841 17919 78505 1 192 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.981 0.099 17919 78506 1 192 . 1 1 2 2 GLN CB C 2 30.760 30.760 29.925 0.835 17919 78507 1 192 . 1 1 2 2 GLN H H 2 8.900 8.900 8.537 0.363 17919 78508 1 192 . 1 1 3 3 ILE N N 3 115.340 115.340 118.622 -3.282 17919 78509 1 192 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.777 -0.564 17919 78510 1 192 . 1 1 3 3 ILE C C 3 172.450 172.450 173.935 -1.485 17919 78511 1 192 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.005 0.565 17919 78512 1 192 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.885 0.325 17919 78513 1 192 . 1 1 3 3 ILE H H 3 8.320 8.320 8.885 -0.565 17919 78514 1 192 . 1 1 4 4 PHE N N 4 118.110 118.110 120.452 -2.342 17919 78515 1 192 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.244 0.386 17919 78516 1 192 . 1 1 4 4 PHE C C 4 175.320 175.320 174.797 0.523 17919 78517 1 192 . 1 1 4 4 PHE CA C 4 55.210 55.210 56.621 -1.411 17919 78518 1 192 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.205 -0.725 17919 78519 1 192 . 1 1 4 4 PHE H H 4 8.610 8.610 9.042 -0.432 17919 78520 1 192 . 1 1 5 5 VAL N N 5 121.000 121.000 124.141 -3.141 17919 78521 1 192 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.809 -0.084 17919 78522 1 192 . 1 1 5 5 VAL C C 5 174.870 174.870 174.477 0.393 17919 78523 1 192 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.606 -0.986 17919 78524 1 192 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.686 0.544 17919 78525 1 192 . 1 1 5 5 VAL H H 5 9.300 9.300 9.374 -0.074 17919 78526 1 192 . 1 1 6 6 LYS N N 6 127.520 127.520 129.046 -1.526 17919 78527 1 192 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.251 0.116 17919 78528 1 192 . 1 1 6 6 LYS C C 6 177.140 177.140 175.908 1.232 17919 78529 1 192 . 1 1 6 6 LYS CA C 6 54.520 54.520 53.735 0.785 17919 78530 1 192 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.713 -0.663 17919 78531 1 192 . 1 1 6 6 LYS H H 6 8.820 8.820 9.367 -0.547 17919 78532 1 192 . 1 1 7 7 THR N N 7 115.400 115.400 118.312 -2.912 17919 78533 1 192 . 1 1 7 7 THR HA H 7 4.970 4.970 5.164 -0.194 17919 78534 1 192 . 1 1 7 7 THR C C 7 176.910 176.910 176.094 0.816 17919 78535 1 192 . 1 1 7 7 THR CA C 7 60.470 60.470 60.080 0.390 17919 78536 1 192 . 1 1 7 7 THR CB C 7 70.630 70.630 70.626 0.004 17919 78537 1 192 . 1 1 7 7 THR H H 7 8.730 8.730 9.062 -0.332 17919 78538 1 192 . 1 1 8 8 LEU N N 8 121.330 121.330 120.959 0.371 17919 78539 1 192 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.462 -0.152 17919 78540 1 192 . 1 1 8 8 LEU C C 8 178.800 178.800 177.194 1.606 17919 78541 1 192 . 1 1 8 8 LEU CA C 8 57.580 57.580 56.617 0.963 17919 78542 1 192 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.391 -0.421 17919 78543 1 192 . 1 1 8 8 LEU H H 8 9.100 9.100 8.571 0.529 17919 78544 1 192 . 1 1 9 9 THR N N 9 105.590 105.590 109.672 -4.082 17919 78545 1 192 . 1 1 9 9 THR HA H 9 4.428 4.428 4.433 -0.005 17919 78546 1 192 . 1 1 9 9 THR C C 9 175.520 175.520 175.747 -0.227 17919 78547 1 192 . 1 1 9 9 THR CA C 9 61.400 61.400 60.992 0.408 17919 78548 1 192 . 1 1 9 9 THR CB C 9 69.140 69.140 68.995 0.145 17919 78549 1 192 . 1 1 9 9 THR H H 9 7.630 7.630 7.532 0.098 17919 78550 1 192 . 1 1 10 10 GLY N N 10 108.890 108.890 111.029 -2.139 17919 78551 1 192 . 1 1 10 10 GLY C C 10 174.070 174.070 173.888 0.182 17919 78552 1 192 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.926 -0.466 17919 78553 1 192 . 1 1 10 10 GLY H H 10 7.810 7.810 7.965 -0.155 17919 78554 1 192 . 1 1 11 11 LYS N N 11 121.600 121.600 120.171 1.429 17919 78555 1 192 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.536 -0.175 17919 78556 1 192 . 1 1 11 11 LYS C C 11 175.940 175.940 174.830 1.110 17919 78557 1 192 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.097 0.183 17919 78558 1 192 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.207 -0.007 17919 78559 1 192 . 1 1 11 11 LYS H H 11 7.280 7.280 7.483 -0.203 17919 78560 1 192 . 1 1 12 12 THR N N 12 120.440 120.440 116.559 3.881 17919 78561 1 192 . 1 1 12 12 THR HA H 12 5.046 5.046 5.379 -0.333 17919 78562 1 192 . 1 1 12 12 THR C C 12 174.320 174.320 174.390 -0.070 17919 78563 1 192 . 1 1 12 12 THR CA C 12 62.390 62.390 61.576 0.814 17919 78564 1 192 . 1 1 12 12 THR CB C 12 69.910 69.910 70.773 -0.863 17919 78565 1 192 . 1 1 12 12 THR H H 12 8.650 8.650 8.262 0.388 17919 78566 1 192 . 1 1 13 13 ILE N N 13 127.110 127.110 121.589 5.521 17919 78567 1 192 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.689 -0.145 17919 78568 1 192 . 1 1 13 13 ILE C C 13 175.220 175.220 174.650 0.570 17919 78569 1 192 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.292 0.688 17919 78570 1 192 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.340 -0.390 17919 78571 1 192 . 1 1 13 13 ILE H H 13 9.450 9.450 9.295 0.155 17919 78572 1 192 . 1 1 14 14 THR N N 14 121.520 121.520 118.210 3.310 17919 78573 1 192 . 1 1 14 14 THR HA H 14 4.964 4.964 4.852 0.112 17919 78574 1 192 . 1 1 14 14 THR C C 14 173.790 173.790 173.948 -0.158 17919 78575 1 192 . 1 1 14 14 THR CA C 14 61.940 61.940 60.405 1.535 17919 78576 1 192 . 1 1 14 14 THR CB C 14 69.650 69.650 69.695 -0.045 17919 78577 1 192 . 1 1 14 14 THR H H 14 8.710 8.710 8.312 0.398 17919 78578 1 192 . 1 1 15 15 LEU N N 15 124.800 124.800 128.107 -3.307 17919 78579 1 192 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.666 0.114 17919 78580 1 192 . 1 1 15 15 LEU C C 15 174.670 174.670 175.084 -0.414 17919 78581 1 192 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.579 -0.749 17919 78582 1 192 . 1 1 15 15 LEU CB C 15 47.070 47.070 44.757 2.313 17919 78583 1 192 . 1 1 15 15 LEU H H 15 8.710 8.710 8.834 -0.124 17919 78584 1 192 . 1 1 16 16 GLU N N 16 122.160 122.160 123.315 -1.155 17919 78585 1 192 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.165 -0.248 17919 78586 1 192 . 1 1 16 16 GLU C C 16 175.860 175.860 176.239 -0.379 17919 78587 1 192 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.407 -0.588 17919 78588 1 192 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.265 -0.815 17919 78589 1 192 . 1 1 16 16 GLU H H 16 8.140 8.140 8.656 -0.516 17919 78590 1 192 . 1 1 17 17 VAL N N 17 117.210 117.210 120.200 -2.990 17919 78591 1 192 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.525 0.189 17919 78592 1 192 . 1 1 17 17 VAL C C 17 174.160 174.160 174.330 -0.170 17919 78593 1 192 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.164 -0.734 17919 78594 1 192 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.287 1.113 17919 78595 1 192 . 1 1 17 17 VAL H H 17 8.900 8.900 8.946 -0.046 17919 78596 1 192 . 1 1 18 18 GLU N N 18 118.990 118.990 122.242 -3.252 17919 78597 1 192 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.811 0.268 17919 78598 1 192 . 1 1 18 18 GLU C C 18 176.160 176.160 175.798 0.362 17919 78599 1 192 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.353 0.367 17919 78600 1 192 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.838 -0.528 17919 78601 1 192 . 1 1 18 18 GLU H H 18 8.640 8.640 8.387 0.253 17919 78602 1 192 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.302 -0.161 17919 78603 1 192 . 1 1 19 19 PRO C C 19 175.310 175.310 176.943 -1.633 17919 78604 1 192 . 1 1 19 19 PRO CA C 19 65.470 65.470 64.634 0.836 17919 78605 1 192 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.845 0.105 17919 78606 1 192 . 1 1 20 20 SER N N 20 103.400 103.400 112.166 -8.766 17919 78607 1 192 . 1 1 20 20 SER HA H 20 4.370 4.370 4.470 -0.100 17919 78608 1 192 . 1 1 20 20 SER C C 20 174.660 174.660 174.637 0.023 17919 78609 1 192 . 1 1 20 20 SER CA C 20 57.400 57.400 58.755 -1.355 17919 78610 1 192 . 1 1 20 20 SER CB C 20 63.370 63.370 63.757 -0.387 17919 78611 1 192 . 1 1 20 20 SER H H 20 7.040 7.040 8.685 -1.645 17919 78612 1 192 . 1 1 21 21 ASP N N 21 123.480 123.480 123.694 -0.214 17919 78613 1 192 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.712 -0.017 17919 78614 1 192 . 1 1 21 21 ASP C C 21 176.360 176.360 175.619 0.741 17919 78615 1 192 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.514 1.186 17919 78616 1 192 . 1 1 21 21 ASP CB C 21 40.800 40.800 42.444 -1.644 17919 78617 1 192 . 1 1 21 21 ASP H H 21 8.030 8.030 7.736 0.294 17919 78618 1 192 . 1 1 22 22 THR N N 22 108.800 108.800 114.476 -5.676 17919 78619 1 192 . 1 1 22 22 THR HA H 22 4.920 4.920 4.785 0.136 17919 78620 1 192 . 1 1 22 22 THR C C 22 176.750 176.750 176.217 0.533 17919 78621 1 192 . 1 1 22 22 THR CA C 22 59.690 59.690 61.168 -1.478 17919 78622 1 192 . 1 1 22 22 THR CB C 22 71.200 71.200 70.662 0.538 17919 78623 1 192 . 1 1 22 22 THR H H 22 7.900 7.900 8.180 -0.280 17919 78624 1 192 . 1 1 23 23 ILE N N 23 121.190 121.190 122.086 -0.896 17919 78625 1 192 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.824 -0.167 17919 78626 1 192 . 1 1 23 23 ILE C C 23 179.040 179.040 177.851 1.189 17919 78627 1 192 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.038 0.222 17919 78628 1 192 . 1 1 23 23 ILE CB C 23 34.350 34.350 35.976 -1.626 17919 78629 1 192 . 1 1 23 23 ILE H H 23 8.560 8.560 9.097 -0.537 17919 78630 1 192 . 1 1 24 24 GLU N N 24 120.830 120.830 121.526 -0.696 17919 78631 1 192 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.844 0.073 17919 78632 1 192 . 1 1 24 24 GLU C C 24 178.640 178.640 178.715 -0.075 17919 78633 1 192 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.334 -0.114 17919 78634 1 192 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.424 -1.144 17919 78635 1 192 . 1 1 24 24 GLU H H 24 9.760 9.760 8.237 1.523 17919 78636 1 192 . 1 1 25 25 ASN N N 25 120.570 120.570 118.052 2.518 17919 78637 1 192 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.487 0.038 17919 78638 1 192 . 1 1 25 25 ASN C C 25 178.380 178.380 178.067 0.313 17919 78639 1 192 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.799 0.261 17919 78640 1 192 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.044 0.407 17919 78641 1 192 . 1 1 25 25 ASN H H 25 7.920 7.920 7.679 0.241 17919 78642 1 192 . 1 1 26 26 VAL N N 26 121.710 121.710 119.969 1.741 17919 78643 1 192 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.586 -0.189 17919 78644 1 192 . 1 1 26 26 VAL C C 26 177.950 177.950 177.933 0.017 17919 78645 1 192 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.642 1.018 17919 78646 1 192 . 1 1 26 26 VAL CB C 26 30.840 30.840 30.822 0.018 17919 78647 1 192 . 1 1 26 26 VAL H H 26 8.070 8.070 8.240 -0.170 17919 78648 1 192 . 1 1 27 27 LYS N N 27 118.860 118.860 119.757 -0.897 17919 78649 1 192 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.206 0.374 17919 78650 1 192 . 1 1 27 27 LYS C C 27 180.550 180.550 179.276 1.274 17919 78651 1 192 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.575 -0.325 17919 78652 1 192 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.085 1.645 17919 78653 1 192 . 1 1 27 27 LYS H H 27 8.560 8.560 7.856 0.704 17919 78654 1 192 . 1 1 28 28 ALA N N 28 123.440 123.440 122.940 0.500 17919 78655 1 192 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.135 0.025 17919 78656 1 192 . 1 1 28 28 ALA C C 28 180.300 180.300 178.934 1.366 17919 78657 1 192 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.907 0.463 17919 78658 1 192 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.442 -0.732 17919 78659 1 192 . 1 1 28 28 ALA H H 28 8.060 8.060 8.302 -0.242 17919 78660 1 192 . 1 1 29 29 LYS N N 29 119.940 119.940 119.772 0.168 17919 78661 1 192 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.000 0.207 17919 78662 1 192 . 1 1 29 29 LYS C C 29 180.320 180.320 178.966 1.354 17919 78663 1 192 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.452 0.198 17919 78664 1 192 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.370 0.920 17919 78665 1 192 . 1 1 29 29 LYS H H 29 7.850 7.850 7.751 0.099 17919 78666 1 192 . 1 1 30 30 ILE N N 30 121.080 121.080 119.701 1.379 17919 78667 1 192 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.610 -0.103 17919 78668 1 192 . 1 1 30 30 ILE C C 30 178.310 178.310 177.396 0.914 17919 78669 1 192 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.192 0.958 17919 78670 1 192 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.895 -1.095 17919 78671 1 192 . 1 1 30 30 ILE H H 30 8.280 8.280 8.329 -0.049 17919 78672 1 192 . 1 1 31 31 GLN N N 31 123.490 123.490 120.788 2.702 17919 78673 1 192 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.078 -0.249 17919 78674 1 192 . 1 1 31 31 GLN C C 31 178.890 178.890 178.733 0.157 17919 78675 1 192 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.042 0.958 17919 78676 1 192 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.535 -0.815 17919 78677 1 192 . 1 1 31 31 GLN H H 31 8.580 8.580 8.107 0.473 17919 78678 1 192 . 1 1 32 32 ASP N N 32 119.360 119.360 120.179 -0.819 17919 78679 1 192 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.361 -0.007 17919 78680 1 192 . 1 1 32 32 ASP C C 32 177.250 177.250 178.023 -0.773 17919 78681 1 192 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.934 0.256 17919 78682 1 192 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.873 -0.293 17919 78683 1 192 . 1 1 32 32 ASP H H 32 8.010 8.010 8.386 -0.376 17919 78684 1 192 . 1 1 33 33 LYS N N 33 115.130 115.130 118.829 -3.699 17919 78685 1 192 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.209 0.128 17919 78686 1 192 . 1 1 33 33 LYS C C 33 177.870 177.870 178.502 -0.632 17919 78687 1 192 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.181 -0.131 17919 78688 1 192 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.103 1.067 17919 78689 1 192 . 1 1 33 33 LYS H H 33 7.430 7.430 7.595 -0.165 17919 78690 1 192 . 1 1 34 34 GLU N N 34 113.870 113.870 113.846 0.024 17919 78691 1 192 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.502 0.123 17919 78692 1 192 . 1 1 34 34 GLU C C 34 177.840 177.840 176.479 1.361 17919 78693 1 192 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.980 -0.810 17919 78694 1 192 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.527 1.133 17919 78695 1 192 . 1 1 34 34 GLU H H 34 8.740 8.740 8.127 0.613 17919 78696 1 192 . 1 1 35 35 GLY N N 35 108.650 108.650 108.720 -0.070 17919 78697 1 192 . 1 1 35 35 GLY C C 35 173.960 173.960 174.513 -0.553 17919 78698 1 192 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.895 0.185 17919 78699 1 192 . 1 1 35 35 GLY H H 35 8.530 8.530 8.077 0.453 17919 78700 1 192 . 1 1 36 36 ILE N N 36 119.880 119.880 122.396 -2.516 17919 78701 1 192 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.368 0.077 17919 78702 1 192 . 1 1 36 36 ILE C C 36 173.590 173.590 174.188 -0.598 17919 78703 1 192 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.025 -0.275 17919 78704 1 192 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.632 1.948 17919 78705 1 192 . 1 1 36 36 ILE H H 36 6.150 6.150 7.707 -1.557 17919 78706 1 192 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.821 -0.187 17919 78707 1 192 . 1 1 37 37 PRO C C 37 176.940 176.940 176.228 0.712 17919 78708 1 192 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.410 0.251 17919 78709 1 192 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.461 0.389 17919 78710 1 192 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.157 -0.040 17919 78711 1 192 . 1 1 38 38 PRO C C 38 178.320 178.320 178.847 -0.527 17919 78712 1 192 . 1 1 38 38 PRO CA C 38 66.260 66.260 66.000 0.260 17919 78713 1 192 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.771 1.119 17919 78714 1 192 . 1 1 39 39 ASP N N 39 113.380 113.380 116.835 -3.455 17919 78715 1 192 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.348 0.082 17919 78716 1 192 . 1 1 39 39 ASP C C 39 177.090 177.090 177.648 -0.558 17919 78717 1 192 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.795 -1.155 17919 78718 1 192 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.456 -0.916 17919 78719 1 192 . 1 1 39 39 ASP H H 39 8.550 8.550 8.585 -0.035 17919 78720 1 192 . 1 1 40 40 GLN N N 40 116.780 116.780 116.435 0.345 17919 78721 1 192 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.344 0.120 17919 78722 1 192 . 1 1 40 40 GLN C C 40 175.380 175.380 176.074 -0.694 17919 78723 1 192 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.029 -0.389 17919 78724 1 192 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.324 0.816 17919 78725 1 192 . 1 1 40 40 GLN H H 40 7.820 7.820 8.404 -0.584 17919 78726 1 192 . 1 1 41 41 GLN N N 41 117.720 117.720 119.037 -1.317 17919 78727 1 192 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.388 -0.144 17919 78728 1 192 . 1 1 41 41 GLN C C 41 176.300 176.300 175.579 0.721 17919 78729 1 192 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.199 0.271 17919 78730 1 192 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.878 1.772 17919 78731 1 192 . 1 1 41 41 GLN H H 41 7.480 7.480 7.255 0.225 17919 78732 1 192 . 1 1 42 42 ARG N N 42 122.680 122.680 125.355 -2.675 17919 78733 1 192 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.606 -0.106 17919 78734 1 192 . 1 1 42 42 ARG C C 42 174.050 174.050 173.739 0.311 17919 78735 1 192 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.688 0.362 17919 78736 1 192 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.678 -0.928 17919 78737 1 192 . 1 1 42 42 ARG H H 42 8.530 8.530 9.195 -0.665 17919 78738 1 192 . 1 1 43 43 LEU N N 43 124.040 124.040 127.437 -3.397 17919 78739 1 192 . 1 1 43 43 LEU C C 43 175.290 175.290 175.613 -0.323 17919 78740 1 192 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.534 -1.554 17919 78741 1 192 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.517 2.273 17919 78742 1 192 . 1 1 43 43 LEU H H 43 8.820 8.820 8.709 0.111 17919 78743 1 192 . 1 1 44 44 ILE N N 44 121.920 121.920 122.475 -0.555 17919 78744 1 192 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.968 0.024 17919 78745 1 192 . 1 1 44 44 ILE C C 44 176.060 176.060 174.100 1.960 17919 78746 1 192 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.981 -1.001 17919 78747 1 192 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.955 -0.535 17919 78748 1 192 . 1 1 44 44 ILE H H 44 9.030 9.030 9.157 -0.127 17919 78749 1 192 . 1 1 45 45 PHE N N 45 125.390 125.390 126.201 -0.811 17919 78750 1 192 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.040 0.005 17919 78751 1 192 . 1 1 45 45 PHE C C 45 174.470 174.470 174.317 0.153 17919 78752 1 192 . 1 1 45 45 PHE CA C 45 57.020 57.020 55.954 1.066 17919 78753 1 192 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.061 0.699 17919 78754 1 192 . 1 1 45 45 PHE H H 45 8.830 8.830 9.107 -0.277 17919 78755 1 192 . 1 1 46 46 ALA N N 46 132.200 132.200 130.076 2.124 17919 78756 1 192 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.626 0.064 17919 78757 1 192 . 1 1 46 46 ALA C C 46 177.290 177.290 177.082 0.208 17919 78758 1 192 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.824 -0.284 17919 78759 1 192 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.191 0.379 17919 78760 1 192 . 1 1 46 46 ALA H H 46 8.810 8.810 9.132 -0.322 17919 78761 1 192 . 1 1 47 47 GLY N N 47 102.340 102.340 105.186 -2.846 17919 78762 1 192 . 1 1 47 47 GLY C C 47 173.810 173.810 174.607 -0.797 17919 78763 1 192 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.437 -0.087 17919 78764 1 192 . 1 1 47 47 GLY H H 47 8.130 8.130 8.548 -0.418 17919 78765 1 192 . 1 1 48 48 LYS N N 48 121.570 121.570 121.601 -0.031 17919 78766 1 192 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.650 -0.028 17919 78767 1 192 . 1 1 48 48 LYS C C 48 174.700 174.700 175.335 -0.635 17919 78768 1 192 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.878 -0.328 17919 78769 1 192 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.598 -0.068 17919 78770 1 192 . 1 1 48 48 LYS H H 48 7.980 7.980 8.088 -0.108 17919 78771 1 192 . 1 1 49 49 GLN N N 49 122.410 122.410 122.202 0.208 17919 78772 1 192 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.312 0.248 17919 78773 1 192 . 1 1 49 49 GLN C C 49 175.670 175.670 175.583 0.087 17919 78774 1 192 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.087 -0.347 17919 78775 1 192 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.365 -0.365 17919 78776 1 192 . 1 1 49 49 GLN H H 49 8.600 8.600 8.462 0.138 17919 78777 1 192 . 1 1 50 50 LEU N N 50 125.520 125.520 128.507 -2.987 17919 78778 1 192 . 1 1 50 50 LEU HA H 50 4.090 4.090 3.935 0.155 17919 78779 1 192 . 1 1 50 50 LEU C C 50 176.660 176.660 175.763 0.897 17919 78780 1 192 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.877 0.363 17919 78781 1 192 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.277 -0.707 17919 78782 1 192 . 1 1 50 50 LEU H H 50 8.530 8.530 8.210 0.320 17919 78783 1 192 . 1 1 51 51 GLU N N 51 122.940 122.940 122.447 0.493 17919 78784 1 192 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.572 -0.084 17919 78785 1 192 . 1 1 51 51 GLU C C 51 175.870 175.870 176.795 -0.925 17919 78786 1 192 . 1 1 51 51 GLU CA C 51 55.960 55.960 54.945 1.015 17919 78787 1 192 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.332 -0.762 17919 78788 1 192 . 1 1 51 51 GLU H H 51 8.400 8.400 7.791 0.609 17919 78789 1 192 . 1 1 52 52 ASP N N 52 120.030 120.030 122.981 -2.951 17919 78790 1 192 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.491 -0.132 17919 78791 1 192 . 1 1 52 52 ASP C C 52 177.330 177.330 177.428 -0.098 17919 78792 1 192 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.039 -0.079 17919 78793 1 192 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.850 0.000 17919 78794 1 192 . 1 1 52 52 ASP H H 52 8.160 8.160 8.826 -0.666 17919 78795 1 192 . 1 1 53 53 GLY N N 53 106.660 106.660 105.033 1.627 17919 78796 1 192 . 1 1 53 53 GLY C C 53 174.870 174.870 173.897 0.973 17919 78797 1 192 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.772 0.398 17919 78798 1 192 . 1 1 53 53 GLY H H 53 9.390 9.390 8.489 0.901 17919 78799 1 192 . 1 1 54 54 ARG N N 54 119.050 119.050 120.418 -1.368 17919 78800 1 192 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.735 -0.040 17919 78801 1 192 . 1 1 54 54 ARG C C 54 175.350 175.350 175.143 0.207 17919 78802 1 192 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.098 0.292 17919 78803 1 192 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.761 -1.111 17919 78804 1 192 . 1 1 54 54 ARG H H 54 7.460 7.460 7.467 -0.007 17919 78805 1 192 . 1 1 55 55 THR N N 55 108.400 108.400 110.932 -2.532 17919 78806 1 192 . 1 1 55 55 THR HA H 55 5.240 5.240 5.146 0.094 17919 78807 1 192 . 1 1 55 55 THR C C 55 176.560 176.560 176.234 0.326 17919 78808 1 192 . 1 1 55 55 THR CA C 55 59.690 59.690 59.867 -0.177 17919 78809 1 192 . 1 1 55 55 THR CB C 55 72.260 72.260 71.559 0.701 17919 78810 1 192 . 1 1 55 55 THR H H 55 8.730 8.730 9.234 -0.504 17919 78811 1 192 . 1 1 56 56 LEU N N 56 117.920 117.920 120.183 -2.263 17919 78812 1 192 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.110 -0.050 17919 78813 1 192 . 1 1 56 56 LEU C C 56 180.810 180.810 178.868 1.942 17919 78814 1 192 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.448 0.262 17919 78815 1 192 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.478 -1.108 17919 78816 1 192 . 1 1 56 56 LEU H H 56 8.140 8.140 8.987 -0.847 17919 78817 1 192 . 1 1 57 57 SER N N 57 113.330 113.330 113.773 -0.443 17919 78818 1 192 . 1 1 57 57 SER HA H 57 4.370 4.370 4.262 0.108 17919 78819 1 192 . 1 1 57 57 SER C C 57 178.310 178.310 176.354 1.956 17919 78820 1 192 . 1 1 57 57 SER CA C 57 61.080 61.080 61.235 -0.155 17919 78821 1 192 . 1 1 57 57 SER CB C 57 62.530 62.530 62.539 -0.010 17919 78822 1 192 . 1 1 57 57 SER H H 57 8.470 8.470 8.146 0.324 17919 78823 1 192 . 1 1 58 58 ASP N N 58 124.190 124.190 123.595 0.595 17919 78824 1 192 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.275 0.021 17919 78825 1 192 . 1 1 58 58 ASP C C 58 177.400 177.400 177.115 0.285 17919 78826 1 192 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.494 0.686 17919 78827 1 192 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.224 -0.124 17919 78828 1 192 . 1 1 58 58 ASP H H 58 7.930 7.930 7.619 0.311 17919 78829 1 192 . 1 1 59 59 TYR N N 59 115.510 115.510 115.736 -0.226 17919 78830 1 192 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.556 0.114 17919 78831 1 192 . 1 1 59 59 TYR C C 59 174.700 174.700 175.099 -0.399 17919 78832 1 192 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.522 0.728 17919 78833 1 192 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.195 1.875 17919 78834 1 192 . 1 1 59 59 TYR H H 59 7.250 7.250 7.311 -0.061 17919 78835 1 192 . 1 1 60 60 ASN N N 60 115.900 115.900 116.021 -0.121 17919 78836 1 192 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.409 -0.054 17919 78837 1 192 . 1 1 60 60 ASN C C 60 174.340 174.340 174.826 -0.486 17919 78838 1 192 . 1 1 60 60 ASN CA C 60 54.120 54.120 53.854 0.266 17919 78839 1 192 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.531 -0.121 17919 78840 1 192 . 1 1 60 60 ASN H H 60 8.150 8.150 7.465 0.685 17919 78841 1 192 . 1 1 61 61 ILE N N 61 118.600 118.600 118.577 0.023 17919 78842 1 192 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.706 -0.313 17919 78843 1 192 . 1 1 61 61 ILE C C 61 174.610 174.610 175.283 -0.673 17919 78844 1 192 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.008 0.412 17919 78845 1 192 . 1 1 61 61 ILE CB C 61 36.740 36.740 38.395 -1.655 17919 78846 1 192 . 1 1 61 61 ILE H H 61 7.250 7.250 8.058 -0.808 17919 78847 1 192 . 1 1 62 62 GLN N N 62 124.740 124.740 122.461 2.279 17919 78848 1 192 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.616 -0.110 17919 78849 1 192 . 1 1 62 62 GLN C C 62 175.970 175.970 176.115 -0.145 17919 78850 1 192 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.294 0.366 17919 78851 1 192 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.195 0.455 17919 78852 1 192 . 1 1 62 62 GLN H H 62 7.610 7.610 8.008 -0.398 17919 78853 1 192 . 1 1 63 63 LYS N N 63 120.300 120.300 122.801 -2.501 17919 78854 1 192 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.018 -0.017 17919 78855 1 192 . 1 1 63 63 LYS C C 63 175.810 175.810 176.997 -1.187 17919 78856 1 192 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.332 -0.542 17919 78857 1 192 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.542 0.108 17919 78858 1 192 . 1 1 63 63 LYS H H 63 8.490 8.490 8.773 -0.283 17919 78859 1 192 . 1 1 64 64 GLU N N 64 113.950 113.950 120.741 -6.791 17919 78860 1 192 . 1 1 64 64 GLU HA H 64 3.465 3.465 4.088 -0.623 17919 78861 1 192 . 1 1 64 64 GLU C C 64 175.250 175.250 176.343 -1.093 17919 78862 1 192 . 1 1 64 64 GLU CA C 64 57.890 57.890 58.221 -0.331 17919 78863 1 192 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.494 -2.594 17919 78864 1 192 . 1 1 64 64 GLU H H 64 9.280 9.280 9.108 0.172 17919 78865 1 192 . 1 1 65 65 SER N N 65 114.730 114.730 114.250 0.480 17919 78866 1 192 . 1 1 65 65 SER HA H 65 4.640 4.640 4.517 0.123 17919 78867 1 192 . 1 1 65 65 SER C C 65 172.160 172.160 174.043 -1.883 17919 78868 1 192 . 1 1 65 65 SER CA C 65 60.890 60.890 59.770 1.120 17919 78869 1 192 . 1 1 65 65 SER CB C 65 64.910 64.910 64.510 0.400 17919 78870 1 192 . 1 1 65 65 SER H H 65 7.670 7.670 7.899 -0.229 17919 78871 1 192 . 1 1 66 66 THR N N 66 117.110 117.110 118.125 -1.015 17919 78872 1 192 . 1 1 66 66 THR HA H 66 5.270 5.270 5.525 -0.255 17919 78873 1 192 . 1 1 66 66 THR C C 66 173.950 173.950 173.939 0.011 17919 78874 1 192 . 1 1 66 66 THR CA C 66 62.340 62.340 61.965 0.375 17919 78875 1 192 . 1 1 66 66 THR CB C 66 70.080 70.080 70.362 -0.282 17919 78876 1 192 . 1 1 66 66 THR H H 66 8.730 8.730 8.410 0.320 17919 78877 1 192 . 1 1 67 67 LEU N N 67 127.110 127.110 127.315 -0.205 17919 78878 1 192 . 1 1 67 67 LEU HA H 67 5.060 5.060 5.033 0.027 17919 78879 1 192 . 1 1 67 67 LEU C C 67 175.770 175.770 175.272 0.498 17919 78880 1 192 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.204 -0.304 17919 78881 1 192 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.282 -0.022 17919 78882 1 192 . 1 1 67 67 LEU H H 67 9.410 9.410 9.288 0.122 17919 78883 1 192 . 1 1 68 68 HIS N N 68 118.380 118.380 123.056 -4.676 17919 78884 1 192 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.438 -0.198 17919 78885 1 192 . 1 1 68 68 HIS C C 68 173.150 173.150 173.558 -0.408 17919 78886 1 192 . 1 1 68 68 HIS CA C 68 55.000 55.000 53.862 1.138 17919 78887 1 192 . 1 1 68 68 HIS CB C 68 30.530 30.530 31.584 -1.054 17919 78888 1 192 . 1 1 68 68 HIS H H 68 9.230 9.230 9.314 -0.084 17919 78889 1 192 . 1 1 69 69 LEU N N 69 124.460 124.460 130.168 -5.708 17919 78890 1 192 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.959 0.231 17919 78891 1 192 . 1 1 69 69 LEU C C 69 175.270 175.270 174.012 1.258 17919 78892 1 192 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.745 0.145 17919 78893 1 192 . 1 1 69 69 LEU CB C 69 44.380 44.380 45.033 -0.653 17919 78894 1 192 . 1 1 69 69 LEU H H 69 8.340 8.340 9.092 -0.752 17919 78895 1 192 . 1 1 70 70 VAL N N 70 126.940 126.940 126.014 0.926 17919 78896 1 192 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.307 0.043 17919 78897 1 192 . 1 1 70 70 VAL C C 70 174.000 174.000 174.330 -0.330 17919 78898 1 192 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.210 0.590 17919 78899 1 192 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.372 -0.462 17919 78900 1 192 . 1 1 70 70 VAL H H 70 9.200 9.200 8.909 0.291 17919 78901 1 192 . 1 1 71 71 LEU N N 71 123.130 123.130 124.869 -1.739 17919 78902 1 192 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.197 -0.137 17919 78903 1 192 . 1 1 71 71 LEU C C 71 177.830 177.830 177.235 0.595 17919 78904 1 192 . 1 1 71 71 LEU CA C 71 53.940 53.940 54.073 -0.133 17919 78905 1 192 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.837 0.014 17919 78906 1 192 . 1 1 71 71 LEU H H 71 8.120 8.120 8.302 -0.182 17919 78907 1 192 . 1 1 72 72 ARG N N 72 123.490 123.490 124.092 -0.602 17919 78908 1 192 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.425 -0.124 17919 78909 1 192 . 1 1 72 72 ARG C C 72 175.350 175.350 175.246 0.104 17919 78910 1 192 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.538 0.072 17919 78911 1 192 . 1 1 72 72 ARG CB C 72 31.350 31.350 31.181 0.169 17919 78912 1 192 . 1 1 72 72 ARG H H 72 8.580 8.580 8.633 -0.053 17919 78913 1 193 . 1 1 2 2 GLN N N 2 123.220 123.220 125.584 -2.364 17919 78914 1 193 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.176 0.073 17919 78915 1 193 . 1 1 2 2 GLN C C 2 175.920 175.920 175.745 0.175 17919 78916 1 193 . 1 1 2 2 GLN CA C 2 55.080 55.080 53.901 1.179 17919 78917 1 193 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.008 0.752 17919 78918 1 193 . 1 1 2 2 GLN H H 2 8.900 8.900 8.536 0.364 17919 78919 1 193 . 1 1 3 3 ILE N N 3 115.340 115.340 115.202 0.138 17919 78920 1 193 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.518 -0.305 17919 78921 1 193 . 1 1 3 3 ILE C C 3 172.450 172.450 173.269 -0.819 17919 78922 1 193 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.648 -0.078 17919 78923 1 193 . 1 1 3 3 ILE CB C 3 42.210 42.210 42.280 -0.070 17919 78924 1 193 . 1 1 3 3 ILE H H 3 8.320 8.320 7.981 0.339 17919 78925 1 193 . 1 1 4 4 PHE N N 4 118.110 118.110 119.677 -1.567 17919 78926 1 193 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.426 0.204 17919 78927 1 193 . 1 1 4 4 PHE C C 4 175.320 175.320 175.251 0.069 17919 78928 1 193 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.681 -0.471 17919 78929 1 193 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.260 -0.780 17919 78930 1 193 . 1 1 4 4 PHE H H 4 8.610 8.610 8.681 -0.071 17919 78931 1 193 . 1 1 5 5 VAL N N 5 121.000 121.000 121.709 -0.709 17919 78932 1 193 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.783 -0.058 17919 78933 1 193 . 1 1 5 5 VAL C C 5 174.870 174.870 174.226 0.644 17919 78934 1 193 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.298 -0.678 17919 78935 1 193 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.768 -0.538 17919 78936 1 193 . 1 1 5 5 VAL H H 5 9.300 9.300 9.328 -0.028 17919 78937 1 193 . 1 1 6 6 LYS N N 6 127.520 127.520 128.568 -1.048 17919 78938 1 193 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.480 -0.113 17919 78939 1 193 . 1 1 6 6 LYS C C 6 177.140 177.140 176.003 1.137 17919 78940 1 193 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.114 0.406 17919 78941 1 193 . 1 1 6 6 LYS CB C 6 35.050 35.050 36.134 -1.084 17919 78942 1 193 . 1 1 6 6 LYS H H 6 8.820 8.820 9.225 -0.405 17919 78943 1 193 . 1 1 7 7 THR N N 7 115.400 115.400 118.621 -3.221 17919 78944 1 193 . 1 1 7 7 THR HA H 7 4.970 4.970 5.039 -0.069 17919 78945 1 193 . 1 1 7 7 THR C C 7 176.910 176.910 176.316 0.594 17919 78946 1 193 . 1 1 7 7 THR CA C 7 60.470 60.470 60.778 -0.308 17919 78947 1 193 . 1 1 7 7 THR CB C 7 70.630 70.630 70.642 -0.012 17919 78948 1 193 . 1 1 7 7 THR H H 7 8.730 8.730 8.894 -0.164 17919 78949 1 193 . 1 1 8 8 LEU N N 8 121.330 121.330 124.397 -3.067 17919 78950 1 193 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.208 0.102 17919 78951 1 193 . 1 1 8 8 LEU C C 8 178.800 178.800 177.568 1.232 17919 78952 1 193 . 1 1 8 8 LEU CA C 8 57.580 57.580 56.999 0.581 17919 78953 1 193 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.978 -0.008 17919 78954 1 193 . 1 1 8 8 LEU H H 8 9.100 9.100 8.867 0.233 17919 78955 1 193 . 1 1 9 9 THR N N 9 105.590 105.590 108.699 -3.109 17919 78956 1 193 . 1 1 9 9 THR HA H 9 4.428 4.428 4.344 0.084 17919 78957 1 193 . 1 1 9 9 THR C C 9 175.520 175.520 175.488 0.032 17919 78958 1 193 . 1 1 9 9 THR CA C 9 61.400 61.400 61.785 -0.385 17919 78959 1 193 . 1 1 9 9 THR CB C 9 69.140 69.140 69.658 -0.518 17919 78960 1 193 . 1 1 9 9 THR H H 9 7.630 7.630 7.735 -0.105 17919 78961 1 193 . 1 1 10 10 GLY N N 10 108.890 108.890 110.743 -1.853 17919 78962 1 193 . 1 1 10 10 GLY C C 10 174.070 174.070 173.890 0.180 17919 78963 1 193 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.838 0.622 17919 78964 1 193 . 1 1 10 10 GLY H H 10 7.810 7.810 7.935 -0.125 17919 78965 1 193 . 1 1 11 11 LYS N N 11 121.600 121.600 121.850 -0.250 17919 78966 1 193 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.363 -0.002 17919 78967 1 193 . 1 1 11 11 LYS C C 11 175.940 175.940 175.572 0.368 17919 78968 1 193 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.291 -0.011 17919 78969 1 193 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.701 -0.501 17919 78970 1 193 . 1 1 11 11 LYS H H 11 7.280 7.280 7.594 -0.314 17919 78971 1 193 . 1 1 12 12 THR N N 12 120.440 120.440 120.368 0.072 17919 78972 1 193 . 1 1 12 12 THR HA H 12 5.046 5.046 5.004 0.042 17919 78973 1 193 . 1 1 12 12 THR C C 12 174.320 174.320 173.823 0.497 17919 78974 1 193 . 1 1 12 12 THR CA C 12 62.390 62.390 61.468 0.922 17919 78975 1 193 . 1 1 12 12 THR CB C 12 69.910 69.910 70.250 -0.340 17919 78976 1 193 . 1 1 12 12 THR H H 12 8.650 8.650 8.344 0.306 17919 78977 1 193 . 1 1 13 13 ILE N N 13 127.110 127.110 128.613 -1.503 17919 78978 1 193 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.498 0.046 17919 78979 1 193 . 1 1 13 13 ILE C C 13 175.220 175.220 174.824 0.396 17919 78980 1 193 . 1 1 13 13 ILE CA C 13 59.980 59.980 58.590 1.391 17919 78981 1 193 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.091 0.859 17919 78982 1 193 . 1 1 13 13 ILE H H 13 9.450 9.450 9.307 0.143 17919 78983 1 193 . 1 1 14 14 THR N N 14 121.520 121.520 123.629 -2.109 17919 78984 1 193 . 1 1 14 14 THR HA H 14 4.964 4.964 5.005 -0.041 17919 78985 1 193 . 1 1 14 14 THR C C 14 173.790 173.790 173.610 0.180 17919 78986 1 193 . 1 1 14 14 THR CA C 14 61.940 61.940 61.827 0.113 17919 78987 1 193 . 1 1 14 14 THR CB C 14 69.650 69.650 70.228 -0.578 17919 78988 1 193 . 1 1 14 14 THR H H 14 8.710 8.710 8.425 0.285 17919 78989 1 193 . 1 1 15 15 LEU N N 15 124.800 124.800 126.593 -1.793 17919 78990 1 193 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.748 0.032 17919 78991 1 193 . 1 1 15 15 LEU C C 15 174.670 174.670 175.245 -0.575 17919 78992 1 193 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.292 -0.462 17919 78993 1 193 . 1 1 15 15 LEU CB C 15 47.070 47.070 46.148 0.922 17919 78994 1 193 . 1 1 15 15 LEU H H 15 8.710 8.710 8.806 -0.096 17919 78995 1 193 . 1 1 16 16 GLU N N 16 122.160 122.160 121.908 0.252 17919 78996 1 193 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.145 -0.228 17919 78997 1 193 . 1 1 16 16 GLU C C 16 175.860 175.860 175.922 -0.062 17919 78998 1 193 . 1 1 16 16 GLU CA C 16 54.820 54.820 54.897 -0.076 17919 78999 1 193 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.660 -1.210 17919 79000 1 193 . 1 1 16 16 GLU H H 16 8.140 8.140 8.476 -0.336 17919 79001 1 193 . 1 1 17 17 VAL N N 17 117.210 117.210 117.400 -0.190 17919 79002 1 193 . 1 1 17 17 VAL HA H 17 4.714 4.714 5.070 -0.356 17919 79003 1 193 . 1 1 17 17 VAL C C 17 174.160 174.160 174.934 -0.774 17919 79004 1 193 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.689 -0.259 17919 79005 1 193 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.870 0.530 17919 79006 1 193 . 1 1 17 17 VAL H H 17 8.900 8.900 8.913 -0.013 17919 79007 1 193 . 1 1 18 18 GLU N N 18 118.990 118.990 120.707 -1.717 17919 79008 1 193 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.799 0.280 17919 79009 1 193 . 1 1 18 18 GLU C C 18 176.160 176.160 175.023 1.137 17919 79010 1 193 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.734 -0.014 17919 79011 1 193 . 1 1 18 18 GLU CB C 18 30.310 30.310 31.043 -0.733 17919 79012 1 193 . 1 1 18 18 GLU H H 18 8.640 8.640 8.860 -0.220 17919 79013 1 193 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.247 -0.106 17919 79014 1 193 . 1 1 19 19 PRO C C 19 175.310 175.310 177.483 -2.173 17919 79015 1 193 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.607 -0.137 17919 79016 1 193 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.927 0.023 17919 79017 1 193 . 1 1 20 20 SER N N 20 103.400 103.400 108.857 -5.457 17919 79018 1 193 . 1 1 20 20 SER HA H 20 4.370 4.370 4.303 0.067 17919 79019 1 193 . 1 1 20 20 SER C C 20 174.660 174.660 174.786 -0.126 17919 79020 1 193 . 1 1 20 20 SER CA C 20 57.400 57.400 59.399 -1.999 17919 79021 1 193 . 1 1 20 20 SER CB C 20 63.370 63.370 62.582 0.788 17919 79022 1 193 . 1 1 20 20 SER H H 20 7.040 7.040 7.989 -0.949 17919 79023 1 193 . 1 1 21 21 ASP N N 21 123.480 123.480 124.657 -1.177 17919 79024 1 193 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.640 0.055 17919 79025 1 193 . 1 1 21 21 ASP C C 21 176.360 176.360 176.170 0.190 17919 79026 1 193 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.720 -0.020 17919 79027 1 193 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.502 -0.702 17919 79028 1 193 . 1 1 21 21 ASP H H 21 8.030 8.030 7.875 0.155 17919 79029 1 193 . 1 1 22 22 THR N N 22 108.800 108.800 113.029 -4.229 17919 79030 1 193 . 1 1 22 22 THR HA H 22 4.920 4.920 4.822 0.098 17919 79031 1 193 . 1 1 22 22 THR C C 22 176.750 176.750 175.709 1.041 17919 79032 1 193 . 1 1 22 22 THR CA C 22 59.690 59.690 61.117 -1.427 17919 79033 1 193 . 1 1 22 22 THR CB C 22 71.200 71.200 71.454 -0.254 17919 79034 1 193 . 1 1 22 22 THR H H 22 7.900 7.900 8.162 -0.262 17919 79035 1 193 . 1 1 23 23 ILE N N 23 121.190 121.190 122.135 -0.945 17919 79036 1 193 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.964 -0.307 17919 79037 1 193 . 1 1 23 23 ILE C C 23 179.040 179.040 177.819 1.221 17919 79038 1 193 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.298 -0.038 17919 79039 1 193 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.609 -2.259 17919 79040 1 193 . 1 1 23 23 ILE H H 23 8.560 8.560 8.735 -0.175 17919 79041 1 193 . 1 1 24 24 GLU N N 24 120.830 120.830 121.169 -0.339 17919 79042 1 193 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.883 0.034 17919 79043 1 193 . 1 1 24 24 GLU C C 24 178.640 178.640 178.663 -0.023 17919 79044 1 193 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.057 0.163 17919 79045 1 193 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.465 -1.185 17919 79046 1 193 . 1 1 24 24 GLU H H 24 9.760 9.760 8.300 1.460 17919 79047 1 193 . 1 1 25 25 ASN N N 25 120.570 120.570 117.460 3.110 17919 79048 1 193 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.583 -0.058 17919 79049 1 193 . 1 1 25 25 ASN C C 25 178.380 178.380 177.881 0.499 17919 79050 1 193 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.703 0.357 17919 79051 1 193 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.819 -0.369 17919 79052 1 193 . 1 1 25 25 ASN H H 25 7.920 7.920 7.666 0.254 17919 79053 1 193 . 1 1 26 26 VAL N N 26 121.710 121.710 121.600 0.110 17919 79054 1 193 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.560 -0.163 17919 79055 1 193 . 1 1 26 26 VAL C C 26 177.950 177.950 177.569 0.381 17919 79056 1 193 . 1 1 26 26 VAL CA C 26 67.660 67.660 67.079 0.581 17919 79057 1 193 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.685 -0.845 17919 79058 1 193 . 1 1 26 26 VAL H H 26 8.070 8.070 8.466 -0.396 17919 79059 1 193 . 1 1 27 27 LYS N N 27 118.860 118.860 120.008 -1.148 17919 79060 1 193 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.225 0.355 17919 79061 1 193 . 1 1 27 27 LYS C C 27 180.550 180.550 179.294 1.256 17919 79062 1 193 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.599 -0.349 17919 79063 1 193 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.231 1.499 17919 79064 1 193 . 1 1 27 27 LYS H H 27 8.560 8.560 8.457 0.103 17919 79065 1 193 . 1 1 28 28 ALA N N 28 123.440 123.440 122.667 0.773 17919 79066 1 193 . 1 1 28 28 ALA HA H 28 4.160 4.160 3.991 0.169 17919 79067 1 193 . 1 1 28 28 ALA C C 28 180.300 180.300 179.069 1.231 17919 79068 1 193 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.209 0.161 17919 79069 1 193 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.321 -0.611 17919 79070 1 193 . 1 1 28 28 ALA H H 28 8.060 8.060 8.034 0.026 17919 79071 1 193 . 1 1 29 29 LYS N N 29 119.940 119.940 119.415 0.525 17919 79072 1 193 . 1 1 29 29 LYS HA H 29 4.207 4.207 3.989 0.218 17919 79073 1 193 . 1 1 29 29 LYS C C 29 180.320 180.320 179.048 1.272 17919 79074 1 193 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.494 0.156 17919 79075 1 193 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.383 0.907 17919 79076 1 193 . 1 1 29 29 LYS H H 29 7.850 7.850 7.919 -0.069 17919 79077 1 193 . 1 1 30 30 ILE N N 30 121.080 121.080 120.355 0.725 17919 79078 1 193 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.592 -0.085 17919 79079 1 193 . 1 1 30 30 ILE C C 30 178.310 178.310 177.414 0.896 17919 79080 1 193 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.383 0.767 17919 79081 1 193 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.654 -0.854 17919 79082 1 193 . 1 1 30 30 ILE H H 30 8.280 8.280 8.596 -0.316 17919 79083 1 193 . 1 1 31 31 GLN N N 31 123.490 123.490 120.024 3.466 17919 79084 1 193 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.938 -0.109 17919 79085 1 193 . 1 1 31 31 GLN C C 31 178.890 178.890 178.640 0.250 17919 79086 1 193 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.199 0.801 17919 79087 1 193 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.450 -0.730 17919 79088 1 193 . 1 1 31 31 GLN H H 31 8.580 8.580 7.895 0.685 17919 79089 1 193 . 1 1 32 32 ASP N N 32 119.360 119.360 119.525 -0.165 17919 79090 1 193 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.449 -0.095 17919 79091 1 193 . 1 1 32 32 ASP C C 32 177.250 177.250 177.910 -0.660 17919 79092 1 193 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.523 0.667 17919 79093 1 193 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.917 -0.337 17919 79094 1 193 . 1 1 32 32 ASP H H 32 8.010 8.010 8.109 -0.099 17919 79095 1 193 . 1 1 33 33 LYS N N 33 115.130 115.130 119.337 -4.207 17919 79096 1 193 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.223 0.114 17919 79097 1 193 . 1 1 33 33 LYS C C 33 177.870 177.870 178.563 -0.693 17919 79098 1 193 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.248 -0.198 17919 79099 1 193 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.227 0.943 17919 79100 1 193 . 1 1 33 33 LYS H H 33 7.430 7.430 7.668 -0.238 17919 79101 1 193 . 1 1 34 34 GLU N N 34 113.870 113.870 114.635 -0.765 17919 79102 1 193 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.546 0.079 17919 79103 1 193 . 1 1 34 34 GLU C C 34 177.840 177.840 176.586 1.254 17919 79104 1 193 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.718 -0.548 17919 79105 1 193 . 1 1 34 34 GLU CB C 34 32.660 32.660 30.695 1.965 17919 79106 1 193 . 1 1 34 34 GLU H H 34 8.740 8.740 8.224 0.516 17919 79107 1 193 . 1 1 35 35 GLY N N 35 108.650 108.650 108.462 0.188 17919 79108 1 193 . 1 1 35 35 GLY C C 35 173.960 173.960 174.578 -0.618 17919 79109 1 193 . 1 1 35 35 GLY CA C 35 46.080 46.080 46.044 0.036 17919 79110 1 193 . 1 1 35 35 GLY H H 35 8.530 8.530 8.056 0.474 17919 79111 1 193 . 1 1 36 36 ILE N N 36 119.880 119.880 121.885 -2.005 17919 79112 1 193 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.279 0.166 17919 79113 1 193 . 1 1 36 36 ILE C C 36 173.590 173.590 174.200 -0.610 17919 79114 1 193 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.345 -0.595 17919 79115 1 193 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.605 1.974 17919 79116 1 193 . 1 1 36 36 ILE H H 36 6.150 6.150 7.682 -1.532 17919 79117 1 193 . 1 1 37 37 PRO HA H 37 4.634 4.634 5.061 -0.427 17919 79118 1 193 . 1 1 37 37 PRO C C 37 176.940 176.940 175.964 0.976 17919 79119 1 193 . 1 1 37 37 PRO CA C 37 61.660 61.660 60.758 0.902 17919 79120 1 193 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.349 0.501 17919 79121 1 193 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.210 -0.093 17919 79122 1 193 . 1 1 38 38 PRO C C 38 178.320 178.320 178.411 -0.091 17919 79123 1 193 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.555 0.705 17919 79124 1 193 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.821 1.069 17919 79125 1 193 . 1 1 39 39 ASP N N 39 113.380 113.380 116.579 -3.199 17919 79126 1 193 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.357 0.073 17919 79127 1 193 . 1 1 39 39 ASP C C 39 177.090 177.090 177.170 -0.080 17919 79128 1 193 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.712 -1.072 17919 79129 1 193 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.298 -0.758 17919 79130 1 193 . 1 1 39 39 ASP H H 39 8.550 8.550 8.823 -0.273 17919 79131 1 193 . 1 1 40 40 GLN N N 40 116.780 116.780 116.498 0.282 17919 79132 1 193 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.258 0.206 17919 79133 1 193 . 1 1 40 40 GLN C C 40 175.380 175.380 176.635 -1.255 17919 79134 1 193 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.644 -1.004 17919 79135 1 193 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.753 0.387 17919 79136 1 193 . 1 1 40 40 GLN H H 40 7.820 7.820 7.809 0.011 17919 79137 1 193 . 1 1 41 41 GLN N N 41 117.720 117.720 119.587 -1.867 17919 79138 1 193 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.490 -0.246 17919 79139 1 193 . 1 1 41 41 GLN C C 41 176.300 176.300 175.191 1.109 17919 79140 1 193 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.905 0.565 17919 79141 1 193 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.122 2.528 17919 79142 1 193 . 1 1 41 41 GLN H H 41 7.480 7.480 7.494 -0.014 17919 79143 1 193 . 1 1 42 42 ARG N N 42 122.680 122.680 127.228 -4.548 17919 79144 1 193 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.577 -0.077 17919 79145 1 193 . 1 1 42 42 ARG C C 42 174.050 174.050 174.232 -0.182 17919 79146 1 193 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.774 0.276 17919 79147 1 193 . 1 1 42 42 ARG CB C 42 31.750 31.750 31.910 -0.160 17919 79148 1 193 . 1 1 42 42 ARG H H 42 8.530 8.530 9.145 -0.615 17919 79149 1 193 . 1 1 43 43 LEU N N 43 124.040 124.040 127.740 -3.700 17919 79150 1 193 . 1 1 43 43 LEU C C 43 175.290 175.290 176.216 -0.926 17919 79151 1 193 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.100 -1.120 17919 79152 1 193 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.477 2.313 17919 79153 1 193 . 1 1 43 43 LEU H H 43 8.820 8.820 8.771 0.049 17919 79154 1 193 . 1 1 44 44 ILE N N 44 121.920 121.920 121.899 0.021 17919 79155 1 193 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.878 0.114 17919 79156 1 193 . 1 1 44 44 ILE C C 44 176.060 176.060 174.204 1.856 17919 79157 1 193 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.470 -1.490 17919 79158 1 193 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.779 -0.360 17919 79159 1 193 . 1 1 44 44 ILE H H 44 9.030 9.030 9.069 -0.039 17919 79160 1 193 . 1 1 45 45 PHE N N 45 125.390 125.390 125.262 0.128 17919 79161 1 193 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.162 -0.117 17919 79162 1 193 . 1 1 45 45 PHE C C 45 174.470 174.470 174.557 -0.087 17919 79163 1 193 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.886 0.134 17919 79164 1 193 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.380 0.380 17919 79165 1 193 . 1 1 45 45 PHE H H 45 8.830 8.830 9.149 -0.319 17919 79166 1 193 . 1 1 46 46 ALA N N 46 132.200 132.200 129.930 2.270 17919 79167 1 193 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.720 -0.030 17919 79168 1 193 . 1 1 46 46 ALA C C 46 177.290 177.290 177.872 -0.582 17919 79169 1 193 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.550 -0.010 17919 79170 1 193 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.463 0.107 17919 79171 1 193 . 1 1 46 46 ALA H H 46 8.810 8.810 8.680 0.130 17919 79172 1 193 . 1 1 47 47 GLY N N 47 102.340 102.340 103.868 -1.528 17919 79173 1 193 . 1 1 47 47 GLY C C 47 173.810 173.810 174.117 -0.307 17919 79174 1 193 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.872 0.478 17919 79175 1 193 . 1 1 47 47 GLY H H 47 8.130 8.130 8.465 -0.335 17919 79176 1 193 . 1 1 48 48 LYS N N 48 121.570 121.570 121.537 0.033 17919 79177 1 193 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.521 0.101 17919 79178 1 193 . 1 1 48 48 LYS C C 48 174.700 174.700 175.282 -0.582 17919 79179 1 193 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.938 -0.388 17919 79180 1 193 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.006 0.524 17919 79181 1 193 . 1 1 48 48 LYS H H 48 7.980 7.980 7.570 0.410 17919 79182 1 193 . 1 1 49 49 GLN N N 49 122.410 122.410 124.554 -2.144 17919 79183 1 193 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.378 0.182 17919 79184 1 193 . 1 1 49 49 GLN C C 49 175.670 175.670 175.517 0.153 17919 79185 1 193 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.890 -0.150 17919 79186 1 193 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.438 -0.438 17919 79187 1 193 . 1 1 49 49 GLN H H 49 8.600 8.600 8.563 0.037 17919 79188 1 193 . 1 1 50 50 LEU N N 50 125.520 125.520 128.924 -3.404 17919 79189 1 193 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.127 -0.037 17919 79190 1 193 . 1 1 50 50 LEU C C 50 176.660 176.660 175.962 0.698 17919 79191 1 193 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.974 0.266 17919 79192 1 193 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.387 -0.817 17919 79193 1 193 . 1 1 50 50 LEU H H 50 8.530 8.530 8.251 0.279 17919 79194 1 193 . 1 1 51 51 GLU N N 51 122.940 122.940 121.502 1.438 17919 79195 1 193 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.595 -0.107 17919 79196 1 193 . 1 1 51 51 GLU C C 51 175.870 175.870 176.909 -1.039 17919 79197 1 193 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.178 0.782 17919 79198 1 193 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.569 -0.999 17919 79199 1 193 . 1 1 51 51 GLU H H 51 8.400 8.400 8.011 0.389 17919 79200 1 193 . 1 1 52 52 ASP N N 52 120.030 120.030 124.513 -4.483 17919 79201 1 193 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.458 -0.099 17919 79202 1 193 . 1 1 52 52 ASP C C 52 177.330 177.330 178.249 -0.919 17919 79203 1 193 . 1 1 52 52 ASP CA C 52 56.960 56.960 58.196 -1.236 17919 79204 1 193 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.672 0.178 17919 79205 1 193 . 1 1 52 52 ASP H H 52 8.160 8.160 8.905 -0.745 17919 79206 1 193 . 1 1 53 53 GLY N N 53 106.660 106.660 104.197 2.463 17919 79207 1 193 . 1 1 53 53 GLY C C 53 174.870 174.870 174.412 0.458 17919 79208 1 193 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.919 0.251 17919 79209 1 193 . 1 1 53 53 GLY H H 53 9.390 9.390 8.452 0.938 17919 79210 1 193 . 1 1 54 54 ARG N N 54 119.050 119.050 119.473 -0.423 17919 79211 1 193 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.528 0.167 17919 79212 1 193 . 1 1 54 54 ARG C C 54 175.350 175.350 175.713 -0.363 17919 79213 1 193 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.592 -0.202 17919 79214 1 193 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.056 -0.405 17919 79215 1 193 . 1 1 54 54 ARG H H 54 7.460 7.460 7.324 0.136 17919 79216 1 193 . 1 1 55 55 THR N N 55 108.400 108.400 111.551 -3.151 17919 79217 1 193 . 1 1 55 55 THR HA H 55 5.240 5.240 4.998 0.242 17919 79218 1 193 . 1 1 55 55 THR C C 55 176.560 176.560 176.190 0.370 17919 79219 1 193 . 1 1 55 55 THR CA C 55 59.690 59.690 60.061 -0.371 17919 79220 1 193 . 1 1 55 55 THR CB C 55 72.260 72.260 71.165 1.095 17919 79221 1 193 . 1 1 55 55 THR H H 55 8.730 8.730 8.533 0.197 17919 79222 1 193 . 1 1 56 56 LEU N N 56 117.920 117.920 120.833 -2.913 17919 79223 1 193 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.058 0.002 17919 79224 1 193 . 1 1 56 56 LEU C C 56 180.810 180.810 179.195 1.615 17919 79225 1 193 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.241 0.469 17919 79226 1 193 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.627 -1.257 17919 79227 1 193 . 1 1 56 56 LEU H H 56 8.140 8.140 8.727 -0.587 17919 79228 1 193 . 1 1 57 57 SER N N 57 113.330 113.330 114.893 -1.563 17919 79229 1 193 . 1 1 57 57 SER HA H 57 4.370 4.370 4.161 0.209 17919 79230 1 193 . 1 1 57 57 SER C C 57 178.310 178.310 176.857 1.453 17919 79231 1 193 . 1 1 57 57 SER CA C 57 61.080 61.080 61.979 -0.899 17919 79232 1 193 . 1 1 57 57 SER CB C 57 62.530 62.530 62.654 -0.124 17919 79233 1 193 . 1 1 57 57 SER H H 57 8.470 8.470 7.997 0.473 17919 79234 1 193 . 1 1 58 58 ASP N N 58 124.190 124.190 122.657 1.533 17919 79235 1 193 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.304 -0.008 17919 79236 1 193 . 1 1 58 58 ASP C C 58 177.400 177.400 177.945 -0.545 17919 79237 1 193 . 1 1 58 58 ASP CA C 58 57.180 57.180 57.011 0.169 17919 79238 1 193 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.608 -0.508 17919 79239 1 193 . 1 1 58 58 ASP H H 58 7.930 7.930 7.605 0.325 17919 79240 1 193 . 1 1 59 59 TYR N N 59 115.510 115.510 115.514 -0.004 17919 79241 1 193 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.541 0.129 17919 79242 1 193 . 1 1 59 59 TYR C C 59 174.700 174.700 174.935 -0.235 17919 79243 1 193 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.690 0.560 17919 79244 1 193 . 1 1 59 59 TYR CB C 59 40.070 40.070 37.961 2.109 17919 79245 1 193 . 1 1 59 59 TYR H H 59 7.250 7.250 7.635 -0.385 17919 79246 1 193 . 1 1 60 60 ASN N N 60 115.900 115.900 117.355 -1.455 17919 79247 1 193 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.417 -0.062 17919 79248 1 193 . 1 1 60 60 ASN C C 60 174.340 174.340 174.683 -0.343 17919 79249 1 193 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.298 -0.178 17919 79250 1 193 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.291 0.118 17919 79251 1 193 . 1 1 60 60 ASN H H 60 8.150 8.150 7.642 0.508 17919 79252 1 193 . 1 1 61 61 ILE N N 61 118.600 118.600 118.633 -0.033 17919 79253 1 193 . 1 1 61 61 ILE HA H 61 3.393 3.393 4.224 -0.831 17919 79254 1 193 . 1 1 61 61 ILE C C 61 174.610 174.610 175.281 -0.671 17919 79255 1 193 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.336 1.084 17919 79256 1 193 . 1 1 61 61 ILE CB C 61 36.740 36.740 38.696 -1.956 17919 79257 1 193 . 1 1 61 61 ILE H H 61 7.250 7.250 7.562 -0.312 17919 79258 1 193 . 1 1 62 62 GLN N N 62 124.740 124.740 125.026 -0.286 17919 79259 1 193 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.714 -0.208 17919 79260 1 193 . 1 1 62 62 GLN C C 62 175.970 175.970 175.629 0.341 17919 79261 1 193 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.943 -0.283 17919 79262 1 193 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.483 0.167 17919 79263 1 193 . 1 1 62 62 GLN H H 62 7.610 7.610 8.192 -0.582 17919 79264 1 193 . 1 1 63 63 LYS N N 63 120.300 120.300 120.891 -0.591 17919 79265 1 193 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.149 -0.148 17919 79266 1 193 . 1 1 63 63 LYS C C 63 175.810 175.810 176.957 -1.147 17919 79267 1 193 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.494 0.296 17919 79268 1 193 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.056 0.594 17919 79269 1 193 . 1 1 63 63 LYS H H 63 8.490 8.490 8.626 -0.136 17919 79270 1 193 . 1 1 64 64 GLU N N 64 113.950 113.950 119.455 -5.505 17919 79271 1 193 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.794 -0.329 17919 79272 1 193 . 1 1 64 64 GLU C C 64 175.250 175.250 175.742 -0.492 17919 79273 1 193 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.745 0.145 17919 79274 1 193 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.781 -2.881 17919 79275 1 193 . 1 1 64 64 GLU H H 64 9.280 9.280 8.864 0.416 17919 79276 1 193 . 1 1 65 65 SER N N 65 114.730 114.730 114.936 -0.206 17919 79277 1 193 . 1 1 65 65 SER HA H 65 4.640 4.640 4.496 0.144 17919 79278 1 193 . 1 1 65 65 SER C C 65 172.160 172.160 174.016 -1.856 17919 79279 1 193 . 1 1 65 65 SER CA C 65 60.890 60.890 60.411 0.478 17919 79280 1 193 . 1 1 65 65 SER CB C 65 64.910 64.910 63.894 1.016 17919 79281 1 193 . 1 1 65 65 SER H H 65 7.670 7.670 7.483 0.187 17919 79282 1 193 . 1 1 66 66 THR N N 66 117.110 117.110 121.078 -3.968 17919 79283 1 193 . 1 1 66 66 THR HA H 66 5.270 5.270 4.981 0.289 17919 79284 1 193 . 1 1 66 66 THR C C 66 173.950 173.950 174.061 -0.111 17919 79285 1 193 . 1 1 66 66 THR CA C 66 62.340 62.340 61.673 0.667 17919 79286 1 193 . 1 1 66 66 THR CB C 66 70.080 70.080 69.927 0.153 17919 79287 1 193 . 1 1 66 66 THR H H 66 8.730 8.730 8.436 0.294 17919 79288 1 193 . 1 1 67 67 LEU N N 67 127.110 127.110 126.878 0.232 17919 79289 1 193 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.756 0.304 17919 79290 1 193 . 1 1 67 67 LEU C C 67 175.770 175.770 175.767 0.003 17919 79291 1 193 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.772 0.128 17919 79292 1 193 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.016 0.244 17919 79293 1 193 . 1 1 67 67 LEU H H 67 9.410 9.410 9.027 0.383 17919 79294 1 193 . 1 1 68 68 HIS N N 68 118.380 118.380 119.046 -0.666 17919 79295 1 193 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.368 -0.128 17919 79296 1 193 . 1 1 68 68 HIS C C 68 173.150 173.150 174.283 -1.133 17919 79297 1 193 . 1 1 68 68 HIS CA C 68 55.000 55.000 55.057 -0.057 17919 79298 1 193 . 1 1 68 68 HIS CB C 68 30.530 30.530 31.110 -0.580 17919 79299 1 193 . 1 1 68 68 HIS H H 68 9.230 9.230 9.272 -0.042 17919 79300 1 193 . 1 1 69 69 LEU N N 69 124.460 124.460 127.421 -2.961 17919 79301 1 193 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.754 0.436 17919 79302 1 193 . 1 1 69 69 LEU C C 69 175.270 175.270 174.632 0.638 17919 79303 1 193 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.176 -0.286 17919 79304 1 193 . 1 1 69 69 LEU CB C 69 44.380 44.380 43.506 0.874 17919 79305 1 193 . 1 1 69 69 LEU H H 69 8.340 8.340 8.932 -0.592 17919 79306 1 193 . 1 1 70 70 VAL N N 70 126.940 126.940 127.815 -0.875 17919 79307 1 193 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.381 -0.031 17919 79308 1 193 . 1 1 70 70 VAL C C 70 174.000 174.000 174.500 -0.500 17919 79309 1 193 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.958 -0.158 17919 79310 1 193 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.291 -0.381 17919 79311 1 193 . 1 1 70 70 VAL H H 70 9.200 9.200 9.045 0.155 17919 79312 1 193 . 1 1 71 71 LEU N N 71 123.130 123.130 125.467 -2.337 17919 79313 1 193 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.216 -0.156 17919 79314 1 193 . 1 1 71 71 LEU C C 71 177.830 177.830 177.109 0.721 17919 79315 1 193 . 1 1 71 71 LEU CA C 71 53.940 53.940 54.091 -0.151 17919 79316 1 193 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.381 -0.531 17919 79317 1 193 . 1 1 71 71 LEU H H 71 8.120 8.120 8.388 -0.268 17919 79318 1 193 . 1 1 72 72 ARG N N 72 123.490 123.490 122.758 0.732 17919 79319 1 193 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.601 -0.300 17919 79320 1 193 . 1 1 72 72 ARG C C 72 175.350 175.350 175.422 -0.072 17919 79321 1 193 . 1 1 72 72 ARG CA C 72 55.610 55.610 54.099 1.511 17919 79322 1 193 . 1 1 72 72 ARG CB C 72 31.350 31.350 31.599 -0.249 17919 79323 1 193 . 1 1 72 72 ARG H H 72 8.580 8.580 8.458 0.122 17919 79324 1 194 . 1 1 2 2 GLN N N 2 123.220 123.220 120.164 3.056 17919 79325 1 194 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.203 0.046 17919 79326 1 194 . 1 1 2 2 GLN C C 2 175.920 175.920 174.942 0.978 17919 79327 1 194 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.689 0.391 17919 79328 1 194 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.710 0.050 17919 79329 1 194 . 1 1 2 2 GLN H H 2 8.900 8.900 8.274 0.626 17919 79330 1 194 . 1 1 3 3 ILE N N 3 115.340 115.340 116.531 -1.191 17919 79331 1 194 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.394 -0.181 17919 79332 1 194 . 1 1 3 3 ILE C C 3 172.450 172.450 173.303 -0.853 17919 79333 1 194 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.239 0.331 17919 79334 1 194 . 1 1 3 3 ILE CB C 3 42.210 42.210 42.100 0.110 17919 79335 1 194 . 1 1 3 3 ILE H H 3 8.320 8.320 8.766 -0.446 17919 79336 1 194 . 1 1 4 4 PHE N N 4 118.110 118.110 120.256 -2.146 17919 79337 1 194 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.480 0.150 17919 79338 1 194 . 1 1 4 4 PHE C C 4 175.320 175.320 175.084 0.236 17919 79339 1 194 . 1 1 4 4 PHE CA C 4 55.210 55.210 54.944 0.266 17919 79340 1 194 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.165 0.315 17919 79341 1 194 . 1 1 4 4 PHE H H 4 8.610 8.610 8.630 -0.020 17919 79342 1 194 . 1 1 5 5 VAL N N 5 121.000 121.000 122.852 -1.852 17919 79343 1 194 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.921 -0.196 17919 79344 1 194 . 1 1 5 5 VAL C C 5 174.870 174.870 174.658 0.212 17919 79345 1 194 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.195 -0.575 17919 79346 1 194 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.744 0.486 17919 79347 1 194 . 1 1 5 5 VAL H H 5 9.300 9.300 9.247 0.053 17919 79348 1 194 . 1 1 6 6 LYS N N 6 127.520 127.520 128.891 -1.371 17919 79349 1 194 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.501 -0.134 17919 79350 1 194 . 1 1 6 6 LYS C C 6 177.140 177.140 176.419 0.721 17919 79351 1 194 . 1 1 6 6 LYS CA C 6 54.520 54.520 53.943 0.577 17919 79352 1 194 . 1 1 6 6 LYS CB C 6 35.050 35.050 36.232 -1.182 17919 79353 1 194 . 1 1 6 6 LYS H H 6 8.820 8.820 9.420 -0.600 17919 79354 1 194 . 1 1 7 7 THR N N 7 115.400 115.400 118.536 -3.136 17919 79355 1 194 . 1 1 7 7 THR HA H 7 4.970 4.970 4.630 0.340 17919 79356 1 194 . 1 1 7 7 THR C C 7 176.910 176.910 176.181 0.729 17919 79357 1 194 . 1 1 7 7 THR CA C 7 60.470 60.470 61.170 -0.700 17919 79358 1 194 . 1 1 7 7 THR CB C 7 70.630 70.630 70.043 0.587 17919 79359 1 194 . 1 1 7 7 THR H H 7 8.730 8.730 8.764 -0.034 17919 79360 1 194 . 1 1 8 8 LEU N N 8 121.330 121.330 122.118 -0.788 17919 79361 1 194 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.298 0.012 17919 79362 1 194 . 1 1 8 8 LEU C C 8 178.800 178.800 177.323 1.477 17919 79363 1 194 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.075 0.505 17919 79364 1 194 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.841 0.129 17919 79365 1 194 . 1 1 8 8 LEU H H 8 9.100 9.100 8.267 0.833 17919 79366 1 194 . 1 1 9 9 THR N N 9 105.590 105.590 106.646 -1.056 17919 79367 1 194 . 1 1 9 9 THR HA H 9 4.428 4.428 4.351 0.077 17919 79368 1 194 . 1 1 9 9 THR C C 9 175.520 175.520 175.598 -0.078 17919 79369 1 194 . 1 1 9 9 THR CA C 9 61.400 61.400 61.773 -0.373 17919 79370 1 194 . 1 1 9 9 THR CB C 9 69.140 69.140 68.635 0.505 17919 79371 1 194 . 1 1 9 9 THR H H 9 7.630 7.630 7.567 0.063 17919 79372 1 194 . 1 1 10 10 GLY N N 10 108.890 108.890 111.624 -2.734 17919 79373 1 194 . 1 1 10 10 GLY C C 10 174.070 174.070 173.487 0.583 17919 79374 1 194 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.172 0.287 17919 79375 1 194 . 1 1 10 10 GLY H H 10 7.810 7.810 8.453 -0.643 17919 79376 1 194 . 1 1 11 11 LYS N N 11 121.600 121.600 121.827 -0.227 17919 79377 1 194 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.435 -0.074 17919 79378 1 194 . 1 1 11 11 LYS C C 11 175.940 175.940 175.334 0.606 17919 79379 1 194 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.213 0.067 17919 79380 1 194 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.798 -0.598 17919 79381 1 194 . 1 1 11 11 LYS H H 11 7.280 7.280 8.299 -1.019 17919 79382 1 194 . 1 1 12 12 THR N N 12 120.440 120.440 119.703 0.737 17919 79383 1 194 . 1 1 12 12 THR HA H 12 5.046 5.046 5.396 -0.350 17919 79384 1 194 . 1 1 12 12 THR C C 12 174.320 174.320 174.116 0.204 17919 79385 1 194 . 1 1 12 12 THR CA C 12 62.390 62.390 60.811 1.579 17919 79386 1 194 . 1 1 12 12 THR CB C 12 69.910 69.910 70.721 -0.811 17919 79387 1 194 . 1 1 12 12 THR H H 12 8.650 8.650 8.183 0.467 17919 79388 1 194 . 1 1 13 13 ILE N N 13 127.110 127.110 121.633 5.477 17919 79389 1 194 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.733 -0.189 17919 79390 1 194 . 1 1 13 13 ILE C C 13 175.220 175.220 174.484 0.736 17919 79391 1 194 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.459 0.521 17919 79392 1 194 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.704 -0.754 17919 79393 1 194 . 1 1 13 13 ILE H H 13 9.450 9.450 9.224 0.226 17919 79394 1 194 . 1 1 14 14 THR N N 14 121.520 121.520 121.862 -0.342 17919 79395 1 194 . 1 1 14 14 THR HA H 14 4.964 4.964 5.214 -0.250 17919 79396 1 194 . 1 1 14 14 THR C C 14 173.790 173.790 173.913 -0.123 17919 79397 1 194 . 1 1 14 14 THR CA C 14 61.940 61.940 62.314 -0.374 17919 79398 1 194 . 1 1 14 14 THR CB C 14 69.650 69.650 69.865 -0.215 17919 79399 1 194 . 1 1 14 14 THR H H 14 8.710 8.710 8.518 0.192 17919 79400 1 194 . 1 1 15 15 LEU N N 15 124.800 124.800 123.940 0.860 17919 79401 1 194 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.758 0.022 17919 79402 1 194 . 1 1 15 15 LEU C C 15 174.670 174.670 174.707 -0.037 17919 79403 1 194 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.400 -0.570 17919 79404 1 194 . 1 1 15 15 LEU CB C 15 47.070 47.070 46.138 0.932 17919 79405 1 194 . 1 1 15 15 LEU H H 15 8.710 8.710 8.826 -0.116 17919 79406 1 194 . 1 1 16 16 GLU N N 16 122.160 122.160 121.036 1.124 17919 79407 1 194 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.399 -0.482 17919 79408 1 194 . 1 1 16 16 GLU C C 16 175.860 175.860 175.672 0.188 17919 79409 1 194 . 1 1 16 16 GLU CA C 16 54.820 54.820 54.581 0.239 17919 79410 1 194 . 1 1 16 16 GLU CB C 16 29.450 29.450 31.617 -2.167 17919 79411 1 194 . 1 1 16 16 GLU H H 16 8.140 8.140 8.579 -0.439 17919 79412 1 194 . 1 1 17 17 VAL N N 17 117.210 117.210 116.425 0.785 17919 79413 1 194 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.823 -0.109 17919 79414 1 194 . 1 1 17 17 VAL C C 17 174.160 174.160 174.260 -0.100 17919 79415 1 194 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.231 -0.801 17919 79416 1 194 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.675 0.725 17919 79417 1 194 . 1 1 17 17 VAL H H 17 8.900 8.900 8.587 0.313 17919 79418 1 194 . 1 1 18 18 GLU N N 18 118.990 118.990 121.617 -2.627 17919 79419 1 194 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.745 0.334 17919 79420 1 194 . 1 1 18 18 GLU C C 18 176.160 176.160 175.685 0.475 17919 79421 1 194 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.454 -0.734 17919 79422 1 194 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.059 0.251 17919 79423 1 194 . 1 1 18 18 GLU H H 18 8.640 8.640 8.786 -0.146 17919 79424 1 194 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.272 -0.131 17919 79425 1 194 . 1 1 19 19 PRO C C 19 175.310 175.310 177.323 -2.013 17919 79426 1 194 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.474 -0.004 17919 79427 1 194 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.170 -0.220 17919 79428 1 194 . 1 1 20 20 SER N N 20 103.400 103.400 109.010 -5.610 17919 79429 1 194 . 1 1 20 20 SER HA H 20 4.370 4.370 4.322 0.048 17919 79430 1 194 . 1 1 20 20 SER C C 20 174.660 174.660 174.165 0.495 17919 79431 1 194 . 1 1 20 20 SER CA C 20 57.400 57.400 58.365 -0.965 17919 79432 1 194 . 1 1 20 20 SER CB C 20 63.370 63.370 62.533 0.837 17919 79433 1 194 . 1 1 20 20 SER H H 20 7.040 7.040 8.006 -0.966 17919 79434 1 194 . 1 1 21 21 ASP N N 21 123.480 123.480 123.256 0.224 17919 79435 1 194 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.701 -0.006 17919 79436 1 194 . 1 1 21 21 ASP C C 21 176.360 176.360 175.914 0.446 17919 79437 1 194 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.316 1.384 17919 79438 1 194 . 1 1 21 21 ASP CB C 21 40.800 40.800 42.411 -1.611 17919 79439 1 194 . 1 1 21 21 ASP H H 21 8.030 8.030 7.632 0.398 17919 79440 1 194 . 1 1 22 22 THR N N 22 108.800 108.800 113.968 -5.168 17919 79441 1 194 . 1 1 22 22 THR HA H 22 4.920 4.920 4.428 0.492 17919 79442 1 194 . 1 1 22 22 THR C C 22 176.750 176.750 176.006 0.744 17919 79443 1 194 . 1 1 22 22 THR CA C 22 59.690 59.690 61.803 -2.113 17919 79444 1 194 . 1 1 22 22 THR CB C 22 71.200 71.200 70.769 0.431 17919 79445 1 194 . 1 1 22 22 THR H H 22 7.900 7.900 8.126 -0.226 17919 79446 1 194 . 1 1 23 23 ILE N N 23 121.190 121.190 124.166 -2.976 17919 79447 1 194 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.741 -0.084 17919 79448 1 194 . 1 1 23 23 ILE C C 23 179.040 179.040 177.733 1.307 17919 79449 1 194 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.418 -1.158 17919 79450 1 194 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.320 -1.970 17919 79451 1 194 . 1 1 23 23 ILE H H 23 8.560 8.560 8.618 -0.058 17919 79452 1 194 . 1 1 24 24 GLU N N 24 120.830 120.830 121.170 -0.340 17919 79453 1 194 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.795 0.122 17919 79454 1 194 . 1 1 24 24 GLU C C 24 178.640 178.640 178.437 0.203 17919 79455 1 194 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.324 -0.104 17919 79456 1 194 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.441 -1.161 17919 79457 1 194 . 1 1 24 24 GLU H H 24 9.760 9.760 8.388 1.372 17919 79458 1 194 . 1 1 25 25 ASN N N 25 120.570 120.570 117.392 3.178 17919 79459 1 194 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.530 -0.005 17919 79460 1 194 . 1 1 25 25 ASN C C 25 178.380 178.380 177.896 0.484 17919 79461 1 194 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.673 0.387 17919 79462 1 194 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.261 0.189 17919 79463 1 194 . 1 1 25 25 ASN H H 25 7.920 7.920 7.702 0.218 17919 79464 1 194 . 1 1 26 26 VAL N N 26 121.710 121.710 121.061 0.649 17919 79465 1 194 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.487 -0.090 17919 79466 1 194 . 1 1 26 26 VAL C C 26 177.950 177.950 177.846 0.104 17919 79467 1 194 . 1 1 26 26 VAL CA C 26 67.660 67.660 67.203 0.457 17919 79468 1 194 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.541 -0.701 17919 79469 1 194 . 1 1 26 26 VAL H H 26 8.070 8.070 8.548 -0.478 17919 79470 1 194 . 1 1 27 27 LYS N N 27 118.860 118.860 120.129 -1.269 17919 79471 1 194 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.040 0.540 17919 79472 1 194 . 1 1 27 27 LYS C C 27 180.550 180.550 179.182 1.368 17919 79473 1 194 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.810 -0.560 17919 79474 1 194 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.177 1.553 17919 79475 1 194 . 1 1 27 27 LYS H H 27 8.560 8.560 8.243 0.317 17919 79476 1 194 . 1 1 28 28 ALA N N 28 123.440 123.440 120.589 2.851 17919 79477 1 194 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.094 0.066 17919 79478 1 194 . 1 1 28 28 ALA C C 28 180.300 180.300 179.344 0.956 17919 79479 1 194 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.838 0.532 17919 79480 1 194 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.456 -0.746 17919 79481 1 194 . 1 1 28 28 ALA H H 28 8.060 8.060 8.039 0.021 17919 79482 1 194 . 1 1 29 29 LYS N N 29 119.940 119.940 119.269 0.671 17919 79483 1 194 . 1 1 29 29 LYS HA H 29 4.207 4.207 3.998 0.209 17919 79484 1 194 . 1 1 29 29 LYS C C 29 180.320 180.320 179.345 0.975 17919 79485 1 194 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.263 0.387 17919 79486 1 194 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.347 0.943 17919 79487 1 194 . 1 1 29 29 LYS H H 29 7.850 7.850 7.809 0.041 17919 79488 1 194 . 1 1 30 30 ILE N N 30 121.080 121.080 120.811 0.269 17919 79489 1 194 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.561 -0.054 17919 79490 1 194 . 1 1 30 30 ILE C C 30 178.310 178.310 177.382 0.928 17919 79491 1 194 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.113 1.037 17919 79492 1 194 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.686 -0.886 17919 79493 1 194 . 1 1 30 30 ILE H H 30 8.280 8.280 8.289 -0.009 17919 79494 1 194 . 1 1 31 31 GLN N N 31 123.490 123.490 120.031 3.459 17919 79495 1 194 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.025 -0.196 17919 79496 1 194 . 1 1 31 31 GLN C C 31 178.890 178.890 178.464 0.426 17919 79497 1 194 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.097 0.903 17919 79498 1 194 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.501 -0.781 17919 79499 1 194 . 1 1 31 31 GLN H H 31 8.580 8.580 8.011 0.569 17919 79500 1 194 . 1 1 32 32 ASP N N 32 119.360 119.360 117.846 1.514 17919 79501 1 194 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.455 -0.101 17919 79502 1 194 . 1 1 32 32 ASP C C 32 177.250 177.250 177.618 -0.368 17919 79503 1 194 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.350 0.840 17919 79504 1 194 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.706 -0.126 17919 79505 1 194 . 1 1 32 32 ASP H H 32 8.010 8.010 7.831 0.179 17919 79506 1 194 . 1 1 33 33 LYS N N 33 115.130 115.130 119.159 -4.029 17919 79507 1 194 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.214 0.123 17919 79508 1 194 . 1 1 33 33 LYS C C 33 177.870 177.870 178.355 -0.485 17919 79509 1 194 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.338 -0.288 17919 79510 1 194 . 1 1 33 33 LYS CB C 33 34.170 34.170 32.906 1.264 17919 79511 1 194 . 1 1 33 33 LYS H H 33 7.430 7.430 7.412 0.018 17919 79512 1 194 . 1 1 34 34 GLU N N 34 113.870 113.870 114.984 -1.114 17919 79513 1 194 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.435 0.190 17919 79514 1 194 . 1 1 34 34 GLU C C 34 177.840 177.840 177.666 0.174 17919 79515 1 194 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.987 -0.817 17919 79516 1 194 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.207 1.453 17919 79517 1 194 . 1 1 34 34 GLU H H 34 8.740 8.740 7.993 0.747 17919 79518 1 194 . 1 1 35 35 GLY N N 35 108.650 108.650 109.768 -1.118 17919 79519 1 194 . 1 1 35 35 GLY C C 35 173.960 173.960 174.188 -0.228 17919 79520 1 194 . 1 1 35 35 GLY CA C 35 46.080 46.080 46.136 -0.056 17919 79521 1 194 . 1 1 35 35 GLY H H 35 8.530 8.530 8.283 0.247 17919 79522 1 194 . 1 1 36 36 ILE N N 36 119.880 119.880 121.204 -1.324 17919 79523 1 194 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.321 0.124 17919 79524 1 194 . 1 1 36 36 ILE C C 36 173.590 173.590 174.360 -0.770 17919 79525 1 194 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.648 0.102 17919 79526 1 194 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.337 2.243 17919 79527 1 194 . 1 1 36 36 ILE H H 36 6.150 6.150 7.392 -1.242 17919 79528 1 194 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.629 0.005 17919 79529 1 194 . 1 1 37 37 PRO C C 37 176.940 176.940 176.106 0.834 17919 79530 1 194 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.487 0.173 17919 79531 1 194 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.061 0.789 17919 79532 1 194 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.138 -0.021 17919 79533 1 194 . 1 1 38 38 PRO C C 38 178.320 178.320 178.559 -0.239 17919 79534 1 194 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.582 0.678 17919 79535 1 194 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.754 1.136 17919 79536 1 194 . 1 1 39 39 ASP N N 39 113.380 113.380 116.464 -3.084 17919 79537 1 194 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.383 0.047 17919 79538 1 194 . 1 1 39 39 ASP C C 39 177.090 177.090 177.056 0.034 17919 79539 1 194 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.471 -0.831 17919 79540 1 194 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.631 -1.091 17919 79541 1 194 . 1 1 39 39 ASP H H 39 8.550 8.550 8.581 -0.031 17919 79542 1 194 . 1 1 40 40 GLN N N 40 116.780 116.780 116.325 0.455 17919 79543 1 194 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.373 0.091 17919 79544 1 194 . 1 1 40 40 GLN C C 40 175.380 175.380 175.529 -0.149 17919 79545 1 194 . 1 1 40 40 GLN CA C 40 55.640 55.640 54.944 0.696 17919 79546 1 194 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.609 0.531 17919 79547 1 194 . 1 1 40 40 GLN H H 40 7.820 7.820 7.905 -0.085 17919 79548 1 194 . 1 1 41 41 GLN N N 41 117.720 117.720 119.987 -2.267 17919 79549 1 194 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.741 -0.497 17919 79550 1 194 . 1 1 41 41 GLN C C 41 176.300 176.300 174.614 1.686 17919 79551 1 194 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.166 1.304 17919 79552 1 194 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.899 1.751 17919 79553 1 194 . 1 1 41 41 GLN H H 41 7.480 7.480 7.262 0.218 17919 79554 1 194 . 1 1 42 42 ARG N N 42 122.680 122.680 125.512 -2.832 17919 79555 1 194 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.566 -0.066 17919 79556 1 194 . 1 1 42 42 ARG C C 42 174.050 174.050 173.988 0.062 17919 79557 1 194 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.173 -0.123 17919 79558 1 194 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.214 -0.464 17919 79559 1 194 . 1 1 42 42 ARG H H 42 8.530 8.530 8.506 0.024 17919 79560 1 194 . 1 1 43 43 LEU N N 43 124.040 124.040 127.658 -3.618 17919 79561 1 194 . 1 1 43 43 LEU C C 43 175.290 175.290 176.109 -0.819 17919 79562 1 194 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.486 -1.506 17919 79563 1 194 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.480 2.310 17919 79564 1 194 . 1 1 43 43 LEU H H 43 8.820 8.820 8.775 0.045 17919 79565 1 194 . 1 1 44 44 ILE N N 44 121.920 121.920 122.365 -0.445 17919 79566 1 194 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.065 -0.073 17919 79567 1 194 . 1 1 44 44 ILE C C 44 176.060 176.060 174.265 1.795 17919 79568 1 194 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.449 -1.469 17919 79569 1 194 . 1 1 44 44 ILE CB C 44 41.420 41.420 42.126 -0.706 17919 79570 1 194 . 1 1 44 44 ILE H H 44 9.030 9.030 9.090 -0.060 17919 79571 1 194 . 1 1 45 45 PHE N N 45 125.390 125.390 125.332 0.058 17919 79572 1 194 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.960 0.085 17919 79573 1 194 . 1 1 45 45 PHE C C 45 174.470 174.470 174.627 -0.157 17919 79574 1 194 . 1 1 45 45 PHE CA C 45 57.020 57.020 57.186 -0.166 17919 79575 1 194 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.959 0.801 17919 79576 1 194 . 1 1 45 45 PHE H H 45 8.830 8.830 9.099 -0.269 17919 79577 1 194 . 1 1 46 46 ALA N N 46 132.200 132.200 129.609 2.591 17919 79578 1 194 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.630 0.060 17919 79579 1 194 . 1 1 46 46 ALA C C 46 177.290 177.290 177.852 -0.562 17919 79580 1 194 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.668 -0.128 17919 79581 1 194 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.606 -0.036 17919 79582 1 194 . 1 1 46 46 ALA H H 46 8.810 8.810 8.731 0.079 17919 79583 1 194 . 1 1 47 47 GLY N N 47 102.340 102.340 104.097 -1.757 17919 79584 1 194 . 1 1 47 47 GLY C C 47 173.810 173.810 173.800 0.010 17919 79585 1 194 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.756 0.594 17919 79586 1 194 . 1 1 47 47 GLY H H 47 8.130 8.130 8.508 -0.379 17919 79587 1 194 . 1 1 48 48 LYS N N 48 121.570 121.570 121.012 0.558 17919 79588 1 194 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.599 0.023 17919 79589 1 194 . 1 1 48 48 LYS C C 48 174.700 174.700 175.074 -0.374 17919 79590 1 194 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.034 -0.484 17919 79591 1 194 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.926 -0.396 17919 79592 1 194 . 1 1 48 48 LYS H H 48 7.980 7.980 7.748 0.232 17919 79593 1 194 . 1 1 49 49 GLN N N 49 122.410 122.410 126.360 -3.950 17919 79594 1 194 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.482 0.078 17919 79595 1 194 . 1 1 49 49 GLN C C 49 175.670 175.670 175.165 0.505 17919 79596 1 194 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.048 -0.308 17919 79597 1 194 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.245 -0.245 17919 79598 1 194 . 1 1 49 49 GLN H H 49 8.600 8.600 8.607 -0.007 17919 79599 1 194 . 1 1 50 50 LEU N N 50 125.520 125.520 128.783 -3.263 17919 79600 1 194 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.121 -0.031 17919 79601 1 194 . 1 1 50 50 LEU C C 50 176.660 176.660 175.460 1.200 17919 79602 1 194 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.795 0.445 17919 79603 1 194 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.131 -0.561 17919 79604 1 194 . 1 1 50 50 LEU H H 50 8.530 8.530 8.445 0.085 17919 79605 1 194 . 1 1 51 51 GLU N N 51 122.940 122.940 123.406 -0.466 17919 79606 1 194 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.517 -0.029 17919 79607 1 194 . 1 1 51 51 GLU C C 51 175.870 175.870 177.283 -1.413 17919 79608 1 194 . 1 1 51 51 GLU CA C 51 55.960 55.960 54.352 1.608 17919 79609 1 194 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.771 -1.201 17919 79610 1 194 . 1 1 51 51 GLU H H 51 8.400 8.400 8.423 -0.023 17919 79611 1 194 . 1 1 52 52 ASP N N 52 120.030 120.030 123.612 -3.582 17919 79612 1 194 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.431 -0.072 17919 79613 1 194 . 1 1 52 52 ASP C C 52 177.330 177.330 177.546 -0.216 17919 79614 1 194 . 1 1 52 52 ASP CA C 52 56.960 56.960 56.999 -0.039 17919 79615 1 194 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.657 0.193 17919 79616 1 194 . 1 1 52 52 ASP H H 52 8.160 8.160 8.873 -0.713 17919 79617 1 194 . 1 1 53 53 GLY N N 53 106.660 106.660 105.132 1.528 17919 79618 1 194 . 1 1 53 53 GLY C C 53 174.870 174.870 174.088 0.782 17919 79619 1 194 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.867 0.303 17919 79620 1 194 . 1 1 53 53 GLY H H 53 9.390 9.390 8.538 0.852 17919 79621 1 194 . 1 1 54 54 ARG N N 54 119.050 119.050 119.383 -0.333 17919 79622 1 194 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.687 0.008 17919 79623 1 194 . 1 1 54 54 ARG C C 54 175.350 175.350 175.307 0.043 17919 79624 1 194 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.586 -0.196 17919 79625 1 194 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.688 -1.038 17919 79626 1 194 . 1 1 54 54 ARG H H 54 7.460 7.460 7.362 0.098 17919 79627 1 194 . 1 1 55 55 THR N N 55 108.400 108.400 113.683 -5.283 17919 79628 1 194 . 1 1 55 55 THR HA H 55 5.240 5.240 4.603 0.637 17919 79629 1 194 . 1 1 55 55 THR C C 55 176.560 176.560 175.878 0.682 17919 79630 1 194 . 1 1 55 55 THR CA C 55 59.690 59.690 62.266 -2.576 17919 79631 1 194 . 1 1 55 55 THR CB C 55 72.260 72.260 70.249 2.011 17919 79632 1 194 . 1 1 55 55 THR H H 55 8.730 8.730 8.632 0.098 17919 79633 1 194 . 1 1 56 56 LEU N N 56 117.920 117.920 121.796 -3.876 17919 79634 1 194 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.159 -0.099 17919 79635 1 194 . 1 1 56 56 LEU C C 56 180.810 180.810 179.126 1.684 17919 79636 1 194 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.295 0.414 17919 79637 1 194 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.229 -0.859 17919 79638 1 194 . 1 1 56 56 LEU H H 56 8.140 8.140 8.464 -0.324 17919 79639 1 194 . 1 1 57 57 SER N N 57 113.330 113.330 115.325 -1.995 17919 79640 1 194 . 1 1 57 57 SER HA H 57 4.370 4.370 4.119 0.251 17919 79641 1 194 . 1 1 57 57 SER C C 57 178.310 178.310 176.889 1.421 17919 79642 1 194 . 1 1 57 57 SER CA C 57 61.080 61.080 61.549 -0.469 17919 79643 1 194 . 1 1 57 57 SER CB C 57 62.530 62.530 62.657 -0.127 17919 79644 1 194 . 1 1 57 57 SER H H 57 8.470 8.470 8.415 0.055 17919 79645 1 194 . 1 1 58 58 ASP N N 58 124.190 124.190 122.164 2.026 17919 79646 1 194 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.243 0.053 17919 79647 1 194 . 1 1 58 58 ASP C C 58 177.400 177.400 177.504 -0.104 17919 79648 1 194 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.688 0.492 17919 79649 1 194 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.377 -0.277 17919 79650 1 194 . 1 1 58 58 ASP H H 58 7.930 7.930 7.819 0.111 17919 79651 1 194 . 1 1 59 59 TYR N N 59 115.510 115.510 115.056 0.454 17919 79652 1 194 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.559 0.111 17919 79653 1 194 . 1 1 59 59 TYR C C 59 174.700 174.700 174.961 -0.261 17919 79654 1 194 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.041 1.209 17919 79655 1 194 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.493 1.577 17919 79656 1 194 . 1 1 59 59 TYR H H 59 7.250 7.250 7.381 -0.131 17919 79657 1 194 . 1 1 60 60 ASN N N 60 115.900 115.900 116.754 -0.854 17919 79658 1 194 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.361 -0.006 17919 79659 1 194 . 1 1 60 60 ASN C C 60 174.340 174.340 174.749 -0.409 17919 79660 1 194 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.120 -0.000 17919 79661 1 194 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.103 0.306 17919 79662 1 194 . 1 1 60 60 ASN H H 60 8.150 8.150 7.662 0.488 17919 79663 1 194 . 1 1 61 61 ILE N N 61 118.600 118.600 118.323 0.277 17919 79664 1 194 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.993 -0.600 17919 79665 1 194 . 1 1 61 61 ILE C C 61 174.610 174.610 175.777 -1.167 17919 79666 1 194 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.723 0.697 17919 79667 1 194 . 1 1 61 61 ILE CB C 61 36.740 36.740 38.339 -1.599 17919 79668 1 194 . 1 1 61 61 ILE H H 61 7.250 7.250 7.744 -0.494 17919 79669 1 194 . 1 1 62 62 GLN N N 62 124.740 124.740 125.956 -1.216 17919 79670 1 194 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.673 -0.167 17919 79671 1 194 . 1 1 62 62 GLN C C 62 175.970 175.970 175.451 0.519 17919 79672 1 194 . 1 1 62 62 GLN CA C 62 53.660 53.660 54.169 -0.509 17919 79673 1 194 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.486 0.164 17919 79674 1 194 . 1 1 62 62 GLN H H 62 7.610 7.610 8.112 -0.502 17919 79675 1 194 . 1 1 63 63 LYS N N 63 120.300 120.300 122.580 -2.280 17919 79676 1 194 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.912 0.089 17919 79677 1 194 . 1 1 63 63 LYS C C 63 175.810 175.810 177.093 -1.283 17919 79678 1 194 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.104 -0.314 17919 79679 1 194 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.485 0.165 17919 79680 1 194 . 1 1 63 63 LYS H H 63 8.490 8.490 8.646 -0.156 17919 79681 1 194 . 1 1 64 64 GLU N N 64 113.950 113.950 119.829 -5.879 17919 79682 1 194 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.351 0.114 17919 79683 1 194 . 1 1 64 64 GLU C C 64 175.250 175.250 175.525 -0.275 17919 79684 1 194 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.735 0.155 17919 79685 1 194 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.940 -3.040 17919 79686 1 194 . 1 1 64 64 GLU H H 64 9.280 9.280 8.612 0.668 17919 79687 1 194 . 1 1 65 65 SER N N 65 114.730 114.730 115.182 -0.452 17919 79688 1 194 . 1 1 65 65 SER HA H 65 4.640 4.640 4.557 0.083 17919 79689 1 194 . 1 1 65 65 SER C C 65 172.160 172.160 173.626 -1.466 17919 79690 1 194 . 1 1 65 65 SER CA C 65 60.890 60.890 60.357 0.533 17919 79691 1 194 . 1 1 65 65 SER CB C 65 64.910 64.910 63.981 0.929 17919 79692 1 194 . 1 1 65 65 SER H H 65 7.670 7.670 7.504 0.166 17919 79693 1 194 . 1 1 66 66 THR N N 66 117.110 117.110 120.769 -3.659 17919 79694 1 194 . 1 1 66 66 THR HA H 66 5.270 5.270 5.164 0.106 17919 79695 1 194 . 1 1 66 66 THR C C 66 173.950 173.950 174.102 -0.152 17919 79696 1 194 . 1 1 66 66 THR CA C 66 62.340 62.340 62.142 0.198 17919 79697 1 194 . 1 1 66 66 THR CB C 66 70.080 70.080 69.844 0.236 17919 79698 1 194 . 1 1 66 66 THR H H 66 8.730 8.730 8.433 0.297 17919 79699 1 194 . 1 1 67 67 LEU N N 67 127.110 127.110 125.550 1.560 17919 79700 1 194 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.940 0.120 17919 79701 1 194 . 1 1 67 67 LEU C C 67 175.770 175.770 175.332 0.438 17919 79702 1 194 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.836 0.064 17919 79703 1 194 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.390 -0.130 17919 79704 1 194 . 1 1 67 67 LEU H H 67 9.410 9.410 9.190 0.220 17919 79705 1 194 . 1 1 68 68 HIS N N 68 118.380 118.380 120.987 -2.607 17919 79706 1 194 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.549 -0.309 17919 79707 1 194 . 1 1 68 68 HIS C C 68 173.150 173.150 173.613 -0.463 17919 79708 1 194 . 1 1 68 68 HIS CA C 68 55.000 55.000 53.794 1.206 17919 79709 1 194 . 1 1 68 68 HIS CB C 68 30.530 30.530 33.236 -2.706 17919 79710 1 194 . 1 1 68 68 HIS H H 68 9.230 9.230 8.989 0.241 17919 79711 1 194 . 1 1 69 69 LEU N N 69 124.460 124.460 129.921 -5.461 17919 79712 1 194 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.970 0.220 17919 79713 1 194 . 1 1 69 69 LEU C C 69 175.270 175.270 173.984 1.286 17919 79714 1 194 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.460 0.430 17919 79715 1 194 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.439 -0.059 17919 79716 1 194 . 1 1 69 69 LEU H H 69 8.340 8.340 8.524 -0.184 17919 79717 1 194 . 1 1 70 70 VAL N N 70 126.940 126.940 126.607 0.333 17919 79718 1 194 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.387 -0.037 17919 79719 1 194 . 1 1 70 70 VAL C C 70 174.000 174.000 174.263 -0.263 17919 79720 1 194 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.200 0.600 17919 79721 1 194 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.389 -0.479 17919 79722 1 194 . 1 1 70 70 VAL H H 70 9.200 9.200 9.080 0.120 17919 79723 1 194 . 1 1 71 71 LEU N N 71 123.130 123.130 124.322 -1.192 17919 79724 1 194 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.957 0.103 17919 79725 1 194 . 1 1 71 71 LEU C C 71 177.830 177.830 176.808 1.022 17919 79726 1 194 . 1 1 71 71 LEU CA C 71 53.940 53.940 52.864 1.076 17919 79727 1 194 . 1 1 71 71 LEU CB C 71 42.850 42.850 44.458 -1.607 17919 79728 1 194 . 1 1 71 71 LEU H H 71 8.120 8.120 8.480 -0.360 17919 79729 1 194 . 1 1 72 72 ARG N N 72 123.490 123.490 124.563 -1.073 17919 79730 1 194 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.247 0.054 17919 79731 1 194 . 1 1 72 72 ARG C C 72 175.350 175.350 175.782 -0.432 17919 79732 1 194 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.401 -0.791 17919 79733 1 194 . 1 1 72 72 ARG CB C 72 31.350 31.350 29.525 1.825 17919 79734 1 194 . 1 1 72 72 ARG H H 72 8.580 8.580 8.206 0.374 17919 79735 1 195 . 1 1 2 2 GLN N N 2 123.220 123.220 121.209 2.011 17919 79736 1 195 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.524 -0.275 17919 79737 1 195 . 1 1 2 2 GLN C C 2 175.920 175.920 175.274 0.646 17919 79738 1 195 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.706 0.374 17919 79739 1 195 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.527 0.233 17919 79740 1 195 . 1 1 2 2 GLN H H 2 8.900 8.900 8.412 0.488 17919 79741 1 195 . 1 1 3 3 ILE N N 3 115.340 115.340 115.561 -0.221 17919 79742 1 195 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.263 -0.050 17919 79743 1 195 . 1 1 3 3 ILE C C 3 172.450 172.450 173.211 -0.761 17919 79744 1 195 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.498 0.072 17919 79745 1 195 . 1 1 3 3 ILE CB C 3 42.210 42.210 42.120 0.090 17919 79746 1 195 . 1 1 3 3 ILE H H 3 8.320 8.320 8.415 -0.095 17919 79747 1 195 . 1 1 4 4 PHE N N 4 118.110 118.110 119.693 -1.583 17919 79748 1 195 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.730 -0.100 17919 79749 1 195 . 1 1 4 4 PHE C C 4 175.320 175.320 175.498 -0.178 17919 79750 1 195 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.024 0.186 17919 79751 1 195 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.665 -0.185 17919 79752 1 195 . 1 1 4 4 PHE H H 4 8.610 8.610 7.930 0.680 17919 79753 1 195 . 1 1 5 5 VAL N N 5 121.000 121.000 121.870 -0.870 17919 79754 1 195 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.689 0.036 17919 79755 1 195 . 1 1 5 5 VAL C C 5 174.870 174.870 174.605 0.265 17919 79756 1 195 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.264 -0.644 17919 79757 1 195 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.487 -0.257 17919 79758 1 195 . 1 1 5 5 VAL H H 5 9.300 9.300 9.332 -0.032 17919 79759 1 195 . 1 1 6 6 LYS N N 6 127.520 127.520 128.880 -1.360 17919 79760 1 195 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.283 0.084 17919 79761 1 195 . 1 1 6 6 LYS C C 6 177.140 177.140 176.380 0.760 17919 79762 1 195 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.806 -0.286 17919 79763 1 195 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.482 -0.432 17919 79764 1 195 . 1 1 6 6 LYS H H 6 8.820 8.820 9.332 -0.512 17919 79765 1 195 . 1 1 7 7 THR N N 7 115.400 115.400 118.552 -3.152 17919 79766 1 195 . 1 1 7 7 THR HA H 7 4.970 4.970 4.495 0.475 17919 79767 1 195 . 1 1 7 7 THR C C 7 176.910 176.910 176.028 0.882 17919 79768 1 195 . 1 1 7 7 THR CA C 7 60.470 60.470 61.460 -0.990 17919 79769 1 195 . 1 1 7 7 THR CB C 7 70.630 70.630 70.640 -0.010 17919 79770 1 195 . 1 1 7 7 THR H H 7 8.730 8.730 9.017 -0.287 17919 79771 1 195 . 1 1 8 8 LEU N N 8 121.330 121.330 122.455 -1.125 17919 79772 1 195 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.259 0.051 17919 79773 1 195 . 1 1 8 8 LEU C C 8 178.800 178.800 177.466 1.334 17919 79774 1 195 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.373 0.207 17919 79775 1 195 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.983 -0.013 17919 79776 1 195 . 1 1 8 8 LEU H H 8 9.100 9.100 8.407 0.693 17919 79777 1 195 . 1 1 9 9 THR N N 9 105.590 105.590 108.892 -3.302 17919 79778 1 195 . 1 1 9 9 THR HA H 9 4.428 4.428 4.410 0.018 17919 79779 1 195 . 1 1 9 9 THR C C 9 175.520 175.520 175.500 0.020 17919 79780 1 195 . 1 1 9 9 THR CA C 9 61.400 61.400 61.859 -0.459 17919 79781 1 195 . 1 1 9 9 THR CB C 9 69.140 69.140 69.446 -0.306 17919 79782 1 195 . 1 1 9 9 THR H H 9 7.630 7.630 7.480 0.150 17919 79783 1 195 . 1 1 10 10 GLY N N 10 108.890 108.890 111.172 -2.282 17919 79784 1 195 . 1 1 10 10 GLY C C 10 174.070 174.070 173.789 0.281 17919 79785 1 195 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.050 0.410 17919 79786 1 195 . 1 1 10 10 GLY H H 10 7.810 7.810 7.998 -0.188 17919 79787 1 195 . 1 1 11 11 LYS N N 11 121.600 121.600 121.060 0.540 17919 79788 1 195 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.571 -0.210 17919 79789 1 195 . 1 1 11 11 LYS C C 11 175.940 175.940 175.324 0.616 17919 79790 1 195 . 1 1 11 11 LYS CA C 11 56.280 56.280 55.625 0.655 17919 79791 1 195 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.935 -0.735 17919 79792 1 195 . 1 1 11 11 LYS H H 11 7.280 7.280 7.789 -0.509 17919 79793 1 195 . 1 1 12 12 THR N N 12 120.440 120.440 120.169 0.271 17919 79794 1 195 . 1 1 12 12 THR HA H 12 5.046 5.046 5.391 -0.345 17919 79795 1 195 . 1 1 12 12 THR C C 12 174.320 174.320 174.399 -0.079 17919 79796 1 195 . 1 1 12 12 THR CA C 12 62.390 62.390 61.466 0.924 17919 79797 1 195 . 1 1 12 12 THR CB C 12 69.910 69.910 70.186 -0.276 17919 79798 1 195 . 1 1 12 12 THR H H 12 8.650 8.650 8.331 0.319 17919 79799 1 195 . 1 1 13 13 ILE N N 13 127.110 127.110 123.194 3.916 17919 79800 1 195 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.724 -0.180 17919 79801 1 195 . 1 1 13 13 ILE C C 13 175.220 175.220 174.686 0.534 17919 79802 1 195 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.431 0.549 17919 79803 1 195 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.726 0.224 17919 79804 1 195 . 1 1 13 13 ILE H H 13 9.450 9.450 9.170 0.280 17919 79805 1 195 . 1 1 14 14 THR N N 14 121.520 121.520 120.231 1.289 17919 79806 1 195 . 1 1 14 14 THR HA H 14 4.964 4.964 5.258 -0.294 17919 79807 1 195 . 1 1 14 14 THR C C 14 173.790 173.790 174.161 -0.371 17919 79808 1 195 . 1 1 14 14 THR CA C 14 61.940 61.940 61.870 0.070 17919 79809 1 195 . 1 1 14 14 THR CB C 14 69.650 69.650 69.963 -0.313 17919 79810 1 195 . 1 1 14 14 THR H H 14 8.710 8.710 8.394 0.316 17919 79811 1 195 . 1 1 15 15 LEU N N 15 124.800 124.800 126.855 -2.055 17919 79812 1 195 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.714 0.066 17919 79813 1 195 . 1 1 15 15 LEU C C 15 174.670 174.670 175.558 -0.888 17919 79814 1 195 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.565 -0.735 17919 79815 1 195 . 1 1 15 15 LEU CB C 15 47.070 47.070 44.763 2.307 17919 79816 1 195 . 1 1 15 15 LEU H H 15 8.710 8.710 8.929 -0.219 17919 79817 1 195 . 1 1 16 16 GLU N N 16 122.160 122.160 122.355 -0.195 17919 79818 1 195 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.212 -0.295 17919 79819 1 195 . 1 1 16 16 GLU C C 16 175.860 175.860 175.634 0.226 17919 79820 1 195 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.699 -0.879 17919 79821 1 195 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.949 -1.499 17919 79822 1 195 . 1 1 16 16 GLU H H 16 8.140 8.140 8.697 -0.557 17919 79823 1 195 . 1 1 17 17 VAL N N 17 117.210 117.210 117.785 -0.575 17919 79824 1 195 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.864 -0.150 17919 79825 1 195 . 1 1 17 17 VAL C C 17 174.160 174.160 174.804 -0.644 17919 79826 1 195 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.594 -1.164 17919 79827 1 195 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.607 0.793 17919 79828 1 195 . 1 1 17 17 VAL H H 17 8.900 8.900 8.811 0.089 17919 79829 1 195 . 1 1 18 18 GLU N N 18 118.990 118.990 123.748 -4.758 17919 79830 1 195 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.824 0.255 17919 79831 1 195 . 1 1 18 18 GLU C C 18 176.160 176.160 175.541 0.619 17919 79832 1 195 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.358 0.362 17919 79833 1 195 . 1 1 18 18 GLU CB C 18 30.310 30.310 29.717 0.593 17919 79834 1 195 . 1 1 18 18 GLU H H 18 8.640 8.640 8.700 -0.060 17919 79835 1 195 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.274 -0.133 17919 79836 1 195 . 1 1 19 19 PRO C C 19 175.310 175.310 177.316 -2.006 17919 79837 1 195 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.237 0.233 17919 79838 1 195 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.971 -0.021 17919 79839 1 195 . 1 1 20 20 SER N N 20 103.400 103.400 109.120 -5.720 17919 79840 1 195 . 1 1 20 20 SER HA H 20 4.370 4.370 4.360 0.010 17919 79841 1 195 . 1 1 20 20 SER C C 20 174.660 174.660 174.607 0.053 17919 79842 1 195 . 1 1 20 20 SER CA C 20 57.400 57.400 58.340 -0.940 17919 79843 1 195 . 1 1 20 20 SER CB C 20 63.370 63.370 62.918 0.452 17919 79844 1 195 . 1 1 20 20 SER H H 20 7.040 7.040 7.925 -0.885 17919 79845 1 195 . 1 1 21 21 ASP N N 21 123.480 123.480 124.332 -0.852 17919 79846 1 195 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.756 -0.061 17919 79847 1 195 . 1 1 21 21 ASP C C 21 176.360 176.360 176.277 0.083 17919 79848 1 195 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.068 0.632 17919 79849 1 195 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.443 -0.643 17919 79850 1 195 . 1 1 21 21 ASP H H 21 8.030 8.030 7.724 0.306 17919 79851 1 195 . 1 1 22 22 THR N N 22 108.800 108.800 112.834 -4.034 17919 79852 1 195 . 1 1 22 22 THR HA H 22 4.920 4.920 4.593 0.327 17919 79853 1 195 . 1 1 22 22 THR C C 22 176.750 176.750 175.970 0.780 17919 79854 1 195 . 1 1 22 22 THR CA C 22 59.690 59.690 61.564 -1.874 17919 79855 1 195 . 1 1 22 22 THR CB C 22 71.200 71.200 70.621 0.579 17919 79856 1 195 . 1 1 22 22 THR H H 22 7.900 7.900 8.266 -0.366 17919 79857 1 195 . 1 1 23 23 ILE N N 23 121.190 121.190 122.349 -1.159 17919 79858 1 195 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.763 -0.106 17919 79859 1 195 . 1 1 23 23 ILE C C 23 179.040 179.040 177.768 1.272 17919 79860 1 195 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.546 -0.286 17919 79861 1 195 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.163 -1.812 17919 79862 1 195 . 1 1 23 23 ILE H H 23 8.560 8.560 9.050 -0.490 17919 79863 1 195 . 1 1 24 24 GLU N N 24 120.830 120.830 120.865 -0.035 17919 79864 1 195 . 1 1 24 24 GLU HA H 24 3.917 3.917 4.058 -0.141 17919 79865 1 195 . 1 1 24 24 GLU C C 24 178.640 178.640 179.009 -0.369 17919 79866 1 195 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.195 0.025 17919 79867 1 195 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.370 -1.090 17919 79868 1 195 . 1 1 24 24 GLU H H 24 9.760 9.760 8.302 1.458 17919 79869 1 195 . 1 1 25 25 ASN N N 25 120.570 120.570 117.081 3.489 17919 79870 1 195 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.561 -0.036 17919 79871 1 195 . 1 1 25 25 ASN C C 25 178.380 178.380 177.992 0.388 17919 79872 1 195 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.800 0.260 17919 79873 1 195 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.628 -0.178 17919 79874 1 195 . 1 1 25 25 ASN H H 25 7.920 7.920 7.719 0.201 17919 79875 1 195 . 1 1 26 26 VAL N N 26 121.710 121.710 121.208 0.502 17919 79876 1 195 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.688 -0.291 17919 79877 1 195 . 1 1 26 26 VAL C C 26 177.950 177.950 177.351 0.599 17919 79878 1 195 . 1 1 26 26 VAL CA C 26 67.660 67.660 65.976 1.684 17919 79879 1 195 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.201 -0.361 17919 79880 1 195 . 1 1 26 26 VAL H H 26 8.070 8.070 7.887 0.183 17919 79881 1 195 . 1 1 27 27 LYS N N 27 118.860 118.860 120.339 -1.479 17919 79882 1 195 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.238 0.342 17919 79883 1 195 . 1 1 27 27 LYS C C 27 180.550 180.550 179.162 1.388 17919 79884 1 195 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.579 -0.329 17919 79885 1 195 . 1 1 27 27 LYS CB C 27 33.730 33.730 31.965 1.765 17919 79886 1 195 . 1 1 27 27 LYS H H 27 8.560 8.560 8.589 -0.029 17919 79887 1 195 . 1 1 28 28 ALA N N 28 123.440 123.440 122.443 0.997 17919 79888 1 195 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.141 0.019 17919 79889 1 195 . 1 1 28 28 ALA C C 28 180.300 180.300 178.857 1.443 17919 79890 1 195 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.879 0.491 17919 79891 1 195 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.556 -0.846 17919 79892 1 195 . 1 1 28 28 ALA H H 28 8.060 8.060 7.947 0.113 17919 79893 1 195 . 1 1 29 29 LYS N N 29 119.940 119.940 118.665 1.275 17919 79894 1 195 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.093 0.114 17919 79895 1 195 . 1 1 29 29 LYS C C 29 180.320 180.320 178.437 1.883 17919 79896 1 195 . 1 1 29 29 LYS CA C 29 59.650 59.650 58.831 0.819 17919 79897 1 195 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.431 0.859 17919 79898 1 195 . 1 1 29 29 LYS H H 29 7.850 7.850 7.575 0.275 17919 79899 1 195 . 1 1 30 30 ILE N N 30 121.080 121.080 118.823 2.257 17919 79900 1 195 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.775 -0.268 17919 79901 1 195 . 1 1 30 30 ILE C C 30 178.310 178.310 177.340 0.970 17919 79902 1 195 . 1 1 30 30 ILE CA C 30 66.150 66.150 64.329 1.821 17919 79903 1 195 . 1 1 30 30 ILE CB C 30 36.800 36.800 38.166 -1.367 17919 79904 1 195 . 1 1 30 30 ILE H H 30 8.280 8.280 8.176 0.104 17919 79905 1 195 . 1 1 31 31 GLN N N 31 123.490 123.490 120.241 3.249 17919 79906 1 195 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.962 -0.133 17919 79907 1 195 . 1 1 31 31 GLN C C 31 178.890 178.890 178.546 0.344 17919 79908 1 195 . 1 1 31 31 GLN CA C 31 60.000 60.000 58.926 1.074 17919 79909 1 195 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.492 -0.772 17919 79910 1 195 . 1 1 31 31 GLN H H 31 8.580 8.580 7.849 0.731 17919 79911 1 195 . 1 1 32 32 ASP N N 32 119.360 119.360 117.902 1.458 17919 79912 1 195 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.521 -0.167 17919 79913 1 195 . 1 1 32 32 ASP C C 32 177.250 177.250 176.838 0.412 17919 79914 1 195 . 1 1 32 32 ASP CA C 32 57.190 57.190 55.931 1.259 17919 79915 1 195 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.667 -0.087 17919 79916 1 195 . 1 1 32 32 ASP H H 32 8.010 8.010 7.915 0.095 17919 79917 1 195 . 1 1 33 33 LYS N N 33 115.130 115.130 118.389 -3.259 17919 79918 1 195 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.544 -0.207 17919 79919 1 195 . 1 1 33 33 LYS C C 33 177.870 177.870 177.651 0.219 17919 79920 1 195 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.182 0.868 17919 79921 1 195 . 1 1 33 33 LYS CB C 33 34.170 34.170 34.401 -0.231 17919 79922 1 195 . 1 1 33 33 LYS H H 33 7.430 7.430 7.488 -0.058 17919 79923 1 195 . 1 1 34 34 GLU N N 34 113.870 113.870 115.259 -1.389 17919 79924 1 195 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.528 0.097 17919 79925 1 195 . 1 1 34 34 GLU C C 34 177.840 177.840 176.899 0.941 17919 79926 1 195 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.433 -0.263 17919 79927 1 195 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.932 0.728 17919 79928 1 195 . 1 1 34 34 GLU H H 34 8.740 8.740 8.325 0.415 17919 79929 1 195 . 1 1 35 35 GLY N N 35 108.650 108.650 108.759 -0.109 17919 79930 1 195 . 1 1 35 35 GLY C C 35 173.960 173.960 174.607 -0.647 17919 79931 1 195 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.999 0.081 17919 79932 1 195 . 1 1 35 35 GLY H H 35 8.530 8.530 7.774 0.756 17919 79933 1 195 . 1 1 36 36 ILE N N 36 119.880 119.880 121.671 -1.791 17919 79934 1 195 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.229 0.216 17919 79935 1 195 . 1 1 36 36 ILE C C 36 173.590 173.590 174.010 -0.420 17919 79936 1 195 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.194 -0.444 17919 79937 1 195 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.351 2.229 17919 79938 1 195 . 1 1 36 36 ILE H H 36 6.150 6.150 7.695 -1.545 17919 79939 1 195 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.471 0.163 17919 79940 1 195 . 1 1 37 37 PRO C C 37 176.940 176.940 176.159 0.781 17919 79941 1 195 . 1 1 37 37 PRO CA C 37 61.660 61.660 62.114 -0.454 17919 79942 1 195 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.365 0.485 17919 79943 1 195 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.225 -0.108 17919 79944 1 195 . 1 1 38 38 PRO C C 38 178.320 178.320 178.026 0.294 17919 79945 1 195 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.615 0.645 17919 79946 1 195 . 1 1 38 38 PRO CB C 38 32.890 32.890 32.040 0.850 17919 79947 1 195 . 1 1 39 39 ASP N N 39 113.380 113.380 116.238 -2.858 17919 79948 1 195 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.466 -0.036 17919 79949 1 195 . 1 1 39 39 ASP C C 39 177.090 177.090 176.978 0.112 17919 79950 1 195 . 1 1 39 39 ASP CA C 39 55.640 55.640 55.683 -0.043 17919 79951 1 195 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.321 -0.781 17919 79952 1 195 . 1 1 39 39 ASP H H 39 8.550 8.550 8.699 -0.149 17919 79953 1 195 . 1 1 40 40 GLN N N 40 116.780 116.780 116.456 0.324 17919 79954 1 195 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.434 0.030 17919 79955 1 195 . 1 1 40 40 GLN C C 40 175.380 175.380 176.538 -1.158 17919 79956 1 195 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.611 0.029 17919 79957 1 195 . 1 1 40 40 GLN CB C 40 30.140 30.140 30.349 -0.209 17919 79958 1 195 . 1 1 40 40 GLN H H 40 7.820 7.820 7.549 0.271 17919 79959 1 195 . 1 1 41 41 GLN N N 41 117.720 117.720 120.049 -2.329 17919 79960 1 195 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.129 0.115 17919 79961 1 195 . 1 1 41 41 GLN C C 41 176.300 176.300 175.875 0.425 17919 79962 1 195 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.803 -0.333 17919 79963 1 195 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.370 2.280 17919 79964 1 195 . 1 1 41 41 GLN H H 41 7.480 7.480 7.635 -0.155 17919 79965 1 195 . 1 1 42 42 ARG N N 42 122.680 122.680 123.086 -0.406 17919 79966 1 195 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.619 -0.119 17919 79967 1 195 . 1 1 42 42 ARG C C 42 174.050 174.050 174.525 -0.475 17919 79968 1 195 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.661 0.389 17919 79969 1 195 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.153 -1.403 17919 79970 1 195 . 1 1 42 42 ARG H H 42 8.530 8.530 8.490 0.040 17919 79971 1 195 . 1 1 43 43 LEU N N 43 124.040 124.040 125.596 -1.556 17919 79972 1 195 . 1 1 43 43 LEU C C 43 175.290 175.290 175.439 -0.149 17919 79973 1 195 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.182 -1.202 17919 79974 1 195 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.202 2.588 17919 79975 1 195 . 1 1 43 43 LEU H H 43 8.820 8.820 8.861 -0.041 17919 79976 1 195 . 1 1 44 44 ILE N N 44 121.920 121.920 123.496 -1.576 17919 79977 1 195 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.092 -0.100 17919 79978 1 195 . 1 1 44 44 ILE C C 44 176.060 176.060 174.288 1.772 17919 79979 1 195 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.265 -1.285 17919 79980 1 195 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.285 0.135 17919 79981 1 195 . 1 1 44 44 ILE H H 44 9.030 9.030 8.893 0.137 17919 79982 1 195 . 1 1 45 45 PHE N N 45 125.390 125.390 127.338 -1.948 17919 79983 1 195 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.961 0.084 17919 79984 1 195 . 1 1 45 45 PHE C C 45 174.470 174.470 174.291 0.179 17919 79985 1 195 . 1 1 45 45 PHE CA C 45 57.020 57.020 57.346 -0.326 17919 79986 1 195 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.111 0.649 17919 79987 1 195 . 1 1 45 45 PHE H H 45 8.830 8.830 9.169 -0.339 17919 79988 1 195 . 1 1 46 46 ALA N N 46 132.200 132.200 129.797 2.403 17919 79989 1 195 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.697 -0.007 17919 79990 1 195 . 1 1 46 46 ALA C C 46 177.290 177.290 177.870 -0.580 17919 79991 1 195 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.739 -0.199 17919 79992 1 195 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.678 -0.108 17919 79993 1 195 . 1 1 46 46 ALA H H 46 8.810 8.810 8.756 0.054 17919 79994 1 195 . 1 1 47 47 GLY N N 47 102.340 102.340 104.464 -2.124 17919 79995 1 195 . 1 1 47 47 GLY C C 47 173.810 173.810 174.509 -0.699 17919 79996 1 195 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.844 0.506 17919 79997 1 195 . 1 1 47 47 GLY H H 47 8.130 8.130 8.475 -0.345 17919 79998 1 195 . 1 1 48 48 LYS N N 48 121.570 121.570 122.188 -0.618 17919 79999 1 195 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.535 0.087 17919 80000 1 195 . 1 1 48 48 LYS C C 48 174.700 174.700 175.261 -0.561 17919 80001 1 195 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.110 -0.560 17919 80002 1 195 . 1 1 48 48 LYS CB C 48 34.530 34.530 33.890 0.640 17919 80003 1 195 . 1 1 48 48 LYS H H 48 7.980 7.980 7.583 0.397 17919 80004 1 195 . 1 1 49 49 GLN N N 49 122.410 122.410 123.452 -1.042 17919 80005 1 195 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.542 0.018 17919 80006 1 195 . 1 1 49 49 GLN C C 49 175.670 175.670 175.777 -0.107 17919 80007 1 195 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.017 -0.277 17919 80008 1 195 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.362 -0.362 17919 80009 1 195 . 1 1 49 49 GLN H H 49 8.600 8.600 8.561 0.039 17919 80010 1 195 . 1 1 50 50 LEU N N 50 125.520 125.520 128.672 -3.152 17919 80011 1 195 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.056 0.034 17919 80012 1 195 . 1 1 50 50 LEU C C 50 176.660 176.660 176.523 0.137 17919 80013 1 195 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.451 -0.211 17919 80014 1 195 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.990 -0.420 17919 80015 1 195 . 1 1 50 50 LEU H H 50 8.530 8.530 8.267 0.263 17919 80016 1 195 . 1 1 51 51 GLU N N 51 122.940 122.940 122.670 0.270 17919 80017 1 195 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.562 -0.074 17919 80018 1 195 . 1 1 51 51 GLU C C 51 175.870 175.870 177.115 -1.245 17919 80019 1 195 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.511 0.448 17919 80020 1 195 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.657 -0.087 17919 80021 1 195 . 1 1 51 51 GLU H H 51 8.400 8.400 8.497 -0.097 17919 80022 1 195 . 1 1 52 52 ASP N N 52 120.030 120.030 124.135 -4.105 17919 80023 1 195 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.481 -0.122 17919 80024 1 195 . 1 1 52 52 ASP C C 52 177.330 177.330 177.720 -0.390 17919 80025 1 195 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.815 -0.855 17919 80026 1 195 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.816 0.034 17919 80027 1 195 . 1 1 52 52 ASP H H 52 8.160 8.160 8.795 -0.635 17919 80028 1 195 . 1 1 53 53 GLY N N 53 106.660 106.660 105.900 0.760 17919 80029 1 195 . 1 1 53 53 GLY C C 53 174.870 174.870 174.503 0.367 17919 80030 1 195 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.135 0.035 17919 80031 1 195 . 1 1 53 53 GLY H H 53 9.390 9.390 8.549 0.841 17919 80032 1 195 . 1 1 54 54 ARG N N 54 119.050 119.050 119.491 -0.441 17919 80033 1 195 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.780 -0.085 17919 80034 1 195 . 1 1 54 54 ARG C C 54 175.350 175.350 175.201 0.149 17919 80035 1 195 . 1 1 54 54 ARG CA C 54 54.390 54.390 52.612 1.778 17919 80036 1 195 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.867 -0.217 17919 80037 1 195 . 1 1 54 54 ARG H H 54 7.460 7.460 7.405 0.055 17919 80038 1 195 . 1 1 55 55 THR N N 55 108.400 108.400 110.688 -2.288 17919 80039 1 195 . 1 1 55 55 THR HA H 55 5.240 5.240 5.188 0.052 17919 80040 1 195 . 1 1 55 55 THR C C 55 176.560 176.560 176.550 0.010 17919 80041 1 195 . 1 1 55 55 THR CA C 55 59.690 59.690 59.546 0.144 17919 80042 1 195 . 1 1 55 55 THR CB C 55 72.260 72.260 71.436 0.824 17919 80043 1 195 . 1 1 55 55 THR H H 55 8.730 8.730 8.742 -0.012 17919 80044 1 195 . 1 1 56 56 LEU N N 56 117.920 117.920 120.876 -2.956 17919 80045 1 195 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.900 0.160 17919 80046 1 195 . 1 1 56 56 LEU C C 56 180.810 180.810 178.871 1.939 17919 80047 1 195 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.767 -0.057 17919 80048 1 195 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.111 -0.741 17919 80049 1 195 . 1 1 56 56 LEU H H 56 8.140 8.140 8.638 -0.498 17919 80050 1 195 . 1 1 57 57 SER N N 57 113.330 113.330 114.420 -1.090 17919 80051 1 195 . 1 1 57 57 SER HA H 57 4.370 4.370 4.087 0.283 17919 80052 1 195 . 1 1 57 57 SER C C 57 178.310 178.310 177.069 1.241 17919 80053 1 195 . 1 1 57 57 SER CA C 57 61.080 61.080 61.428 -0.348 17919 80054 1 195 . 1 1 57 57 SER CB C 57 62.530 62.530 62.947 -0.417 17919 80055 1 195 . 1 1 57 57 SER H H 57 8.470 8.470 8.163 0.307 17919 80056 1 195 . 1 1 58 58 ASP N N 58 124.190 124.190 122.219 1.971 17919 80057 1 195 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.330 -0.034 17919 80058 1 195 . 1 1 58 58 ASP C C 58 177.400 177.400 177.577 -0.177 17919 80059 1 195 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.849 0.331 17919 80060 1 195 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.630 -0.530 17919 80061 1 195 . 1 1 58 58 ASP H H 58 7.930 7.930 7.775 0.155 17919 80062 1 195 . 1 1 59 59 TYR N N 59 115.510 115.510 115.344 0.166 17919 80063 1 195 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.727 -0.057 17919 80064 1 195 . 1 1 59 59 TYR C C 59 174.700 174.700 174.959 -0.259 17919 80065 1 195 . 1 1 59 59 TYR CA C 59 58.250 58.250 56.908 1.342 17919 80066 1 195 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.151 1.919 17919 80067 1 195 . 1 1 59 59 TYR H H 59 7.250 7.250 7.463 -0.213 17919 80068 1 195 . 1 1 60 60 ASN N N 60 115.900 115.900 116.673 -0.773 17919 80069 1 195 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.360 -0.005 17919 80070 1 195 . 1 1 60 60 ASN C C 60 174.340 174.340 174.489 -0.149 17919 80071 1 195 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.555 -0.435 17919 80072 1 195 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.719 -0.309 17919 80073 1 195 . 1 1 60 60 ASN H H 60 8.150 8.150 7.805 0.345 17919 80074 1 195 . 1 1 61 61 ILE N N 61 118.600 118.600 120.349 -1.749 17919 80075 1 195 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.821 -0.428 17919 80076 1 195 . 1 1 61 61 ILE C C 61 174.610 174.610 174.897 -0.287 17919 80077 1 195 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.527 -0.107 17919 80078 1 195 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.598 -0.858 17919 80079 1 195 . 1 1 61 61 ILE H H 61 7.250 7.250 8.097 -0.847 17919 80080 1 195 . 1 1 62 62 GLN N N 62 124.740 124.740 125.570 -0.830 17919 80081 1 195 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.684 -0.178 17919 80082 1 195 . 1 1 62 62 GLN C C 62 175.970 175.970 175.843 0.127 17919 80083 1 195 . 1 1 62 62 GLN CA C 62 53.660 53.660 52.661 0.999 17919 80084 1 195 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.692 -0.042 17919 80085 1 195 . 1 1 62 62 GLN H H 62 7.610 7.610 8.126 -0.516 17919 80086 1 195 . 1 1 63 63 LYS N N 63 120.300 120.300 120.019 0.281 17919 80087 1 195 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.133 -0.132 17919 80088 1 195 . 1 1 63 63 LYS C C 63 175.810 175.810 177.904 -2.094 17919 80089 1 195 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.411 0.379 17919 80090 1 195 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.478 0.172 17919 80091 1 195 . 1 1 63 63 LYS H H 63 8.490 8.490 8.551 -0.061 17919 80092 1 195 . 1 1 64 64 GLU N N 64 113.950 113.950 117.306 -3.356 17919 80093 1 195 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.549 -0.084 17919 80094 1 195 . 1 1 64 64 GLU C C 64 175.250 175.250 175.997 -0.747 17919 80095 1 195 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.555 0.335 17919 80096 1 195 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.401 -2.501 17919 80097 1 195 . 1 1 64 64 GLU H H 64 9.280 9.280 8.504 0.776 17919 80098 1 195 . 1 1 65 65 SER N N 65 114.730 114.730 118.007 -3.277 17919 80099 1 195 . 1 1 65 65 SER HA H 65 4.640 4.640 4.389 0.251 17919 80100 1 195 . 1 1 65 65 SER C C 65 172.160 172.160 174.155 -1.995 17919 80101 1 195 . 1 1 65 65 SER CA C 65 60.890 60.890 60.694 0.196 17919 80102 1 195 . 1 1 65 65 SER CB C 65 64.910 64.910 63.971 0.939 17919 80103 1 195 . 1 1 65 65 SER H H 65 7.670 7.670 7.240 0.430 17919 80104 1 195 . 1 1 66 66 THR N N 66 117.110 117.110 120.146 -3.036 17919 80105 1 195 . 1 1 66 66 THR HA H 66 5.270 5.270 4.900 0.370 17919 80106 1 195 . 1 1 66 66 THR C C 66 173.950 173.950 174.483 -0.533 17919 80107 1 195 . 1 1 66 66 THR CA C 66 62.340 62.340 62.206 0.134 17919 80108 1 195 . 1 1 66 66 THR CB C 66 70.080 70.080 70.211 -0.131 17919 80109 1 195 . 1 1 66 66 THR H H 66 8.730 8.730 8.517 0.213 17919 80110 1 195 . 1 1 67 67 LEU N N 67 127.110 127.110 127.665 -0.555 17919 80111 1 195 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.810 0.250 17919 80112 1 195 . 1 1 67 67 LEU C C 67 175.770 175.770 175.601 0.169 17919 80113 1 195 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.239 -0.339 17919 80114 1 195 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.688 0.572 17919 80115 1 195 . 1 1 67 67 LEU H H 67 9.410 9.410 8.764 0.646 17919 80116 1 195 . 1 1 68 68 HIS N N 68 118.380 118.380 121.424 -3.044 17919 80117 1 195 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.355 -0.115 17919 80118 1 195 . 1 1 68 68 HIS C C 68 173.150 173.150 173.625 -0.475 17919 80119 1 195 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.355 0.645 17919 80120 1 195 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.563 -2.033 17919 80121 1 195 . 1 1 68 68 HIS H H 68 9.230 9.230 8.654 0.576 17919 80122 1 195 . 1 1 69 69 LEU N N 69 124.460 124.460 128.965 -4.505 17919 80123 1 195 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.277 -0.087 17919 80124 1 195 . 1 1 69 69 LEU C C 69 175.270 175.270 173.897 1.373 17919 80125 1 195 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.468 0.422 17919 80126 1 195 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.170 0.210 17919 80127 1 195 . 1 1 69 69 LEU H H 69 8.340 8.340 8.708 -0.368 17919 80128 1 195 . 1 1 70 70 VAL N N 70 126.940 126.940 125.870 1.070 17919 80129 1 195 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.325 0.025 17919 80130 1 195 . 1 1 70 70 VAL C C 70 174.000 174.000 174.266 -0.266 17919 80131 1 195 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.233 0.568 17919 80132 1 195 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.689 -0.779 17919 80133 1 195 . 1 1 70 70 VAL H H 70 9.200 9.200 8.996 0.204 17919 80134 1 195 . 1 1 71 71 LEU N N 71 123.130 123.130 122.357 0.773 17919 80135 1 195 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.914 0.146 17919 80136 1 195 . 1 1 71 71 LEU C C 71 177.830 177.830 177.710 0.120 17919 80137 1 195 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.158 0.782 17919 80138 1 195 . 1 1 71 71 LEU CB C 71 42.850 42.850 44.392 -1.542 17919 80139 1 195 . 1 1 71 71 LEU H H 71 8.120 8.120 8.365 -0.245 17919 80140 1 195 . 1 1 72 72 ARG N N 72 123.490 123.490 124.475 -0.985 17919 80141 1 195 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.202 0.099 17919 80142 1 195 . 1 1 72 72 ARG C C 72 175.350 175.350 176.295 -0.945 17919 80143 1 195 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.436 -0.826 17919 80144 1 195 . 1 1 72 72 ARG CB C 72 31.350 31.350 28.536 2.814 17919 80145 1 195 . 1 1 72 72 ARG H H 72 8.580 8.580 8.520 0.060 17919 80146 1 196 . 1 1 2 2 GLN N N 2 123.220 123.220 125.311 -2.091 17919 80147 1 196 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.475 -0.226 17919 80148 1 196 . 1 1 2 2 GLN C C 2 175.920 175.920 174.962 0.958 17919 80149 1 196 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.559 0.520 17919 80150 1 196 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.811 -0.051 17919 80151 1 196 . 1 1 2 2 GLN H H 2 8.900 8.900 8.500 0.400 17919 80152 1 196 . 1 1 3 3 ILE N N 3 115.340 115.340 118.044 -2.704 17919 80153 1 196 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.759 -0.546 17919 80154 1 196 . 1 1 3 3 ILE C C 3 172.450 172.450 173.339 -0.889 17919 80155 1 196 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.505 0.064 17919 80156 1 196 . 1 1 3 3 ILE CB C 3 42.210 42.210 42.205 0.006 17919 80157 1 196 . 1 1 3 3 ILE H H 3 8.320 8.320 7.807 0.513 17919 80158 1 196 . 1 1 4 4 PHE N N 4 118.110 118.110 120.793 -2.683 17919 80159 1 196 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.297 0.333 17919 80160 1 196 . 1 1 4 4 PHE C C 4 175.320 175.320 175.070 0.250 17919 80161 1 196 . 1 1 4 4 PHE CA C 4 55.210 55.210 56.169 -0.959 17919 80162 1 196 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.727 -0.247 17919 80163 1 196 . 1 1 4 4 PHE H H 4 8.610 8.610 8.437 0.173 17919 80164 1 196 . 1 1 5 5 VAL N N 5 121.000 121.000 124.069 -3.069 17919 80165 1 196 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.610 0.115 17919 80166 1 196 . 1 1 5 5 VAL C C 5 174.870 174.870 174.614 0.256 17919 80167 1 196 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.629 -1.009 17919 80168 1 196 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.331 0.899 17919 80169 1 196 . 1 1 5 5 VAL H H 5 9.300 9.300 9.323 -0.023 17919 80170 1 196 . 1 1 6 6 LYS N N 6 127.520 127.520 129.486 -1.966 17919 80171 1 196 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.227 0.140 17919 80172 1 196 . 1 1 6 6 LYS C C 6 177.140 177.140 176.535 0.605 17919 80173 1 196 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.404 0.116 17919 80174 1 196 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.436 -0.386 17919 80175 1 196 . 1 1 6 6 LYS H H 6 8.820 8.820 9.322 -0.502 17919 80176 1 196 . 1 1 7 7 THR N N 7 115.400 115.400 121.684 -6.284 17919 80177 1 196 . 1 1 7 7 THR HA H 7 4.970 4.970 4.762 0.208 17919 80178 1 196 . 1 1 7 7 THR C C 7 176.910 176.910 175.790 1.120 17919 80179 1 196 . 1 1 7 7 THR CA C 7 60.470 60.470 62.933 -2.463 17919 80180 1 196 . 1 1 7 7 THR CB C 7 70.630 70.630 69.779 0.851 17919 80181 1 196 . 1 1 7 7 THR H H 7 8.730 8.730 8.917 -0.187 17919 80182 1 196 . 1 1 8 8 LEU N N 8 121.330 121.330 122.553 -1.223 17919 80183 1 196 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.474 -0.164 17919 80184 1 196 . 1 1 8 8 LEU C C 8 178.800 178.800 176.989 1.811 17919 80185 1 196 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.124 0.456 17919 80186 1 196 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.438 -0.468 17919 80187 1 196 . 1 1 8 8 LEU H H 8 9.100 9.100 8.587 0.513 17919 80188 1 196 . 1 1 9 9 THR N N 9 105.590 105.590 107.773 -2.183 17919 80189 1 196 . 1 1 9 9 THR HA H 9 4.428 4.428 4.409 0.019 17919 80190 1 196 . 1 1 9 9 THR C C 9 175.520 175.520 175.589 -0.069 17919 80191 1 196 . 1 1 9 9 THR CA C 9 61.400 61.400 61.319 0.081 17919 80192 1 196 . 1 1 9 9 THR CB C 9 69.140 69.140 68.649 0.491 17919 80193 1 196 . 1 1 9 9 THR H H 9 7.630 7.630 7.734 -0.104 17919 80194 1 196 . 1 1 10 10 GLY N N 10 108.890 108.890 110.566 -1.676 17919 80195 1 196 . 1 1 10 10 GLY C C 10 174.070 174.070 173.846 0.224 17919 80196 1 196 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.896 0.564 17919 80197 1 196 . 1 1 10 10 GLY H H 10 7.810 7.810 7.808 0.002 17919 80198 1 196 . 1 1 11 11 LYS N N 11 121.600 121.600 121.853 -0.253 17919 80199 1 196 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.577 -0.216 17919 80200 1 196 . 1 1 11 11 LYS C C 11 175.940 175.940 175.561 0.379 17919 80201 1 196 . 1 1 11 11 LYS CA C 11 56.280 56.280 55.293 0.987 17919 80202 1 196 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.548 -0.348 17919 80203 1 196 . 1 1 11 11 LYS H H 11 7.280 7.280 7.998 -0.718 17919 80204 1 196 . 1 1 12 12 THR N N 12 120.440 120.440 121.902 -1.462 17919 80205 1 196 . 1 1 12 12 THR HA H 12 5.046 5.046 5.141 -0.095 17919 80206 1 196 . 1 1 12 12 THR C C 12 174.320 174.320 174.703 -0.383 17919 80207 1 196 . 1 1 12 12 THR CA C 12 62.390 62.390 61.894 0.496 17919 80208 1 196 . 1 1 12 12 THR CB C 12 69.910 69.910 69.685 0.225 17919 80209 1 196 . 1 1 12 12 THR H H 12 8.650 8.650 8.466 0.184 17919 80210 1 196 . 1 1 13 13 ILE N N 13 127.110 127.110 122.993 4.117 17919 80211 1 196 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.752 -0.208 17919 80212 1 196 . 1 1 13 13 ILE C C 13 175.220 175.220 174.144 1.076 17919 80213 1 196 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.761 0.219 17919 80214 1 196 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.508 0.442 17919 80215 1 196 . 1 1 13 13 ILE H H 13 9.450 9.450 9.137 0.313 17919 80216 1 196 . 1 1 14 14 THR N N 14 121.520 121.520 122.146 -0.626 17919 80217 1 196 . 1 1 14 14 THR HA H 14 4.964 4.964 4.930 0.034 17919 80218 1 196 . 1 1 14 14 THR C C 14 173.790 173.790 173.864 -0.074 17919 80219 1 196 . 1 1 14 14 THR CA C 14 61.940 61.940 61.408 0.532 17919 80220 1 196 . 1 1 14 14 THR CB C 14 69.650 69.650 70.011 -0.361 17919 80221 1 196 . 1 1 14 14 THR H H 14 8.710 8.710 8.231 0.479 17919 80222 1 196 . 1 1 15 15 LEU N N 15 124.800 124.800 126.188 -1.388 17919 80223 1 196 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.639 0.141 17919 80224 1 196 . 1 1 15 15 LEU C C 15 174.670 174.670 174.780 -0.110 17919 80225 1 196 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.497 -0.667 17919 80226 1 196 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.512 1.558 17919 80227 1 196 . 1 1 15 15 LEU H H 15 8.710 8.710 8.896 -0.186 17919 80228 1 196 . 1 1 16 16 GLU N N 16 122.160 122.160 122.079 0.081 17919 80229 1 196 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.294 -0.377 17919 80230 1 196 . 1 1 16 16 GLU C C 16 175.860 175.860 175.267 0.593 17919 80231 1 196 . 1 1 16 16 GLU CA C 16 54.820 54.820 54.533 0.287 17919 80232 1 196 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.495 -1.045 17919 80233 1 196 . 1 1 16 16 GLU H H 16 8.140 8.140 8.389 -0.249 17919 80234 1 196 . 1 1 17 17 VAL N N 17 117.210 117.210 119.673 -2.463 17919 80235 1 196 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.624 0.090 17919 80236 1 196 . 1 1 17 17 VAL C C 17 174.160 174.160 174.811 -0.651 17919 80237 1 196 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.518 -1.088 17919 80238 1 196 . 1 1 17 17 VAL CB C 17 36.400 36.400 34.658 1.742 17919 80239 1 196 . 1 1 17 17 VAL H H 17 8.900 8.900 8.292 0.608 17919 80240 1 196 . 1 1 18 18 GLU N N 18 118.990 118.990 120.015 -1.025 17919 80241 1 196 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.796 0.283 17919 80242 1 196 . 1 1 18 18 GLU C C 18 176.160 176.160 175.649 0.511 17919 80243 1 196 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.846 -0.126 17919 80244 1 196 . 1 1 18 18 GLU CB C 18 30.310 30.310 31.241 -0.931 17919 80245 1 196 . 1 1 18 18 GLU H H 18 8.640 8.640 8.508 0.132 17919 80246 1 196 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.318 -0.177 17919 80247 1 196 . 1 1 19 19 PRO C C 19 175.310 175.310 176.993 -1.683 17919 80248 1 196 . 1 1 19 19 PRO CA C 19 65.470 65.470 64.522 0.948 17919 80249 1 196 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.882 0.068 17919 80250 1 196 . 1 1 20 20 SER N N 20 103.400 103.400 110.765 -7.365 17919 80251 1 196 . 1 1 20 20 SER HA H 20 4.370 4.370 4.347 0.023 17919 80252 1 196 . 1 1 20 20 SER C C 20 174.660 174.660 174.622 0.038 17919 80253 1 196 . 1 1 20 20 SER CA C 20 57.400 57.400 58.107 -0.707 17919 80254 1 196 . 1 1 20 20 SER CB C 20 63.370 63.370 63.022 0.348 17919 80255 1 196 . 1 1 20 20 SER H H 20 7.040 7.040 8.019 -0.979 17919 80256 1 196 . 1 1 21 21 ASP N N 21 123.480 123.480 124.344 -0.864 17919 80257 1 196 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.780 -0.085 17919 80258 1 196 . 1 1 21 21 ASP C C 21 176.360 176.360 175.223 1.137 17919 80259 1 196 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.025 1.675 17919 80260 1 196 . 1 1 21 21 ASP CB C 21 40.800 40.800 42.361 -1.561 17919 80261 1 196 . 1 1 21 21 ASP H H 21 8.030 8.030 7.649 0.381 17919 80262 1 196 . 1 1 22 22 THR N N 22 108.800 108.800 112.958 -4.158 17919 80263 1 196 . 1 1 22 22 THR HA H 22 4.920 4.920 4.891 0.029 17919 80264 1 196 . 1 1 22 22 THR C C 22 176.750 176.750 176.272 0.478 17919 80265 1 196 . 1 1 22 22 THR CA C 22 59.690 59.690 60.769 -1.079 17919 80266 1 196 . 1 1 22 22 THR CB C 22 71.200 71.200 71.343 -0.143 17919 80267 1 196 . 1 1 22 22 THR H H 22 7.900 7.900 8.153 -0.253 17919 80268 1 196 . 1 1 23 23 ILE N N 23 121.190 121.190 122.315 -1.125 17919 80269 1 196 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.838 -0.181 17919 80270 1 196 . 1 1 23 23 ILE C C 23 179.040 179.040 177.972 1.068 17919 80271 1 196 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.124 -0.865 17919 80272 1 196 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.308 -1.958 17919 80273 1 196 . 1 1 23 23 ILE H H 23 8.560 8.560 9.000 -0.440 17919 80274 1 196 . 1 1 24 24 GLU N N 24 120.830 120.830 122.576 -1.746 17919 80275 1 196 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.907 0.010 17919 80276 1 196 . 1 1 24 24 GLU C C 24 178.640 178.640 178.745 -0.105 17919 80277 1 196 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.139 0.081 17919 80278 1 196 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.503 -1.222 17919 80279 1 196 . 1 1 24 24 GLU H H 24 9.760 9.760 7.965 1.795 17919 80280 1 196 . 1 1 25 25 ASN N N 25 120.570 120.570 117.554 3.016 17919 80281 1 196 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.553 -0.028 17919 80282 1 196 . 1 1 25 25 ASN C C 25 178.380 178.380 178.207 0.173 17919 80283 1 196 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.658 0.402 17919 80284 1 196 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.486 -0.036 17919 80285 1 196 . 1 1 25 25 ASN H H 25 7.920 7.920 7.936 -0.016 17919 80286 1 196 . 1 1 26 26 VAL N N 26 121.710 121.710 121.151 0.559 17919 80287 1 196 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.704 -0.307 17919 80288 1 196 . 1 1 26 26 VAL C C 26 177.950 177.950 177.179 0.771 17919 80289 1 196 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.154 1.506 17919 80290 1 196 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.729 -0.889 17919 80291 1 196 . 1 1 26 26 VAL H H 26 8.070 8.070 8.700 -0.630 17919 80292 1 196 . 1 1 27 27 LYS N N 27 118.860 118.860 121.034 -2.174 17919 80293 1 196 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.142 0.438 17919 80294 1 196 . 1 1 27 27 LYS C C 27 180.550 180.550 178.874 1.676 17919 80295 1 196 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.835 -0.585 17919 80296 1 196 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.185 1.545 17919 80297 1 196 . 1 1 27 27 LYS H H 27 8.560 8.560 8.444 0.116 17919 80298 1 196 . 1 1 28 28 ALA N N 28 123.440 123.440 122.154 1.286 17919 80299 1 196 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.192 -0.032 17919 80300 1 196 . 1 1 28 28 ALA C C 28 180.300 180.300 179.022 1.278 17919 80301 1 196 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.866 0.504 17919 80302 1 196 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.585 -0.875 17919 80303 1 196 . 1 1 28 28 ALA H H 28 8.060 8.060 8.355 -0.295 17919 80304 1 196 . 1 1 29 29 LYS N N 29 119.940 119.940 119.692 0.248 17919 80305 1 196 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.088 0.118 17919 80306 1 196 . 1 1 29 29 LYS C C 29 180.320 180.320 179.001 1.319 17919 80307 1 196 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.249 0.401 17919 80308 1 196 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.483 0.807 17919 80309 1 196 . 1 1 29 29 LYS H H 29 7.850 7.850 7.687 0.163 17919 80310 1 196 . 1 1 30 30 ILE N N 30 121.080 121.080 120.425 0.655 17919 80311 1 196 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.594 -0.087 17919 80312 1 196 . 1 1 30 30 ILE C C 30 178.310 178.310 177.457 0.853 17919 80313 1 196 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.281 0.869 17919 80314 1 196 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.829 -1.029 17919 80315 1 196 . 1 1 30 30 ILE H H 30 8.280 8.280 8.257 0.023 17919 80316 1 196 . 1 1 31 31 GLN N N 31 123.490 123.490 120.322 3.168 17919 80317 1 196 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.896 -0.067 17919 80318 1 196 . 1 1 31 31 GLN C C 31 178.890 178.890 178.297 0.593 17919 80319 1 196 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.312 0.688 17919 80320 1 196 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.395 -0.675 17919 80321 1 196 . 1 1 31 31 GLN H H 31 8.580 8.580 8.209 0.371 17919 80322 1 196 . 1 1 32 32 ASP N N 32 119.360 119.360 120.565 -1.205 17919 80323 1 196 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.339 0.015 17919 80324 1 196 . 1 1 32 32 ASP C C 32 177.250 177.250 178.121 -0.871 17919 80325 1 196 . 1 1 32 32 ASP CA C 32 57.190 57.190 57.041 0.149 17919 80326 1 196 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.822 -0.241 17919 80327 1 196 . 1 1 32 32 ASP H H 32 8.010 8.010 8.378 -0.368 17919 80328 1 196 . 1 1 33 33 LYS N N 33 115.130 115.130 117.314 -2.184 17919 80329 1 196 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.348 -0.011 17919 80330 1 196 . 1 1 33 33 LYS C C 33 177.870 177.870 177.844 0.026 17919 80331 1 196 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.645 0.405 17919 80332 1 196 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.399 0.771 17919 80333 1 196 . 1 1 33 33 LYS H H 33 7.430 7.430 7.634 -0.204 17919 80334 1 196 . 1 1 34 34 GLU N N 34 113.870 113.870 114.540 -0.670 17919 80335 1 196 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.500 0.125 17919 80336 1 196 . 1 1 34 34 GLU C C 34 177.840 177.840 177.269 0.571 17919 80337 1 196 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.178 -1.008 17919 80338 1 196 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.860 0.800 17919 80339 1 196 . 1 1 34 34 GLU H H 34 8.740 8.740 8.148 0.592 17919 80340 1 196 . 1 1 35 35 GLY N N 35 108.650 108.650 108.482 0.168 17919 80341 1 196 . 1 1 35 35 GLY C C 35 173.960 173.960 174.332 -0.372 17919 80342 1 196 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.409 0.671 17919 80343 1 196 . 1 1 35 35 GLY H H 35 8.530 8.530 8.117 0.413 17919 80344 1 196 . 1 1 36 36 ILE N N 36 119.880 119.880 122.134 -2.254 17919 80345 1 196 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.332 0.113 17919 80346 1 196 . 1 1 36 36 ILE C C 36 173.590 173.590 173.948 -0.358 17919 80347 1 196 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.056 -0.306 17919 80348 1 196 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.445 2.135 17919 80349 1 196 . 1 1 36 36 ILE H H 36 6.150 6.150 7.764 -1.614 17919 80350 1 196 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.535 0.099 17919 80351 1 196 . 1 1 37 37 PRO C C 37 176.940 176.940 176.007 0.933 17919 80352 1 196 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.678 -0.018 17919 80353 1 196 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.274 0.576 17919 80354 1 196 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.149 -0.032 17919 80355 1 196 . 1 1 38 38 PRO C C 38 178.320 178.320 178.352 -0.032 17919 80356 1 196 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.570 0.690 17919 80357 1 196 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.880 1.010 17919 80358 1 196 . 1 1 39 39 ASP N N 39 113.380 113.380 116.817 -3.437 17919 80359 1 196 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.406 0.024 17919 80360 1 196 . 1 1 39 39 ASP C C 39 177.090 177.090 177.877 -0.787 17919 80361 1 196 . 1 1 39 39 ASP CA C 39 55.640 55.640 57.087 -1.447 17919 80362 1 196 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.629 -1.089 17919 80363 1 196 . 1 1 39 39 ASP H H 39 8.550 8.550 8.712 -0.162 17919 80364 1 196 . 1 1 40 40 GLN N N 40 116.780 116.780 118.383 -1.603 17919 80365 1 196 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.177 0.287 17919 80366 1 196 . 1 1 40 40 GLN C C 40 175.380 175.380 175.858 -0.478 17919 80367 1 196 . 1 1 40 40 GLN CA C 40 55.640 55.640 57.032 -1.392 17919 80368 1 196 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.178 0.962 17919 80369 1 196 . 1 1 40 40 GLN H H 40 7.820 7.820 8.121 -0.301 17919 80370 1 196 . 1 1 41 41 GLN N N 41 117.720 117.720 118.325 -0.605 17919 80371 1 196 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.460 -0.216 17919 80372 1 196 . 1 1 41 41 GLN C C 41 176.300 176.300 175.512 0.788 17919 80373 1 196 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.893 0.577 17919 80374 1 196 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.628 2.022 17919 80375 1 196 . 1 1 41 41 GLN H H 41 7.480 7.480 7.298 0.182 17919 80376 1 196 . 1 1 42 42 ARG N N 42 122.680 122.680 125.608 -2.928 17919 80377 1 196 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.631 -0.131 17919 80378 1 196 . 1 1 42 42 ARG C C 42 174.050 174.050 174.318 -0.268 17919 80379 1 196 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.056 0.994 17919 80380 1 196 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.025 -0.275 17919 80381 1 196 . 1 1 42 42 ARG H H 42 8.530 8.530 8.434 0.096 17919 80382 1 196 . 1 1 43 43 LEU N N 43 124.040 124.040 126.863 -2.823 17919 80383 1 196 . 1 1 43 43 LEU C C 43 175.290 175.290 175.655 -0.365 17919 80384 1 196 . 1 1 43 43 LEU CA C 43 52.980 52.980 55.170 -2.190 17919 80385 1 196 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.349 2.441 17919 80386 1 196 . 1 1 43 43 LEU H H 43 8.820 8.820 8.792 0.028 17919 80387 1 196 . 1 1 44 44 ILE N N 44 121.920 121.920 121.962 -0.042 17919 80388 1 196 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.948 0.044 17919 80389 1 196 . 1 1 44 44 ILE C C 44 176.060 176.060 174.300 1.760 17919 80390 1 196 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.249 -1.269 17919 80391 1 196 . 1 1 44 44 ILE CB C 44 41.420 41.420 40.699 0.721 17919 80392 1 196 . 1 1 44 44 ILE H H 44 9.030 9.030 8.813 0.217 17919 80393 1 196 . 1 1 45 45 PHE N N 45 125.390 125.390 126.808 -1.418 17919 80394 1 196 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.942 0.103 17919 80395 1 196 . 1 1 45 45 PHE C C 45 174.470 174.470 174.299 0.171 17919 80396 1 196 . 1 1 45 45 PHE CA C 45 57.020 57.020 57.008 0.012 17919 80397 1 196 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.693 0.067 17919 80398 1 196 . 1 1 45 45 PHE H H 45 8.830 8.830 8.877 -0.047 17919 80399 1 196 . 1 1 46 46 ALA N N 46 132.200 132.200 129.490 2.710 17919 80400 1 196 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.679 0.011 17919 80401 1 196 . 1 1 46 46 ALA C C 46 177.290 177.290 178.188 -0.898 17919 80402 1 196 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.441 0.099 17919 80403 1 196 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.869 -0.299 17919 80404 1 196 . 1 1 46 46 ALA H H 46 8.810 8.810 8.543 0.267 17919 80405 1 196 . 1 1 47 47 GLY N N 47 102.340 102.340 103.972 -1.632 17919 80406 1 196 . 1 1 47 47 GLY C C 47 173.810 173.810 174.662 -0.852 17919 80407 1 196 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.123 0.227 17919 80408 1 196 . 1 1 47 47 GLY H H 47 8.130 8.130 8.509 -0.379 17919 80409 1 196 . 1 1 48 48 LYS N N 48 121.570 121.570 122.044 -0.474 17919 80410 1 196 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.562 0.060 17919 80411 1 196 . 1 1 48 48 LYS C C 48 174.700 174.700 175.844 -1.144 17919 80412 1 196 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.208 -0.658 17919 80413 1 196 . 1 1 48 48 LYS CB C 48 34.530 34.530 33.824 0.706 17919 80414 1 196 . 1 1 48 48 LYS H H 48 7.980 7.980 7.825 0.155 17919 80415 1 196 . 1 1 49 49 GLN N N 49 122.410 122.410 121.770 0.640 17919 80416 1 196 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.432 0.128 17919 80417 1 196 . 1 1 49 49 GLN C C 49 175.670 175.670 176.071 -0.401 17919 80418 1 196 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.186 -0.446 17919 80419 1 196 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.469 -0.469 17919 80420 1 196 . 1 1 49 49 GLN H H 49 8.600 8.600 8.505 0.095 17919 80421 1 196 . 1 1 50 50 LEU N N 50 125.520 125.520 124.660 0.860 17919 80422 1 196 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.102 -0.012 17919 80423 1 196 . 1 1 50 50 LEU C C 50 176.660 176.660 176.098 0.562 17919 80424 1 196 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.932 0.308 17919 80425 1 196 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.965 -0.395 17919 80426 1 196 . 1 1 50 50 LEU H H 50 8.530 8.530 8.120 0.410 17919 80427 1 196 . 1 1 51 51 GLU N N 51 122.940 122.940 123.629 -0.689 17919 80428 1 196 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.568 -0.080 17919 80429 1 196 . 1 1 51 51 GLU C C 51 175.870 175.870 176.780 -0.910 17919 80430 1 196 . 1 1 51 51 GLU CA C 51 55.960 55.960 54.733 1.228 17919 80431 1 196 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.423 -0.853 17919 80432 1 196 . 1 1 51 51 GLU H H 51 8.400 8.400 8.482 -0.082 17919 80433 1 196 . 1 1 52 52 ASP N N 52 120.030 120.030 126.979 -6.949 17919 80434 1 196 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.407 -0.048 17919 80435 1 196 . 1 1 52 52 ASP C C 52 177.330 177.330 177.402 -0.072 17919 80436 1 196 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.578 -0.618 17919 80437 1 196 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.990 -0.140 17919 80438 1 196 . 1 1 52 52 ASP H H 52 8.160 8.160 8.785 -0.625 17919 80439 1 196 . 1 1 53 53 GLY N N 53 106.660 106.660 105.145 1.515 17919 80440 1 196 . 1 1 53 53 GLY C C 53 174.870 174.870 174.322 0.548 17919 80441 1 196 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.993 0.177 17919 80442 1 196 . 1 1 53 53 GLY H H 53 9.390 9.390 8.519 0.871 17919 80443 1 196 . 1 1 54 54 ARG N N 54 119.050 119.050 120.351 -1.301 17919 80444 1 196 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.843 -0.148 17919 80445 1 196 . 1 1 54 54 ARG C C 54 175.350 175.350 175.208 0.142 17919 80446 1 196 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.218 0.172 17919 80447 1 196 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.917 -1.267 17919 80448 1 196 . 1 1 54 54 ARG H H 54 7.460 7.460 7.624 -0.164 17919 80449 1 196 . 1 1 55 55 THR N N 55 108.400 108.400 112.239 -3.839 17919 80450 1 196 . 1 1 55 55 THR HA H 55 5.240 5.240 5.037 0.203 17919 80451 1 196 . 1 1 55 55 THR C C 55 176.560 176.560 175.862 0.698 17919 80452 1 196 . 1 1 55 55 THR CA C 55 59.690 59.690 60.200 -0.510 17919 80453 1 196 . 1 1 55 55 THR CB C 55 72.260 72.260 70.752 1.508 17919 80454 1 196 . 1 1 55 55 THR H H 55 8.730 8.730 9.058 -0.328 17919 80455 1 196 . 1 1 56 56 LEU N N 56 117.920 117.920 119.667 -1.747 17919 80456 1 196 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.201 -0.141 17919 80457 1 196 . 1 1 56 56 LEU C C 56 180.810 180.810 179.006 1.804 17919 80458 1 196 . 1 1 56 56 LEU CA C 56 58.710 58.710 57.828 0.882 17919 80459 1 196 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.498 -1.128 17919 80460 1 196 . 1 1 56 56 LEU H H 56 8.140 8.140 8.410 -0.270 17919 80461 1 196 . 1 1 57 57 SER N N 57 113.330 113.330 115.789 -2.459 17919 80462 1 196 . 1 1 57 57 SER HA H 57 4.370 4.370 4.150 0.220 17919 80463 1 196 . 1 1 57 57 SER C C 57 178.310 178.310 176.980 1.330 17919 80464 1 196 . 1 1 57 57 SER CA C 57 61.080 61.080 61.858 -0.778 17919 80465 1 196 . 1 1 57 57 SER CB C 57 62.530 62.530 62.671 -0.141 17919 80466 1 196 . 1 1 57 57 SER H H 57 8.470 8.470 8.428 0.042 17919 80467 1 196 . 1 1 58 58 ASP N N 58 124.190 124.190 120.834 3.356 17919 80468 1 196 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.318 -0.022 17919 80469 1 196 . 1 1 58 58 ASP C C 58 177.400 177.400 177.002 0.398 17919 80470 1 196 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.381 0.799 17919 80471 1 196 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.308 -0.208 17919 80472 1 196 . 1 1 58 58 ASP H H 58 7.930 7.930 7.898 0.032 17919 80473 1 196 . 1 1 59 59 TYR N N 59 115.510 115.510 115.572 -0.062 17919 80474 1 196 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.724 -0.054 17919 80475 1 196 . 1 1 59 59 TYR C C 59 174.700 174.700 174.886 -0.186 17919 80476 1 196 . 1 1 59 59 TYR CA C 59 58.250 58.250 56.363 1.887 17919 80477 1 196 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.827 1.243 17919 80478 1 196 . 1 1 59 59 TYR H H 59 7.250 7.250 7.290 -0.040 17919 80479 1 196 . 1 1 60 60 ASN N N 60 115.900 115.900 118.333 -2.433 17919 80480 1 196 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.420 -0.065 17919 80481 1 196 . 1 1 60 60 ASN C C 60 174.340 174.340 174.697 -0.357 17919 80482 1 196 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.279 -0.159 17919 80483 1 196 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.553 -0.143 17919 80484 1 196 . 1 1 60 60 ASN H H 60 8.150 8.150 7.946 0.204 17919 80485 1 196 . 1 1 61 61 ILE N N 61 118.600 118.600 119.929 -1.329 17919 80486 1 196 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.880 -0.487 17919 80487 1 196 . 1 1 61 61 ILE C C 61 174.610 174.610 174.663 -0.053 17919 80488 1 196 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.368 0.052 17919 80489 1 196 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.792 -1.052 17919 80490 1 196 . 1 1 61 61 ILE H H 61 7.250 7.250 7.904 -0.654 17919 80491 1 196 . 1 1 62 62 GLN N N 62 124.740 124.740 124.597 0.143 17919 80492 1 196 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.729 -0.223 17919 80493 1 196 . 1 1 62 62 GLN C C 62 175.970 175.970 175.531 0.439 17919 80494 1 196 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.503 0.157 17919 80495 1 196 . 1 1 62 62 GLN CB C 62 31.650 31.650 33.147 -1.497 17919 80496 1 196 . 1 1 62 62 GLN H H 62 7.610 7.610 8.165 -0.555 17919 80497 1 196 . 1 1 63 63 LYS N N 63 120.300 120.300 122.793 -2.493 17919 80498 1 196 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.968 0.033 17919 80499 1 196 . 1 1 63 63 LYS C C 63 175.810 175.810 177.179 -1.369 17919 80500 1 196 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.168 -0.378 17919 80501 1 196 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.440 0.210 17919 80502 1 196 . 1 1 63 63 LYS H H 63 8.490 8.490 8.745 -0.255 17919 80503 1 196 . 1 1 64 64 GLU N N 64 113.950 113.950 120.530 -6.580 17919 80504 1 196 . 1 1 64 64 GLU HA H 64 3.465 3.465 4.020 -0.555 17919 80505 1 196 . 1 1 64 64 GLU C C 64 175.250 175.250 175.800 -0.550 17919 80506 1 196 . 1 1 64 64 GLU CA C 64 57.890 57.890 58.413 -0.523 17919 80507 1 196 . 1 1 64 64 GLU CB C 64 25.900 25.900 29.255 -3.355 17919 80508 1 196 . 1 1 64 64 GLU H H 64 9.280 9.280 8.974 0.306 17919 80509 1 196 . 1 1 65 65 SER N N 65 114.730 114.730 114.485 0.245 17919 80510 1 196 . 1 1 65 65 SER HA H 65 4.640 4.640 4.460 0.180 17919 80511 1 196 . 1 1 65 65 SER C C 65 172.160 172.160 174.182 -2.022 17919 80512 1 196 . 1 1 65 65 SER CA C 65 60.890 60.890 59.859 1.031 17919 80513 1 196 . 1 1 65 65 SER CB C 65 64.910 64.910 64.413 0.497 17919 80514 1 196 . 1 1 65 65 SER H H 65 7.670 7.670 7.747 -0.077 17919 80515 1 196 . 1 1 66 66 THR N N 66 117.110 117.110 117.465 -0.355 17919 80516 1 196 . 1 1 66 66 THR HA H 66 5.270 5.270 5.437 -0.167 17919 80517 1 196 . 1 1 66 66 THR C C 66 173.950 173.950 174.294 -0.344 17919 80518 1 196 . 1 1 66 66 THR CA C 66 62.340 62.340 61.885 0.455 17919 80519 1 196 . 1 1 66 66 THR CB C 66 70.080 70.080 70.299 -0.219 17919 80520 1 196 . 1 1 66 66 THR H H 66 8.730 8.730 8.362 0.368 17919 80521 1 196 . 1 1 67 67 LEU N N 67 127.110 127.110 126.108 1.002 17919 80522 1 196 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.927 0.133 17919 80523 1 196 . 1 1 67 67 LEU C C 67 175.770 175.770 174.827 0.943 17919 80524 1 196 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.087 -0.187 17919 80525 1 196 . 1 1 67 67 LEU CB C 67 44.260 44.260 45.248 -0.988 17919 80526 1 196 . 1 1 67 67 LEU H H 67 9.410 9.410 9.209 0.201 17919 80527 1 196 . 1 1 68 68 HIS N N 68 118.380 118.380 122.168 -3.788 17919 80528 1 196 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.515 -0.275 17919 80529 1 196 . 1 1 68 68 HIS C C 68 173.150 173.150 173.663 -0.513 17919 80530 1 196 . 1 1 68 68 HIS CA C 68 55.000 55.000 53.901 1.099 17919 80531 1 196 . 1 1 68 68 HIS CB C 68 30.530 30.530 31.601 -1.071 17919 80532 1 196 . 1 1 68 68 HIS H H 68 9.230 9.230 8.519 0.711 17919 80533 1 196 . 1 1 69 69 LEU N N 69 124.460 124.460 130.206 -5.746 17919 80534 1 196 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.885 0.305 17919 80535 1 196 . 1 1 69 69 LEU C C 69 175.270 175.270 174.024 1.246 17919 80536 1 196 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.392 0.498 17919 80537 1 196 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.353 0.027 17919 80538 1 196 . 1 1 69 69 LEU H H 69 8.340 8.340 8.953 -0.613 17919 80539 1 196 . 1 1 70 70 VAL N N 70 126.940 126.940 126.555 0.385 17919 80540 1 196 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.211 0.139 17919 80541 1 196 . 1 1 70 70 VAL C C 70 174.000 174.000 174.791 -0.791 17919 80542 1 196 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.950 -0.150 17919 80543 1 196 . 1 1 70 70 VAL CB C 70 34.910 34.910 33.468 1.442 17919 80544 1 196 . 1 1 70 70 VAL H H 70 9.200 9.200 8.977 0.223 17919 80545 1 196 . 1 1 71 71 LEU N N 71 123.130 123.130 124.817 -1.687 17919 80546 1 196 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.581 0.479 17919 80547 1 196 . 1 1 71 71 LEU C C 71 177.830 177.830 177.127 0.703 17919 80548 1 196 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.890 0.050 17919 80549 1 196 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.910 -0.060 17919 80550 1 196 . 1 1 71 71 LEU H H 71 8.120 8.120 8.400 -0.280 17919 80551 1 196 . 1 1 72 72 ARG N N 72 123.490 123.490 124.524 -1.034 17919 80552 1 196 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.409 -0.108 17919 80553 1 196 . 1 1 72 72 ARG C C 72 175.350 175.350 175.316 0.034 17919 80554 1 196 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.855 -0.245 17919 80555 1 196 . 1 1 72 72 ARG CB C 72 31.350 31.350 31.272 0.078 17919 80556 1 196 . 1 1 72 72 ARG H H 72 8.580 8.580 8.502 0.078 17919 80557 1 197 . 1 1 2 2 GLN N N 2 123.220 123.220 121.814 1.406 17919 80558 1 197 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.367 -0.118 17919 80559 1 197 . 1 1 2 2 GLN C C 2 175.920 175.920 174.531 1.389 17919 80560 1 197 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.579 0.501 17919 80561 1 197 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.617 0.143 17919 80562 1 197 . 1 1 2 2 GLN H H 2 8.900 8.900 8.304 0.596 17919 80563 1 197 . 1 1 3 3 ILE N N 3 115.340 115.340 118.176 -2.836 17919 80564 1 197 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.407 -0.194 17919 80565 1 197 . 1 1 3 3 ILE C C 3 172.450 172.450 173.014 -0.564 17919 80566 1 197 . 1 1 3 3 ILE CA C 3 59.570 59.570 60.227 -0.657 17919 80567 1 197 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.301 0.909 17919 80568 1 197 . 1 1 3 3 ILE H H 3 8.320 8.320 8.504 -0.184 17919 80569 1 197 . 1 1 4 4 PHE N N 4 118.110 118.110 123.558 -5.448 17919 80570 1 197 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.457 0.173 17919 80571 1 197 . 1 1 4 4 PHE C C 4 175.320 175.320 175.484 -0.164 17919 80572 1 197 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.420 -0.210 17919 80573 1 197 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.499 -0.020 17919 80574 1 197 . 1 1 4 4 PHE H H 4 8.610 8.610 8.611 -0.001 17919 80575 1 197 . 1 1 5 5 VAL N N 5 121.000 121.000 121.435 -0.435 17919 80576 1 197 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.828 -0.103 17919 80577 1 197 . 1 1 5 5 VAL C C 5 174.870 174.870 174.767 0.103 17919 80578 1 197 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.080 -0.460 17919 80579 1 197 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.344 0.886 17919 80580 1 197 . 1 1 5 5 VAL H H 5 9.300 9.300 9.201 0.099 17919 80581 1 197 . 1 1 6 6 LYS N N 6 127.520 127.520 129.197 -1.677 17919 80582 1 197 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.372 -0.005 17919 80583 1 197 . 1 1 6 6 LYS C C 6 177.140 177.140 175.833 1.307 17919 80584 1 197 . 1 1 6 6 LYS CA C 6 54.520 54.520 53.688 0.832 17919 80585 1 197 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.979 -0.929 17919 80586 1 197 . 1 1 6 6 LYS H H 6 8.820 8.820 9.141 -0.321 17919 80587 1 197 . 1 1 7 7 THR N N 7 115.400 115.400 114.992 0.408 17919 80588 1 197 . 1 1 7 7 THR HA H 7 4.970 4.970 4.926 0.044 17919 80589 1 197 . 1 1 7 7 THR C C 7 176.910 176.910 176.257 0.653 17919 80590 1 197 . 1 1 7 7 THR CA C 7 60.470 60.470 59.639 0.831 17919 80591 1 197 . 1 1 7 7 THR CB C 7 70.630 70.630 71.156 -0.526 17919 80592 1 197 . 1 1 7 7 THR H H 7 8.730 8.730 8.766 -0.036 17919 80593 1 197 . 1 1 8 8 LEU N N 8 121.330 121.330 121.336 -0.006 17919 80594 1 197 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.314 -0.004 17919 80595 1 197 . 1 1 8 8 LEU C C 8 178.800 178.800 177.707 1.093 17919 80596 1 197 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.226 0.354 17919 80597 1 197 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.011 -0.041 17919 80598 1 197 . 1 1 8 8 LEU H H 8 9.100 9.100 8.705 0.395 17919 80599 1 197 . 1 1 9 9 THR N N 9 105.590 105.590 110.294 -4.704 17919 80600 1 197 . 1 1 9 9 THR HA H 9 4.428 4.428 4.298 0.130 17919 80601 1 197 . 1 1 9 9 THR C C 9 175.520 175.520 175.527 -0.007 17919 80602 1 197 . 1 1 9 9 THR CA C 9 61.400 61.400 62.004 -0.604 17919 80603 1 197 . 1 1 9 9 THR CB C 9 69.140 69.140 69.224 -0.084 17919 80604 1 197 . 1 1 9 9 THR H H 9 7.630 7.630 7.678 -0.048 17919 80605 1 197 . 1 1 10 10 GLY N N 10 108.890 108.890 110.977 -2.087 17919 80606 1 197 . 1 1 10 10 GLY C C 10 174.070 174.070 173.319 0.751 17919 80607 1 197 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.947 0.513 17919 80608 1 197 . 1 1 10 10 GLY H H 10 7.810 7.810 7.870 -0.060 17919 80609 1 197 . 1 1 11 11 LYS N N 11 121.600 121.600 121.829 -0.229 17919 80610 1 197 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.268 0.093 17919 80611 1 197 . 1 1 11 11 LYS C C 11 175.940 175.940 175.295 0.645 17919 80612 1 197 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.708 -0.428 17919 80613 1 197 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.537 -0.337 17919 80614 1 197 . 1 1 11 11 LYS H H 11 7.280 7.280 7.812 -0.532 17919 80615 1 197 . 1 1 12 12 THR N N 12 120.440 120.440 119.965 0.475 17919 80616 1 197 . 1 1 12 12 THR HA H 12 5.046 5.046 5.193 -0.147 17919 80617 1 197 . 1 1 12 12 THR C C 12 174.320 174.320 174.454 -0.134 17919 80618 1 197 . 1 1 12 12 THR CA C 12 62.390 62.390 61.739 0.651 17919 80619 1 197 . 1 1 12 12 THR CB C 12 69.910 69.910 70.271 -0.361 17919 80620 1 197 . 1 1 12 12 THR H H 12 8.650 8.650 8.289 0.361 17919 80621 1 197 . 1 1 13 13 ILE N N 13 127.110 127.110 125.569 1.541 17919 80622 1 197 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.614 -0.070 17919 80623 1 197 . 1 1 13 13 ILE C C 13 175.220 175.220 175.180 0.040 17919 80624 1 197 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.281 -0.301 17919 80625 1 197 . 1 1 13 13 ILE CB C 13 40.950 40.950 42.083 -1.133 17919 80626 1 197 . 1 1 13 13 ILE H H 13 9.450 9.450 9.096 0.354 17919 80627 1 197 . 1 1 14 14 THR N N 14 121.520 121.520 123.274 -1.754 17919 80628 1 197 . 1 1 14 14 THR HA H 14 4.964 4.964 4.618 0.346 17919 80629 1 197 . 1 1 14 14 THR C C 14 173.790 173.790 173.548 0.242 17919 80630 1 197 . 1 1 14 14 THR CA C 14 61.940 61.940 62.351 -0.411 17919 80631 1 197 . 1 1 14 14 THR CB C 14 69.650 69.650 69.505 0.145 17919 80632 1 197 . 1 1 14 14 THR H H 14 8.710 8.710 8.468 0.242 17919 80633 1 197 . 1 1 15 15 LEU N N 15 124.800 124.800 126.465 -1.665 17919 80634 1 197 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.842 -0.062 17919 80635 1 197 . 1 1 15 15 LEU C C 15 174.670 174.670 174.584 0.086 17919 80636 1 197 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.412 -0.582 17919 80637 1 197 . 1 1 15 15 LEU CB C 15 47.070 47.070 46.037 1.033 17919 80638 1 197 . 1 1 15 15 LEU H H 15 8.710 8.710 8.842 -0.132 17919 80639 1 197 . 1 1 16 16 GLU N N 16 122.160 122.160 122.890 -0.730 17919 80640 1 197 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.285 -0.367 17919 80641 1 197 . 1 1 16 16 GLU C C 16 175.860 175.860 175.467 0.393 17919 80642 1 197 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.085 -0.265 17919 80643 1 197 . 1 1 16 16 GLU CB C 16 29.450 29.450 31.570 -2.120 17919 80644 1 197 . 1 1 16 16 GLU H H 16 8.140 8.140 8.604 -0.464 17919 80645 1 197 . 1 1 17 17 VAL N N 17 117.210 117.210 120.451 -3.241 17919 80646 1 197 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.680 0.034 17919 80647 1 197 . 1 1 17 17 VAL C C 17 174.160 174.160 174.825 -0.665 17919 80648 1 197 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.004 -0.574 17919 80649 1 197 . 1 1 17 17 VAL CB C 17 36.400 36.400 34.938 1.462 17919 80650 1 197 . 1 1 17 17 VAL H H 17 8.900 8.900 8.976 -0.076 17919 80651 1 197 . 1 1 18 18 GLU N N 18 118.990 118.990 123.300 -4.310 17919 80652 1 197 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.773 0.306 17919 80653 1 197 . 1 1 18 18 GLU C C 18 176.160 176.160 175.645 0.515 17919 80654 1 197 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.785 -0.065 17919 80655 1 197 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.391 -0.081 17919 80656 1 197 . 1 1 18 18 GLU H H 18 8.640 8.640 8.624 0.016 17919 80657 1 197 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.330 -0.189 17919 80658 1 197 . 1 1 19 19 PRO C C 19 175.310 175.310 178.018 -2.708 17919 80659 1 197 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.163 0.307 17919 80660 1 197 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.997 -0.047 17919 80661 1 197 . 1 1 20 20 SER N N 20 103.400 103.400 113.091 -9.691 17919 80662 1 197 . 1 1 20 20 SER HA H 20 4.370 4.370 4.281 0.089 17919 80663 1 197 . 1 1 20 20 SER C C 20 174.660 174.660 174.228 0.432 17919 80664 1 197 . 1 1 20 20 SER CA C 20 57.400 57.400 59.576 -2.176 17919 80665 1 197 . 1 1 20 20 SER CB C 20 63.370 63.370 62.669 0.701 17919 80666 1 197 . 1 1 20 20 SER H H 20 7.040 7.040 8.163 -1.123 17919 80667 1 197 . 1 1 21 21 ASP N N 21 123.480 123.480 121.493 1.987 17919 80668 1 197 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.769 -0.074 17919 80669 1 197 . 1 1 21 21 ASP C C 21 176.360 176.360 175.794 0.566 17919 80670 1 197 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.458 1.242 17919 80671 1 197 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.828 -1.028 17919 80672 1 197 . 1 1 21 21 ASP H H 21 8.030 8.030 7.427 0.603 17919 80673 1 197 . 1 1 22 22 THR N N 22 108.800 108.800 112.492 -3.692 17919 80674 1 197 . 1 1 22 22 THR HA H 22 4.920 4.920 4.557 0.363 17919 80675 1 197 . 1 1 22 22 THR C C 22 176.750 176.750 175.892 0.858 17919 80676 1 197 . 1 1 22 22 THR CA C 22 59.690 59.690 61.752 -2.062 17919 80677 1 197 . 1 1 22 22 THR CB C 22 71.200 71.200 70.700 0.500 17919 80678 1 197 . 1 1 22 22 THR H H 22 7.900 7.900 8.230 -0.330 17919 80679 1 197 . 1 1 23 23 ILE N N 23 121.190 121.190 122.258 -1.068 17919 80680 1 197 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.883 -0.226 17919 80681 1 197 . 1 1 23 23 ILE C C 23 179.040 179.040 177.644 1.396 17919 80682 1 197 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.370 -0.110 17919 80683 1 197 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.245 -1.895 17919 80684 1 197 . 1 1 23 23 ILE H H 23 8.560 8.560 8.769 -0.209 17919 80685 1 197 . 1 1 24 24 GLU N N 24 120.830 120.830 121.905 -1.075 17919 80686 1 197 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.892 0.025 17919 80687 1 197 . 1 1 24 24 GLU C C 24 178.640 178.640 178.234 0.406 17919 80688 1 197 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.128 0.092 17919 80689 1 197 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.532 -1.252 17919 80690 1 197 . 1 1 24 24 GLU H H 24 9.760 9.760 8.202 1.558 17919 80691 1 197 . 1 1 25 25 ASN N N 25 120.570 120.570 118.234 2.336 17919 80692 1 197 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.472 0.053 17919 80693 1 197 . 1 1 25 25 ASN C C 25 178.380 178.380 177.856 0.524 17919 80694 1 197 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.245 -0.185 17919 80695 1 197 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.696 -0.246 17919 80696 1 197 . 1 1 25 25 ASN H H 25 7.920 7.920 7.732 0.188 17919 80697 1 197 . 1 1 26 26 VAL N N 26 121.710 121.710 120.493 1.217 17919 80698 1 197 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.542 -0.145 17919 80699 1 197 . 1 1 26 26 VAL C C 26 177.950 177.950 177.833 0.117 17919 80700 1 197 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.647 1.013 17919 80701 1 197 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.632 -0.792 17919 80702 1 197 . 1 1 26 26 VAL H H 26 8.070 8.070 7.945 0.125 17919 80703 1 197 . 1 1 27 27 LYS N N 27 118.860 118.860 120.199 -1.339 17919 80704 1 197 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.195 0.385 17919 80705 1 197 . 1 1 27 27 LYS C C 27 180.550 180.550 179.157 1.393 17919 80706 1 197 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.682 -0.432 17919 80707 1 197 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.271 1.459 17919 80708 1 197 . 1 1 27 27 LYS H H 27 8.560 8.560 8.210 0.350 17919 80709 1 197 . 1 1 28 28 ALA N N 28 123.440 123.440 121.629 1.811 17919 80710 1 197 . 1 1 28 28 ALA HA H 28 4.160 4.160 3.997 0.163 17919 80711 1 197 . 1 1 28 28 ALA C C 28 180.300 180.300 179.135 1.165 17919 80712 1 197 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.114 0.256 17919 80713 1 197 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.336 -0.626 17919 80714 1 197 . 1 1 28 28 ALA H H 28 8.060 8.060 8.200 -0.140 17919 80715 1 197 . 1 1 29 29 LYS N N 29 119.940 119.940 119.091 0.849 17919 80716 1 197 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.050 0.157 17919 80717 1 197 . 1 1 29 29 LYS C C 29 180.320 180.320 179.244 1.076 17919 80718 1 197 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.280 0.370 17919 80719 1 197 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.393 0.897 17919 80720 1 197 . 1 1 29 29 LYS H H 29 7.850 7.850 8.023 -0.173 17919 80721 1 197 . 1 1 30 30 ILE N N 30 121.080 121.080 120.714 0.366 17919 80722 1 197 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.651 -0.144 17919 80723 1 197 . 1 1 30 30 ILE C C 30 178.310 178.310 177.125 1.185 17919 80724 1 197 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.184 0.966 17919 80725 1 197 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.775 -0.975 17919 80726 1 197 . 1 1 30 30 ILE H H 30 8.280 8.280 8.100 0.180 17919 80727 1 197 . 1 1 31 31 GLN N N 31 123.490 123.490 121.141 2.349 17919 80728 1 197 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.003 -0.174 17919 80729 1 197 . 1 1 31 31 GLN C C 31 178.890 178.890 178.245 0.645 17919 80730 1 197 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.331 0.669 17919 80731 1 197 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.459 -0.739 17919 80732 1 197 . 1 1 31 31 GLN H H 31 8.580 8.580 8.105 0.475 17919 80733 1 197 . 1 1 32 32 ASP N N 32 119.360 119.360 119.704 -0.344 17919 80734 1 197 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.330 0.024 17919 80735 1 197 . 1 1 32 32 ASP C C 32 177.250 177.250 178.031 -0.781 17919 80736 1 197 . 1 1 32 32 ASP CA C 32 57.190 57.190 57.231 -0.041 17919 80737 1 197 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.735 -0.155 17919 80738 1 197 . 1 1 32 32 ASP H H 32 8.010 8.010 7.956 0.054 17919 80739 1 197 . 1 1 33 33 LYS N N 33 115.130 115.130 116.839 -1.709 17919 80740 1 197 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.284 0.053 17919 80741 1 197 . 1 1 33 33 LYS C C 33 177.870 177.870 177.926 -0.056 17919 80742 1 197 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.916 0.134 17919 80743 1 197 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.206 0.964 17919 80744 1 197 . 1 1 33 33 LYS H H 33 7.430 7.430 7.510 -0.080 17919 80745 1 197 . 1 1 34 34 GLU N N 34 113.870 113.870 113.925 -0.055 17919 80746 1 197 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.540 0.085 17919 80747 1 197 . 1 1 34 34 GLU C C 34 177.840 177.840 176.823 1.017 17919 80748 1 197 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.844 -0.674 17919 80749 1 197 . 1 1 34 34 GLU CB C 34 32.660 32.660 32.202 0.458 17919 80750 1 197 . 1 1 34 34 GLU H H 34 8.740 8.740 8.176 0.564 17919 80751 1 197 . 1 1 35 35 GLY N N 35 108.650 108.650 109.556 -0.906 17919 80752 1 197 . 1 1 35 35 GLY C C 35 173.960 173.960 174.252 -0.292 17919 80753 1 197 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.777 0.303 17919 80754 1 197 . 1 1 35 35 GLY H H 35 8.530 8.530 8.294 0.236 17919 80755 1 197 . 1 1 36 36 ILE N N 36 119.880 119.880 120.749 -0.869 17919 80756 1 197 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.301 0.144 17919 80757 1 197 . 1 1 36 36 ILE C C 36 173.590 173.590 174.168 -0.578 17919 80758 1 197 . 1 1 36 36 ILE CA C 36 57.750 57.750 56.690 1.060 17919 80759 1 197 . 1 1 36 36 ILE CB C 36 40.580 40.580 36.928 3.652 17919 80760 1 197 . 1 1 36 36 ILE H H 36 6.150 6.150 7.613 -1.463 17919 80761 1 197 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.645 -0.011 17919 80762 1 197 . 1 1 37 37 PRO C C 37 176.940 176.940 176.247 0.693 17919 80763 1 197 . 1 1 37 37 PRO CA C 37 61.660 61.660 62.240 -0.580 17919 80764 1 197 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.515 0.335 17919 80765 1 197 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.081 0.036 17919 80766 1 197 . 1 1 38 38 PRO C C 38 178.320 178.320 178.120 0.200 17919 80767 1 197 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.907 0.353 17919 80768 1 197 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.783 1.107 17919 80769 1 197 . 1 1 39 39 ASP N N 39 113.380 113.380 115.927 -2.547 17919 80770 1 197 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.343 0.087 17919 80771 1 197 . 1 1 39 39 ASP C C 39 177.090 177.090 177.312 -0.222 17919 80772 1 197 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.449 -0.809 17919 80773 1 197 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.231 -0.691 17919 80774 1 197 . 1 1 39 39 ASP H H 39 8.550 8.550 8.729 -0.179 17919 80775 1 197 . 1 1 40 40 GLN N N 40 116.780 116.780 116.196 0.584 17919 80776 1 197 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.348 0.116 17919 80777 1 197 . 1 1 40 40 GLN C C 40 175.380 175.380 175.117 0.263 17919 80778 1 197 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.047 -0.407 17919 80779 1 197 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.404 0.736 17919 80780 1 197 . 1 1 40 40 GLN H H 40 7.820 7.820 7.938 -0.118 17919 80781 1 197 . 1 1 41 41 GLN N N 41 117.720 117.720 119.241 -1.521 17919 80782 1 197 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.635 -0.391 17919 80783 1 197 . 1 1 41 41 GLN C C 41 176.300 176.300 174.743 1.557 17919 80784 1 197 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.324 1.146 17919 80785 1 197 . 1 1 41 41 GLN CB C 41 31.650 31.650 30.442 1.208 17919 80786 1 197 . 1 1 41 41 GLN H H 41 7.480 7.480 7.213 0.267 17919 80787 1 197 . 1 1 42 42 ARG N N 42 122.680 122.680 124.006 -1.326 17919 80788 1 197 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.644 -0.144 17919 80789 1 197 . 1 1 42 42 ARG C C 42 174.050 174.050 174.739 -0.689 17919 80790 1 197 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.744 0.306 17919 80791 1 197 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.153 -0.403 17919 80792 1 197 . 1 1 42 42 ARG H H 42 8.530 8.530 8.709 -0.179 17919 80793 1 197 . 1 1 43 43 LEU N N 43 124.040 124.040 126.211 -2.171 17919 80794 1 197 . 1 1 43 43 LEU C C 43 175.290 175.290 175.944 -0.654 17919 80795 1 197 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.991 -1.011 17919 80796 1 197 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.218 2.572 17919 80797 1 197 . 1 1 43 43 LEU H H 43 8.820 8.820 8.876 -0.056 17919 80798 1 197 . 1 1 44 44 ILE N N 44 121.920 121.920 122.398 -0.478 17919 80799 1 197 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.786 0.206 17919 80800 1 197 . 1 1 44 44 ILE C C 44 176.060 176.060 174.241 1.819 17919 80801 1 197 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.367 -1.387 17919 80802 1 197 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.648 -0.228 17919 80803 1 197 . 1 1 44 44 ILE H H 44 9.030 9.030 9.211 -0.181 17919 80804 1 197 . 1 1 45 45 PHE N N 45 125.390 125.390 126.925 -1.535 17919 80805 1 197 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.011 0.034 17919 80806 1 197 . 1 1 45 45 PHE C C 45 174.470 174.470 174.303 0.167 17919 80807 1 197 . 1 1 45 45 PHE CA C 45 57.020 57.020 57.271 -0.251 17919 80808 1 197 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.751 1.010 17919 80809 1 197 . 1 1 45 45 PHE H H 45 8.830 8.830 9.080 -0.250 17919 80810 1 197 . 1 1 46 46 ALA N N 46 132.200 132.200 131.321 0.879 17919 80811 1 197 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.628 0.062 17919 80812 1 197 . 1 1 46 46 ALA C C 46 177.290 177.290 177.026 0.264 17919 80813 1 197 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.611 -0.071 17919 80814 1 197 . 1 1 46 46 ALA CB C 46 16.570 16.570 17.087 -0.517 17919 80815 1 197 . 1 1 46 46 ALA H H 46 8.810 8.810 8.766 0.044 17919 80816 1 197 . 1 1 47 47 GLY N N 47 102.340 102.340 105.012 -2.672 17919 80817 1 197 . 1 1 47 47 GLY C C 47 173.810 173.810 174.765 -0.955 17919 80818 1 197 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.454 -0.104 17919 80819 1 197 . 1 1 47 47 GLY H H 47 8.130 8.130 8.530 -0.400 17919 80820 1 197 . 1 1 48 48 LYS N N 48 121.570 121.570 121.626 -0.056 17919 80821 1 197 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.514 0.108 17919 80822 1 197 . 1 1 48 48 LYS C C 48 174.700 174.700 175.340 -0.640 17919 80823 1 197 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.366 -0.816 17919 80824 1 197 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.206 0.324 17919 80825 1 197 . 1 1 48 48 LYS H H 48 7.980 7.980 7.454 0.526 17919 80826 1 197 . 1 1 49 49 GLN N N 49 122.410 122.410 122.664 -0.254 17919 80827 1 197 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.689 -0.129 17919 80828 1 197 . 1 1 49 49 GLN C C 49 175.670 175.670 176.006 -0.336 17919 80829 1 197 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.667 0.073 17919 80830 1 197 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.468 -0.468 17919 80831 1 197 . 1 1 49 49 GLN H H 49 8.600 8.600 8.478 0.122 17919 80832 1 197 . 1 1 50 50 LEU N N 50 125.520 125.520 127.588 -2.068 17919 80833 1 197 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.226 -0.136 17919 80834 1 197 . 1 1 50 50 LEU C C 50 176.660 176.660 176.640 0.020 17919 80835 1 197 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.496 -0.256 17919 80836 1 197 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.314 -0.744 17919 80837 1 197 . 1 1 50 50 LEU H H 50 8.530 8.530 8.047 0.483 17919 80838 1 197 . 1 1 51 51 GLU N N 51 122.940 122.940 123.200 -0.260 17919 80839 1 197 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.415 0.073 17919 80840 1 197 . 1 1 51 51 GLU C C 51 175.870 175.870 177.057 -1.187 17919 80841 1 197 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.923 0.037 17919 80842 1 197 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.009 0.561 17919 80843 1 197 . 1 1 51 51 GLU H H 51 8.400 8.400 8.560 -0.160 17919 80844 1 197 . 1 1 52 52 ASP N N 52 120.030 120.030 127.617 -7.587 17919 80845 1 197 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.423 -0.064 17919 80846 1 197 . 1 1 52 52 ASP C C 52 177.330 177.330 177.480 -0.150 17919 80847 1 197 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.170 -0.210 17919 80848 1 197 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.577 0.273 17919 80849 1 197 . 1 1 52 52 ASP H H 52 8.160 8.160 8.851 -0.691 17919 80850 1 197 . 1 1 53 53 GLY N N 53 106.660 106.660 104.924 1.736 17919 80851 1 197 . 1 1 53 53 GLY C C 53 174.870 174.870 174.548 0.322 17919 80852 1 197 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.967 0.203 17919 80853 1 197 . 1 1 53 53 GLY H H 53 9.390 9.390 8.502 0.888 17919 80854 1 197 . 1 1 54 54 ARG N N 54 119.050 119.050 119.203 -0.153 17919 80855 1 197 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.607 0.088 17919 80856 1 197 . 1 1 54 54 ARG C C 54 175.350 175.350 174.678 0.672 17919 80857 1 197 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.363 0.027 17919 80858 1 197 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.041 -0.391 17919 80859 1 197 . 1 1 54 54 ARG H H 54 7.460 7.460 7.384 0.076 17919 80860 1 197 . 1 1 55 55 THR N N 55 108.400 108.400 113.053 -4.653 17919 80861 1 197 . 1 1 55 55 THR HA H 55 5.240 5.240 5.126 0.114 17919 80862 1 197 . 1 1 55 55 THR C C 55 176.560 176.560 175.789 0.771 17919 80863 1 197 . 1 1 55 55 THR CA C 55 59.690 59.690 60.325 -0.635 17919 80864 1 197 . 1 1 55 55 THR CB C 55 72.260 72.260 70.661 1.599 17919 80865 1 197 . 1 1 55 55 THR H H 55 8.730 8.730 7.946 0.784 17919 80866 1 197 . 1 1 56 56 LEU N N 56 117.920 117.920 123.163 -5.243 17919 80867 1 197 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.903 0.157 17919 80868 1 197 . 1 1 56 56 LEU C C 56 180.810 180.810 178.923 1.887 17919 80869 1 197 . 1 1 56 56 LEU CA C 56 58.710 58.710 59.052 -0.342 17919 80870 1 197 . 1 1 56 56 LEU CB C 56 40.370 40.370 40.976 -0.606 17919 80871 1 197 . 1 1 56 56 LEU H H 56 8.140 8.140 8.612 -0.472 17919 80872 1 197 . 1 1 57 57 SER N N 57 113.330 113.330 114.071 -0.741 17919 80873 1 197 . 1 1 57 57 SER HA H 57 4.370 4.370 4.040 0.330 17919 80874 1 197 . 1 1 57 57 SER C C 57 178.310 178.310 176.800 1.510 17919 80875 1 197 . 1 1 57 57 SER CA C 57 61.080 61.080 62.266 -1.186 17919 80876 1 197 . 1 1 57 57 SER CB C 57 62.530 62.530 62.625 -0.095 17919 80877 1 197 . 1 1 57 57 SER H H 57 8.470 8.470 8.014 0.456 17919 80878 1 197 . 1 1 58 58 ASP N N 58 124.190 124.190 121.424 2.766 17919 80879 1 197 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.307 -0.011 17919 80880 1 197 . 1 1 58 58 ASP C C 58 177.400 177.400 177.460 -0.060 17919 80881 1 197 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.518 0.662 17919 80882 1 197 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.682 -0.582 17919 80883 1 197 . 1 1 58 58 ASP H H 58 7.930 7.930 7.420 0.510 17919 80884 1 197 . 1 1 59 59 TYR N N 59 115.510 115.510 116.058 -0.548 17919 80885 1 197 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.677 -0.007 17919 80886 1 197 . 1 1 59 59 TYR C C 59 174.700 174.700 174.846 -0.146 17919 80887 1 197 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.054 1.196 17919 80888 1 197 . 1 1 59 59 TYR CB C 59 40.070 40.070 37.628 2.442 17919 80889 1 197 . 1 1 59 59 TYR H H 59 7.250 7.250 7.436 -0.186 17919 80890 1 197 . 1 1 60 60 ASN N N 60 115.900 115.900 116.882 -0.982 17919 80891 1 197 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.398 -0.043 17919 80892 1 197 . 1 1 60 60 ASN C C 60 174.340 174.340 174.835 -0.495 17919 80893 1 197 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.069 0.051 17919 80894 1 197 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.579 -0.169 17919 80895 1 197 . 1 1 60 60 ASN H H 60 8.150 8.150 7.656 0.494 17919 80896 1 197 . 1 1 61 61 ILE N N 61 118.600 118.600 119.394 -0.794 17919 80897 1 197 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.763 -0.370 17919 80898 1 197 . 1 1 61 61 ILE C C 61 174.610 174.610 175.061 -0.451 17919 80899 1 197 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.203 0.217 17919 80900 1 197 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.630 -0.890 17919 80901 1 197 . 1 1 61 61 ILE H H 61 7.250 7.250 8.195 -0.945 17919 80902 1 197 . 1 1 62 62 GLN N N 62 124.740 124.740 125.439 -0.699 17919 80903 1 197 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.854 -0.348 17919 80904 1 197 . 1 1 62 62 GLN C C 62 175.970 175.970 175.665 0.305 17919 80905 1 197 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.186 0.474 17919 80906 1 197 . 1 1 62 62 GLN CB C 62 31.650 31.650 32.356 -0.706 17919 80907 1 197 . 1 1 62 62 GLN H H 62 7.610 7.610 7.963 -0.353 17919 80908 1 197 . 1 1 63 63 LYS N N 63 120.300 120.300 121.333 -1.033 17919 80909 1 197 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.114 -0.113 17919 80910 1 197 . 1 1 63 63 LYS C C 63 175.810 175.810 177.168 -1.358 17919 80911 1 197 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.908 -0.118 17919 80912 1 197 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.145 0.505 17919 80913 1 197 . 1 1 63 63 LYS H H 63 8.490 8.490 8.667 -0.177 17919 80914 1 197 . 1 1 64 64 GLU N N 64 113.950 113.950 119.345 -5.395 17919 80915 1 197 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.733 -0.268 17919 80916 1 197 . 1 1 64 64 GLU C C 64 175.250 175.250 176.172 -0.922 17919 80917 1 197 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.629 0.261 17919 80918 1 197 . 1 1 64 64 GLU CB C 64 25.900 25.900 29.086 -3.186 17919 80919 1 197 . 1 1 64 64 GLU H H 64 9.280 9.280 8.839 0.441 17919 80920 1 197 . 1 1 65 65 SER N N 65 114.730 114.730 115.053 -0.323 17919 80921 1 197 . 1 1 65 65 SER HA H 65 4.640 4.640 4.491 0.149 17919 80922 1 197 . 1 1 65 65 SER C C 65 172.160 172.160 173.552 -1.392 17919 80923 1 197 . 1 1 65 65 SER CA C 65 60.890 60.890 60.842 0.048 17919 80924 1 197 . 1 1 65 65 SER CB C 65 64.910 64.910 64.067 0.843 17919 80925 1 197 . 1 1 65 65 SER H H 65 7.670 7.670 7.497 0.173 17919 80926 1 197 . 1 1 66 66 THR N N 66 117.110 117.110 120.794 -3.684 17919 80927 1 197 . 1 1 66 66 THR HA H 66 5.270 5.270 5.091 0.179 17919 80928 1 197 . 1 1 66 66 THR C C 66 173.950 173.950 174.292 -0.342 17919 80929 1 197 . 1 1 66 66 THR CA C 66 62.340 62.340 62.039 0.301 17919 80930 1 197 . 1 1 66 66 THR CB C 66 70.080 70.080 69.984 0.096 17919 80931 1 197 . 1 1 66 66 THR H H 66 8.730 8.730 8.550 0.180 17919 80932 1 197 . 1 1 67 67 LEU N N 67 127.110 127.110 126.740 0.370 17919 80933 1 197 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.766 0.294 17919 80934 1 197 . 1 1 67 67 LEU C C 67 175.770 175.770 175.596 0.174 17919 80935 1 197 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.671 0.229 17919 80936 1 197 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.558 -0.298 17919 80937 1 197 . 1 1 67 67 LEU H H 67 9.410 9.410 8.743 0.667 17919 80938 1 197 . 1 1 68 68 HIS N N 68 118.380 118.380 119.908 -1.528 17919 80939 1 197 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.398 -0.158 17919 80940 1 197 . 1 1 68 68 HIS C C 68 173.150 173.150 174.037 -0.887 17919 80941 1 197 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.979 0.021 17919 80942 1 197 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.008 -1.478 17919 80943 1 197 . 1 1 68 68 HIS H H 68 9.230 9.230 8.996 0.234 17919 80944 1 197 . 1 1 69 69 LEU N N 69 124.460 124.460 127.315 -2.855 17919 80945 1 197 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.460 -0.270 17919 80946 1 197 . 1 1 69 69 LEU C C 69 175.270 175.270 174.356 0.914 17919 80947 1 197 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.286 0.604 17919 80948 1 197 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.417 -0.037 17919 80949 1 197 . 1 1 69 69 LEU H H 69 8.340 8.340 8.513 -0.173 17919 80950 1 197 . 1 1 70 70 VAL N N 70 126.940 126.940 125.529 1.411 17919 80951 1 197 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.434 -0.084 17919 80952 1 197 . 1 1 70 70 VAL C C 70 174.000 174.000 174.185 -0.185 17919 80953 1 197 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.851 -0.051 17919 80954 1 197 . 1 1 70 70 VAL CB C 70 34.910 34.910 34.180 0.730 17919 80955 1 197 . 1 1 70 70 VAL H H 70 9.200 9.200 9.103 0.097 17919 80956 1 197 . 1 1 71 71 LEU N N 71 123.130 123.130 126.902 -3.772 17919 80957 1 197 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.979 0.081 17919 80958 1 197 . 1 1 71 71 LEU C C 71 177.830 177.830 175.929 1.901 17919 80959 1 197 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.085 0.855 17919 80960 1 197 . 1 1 71 71 LEU CB C 71 42.850 42.850 44.431 -1.581 17919 80961 1 197 . 1 1 71 71 LEU H H 71 8.120 8.120 8.373 -0.253 17919 80962 1 197 . 1 1 72 72 ARG N N 72 123.490 123.490 125.606 -2.116 17919 80963 1 197 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.403 -0.102 17919 80964 1 197 . 1 1 72 72 ARG C C 72 175.350 175.350 175.614 -0.264 17919 80965 1 197 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.403 -0.793 17919 80966 1 197 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.888 0.462 17919 80967 1 197 . 1 1 72 72 ARG H H 72 8.580 8.580 8.311 0.269 17919 80968 1 198 . 1 1 2 2 GLN N N 2 123.220 123.220 120.149 3.071 17919 80969 1 198 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.420 -0.171 17919 80970 1 198 . 1 1 2 2 GLN C C 2 175.920 175.920 174.488 1.432 17919 80971 1 198 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.039 1.041 17919 80972 1 198 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.925 -0.166 17919 80973 1 198 . 1 1 2 2 GLN H H 2 8.900 8.900 8.040 0.860 17919 80974 1 198 . 1 1 3 3 ILE N N 3 115.340 115.340 115.819 -0.479 17919 80975 1 198 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.069 0.144 17919 80976 1 198 . 1 1 3 3 ILE C C 3 172.450 172.450 173.210 -0.760 17919 80977 1 198 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.217 0.353 17919 80978 1 198 . 1 1 3 3 ILE CB C 3 42.210 42.210 42.061 0.149 17919 80979 1 198 . 1 1 3 3 ILE H H 3 8.320 8.320 8.348 -0.028 17919 80980 1 198 . 1 1 4 4 PHE N N 4 118.110 118.110 120.364 -2.254 17919 80981 1 198 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.510 0.120 17919 80982 1 198 . 1 1 4 4 PHE C C 4 175.320 175.320 175.006 0.314 17919 80983 1 198 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.090 0.120 17919 80984 1 198 . 1 1 4 4 PHE CB C 4 41.480 41.480 40.799 0.681 17919 80985 1 198 . 1 1 4 4 PHE H H 4 8.610 8.610 8.436 0.174 17919 80986 1 198 . 1 1 5 5 VAL N N 5 121.000 121.000 122.066 -1.066 17919 80987 1 198 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.735 -0.010 17919 80988 1 198 . 1 1 5 5 VAL C C 5 174.870 174.870 174.789 0.081 17919 80989 1 198 . 1 1 5 5 VAL CA C 5 60.620 60.620 60.680 -0.060 17919 80990 1 198 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.571 -0.341 17919 80991 1 198 . 1 1 5 5 VAL H H 5 9.300 9.300 8.751 0.549 17919 80992 1 198 . 1 1 6 6 LYS N N 6 127.520 127.520 127.455 0.065 17919 80993 1 198 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.414 -0.047 17919 80994 1 198 . 1 1 6 6 LYS C C 6 177.140 177.140 176.178 0.962 17919 80995 1 198 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.656 -0.136 17919 80996 1 198 . 1 1 6 6 LYS CB C 6 35.050 35.050 36.358 -1.308 17919 80997 1 198 . 1 1 6 6 LYS H H 6 8.820 8.820 9.257 -0.437 17919 80998 1 198 . 1 1 7 7 THR N N 7 115.400 115.400 113.962 1.438 17919 80999 1 198 . 1 1 7 7 THR HA H 7 4.970 4.970 5.010 -0.040 17919 81000 1 198 . 1 1 7 7 THR C C 7 176.910 176.910 176.429 0.481 17919 81001 1 198 . 1 1 7 7 THR CA C 7 60.470 60.470 59.804 0.666 17919 81002 1 198 . 1 1 7 7 THR CB C 7 70.630 70.630 71.019 -0.389 17919 81003 1 198 . 1 1 7 7 THR H H 7 8.730 8.730 8.867 -0.137 17919 81004 1 198 . 1 1 8 8 LEU N N 8 121.330 121.330 122.012 -0.682 17919 81005 1 198 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.404 -0.094 17919 81006 1 198 . 1 1 8 8 LEU C C 8 178.800 178.800 177.005 1.795 17919 81007 1 198 . 1 1 8 8 LEU CA C 8 57.580 57.580 56.680 0.900 17919 81008 1 198 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.149 -0.179 17919 81009 1 198 . 1 1 8 8 LEU H H 8 9.100 9.100 8.706 0.394 17919 81010 1 198 . 1 1 9 9 THR N N 9 105.590 105.590 110.130 -4.540 17919 81011 1 198 . 1 1 9 9 THR HA H 9 4.428 4.428 4.405 0.023 17919 81012 1 198 . 1 1 9 9 THR C C 9 175.520 175.520 175.169 0.351 17919 81013 1 198 . 1 1 9 9 THR CA C 9 61.400 61.400 61.553 -0.153 17919 81014 1 198 . 1 1 9 9 THR CB C 9 69.140 69.140 69.308 -0.168 17919 81015 1 198 . 1 1 9 9 THR H H 9 7.630 7.630 7.844 -0.214 17919 81016 1 198 . 1 1 10 10 GLY N N 10 108.890 108.890 110.517 -1.627 17919 81017 1 198 . 1 1 10 10 GLY C C 10 174.070 174.070 173.553 0.517 17919 81018 1 198 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.937 0.523 17919 81019 1 198 . 1 1 10 10 GLY H H 10 7.810 7.810 7.826 -0.016 17919 81020 1 198 . 1 1 11 11 LYS N N 11 121.600 121.600 119.959 1.641 17919 81021 1 198 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.805 -0.444 17919 81022 1 198 . 1 1 11 11 LYS C C 11 175.940 175.940 174.982 0.958 17919 81023 1 198 . 1 1 11 11 LYS CA C 11 56.280 56.280 54.556 1.724 17919 81024 1 198 . 1 1 11 11 LYS CB C 11 33.200 33.200 34.770 -1.570 17919 81025 1 198 . 1 1 11 11 LYS H H 11 7.280 7.280 7.691 -0.411 17919 81026 1 198 . 1 1 12 12 THR N N 12 120.440 120.440 118.813 1.627 17919 81027 1 198 . 1 1 12 12 THR HA H 12 5.046 5.046 5.455 -0.409 17919 81028 1 198 . 1 1 12 12 THR C C 12 174.320 174.320 174.416 -0.096 17919 81029 1 198 . 1 1 12 12 THR CA C 12 62.390 62.390 61.574 0.816 17919 81030 1 198 . 1 1 12 12 THR CB C 12 69.910 69.910 69.992 -0.082 17919 81031 1 198 . 1 1 12 12 THR H H 12 8.650 8.650 8.406 0.244 17919 81032 1 198 . 1 1 13 13 ILE N N 13 127.110 127.110 128.263 -1.153 17919 81033 1 198 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.477 0.067 17919 81034 1 198 . 1 1 13 13 ILE C C 13 175.220 175.220 175.575 -0.355 17919 81035 1 198 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.427 -0.447 17919 81036 1 198 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.392 0.559 17919 81037 1 198 . 1 1 13 13 ILE H H 13 9.450 9.450 8.753 0.697 17919 81038 1 198 . 1 1 14 14 THR N N 14 121.520 121.520 123.142 -1.622 17919 81039 1 198 . 1 1 14 14 THR HA H 14 4.964 4.964 4.940 0.024 17919 81040 1 198 . 1 1 14 14 THR C C 14 173.790 173.790 173.986 -0.196 17919 81041 1 198 . 1 1 14 14 THR CA C 14 61.940 61.940 61.890 0.050 17919 81042 1 198 . 1 1 14 14 THR CB C 14 69.650 69.650 69.952 -0.302 17919 81043 1 198 . 1 1 14 14 THR H H 14 8.710 8.710 8.352 0.358 17919 81044 1 198 . 1 1 15 15 LEU N N 15 124.800 124.800 125.343 -0.543 17919 81045 1 198 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.716 0.064 17919 81046 1 198 . 1 1 15 15 LEU C C 15 174.670 174.670 175.014 -0.344 17919 81047 1 198 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.912 -1.082 17919 81048 1 198 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.747 1.323 17919 81049 1 198 . 1 1 15 15 LEU H H 15 8.710 8.710 8.989 -0.279 17919 81050 1 198 . 1 1 16 16 GLU N N 16 122.160 122.160 122.508 -0.348 17919 81051 1 198 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.413 -0.496 17919 81052 1 198 . 1 1 16 16 GLU C C 16 175.860 175.860 175.815 0.045 17919 81053 1 198 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.398 -0.578 17919 81054 1 198 . 1 1 16 16 GLU CB C 16 29.450 29.450 31.568 -2.118 17919 81055 1 198 . 1 1 16 16 GLU H H 16 8.140 8.140 8.715 -0.575 17919 81056 1 198 . 1 1 17 17 VAL N N 17 117.210 117.210 119.278 -2.068 17919 81057 1 198 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.947 -0.233 17919 81058 1 198 . 1 1 17 17 VAL C C 17 174.160 174.160 174.527 -0.367 17919 81059 1 198 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.243 -0.813 17919 81060 1 198 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.823 0.577 17919 81061 1 198 . 1 1 17 17 VAL H H 17 8.900 8.900 8.757 0.143 17919 81062 1 198 . 1 1 18 18 GLU N N 18 118.990 118.990 119.318 -0.328 17919 81063 1 198 . 1 1 18 18 GLU HA H 18 5.079 5.079 5.007 0.072 17919 81064 1 198 . 1 1 18 18 GLU C C 18 176.160 176.160 175.316 0.844 17919 81065 1 198 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.389 0.331 17919 81066 1 198 . 1 1 18 18 GLU CB C 18 30.310 30.310 31.738 -1.428 17919 81067 1 198 . 1 1 18 18 GLU H H 18 8.640 8.640 9.493 -0.853 17919 81068 1 198 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.231 -0.090 17919 81069 1 198 . 1 1 19 19 PRO C C 19 175.310 175.310 177.807 -2.497 17919 81070 1 198 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.684 -0.214 17919 81071 1 198 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.826 0.124 17919 81072 1 198 . 1 1 20 20 SER N N 20 103.400 103.400 109.680 -6.280 17919 81073 1 198 . 1 1 20 20 SER HA H 20 4.370 4.370 4.283 0.087 17919 81074 1 198 . 1 1 20 20 SER C C 20 174.660 174.660 174.935 -0.275 17919 81075 1 198 . 1 1 20 20 SER CA C 20 57.400 57.400 59.331 -1.931 17919 81076 1 198 . 1 1 20 20 SER CB C 20 63.370 63.370 62.613 0.757 17919 81077 1 198 . 1 1 20 20 SER H H 20 7.040 7.040 7.982 -0.942 17919 81078 1 198 . 1 1 21 21 ASP N N 21 123.480 123.480 124.931 -1.451 17919 81079 1 198 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.832 -0.137 17919 81080 1 198 . 1 1 21 21 ASP C C 21 176.360 176.360 175.889 0.471 17919 81081 1 198 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.757 0.943 17919 81082 1 198 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.794 -0.994 17919 81083 1 198 . 1 1 21 21 ASP H H 21 8.030 8.030 8.130 -0.100 17919 81084 1 198 . 1 1 22 22 THR N N 22 108.800 108.800 113.788 -4.988 17919 81085 1 198 . 1 1 22 22 THR HA H 22 4.920 4.920 4.778 0.142 17919 81086 1 198 . 1 1 22 22 THR C C 22 176.750 176.750 176.387 0.363 17919 81087 1 198 . 1 1 22 22 THR CA C 22 59.690 59.690 61.401 -1.710 17919 81088 1 198 . 1 1 22 22 THR CB C 22 71.200 71.200 70.208 0.992 17919 81089 1 198 . 1 1 22 22 THR H H 22 7.900 7.900 8.226 -0.326 17919 81090 1 198 . 1 1 23 23 ILE N N 23 121.190 121.190 122.637 -1.447 17919 81091 1 198 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.710 -0.053 17919 81092 1 198 . 1 1 23 23 ILE C C 23 179.040 179.040 178.102 0.938 17919 81093 1 198 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.767 -1.507 17919 81094 1 198 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.528 -2.178 17919 81095 1 198 . 1 1 23 23 ILE H H 23 8.560 8.560 8.340 0.220 17919 81096 1 198 . 1 1 24 24 GLU N N 24 120.830 120.830 119.069 1.761 17919 81097 1 198 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.949 -0.032 17919 81098 1 198 . 1 1 24 24 GLU C C 24 178.640 178.640 178.464 0.176 17919 81099 1 198 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.548 0.672 17919 81100 1 198 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.109 -0.829 17919 81101 1 198 . 1 1 24 24 GLU H H 24 9.760 9.760 8.566 1.194 17919 81102 1 198 . 1 1 25 25 ASN N N 25 120.570 120.570 117.753 2.817 17919 81103 1 198 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.520 0.005 17919 81104 1 198 . 1 1 25 25 ASN C C 25 178.380 178.380 177.763 0.617 17919 81105 1 198 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.126 -0.066 17919 81106 1 198 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.799 -0.349 17919 81107 1 198 . 1 1 25 25 ASN H H 25 7.920 7.920 7.645 0.275 17919 81108 1 198 . 1 1 26 26 VAL N N 26 121.710 121.710 120.304 1.406 17919 81109 1 198 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.661 -0.264 17919 81110 1 198 . 1 1 26 26 VAL C C 26 177.950 177.950 177.507 0.443 17919 81111 1 198 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.103 1.557 17919 81112 1 198 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.658 -0.818 17919 81113 1 198 . 1 1 26 26 VAL H H 26 8.070 8.070 8.295 -0.225 17919 81114 1 198 . 1 1 27 27 LYS N N 27 118.860 118.860 120.108 -1.248 17919 81115 1 198 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.110 0.470 17919 81116 1 198 . 1 1 27 27 LYS C C 27 180.550 180.550 178.771 1.779 17919 81117 1 198 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.272 -0.022 17919 81118 1 198 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.236 1.494 17919 81119 1 198 . 1 1 27 27 LYS H H 27 8.560 8.560 8.310 0.250 17919 81120 1 198 . 1 1 28 28 ALA N N 28 123.440 123.440 121.734 1.706 17919 81121 1 198 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.124 0.036 17919 81122 1 198 . 1 1 28 28 ALA C C 28 180.300 180.300 178.736 1.564 17919 81123 1 198 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.021 0.349 17919 81124 1 198 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.501 -0.791 17919 81125 1 198 . 1 1 28 28 ALA H H 28 8.060 8.060 8.188 -0.128 17919 81126 1 198 . 1 1 29 29 LYS N N 29 119.940 119.940 117.942 1.998 17919 81127 1 198 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.176 0.031 17919 81128 1 198 . 1 1 29 29 LYS C C 29 180.320 180.320 178.259 2.061 17919 81129 1 198 . 1 1 29 29 LYS CA C 29 59.650 59.650 58.484 1.166 17919 81130 1 198 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.522 0.768 17919 81131 1 198 . 1 1 29 29 LYS H H 29 7.850 7.850 7.463 0.387 17919 81132 1 198 . 1 1 30 30 ILE N N 30 121.080 121.080 119.228 1.852 17919 81133 1 198 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.774 -0.267 17919 81134 1 198 . 1 1 30 30 ILE C C 30 178.310 178.310 176.947 1.363 17919 81135 1 198 . 1 1 30 30 ILE CA C 30 66.150 66.150 64.319 1.831 17919 81136 1 198 . 1 1 30 30 ILE CB C 30 36.800 36.800 38.082 -1.282 17919 81137 1 198 . 1 1 30 30 ILE H H 30 8.280 8.280 7.672 0.608 17919 81138 1 198 . 1 1 31 31 GLN N N 31 123.490 123.490 120.224 3.266 17919 81139 1 198 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.961 -0.132 17919 81140 1 198 . 1 1 31 31 GLN C C 31 178.890 178.890 177.874 1.016 17919 81141 1 198 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.099 0.901 17919 81142 1 198 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.570 -0.850 17919 81143 1 198 . 1 1 31 31 GLN H H 31 8.580 8.580 8.145 0.435 17919 81144 1 198 . 1 1 32 32 ASP N N 32 119.360 119.360 118.327 1.033 17919 81145 1 198 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.494 -0.140 17919 81146 1 198 . 1 1 32 32 ASP C C 32 177.250 177.250 177.615 -0.365 17919 81147 1 198 . 1 1 32 32 ASP CA C 32 57.190 57.190 55.948 1.242 17919 81148 1 198 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.800 -0.220 17919 81149 1 198 . 1 1 32 32 ASP H H 32 8.010 8.010 7.947 0.063 17919 81150 1 198 . 1 1 33 33 LYS N N 33 115.130 115.130 118.694 -3.564 17919 81151 1 198 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.415 -0.078 17919 81152 1 198 . 1 1 33 33 LYS C C 33 177.870 177.870 177.623 0.247 17919 81153 1 198 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.796 0.254 17919 81154 1 198 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.836 0.334 17919 81155 1 198 . 1 1 33 33 LYS H H 33 7.430 7.430 7.818 -0.388 17919 81156 1 198 . 1 1 34 34 GLU N N 34 113.870 113.870 116.332 -2.462 17919 81157 1 198 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.535 0.090 17919 81158 1 198 . 1 1 34 34 GLU C C 34 177.840 177.840 176.953 0.887 17919 81159 1 198 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.096 0.074 17919 81160 1 198 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.726 0.934 17919 81161 1 198 . 1 1 34 34 GLU H H 34 8.740 8.740 8.387 0.353 17919 81162 1 198 . 1 1 35 35 GLY N N 35 108.650 108.650 107.805 0.845 17919 81163 1 198 . 1 1 35 35 GLY C C 35 173.960 173.960 174.709 -0.749 17919 81164 1 198 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.485 0.595 17919 81165 1 198 . 1 1 35 35 GLY H H 35 8.530 8.530 7.751 0.779 17919 81166 1 198 . 1 1 36 36 ILE N N 36 119.880 119.880 121.768 -1.888 17919 81167 1 198 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.164 0.281 17919 81168 1 198 . 1 1 36 36 ILE C C 36 173.590 173.590 173.980 -0.390 17919 81169 1 198 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.479 -0.729 17919 81170 1 198 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.100 2.480 17919 81171 1 198 . 1 1 36 36 ILE H H 36 6.150 6.150 7.667 -1.517 17919 81172 1 198 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.523 0.111 17919 81173 1 198 . 1 1 37 37 PRO C C 37 176.940 176.940 175.981 0.959 17919 81174 1 198 . 1 1 37 37 PRO CA C 37 61.660 61.660 62.065 -0.405 17919 81175 1 198 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.599 0.252 17919 81176 1 198 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.167 -0.050 17919 81177 1 198 . 1 1 38 38 PRO C C 38 178.320 178.320 178.461 -0.141 17919 81178 1 198 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.567 0.693 17919 81179 1 198 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.990 0.900 17919 81180 1 198 . 1 1 39 39 ASP N N 39 113.380 113.380 115.261 -1.881 17919 81181 1 198 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.370 0.060 17919 81182 1 198 . 1 1 39 39 ASP C C 39 177.090 177.090 178.260 -1.170 17919 81183 1 198 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.779 -1.139 17919 81184 1 198 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.597 -1.057 17919 81185 1 198 . 1 1 39 39 ASP H H 39 8.550 8.550 8.735 -0.185 17919 81186 1 198 . 1 1 40 40 GLN N N 40 116.780 116.780 117.430 -0.650 17919 81187 1 198 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.360 0.104 17919 81188 1 198 . 1 1 40 40 GLN C C 40 175.380 175.380 176.533 -1.153 17919 81189 1 198 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.283 -0.643 17919 81190 1 198 . 1 1 40 40 GLN CB C 40 30.140 30.140 30.200 -0.060 17919 81191 1 198 . 1 1 40 40 GLN H H 40 7.820 7.820 8.061 -0.241 17919 81192 1 198 . 1 1 41 41 GLN N N 41 117.720 117.720 120.355 -2.635 17919 81193 1 198 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.092 0.152 17919 81194 1 198 . 1 1 41 41 GLN C C 41 176.300 176.300 175.252 1.048 17919 81195 1 198 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.910 -0.440 17919 81196 1 198 . 1 1 41 41 GLN CB C 41 31.650 31.650 28.532 3.118 17919 81197 1 198 . 1 1 41 41 GLN H H 41 7.480 7.480 7.373 0.107 17919 81198 1 198 . 1 1 42 42 ARG N N 42 122.680 122.680 126.472 -3.792 17919 81199 1 198 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.526 -0.026 17919 81200 1 198 . 1 1 42 42 ARG C C 42 174.050 174.050 173.994 0.056 17919 81201 1 198 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.096 -0.046 17919 81202 1 198 . 1 1 42 42 ARG CB C 42 31.750 31.750 31.730 0.020 17919 81203 1 198 . 1 1 42 42 ARG H H 42 8.530 8.530 8.931 -0.401 17919 81204 1 198 . 1 1 43 43 LEU N N 43 124.040 124.040 128.476 -4.436 17919 81205 1 198 . 1 1 43 43 LEU C C 43 175.290 175.290 174.874 0.416 17919 81206 1 198 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.254 -1.274 17919 81207 1 198 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.336 1.454 17919 81208 1 198 . 1 1 43 43 LEU H H 43 8.820 8.820 8.795 0.025 17919 81209 1 198 . 1 1 44 44 ILE N N 44 121.920 121.920 127.868 -5.948 17919 81210 1 198 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.084 -0.092 17919 81211 1 198 . 1 1 44 44 ILE C C 44 176.060 176.060 174.348 1.712 17919 81212 1 198 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.917 -0.938 17919 81213 1 198 . 1 1 44 44 ILE CB C 44 41.420 41.420 40.794 0.626 17919 81214 1 198 . 1 1 44 44 ILE H H 44 9.030 9.030 9.223 -0.193 17919 81215 1 198 . 1 1 45 45 PHE N N 45 125.390 125.390 128.536 -3.146 17919 81216 1 198 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.847 0.198 17919 81217 1 198 . 1 1 45 45 PHE C C 45 174.470 174.470 175.249 -0.779 17919 81218 1 198 . 1 1 45 45 PHE CA C 45 57.020 57.020 55.920 1.100 17919 81219 1 198 . 1 1 45 45 PHE CB C 45 43.760 43.760 41.619 2.141 17919 81220 1 198 . 1 1 45 45 PHE H H 45 8.830 8.830 8.575 0.255 17919 81221 1 198 . 1 1 46 46 ALA N N 46 132.200 132.200 130.035 2.165 17919 81222 1 198 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.687 0.003 17919 81223 1 198 . 1 1 46 46 ALA C C 46 177.290 177.290 177.311 -0.021 17919 81224 1 198 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.593 -0.053 17919 81225 1 198 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.222 0.348 17919 81226 1 198 . 1 1 46 46 ALA H H 46 8.810 8.810 8.769 0.041 17919 81227 1 198 . 1 1 47 47 GLY N N 47 102.340 102.340 103.649 -1.309 17919 81228 1 198 . 1 1 47 47 GLY C C 47 173.810 173.810 174.504 -0.694 17919 81229 1 198 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.094 0.256 17919 81230 1 198 . 1 1 47 47 GLY H H 47 8.130 8.130 8.281 -0.151 17919 81231 1 198 . 1 1 48 48 LYS N N 48 121.570 121.570 120.980 0.590 17919 81232 1 198 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.612 0.010 17919 81233 1 198 . 1 1 48 48 LYS C C 48 174.700 174.700 175.160 -0.460 17919 81234 1 198 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.300 0.250 17919 81235 1 198 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.619 -0.089 17919 81236 1 198 . 1 1 48 48 LYS H H 48 7.980 7.980 8.249 -0.269 17919 81237 1 198 . 1 1 49 49 GLN N N 49 122.410 122.410 124.475 -2.065 17919 81238 1 198 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.489 0.071 17919 81239 1 198 . 1 1 49 49 GLN C C 49 175.670 175.670 175.629 0.041 17919 81240 1 198 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.085 -0.345 17919 81241 1 198 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.117 -0.117 17919 81242 1 198 . 1 1 49 49 GLN H H 49 8.600 8.600 8.479 0.121 17919 81243 1 198 . 1 1 50 50 LEU N N 50 125.520 125.520 126.476 -0.956 17919 81244 1 198 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.187 -0.097 17919 81245 1 198 . 1 1 50 50 LEU C C 50 176.660 176.660 176.763 -0.103 17919 81246 1 198 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.904 -0.664 17919 81247 1 198 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.960 -0.390 17919 81248 1 198 . 1 1 50 50 LEU H H 50 8.530 8.530 8.736 -0.206 17919 81249 1 198 . 1 1 51 51 GLU N N 51 122.940 122.940 122.825 0.115 17919 81250 1 198 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.581 -0.093 17919 81251 1 198 . 1 1 51 51 GLU C C 51 175.870 175.870 176.622 -0.752 17919 81252 1 198 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.626 0.334 17919 81253 1 198 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.500 0.070 17919 81254 1 198 . 1 1 51 51 GLU H H 51 8.400 8.400 8.821 -0.421 17919 81255 1 198 . 1 1 52 52 ASP N N 52 120.030 120.030 125.030 -5.000 17919 81256 1 198 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.533 -0.174 17919 81257 1 198 . 1 1 52 52 ASP C C 52 177.330 177.330 177.088 0.242 17919 81258 1 198 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.051 -0.091 17919 81259 1 198 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.961 -0.111 17919 81260 1 198 . 1 1 52 52 ASP H H 52 8.160 8.160 8.866 -0.706 17919 81261 1 198 . 1 1 53 53 GLY N N 53 106.660 106.660 105.744 0.916 17919 81262 1 198 . 1 1 53 53 GLY C C 53 174.870 174.870 174.691 0.179 17919 81263 1 198 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.674 0.496 17919 81264 1 198 . 1 1 53 53 GLY H H 53 9.390 9.390 8.370 1.020 17919 81265 1 198 . 1 1 54 54 ARG N N 54 119.050 119.050 120.941 -1.891 17919 81266 1 198 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.444 0.251 17919 81267 1 198 . 1 1 54 54 ARG C C 54 175.350 175.350 175.612 -0.262 17919 81268 1 198 . 1 1 54 54 ARG CA C 54 54.390 54.390 56.015 -1.625 17919 81269 1 198 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.102 0.548 17919 81270 1 198 . 1 1 54 54 ARG H H 54 7.460 7.460 7.647 -0.187 17919 81271 1 198 . 1 1 55 55 THR N N 55 108.400 108.400 111.647 -3.247 17919 81272 1 198 . 1 1 55 55 THR HA H 55 5.240 5.240 5.050 0.190 17919 81273 1 198 . 1 1 55 55 THR C C 55 176.560 176.560 176.556 0.004 17919 81274 1 198 . 1 1 55 55 THR CA C 55 59.690 59.690 60.435 -0.745 17919 81275 1 198 . 1 1 55 55 THR CB C 55 72.260 72.260 70.535 1.725 17919 81276 1 198 . 1 1 55 55 THR H H 55 8.730 8.730 8.653 0.077 17919 81277 1 198 . 1 1 56 56 LEU N N 56 117.920 117.920 121.495 -3.575 17919 81278 1 198 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.980 0.080 17919 81279 1 198 . 1 1 56 56 LEU C C 56 180.810 180.810 178.907 1.903 17919 81280 1 198 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.608 0.102 17919 81281 1 198 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.254 -0.884 17919 81282 1 198 . 1 1 56 56 LEU H H 56 8.140 8.140 8.593 -0.453 17919 81283 1 198 . 1 1 57 57 SER N N 57 113.330 113.330 114.217 -0.887 17919 81284 1 198 . 1 1 57 57 SER HA H 57 4.370 4.370 4.115 0.255 17919 81285 1 198 . 1 1 57 57 SER C C 57 178.310 178.310 177.121 1.189 17919 81286 1 198 . 1 1 57 57 SER CA C 57 61.080 61.080 61.630 -0.550 17919 81287 1 198 . 1 1 57 57 SER CB C 57 62.530 62.530 62.765 -0.235 17919 81288 1 198 . 1 1 57 57 SER H H 57 8.470 8.470 8.337 0.133 17919 81289 1 198 . 1 1 58 58 ASP N N 58 124.190 124.190 122.725 1.465 17919 81290 1 198 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.297 -0.001 17919 81291 1 198 . 1 1 58 58 ASP C C 58 177.400 177.400 177.790 -0.390 17919 81292 1 198 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.878 0.302 17919 81293 1 198 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.402 -0.302 17919 81294 1 198 . 1 1 58 58 ASP H H 58 7.930 7.930 7.942 -0.012 17919 81295 1 198 . 1 1 59 59 TYR N N 59 115.510 115.510 115.770 -0.260 17919 81296 1 198 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.529 0.141 17919 81297 1 198 . 1 1 59 59 TYR C C 59 174.700 174.700 174.871 -0.171 17919 81298 1 198 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.653 0.597 17919 81299 1 198 . 1 1 59 59 TYR CB C 59 40.070 40.070 37.979 2.091 17919 81300 1 198 . 1 1 59 59 TYR H H 59 7.250 7.250 7.384 -0.134 17919 81301 1 198 . 1 1 60 60 ASN N N 60 115.900 115.900 116.865 -0.965 17919 81302 1 198 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.363 -0.008 17919 81303 1 198 . 1 1 60 60 ASN C C 60 174.340 174.340 174.731 -0.391 17919 81304 1 198 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.432 -0.312 17919 81305 1 198 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.418 -0.008 17919 81306 1 198 . 1 1 60 60 ASN H H 60 8.150 8.150 7.879 0.271 17919 81307 1 198 . 1 1 61 61 ILE N N 61 118.600 118.600 118.592 0.008 17919 81308 1 198 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.896 -0.503 17919 81309 1 198 . 1 1 61 61 ILE C C 61 174.610 174.610 175.647 -1.037 17919 81310 1 198 . 1 1 61 61 ILE CA C 61 62.420 62.420 60.999 1.421 17919 81311 1 198 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.480 -0.740 17919 81312 1 198 . 1 1 61 61 ILE H H 61 7.250 7.250 7.384 -0.134 17919 81313 1 198 . 1 1 62 62 GLN N N 62 124.740 124.740 124.569 0.171 17919 81314 1 198 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.641 -0.135 17919 81315 1 198 . 1 1 62 62 GLN C C 62 175.970 175.970 175.073 0.897 17919 81316 1 198 . 1 1 62 62 GLN CA C 62 53.660 53.660 54.027 -0.367 17919 81317 1 198 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.585 0.065 17919 81318 1 198 . 1 1 62 62 GLN H H 62 7.610 7.610 8.359 -0.749 17919 81319 1 198 . 1 1 63 63 LYS N N 63 120.300 120.300 121.192 -0.892 17919 81320 1 198 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.038 -0.037 17919 81321 1 198 . 1 1 63 63 LYS C C 63 175.810 175.810 177.268 -1.458 17919 81322 1 198 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.517 0.273 17919 81323 1 198 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.178 0.472 17919 81324 1 198 . 1 1 63 63 LYS H H 63 8.490 8.490 8.743 -0.253 17919 81325 1 198 . 1 1 64 64 GLU N N 64 113.950 113.950 118.846 -4.896 17919 81326 1 198 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.448 0.017 17919 81327 1 198 . 1 1 64 64 GLU C C 64 175.250 175.250 175.428 -0.178 17919 81328 1 198 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.484 0.406 17919 81329 1 198 . 1 1 64 64 GLU CB C 64 25.900 25.900 29.031 -3.131 17919 81330 1 198 . 1 1 64 64 GLU H H 64 9.280 9.280 9.025 0.255 17919 81331 1 198 . 1 1 65 65 SER N N 65 114.730 114.730 115.317 -0.587 17919 81332 1 198 . 1 1 65 65 SER HA H 65 4.640 4.640 4.614 0.026 17919 81333 1 198 . 1 1 65 65 SER C C 65 172.160 172.160 173.641 -1.481 17919 81334 1 198 . 1 1 65 65 SER CA C 65 60.890 60.890 59.418 1.472 17919 81335 1 198 . 1 1 65 65 SER CB C 65 64.910 64.910 64.371 0.540 17919 81336 1 198 . 1 1 65 65 SER H H 65 7.670 7.670 7.480 0.190 17919 81337 1 198 . 1 1 66 66 THR N N 66 117.110 117.110 119.203 -2.093 17919 81338 1 198 . 1 1 66 66 THR HA H 66 5.270 5.270 5.289 -0.019 17919 81339 1 198 . 1 1 66 66 THR C C 66 173.950 173.950 174.046 -0.096 17919 81340 1 198 . 1 1 66 66 THR CA C 66 62.340 62.340 61.579 0.761 17919 81341 1 198 . 1 1 66 66 THR CB C 66 70.080 70.080 70.729 -0.649 17919 81342 1 198 . 1 1 66 66 THR H H 66 8.730 8.730 8.400 0.330 17919 81343 1 198 . 1 1 67 67 LEU N N 67 127.110 127.110 127.085 0.025 17919 81344 1 198 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.804 0.256 17919 81345 1 198 . 1 1 67 67 LEU C C 67 175.770 175.770 175.589 0.181 17919 81346 1 198 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.274 -0.374 17919 81347 1 198 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.601 0.659 17919 81348 1 198 . 1 1 67 67 LEU H H 67 9.410 9.410 9.215 0.195 17919 81349 1 198 . 1 1 68 68 HIS N N 68 118.380 118.380 122.072 -3.692 17919 81350 1 198 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.486 -0.246 17919 81351 1 198 . 1 1 68 68 HIS C C 68 173.150 173.150 173.543 -0.393 17919 81352 1 198 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.440 0.560 17919 81353 1 198 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.732 -2.202 17919 81354 1 198 . 1 1 68 68 HIS H H 68 9.230 9.230 9.309 -0.079 17919 81355 1 198 . 1 1 69 69 LEU N N 69 124.460 124.460 128.670 -4.210 17919 81356 1 198 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.123 0.067 17919 81357 1 198 . 1 1 69 69 LEU C C 69 175.270 175.270 174.206 1.064 17919 81358 1 198 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.034 0.856 17919 81359 1 198 . 1 1 69 69 LEU CB C 69 44.380 44.380 45.558 -1.178 17919 81360 1 198 . 1 1 69 69 LEU H H 69 8.340 8.340 8.327 0.013 17919 81361 1 198 . 1 1 70 70 VAL N N 70 126.940 126.940 121.787 5.153 17919 81362 1 198 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.625 -0.275 17919 81363 1 198 . 1 1 70 70 VAL C C 70 174.000 174.000 173.710 0.290 17919 81364 1 198 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.670 1.130 17919 81365 1 198 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.862 -0.952 17919 81366 1 198 . 1 1 70 70 VAL H H 70 9.200 9.200 8.786 0.414 17919 81367 1 198 . 1 1 71 71 LEU N N 71 123.130 123.130 121.609 1.521 17919 81368 1 198 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.322 -0.262 17919 81369 1 198 . 1 1 71 71 LEU C C 71 177.830 177.830 177.395 0.435 17919 81370 1 198 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.489 0.452 17919 81371 1 198 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.486 -0.636 17919 81372 1 198 . 1 1 71 71 LEU H H 71 8.120 8.120 8.354 -0.234 17919 81373 1 198 . 1 1 72 72 ARG N N 72 123.490 123.490 122.304 1.186 17919 81374 1 198 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.482 -0.181 17919 81375 1 198 . 1 1 72 72 ARG C C 72 175.350 175.350 175.408 -0.058 17919 81376 1 198 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.955 -0.345 17919 81377 1 198 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.965 0.385 17919 81378 1 198 . 1 1 72 72 ARG H H 72 8.580 8.580 8.094 0.486 17919 81379 1 199 . 1 1 2 2 GLN N N 2 123.220 123.220 121.291 1.929 17919 81380 1 199 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.428 -0.179 17919 81381 1 199 . 1 1 2 2 GLN C C 2 175.920 175.920 175.115 0.805 17919 81382 1 199 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.593 0.487 17919 81383 1 199 . 1 1 2 2 GLN CB C 2 30.760 30.760 31.102 -0.342 17919 81384 1 199 . 1 1 2 2 GLN H H 2 8.900 8.900 8.392 0.508 17919 81385 1 199 . 1 1 3 3 ILE N N 3 115.340 115.340 116.364 -1.024 17919 81386 1 199 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.261 -0.048 17919 81387 1 199 . 1 1 3 3 ILE C C 3 172.450 172.450 173.088 -0.638 17919 81388 1 199 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.190 0.380 17919 81389 1 199 . 1 1 3 3 ILE CB C 3 42.210 42.210 42.062 0.148 17919 81390 1 199 . 1 1 3 3 ILE H H 3 8.320 8.320 8.683 -0.363 17919 81391 1 199 . 1 1 4 4 PHE N N 4 118.110 118.110 118.360 -0.250 17919 81392 1 199 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.506 0.124 17919 81393 1 199 . 1 1 4 4 PHE C C 4 175.320 175.320 175.156 0.164 17919 81394 1 199 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.357 -0.147 17919 81395 1 199 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.763 -0.283 17919 81396 1 199 . 1 1 4 4 PHE H H 4 8.610 8.610 8.515 0.095 17919 81397 1 199 . 1 1 5 5 VAL N N 5 121.000 121.000 122.485 -1.485 17919 81398 1 199 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.713 0.012 17919 81399 1 199 . 1 1 5 5 VAL C C 5 174.870 174.870 175.395 -0.525 17919 81400 1 199 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.056 -0.436 17919 81401 1 199 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.592 -0.362 17919 81402 1 199 . 1 1 5 5 VAL H H 5 9.300 9.300 9.103 0.197 17919 81403 1 199 . 1 1 6 6 LYS N N 6 127.520 127.520 127.751 -0.231 17919 81404 1 199 . 1 1 6 6 LYS HA H 6 5.367 5.367 4.916 0.451 17919 81405 1 199 . 1 1 6 6 LYS C C 6 177.140 177.140 176.663 0.477 17919 81406 1 199 . 1 1 6 6 LYS CA C 6 54.520 54.520 53.914 0.606 17919 81407 1 199 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.084 0.966 17919 81408 1 199 . 1 1 6 6 LYS H H 6 8.820 8.820 8.944 -0.124 17919 81409 1 199 . 1 1 7 7 THR N N 7 115.400 115.400 113.560 1.840 17919 81410 1 199 . 1 1 7 7 THR HA H 7 4.970 4.970 4.703 0.267 17919 81411 1 199 . 1 1 7 7 THR C C 7 176.910 176.910 176.448 0.462 17919 81412 1 199 . 1 1 7 7 THR CA C 7 60.470 60.470 59.960 0.510 17919 81413 1 199 . 1 1 7 7 THR CB C 7 70.630 70.630 70.834 -0.204 17919 81414 1 199 . 1 1 7 7 THR H H 7 8.730 8.730 8.239 0.491 17919 81415 1 199 . 1 1 8 8 LEU N N 8 121.330 121.330 121.940 -0.610 17919 81416 1 199 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.097 0.213 17919 81417 1 199 . 1 1 8 8 LEU C C 8 178.800 178.800 178.230 0.570 17919 81418 1 199 . 1 1 8 8 LEU CA C 8 57.580 57.580 58.169 -0.589 17919 81419 1 199 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.977 -0.007 17919 81420 1 199 . 1 1 8 8 LEU H H 8 9.100 9.100 8.814 0.286 17919 81421 1 199 . 1 1 9 9 THR N N 9 105.590 105.590 107.074 -1.484 17919 81422 1 199 . 1 1 9 9 THR HA H 9 4.428 4.428 4.249 0.179 17919 81423 1 199 . 1 1 9 9 THR C C 9 175.520 175.520 175.874 -0.354 17919 81424 1 199 . 1 1 9 9 THR CA C 9 61.400 61.400 61.770 -0.370 17919 81425 1 199 . 1 1 9 9 THR CB C 9 69.140 69.140 68.860 0.280 17919 81426 1 199 . 1 1 9 9 THR H H 9 7.630 7.630 7.794 -0.164 17919 81427 1 199 . 1 1 10 10 GLY N N 10 108.890 108.890 111.407 -2.517 17919 81428 1 199 . 1 1 10 10 GLY C C 10 174.070 174.070 174.204 -0.134 17919 81429 1 199 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.434 0.026 17919 81430 1 199 . 1 1 10 10 GLY H H 10 7.810 7.810 8.314 -0.504 17919 81431 1 199 . 1 1 11 11 LYS N N 11 121.600 121.600 122.216 -0.616 17919 81432 1 199 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.141 0.220 17919 81433 1 199 . 1 1 11 11 LYS C C 11 175.940 175.940 176.230 -0.290 17919 81434 1 199 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.472 -0.193 17919 81435 1 199 . 1 1 11 11 LYS CB C 11 33.200 33.200 32.831 0.369 17919 81436 1 199 . 1 1 11 11 LYS H H 11 7.280 7.280 7.696 -0.416 17919 81437 1 199 . 1 1 12 12 THR N N 12 120.440 120.440 123.023 -2.583 17919 81438 1 199 . 1 1 12 12 THR HA H 12 5.046 5.046 4.564 0.482 17919 81439 1 199 . 1 1 12 12 THR C C 12 174.320 174.320 174.203 0.117 17919 81440 1 199 . 1 1 12 12 THR CA C 12 62.390 62.390 63.281 -0.891 17919 81441 1 199 . 1 1 12 12 THR CB C 12 69.910 69.910 69.351 0.559 17919 81442 1 199 . 1 1 12 12 THR H H 12 8.650 8.650 8.295 0.355 17919 81443 1 199 . 1 1 13 13 ILE N N 13 127.110 127.110 128.497 -1.387 17919 81444 1 199 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.492 0.052 17919 81445 1 199 . 1 1 13 13 ILE C C 13 175.220 175.220 175.413 -0.193 17919 81446 1 199 . 1 1 13 13 ILE CA C 13 59.980 59.980 58.552 1.428 17919 81447 1 199 . 1 1 13 13 ILE CB C 13 40.950 40.950 38.943 2.007 17919 81448 1 199 . 1 1 13 13 ILE H H 13 9.450 9.450 9.089 0.361 17919 81449 1 199 . 1 1 14 14 THR N N 14 121.520 121.520 123.384 -1.864 17919 81450 1 199 . 1 1 14 14 THR HA H 14 4.964 4.964 4.736 0.228 17919 81451 1 199 . 1 1 14 14 THR C C 14 173.790 173.790 173.700 0.090 17919 81452 1 199 . 1 1 14 14 THR CA C 14 61.940 61.940 62.881 -0.941 17919 81453 1 199 . 1 1 14 14 THR CB C 14 69.650 69.650 69.798 -0.148 17919 81454 1 199 . 1 1 14 14 THR H H 14 8.710 8.710 8.548 0.162 17919 81455 1 199 . 1 1 15 15 LEU N N 15 124.800 124.800 128.323 -3.523 17919 81456 1 199 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.723 0.057 17919 81457 1 199 . 1 1 15 15 LEU C C 15 174.670 174.670 175.150 -0.480 17919 81458 1 199 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.730 -0.900 17919 81459 1 199 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.766 1.304 17919 81460 1 199 . 1 1 15 15 LEU H H 15 8.710 8.710 9.078 -0.368 17919 81461 1 199 . 1 1 16 16 GLU N N 16 122.160 122.160 123.294 -1.134 17919 81462 1 199 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.331 -0.414 17919 81463 1 199 . 1 1 16 16 GLU C C 16 175.860 175.860 175.852 0.008 17919 81464 1 199 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.383 -0.563 17919 81465 1 199 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.863 -1.413 17919 81466 1 199 . 1 1 16 16 GLU H H 16 8.140 8.140 8.630 -0.490 17919 81467 1 199 . 1 1 17 17 VAL N N 17 117.210 117.210 118.170 -0.960 17919 81468 1 199 . 1 1 17 17 VAL HA H 17 4.714 4.714 5.032 -0.318 17919 81469 1 199 . 1 1 17 17 VAL C C 17 174.160 174.160 175.051 -0.891 17919 81470 1 199 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.550 -0.120 17919 81471 1 199 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.142 1.258 17919 81472 1 199 . 1 1 17 17 VAL H H 17 8.900 8.900 8.839 0.061 17919 81473 1 199 . 1 1 18 18 GLU N N 18 118.990 118.990 121.950 -2.960 17919 81474 1 199 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.734 0.345 17919 81475 1 199 . 1 1 18 18 GLU C C 18 176.160 176.160 175.403 0.757 17919 81476 1 199 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.112 -0.392 17919 81477 1 199 . 1 1 18 18 GLU CB C 18 30.310 30.310 29.909 0.401 17919 81478 1 199 . 1 1 18 18 GLU H H 18 8.640 8.640 8.898 -0.258 17919 81479 1 199 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.221 -0.080 17919 81480 1 199 . 1 1 19 19 PRO C C 19 175.310 175.310 177.216 -1.906 17919 81481 1 199 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.375 0.095 17919 81482 1 199 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.914 0.036 17919 81483 1 199 . 1 1 20 20 SER N N 20 103.400 103.400 108.808 -5.408 17919 81484 1 199 . 1 1 20 20 SER HA H 20 4.370 4.370 4.247 0.123 17919 81485 1 199 . 1 1 20 20 SER C C 20 174.660 174.660 174.061 0.599 17919 81486 1 199 . 1 1 20 20 SER CA C 20 57.400 57.400 58.603 -1.203 17919 81487 1 199 . 1 1 20 20 SER CB C 20 63.370 63.370 62.727 0.643 17919 81488 1 199 . 1 1 20 20 SER H H 20 7.040 7.040 8.279 -1.239 17919 81489 1 199 . 1 1 21 21 ASP N N 21 123.480 123.480 124.510 -1.030 17919 81490 1 199 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.788 -0.093 17919 81491 1 199 . 1 1 21 21 ASP C C 21 176.360 176.360 176.049 0.311 17919 81492 1 199 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.787 0.913 17919 81493 1 199 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.681 -0.881 17919 81494 1 199 . 1 1 21 21 ASP H H 21 8.030 8.030 7.704 0.326 17919 81495 1 199 . 1 1 22 22 THR N N 22 108.800 108.800 113.578 -4.778 17919 81496 1 199 . 1 1 22 22 THR HA H 22 4.920 4.920 4.853 0.067 17919 81497 1 199 . 1 1 22 22 THR C C 22 176.750 176.750 176.376 0.374 17919 81498 1 199 . 1 1 22 22 THR CA C 22 59.690 59.690 61.153 -1.463 17919 81499 1 199 . 1 1 22 22 THR CB C 22 71.200 71.200 70.800 0.400 17919 81500 1 199 . 1 1 22 22 THR H H 22 7.900 7.900 8.203 -0.303 17919 81501 1 199 . 1 1 23 23 ILE N N 23 121.190 121.190 122.998 -1.808 17919 81502 1 199 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.725 -0.068 17919 81503 1 199 . 1 1 23 23 ILE C C 23 179.040 179.040 177.766 1.274 17919 81504 1 199 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.841 -0.581 17919 81505 1 199 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.091 -1.741 17919 81506 1 199 . 1 1 23 23 ILE H H 23 8.560 8.560 8.598 -0.038 17919 81507 1 199 . 1 1 24 24 GLU N N 24 120.830 120.830 121.282 -0.452 17919 81508 1 199 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.809 0.108 17919 81509 1 199 . 1 1 24 24 GLU C C 24 178.640 178.640 178.793 -0.153 17919 81510 1 199 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.079 0.141 17919 81511 1 199 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.401 -1.121 17919 81512 1 199 . 1 1 24 24 GLU H H 24 9.760 9.760 8.170 1.590 17919 81513 1 199 . 1 1 25 25 ASN N N 25 120.570 120.570 117.433 3.137 17919 81514 1 199 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.480 0.045 17919 81515 1 199 . 1 1 25 25 ASN C C 25 178.380 178.380 178.052 0.328 17919 81516 1 199 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.053 0.007 17919 81517 1 199 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.674 -0.224 17919 81518 1 199 . 1 1 25 25 ASN H H 25 7.920 7.920 7.782 0.138 17919 81519 1 199 . 1 1 26 26 VAL N N 26 121.710 121.710 120.406 1.304 17919 81520 1 199 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.688 -0.291 17919 81521 1 199 . 1 1 26 26 VAL C C 26 177.950 177.950 177.664 0.286 17919 81522 1 199 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.024 1.636 17919 81523 1 199 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.621 -0.781 17919 81524 1 199 . 1 1 26 26 VAL H H 26 8.070 8.070 8.238 -0.168 17919 81525 1 199 . 1 1 27 27 LYS N N 27 118.860 118.860 119.811 -0.951 17919 81526 1 199 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.198 0.382 17919 81527 1 199 . 1 1 27 27 LYS C C 27 180.550 180.550 178.693 1.857 17919 81528 1 199 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.336 -0.086 17919 81529 1 199 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.200 1.530 17919 81530 1 199 . 1 1 27 27 LYS H H 27 8.560 8.560 8.395 0.165 17919 81531 1 199 . 1 1 28 28 ALA N N 28 123.440 123.440 122.396 1.044 17919 81532 1 199 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.211 -0.051 17919 81533 1 199 . 1 1 28 28 ALA C C 28 180.300 180.300 178.979 1.321 17919 81534 1 199 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.782 0.588 17919 81535 1 199 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.505 -0.795 17919 81536 1 199 . 1 1 28 28 ALA H H 28 8.060 8.060 7.922 0.138 17919 81537 1 199 . 1 1 29 29 LYS N N 29 119.940 119.940 118.893 1.047 17919 81538 1 199 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.041 0.166 17919 81539 1 199 . 1 1 29 29 LYS C C 29 180.320 180.320 179.025 1.295 17919 81540 1 199 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.295 0.355 17919 81541 1 199 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.248 1.042 17919 81542 1 199 . 1 1 29 29 LYS H H 29 7.850 7.850 7.423 0.427 17919 81543 1 199 . 1 1 30 30 ILE N N 30 121.080 121.080 119.308 1.772 17919 81544 1 199 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.756 -0.249 17919 81545 1 199 . 1 1 30 30 ILE C C 30 178.310 178.310 177.529 0.781 17919 81546 1 199 . 1 1 30 30 ILE CA C 30 66.150 66.150 64.162 1.988 17919 81547 1 199 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.220 -0.420 17919 81548 1 199 . 1 1 30 30 ILE H H 30 8.280 8.280 7.471 0.809 17919 81549 1 199 . 1 1 31 31 GLN N N 31 123.490 123.490 121.089 2.401 17919 81550 1 199 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.128 -0.299 17919 81551 1 199 . 1 1 31 31 GLN C C 31 178.890 178.890 178.597 0.293 17919 81552 1 199 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.041 0.959 17919 81553 1 199 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.517 -0.797 17919 81554 1 199 . 1 1 31 31 GLN H H 31 8.580 8.580 7.962 0.618 17919 81555 1 199 . 1 1 32 32 ASP N N 32 119.360 119.360 118.752 0.608 17919 81556 1 199 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.468 -0.114 17919 81557 1 199 . 1 1 32 32 ASP C C 32 177.250 177.250 177.616 -0.366 17919 81558 1 199 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.381 0.809 17919 81559 1 199 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.776 -0.196 17919 81560 1 199 . 1 1 32 32 ASP H H 32 8.010 8.010 8.027 -0.017 17919 81561 1 199 . 1 1 33 33 LYS N N 33 115.130 115.130 117.737 -2.607 17919 81562 1 199 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.376 -0.039 17919 81563 1 199 . 1 1 33 33 LYS C C 33 177.870 177.870 177.840 0.030 17919 81564 1 199 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.166 -0.116 17919 81565 1 199 . 1 1 33 33 LYS CB C 33 34.170 34.170 34.183 -0.013 17919 81566 1 199 . 1 1 33 33 LYS H H 33 7.430 7.430 7.532 -0.102 17919 81567 1 199 . 1 1 34 34 GLU N N 34 113.870 113.870 114.242 -0.372 17919 81568 1 199 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.524 0.101 17919 81569 1 199 . 1 1 34 34 GLU C C 34 177.840 177.840 176.730 1.110 17919 81570 1 199 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.373 -0.203 17919 81571 1 199 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.238 1.422 17919 81572 1 199 . 1 1 34 34 GLU H H 34 8.740 8.740 8.024 0.716 17919 81573 1 199 . 1 1 35 35 GLY N N 35 108.650 108.650 108.997 -0.347 17919 81574 1 199 . 1 1 35 35 GLY C C 35 173.960 173.960 174.633 -0.673 17919 81575 1 199 . 1 1 35 35 GLY CA C 35 46.080 46.080 46.149 -0.069 17919 81576 1 199 . 1 1 35 35 GLY H H 35 8.530 8.530 7.949 0.581 17919 81577 1 199 . 1 1 36 36 ILE N N 36 119.880 119.880 121.959 -2.079 17919 81578 1 199 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.301 0.144 17919 81579 1 199 . 1 1 36 36 ILE C C 36 173.590 173.590 174.226 -0.636 17919 81580 1 199 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.345 -0.595 17919 81581 1 199 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.286 2.294 17919 81582 1 199 . 1 1 36 36 ILE H H 36 6.150 6.150 7.686 -1.536 17919 81583 1 199 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.933 -0.299 17919 81584 1 199 . 1 1 37 37 PRO C C 37 176.940 176.940 176.021 0.919 17919 81585 1 199 . 1 1 37 37 PRO CA C 37 61.660 61.660 60.774 0.886 17919 81586 1 199 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.795 0.055 17919 81587 1 199 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.143 -0.026 17919 81588 1 199 . 1 1 38 38 PRO C C 38 178.320 178.320 177.955 0.365 17919 81589 1 199 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.660 0.600 17919 81590 1 199 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.775 1.115 17919 81591 1 199 . 1 1 39 39 ASP N N 39 113.380 113.380 115.779 -2.399 17919 81592 1 199 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.358 0.072 17919 81593 1 199 . 1 1 39 39 ASP C C 39 177.090 177.090 178.008 -0.918 17919 81594 1 199 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.864 -1.224 17919 81595 1 199 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.552 -1.012 17919 81596 1 199 . 1 1 39 39 ASP H H 39 8.550 8.550 8.620 -0.070 17919 81597 1 199 . 1 1 40 40 GLN N N 40 116.780 116.780 117.965 -1.185 17919 81598 1 199 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.362 0.102 17919 81599 1 199 . 1 1 40 40 GLN C C 40 175.380 175.380 176.778 -1.398 17919 81600 1 199 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.052 -0.412 17919 81601 1 199 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.458 0.682 17919 81602 1 199 . 1 1 40 40 GLN H H 40 7.820 7.820 8.059 -0.239 17919 81603 1 199 . 1 1 41 41 GLN N N 41 117.720 117.720 119.675 -1.955 17919 81604 1 199 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.226 0.018 17919 81605 1 199 . 1 1 41 41 GLN C C 41 176.300 176.300 175.344 0.956 17919 81606 1 199 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.966 -0.496 17919 81607 1 199 . 1 1 41 41 GLN CB C 41 31.650 31.650 28.868 2.782 17919 81608 1 199 . 1 1 41 41 GLN H H 41 7.480 7.480 7.390 0.090 17919 81609 1 199 . 1 1 42 42 ARG N N 42 122.680 122.680 122.083 0.597 17919 81610 1 199 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.615 -0.115 17919 81611 1 199 . 1 1 42 42 ARG C C 42 174.050 174.050 174.340 -0.290 17919 81612 1 199 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.748 0.302 17919 81613 1 199 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.525 -1.775 17919 81614 1 199 . 1 1 42 42 ARG H H 42 8.530 8.530 8.808 -0.278 17919 81615 1 199 . 1 1 43 43 LEU N N 43 124.040 124.040 125.340 -1.300 17919 81616 1 199 . 1 1 43 43 LEU C C 43 175.290 175.290 175.024 0.266 17919 81617 1 199 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.330 -1.350 17919 81618 1 199 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.953 0.837 17919 81619 1 199 . 1 1 43 43 LEU H H 43 8.820 8.820 8.852 -0.032 17919 81620 1 199 . 1 1 44 44 ILE N N 44 121.920 121.920 120.407 1.513 17919 81621 1 199 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.257 -0.265 17919 81622 1 199 . 1 1 44 44 ILE C C 44 176.060 176.060 173.472 2.588 17919 81623 1 199 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.707 -0.727 17919 81624 1 199 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.229 0.191 17919 81625 1 199 . 1 1 44 44 ILE H H 44 9.030 9.030 8.913 0.117 17919 81626 1 199 . 1 1 45 45 PHE N N 45 125.390 125.390 128.058 -2.668 17919 81627 1 199 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.174 -0.129 17919 81628 1 199 . 1 1 45 45 PHE C C 45 174.470 174.470 174.535 -0.065 17919 81629 1 199 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.854 0.166 17919 81630 1 199 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.343 0.417 17919 81631 1 199 . 1 1 45 45 PHE H H 45 8.830 8.830 8.738 0.092 17919 81632 1 199 . 1 1 46 46 ALA N N 46 132.200 132.200 129.783 2.417 17919 81633 1 199 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.618 0.072 17919 81634 1 199 . 1 1 46 46 ALA C C 46 177.290 177.290 177.916 -0.626 17919 81635 1 199 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.893 -0.353 17919 81636 1 199 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.725 -0.155 17919 81637 1 199 . 1 1 46 46 ALA H H 46 8.810 8.810 8.560 0.250 17919 81638 1 199 . 1 1 47 47 GLY N N 47 102.340 102.340 103.278 -0.938 17919 81639 1 199 . 1 1 47 47 GLY C C 47 173.810 173.810 174.780 -0.970 17919 81640 1 199 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.778 -0.428 17919 81641 1 199 . 1 1 47 47 GLY H H 47 8.130 8.130 8.543 -0.413 17919 81642 1 199 . 1 1 48 48 LYS N N 48 121.570 121.570 121.227 0.343 17919 81643 1 199 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.567 0.055 17919 81644 1 199 . 1 1 48 48 LYS C C 48 174.700 174.700 175.427 -0.727 17919 81645 1 199 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.887 -0.337 17919 81646 1 199 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.028 0.502 17919 81647 1 199 . 1 1 48 48 LYS H H 48 7.980 7.980 8.043 -0.063 17919 81648 1 199 . 1 1 49 49 GLN N N 49 122.410 122.410 124.723 -2.313 17919 81649 1 199 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.192 0.368 17919 81650 1 199 . 1 1 49 49 GLN C C 49 175.670 175.670 175.078 0.592 17919 81651 1 199 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.320 -0.580 17919 81652 1 199 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.031 -0.031 17919 81653 1 199 . 1 1 49 49 GLN H H 49 8.600 8.600 8.639 -0.039 17919 81654 1 199 . 1 1 50 50 LEU N N 50 125.520 125.520 130.326 -4.806 17919 81655 1 199 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.356 -0.266 17919 81656 1 199 . 1 1 50 50 LEU C C 50 176.660 176.660 175.860 0.800 17919 81657 1 199 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.998 0.242 17919 81658 1 199 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.767 -0.197 17919 81659 1 199 . 1 1 50 50 LEU H H 50 8.530 8.530 8.788 -0.258 17919 81660 1 199 . 1 1 51 51 GLU N N 51 122.940 122.940 124.600 -1.660 17919 81661 1 199 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.450 0.038 17919 81662 1 199 . 1 1 51 51 GLU C C 51 175.870 175.870 176.810 -0.940 17919 81663 1 199 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.451 0.509 17919 81664 1 199 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.503 0.067 17919 81665 1 199 . 1 1 51 51 GLU H H 51 8.400 8.400 8.813 -0.413 17919 81666 1 199 . 1 1 52 52 ASP N N 52 120.030 120.030 123.077 -3.047 17919 81667 1 199 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.497 -0.138 17919 81668 1 199 . 1 1 52 52 ASP C C 52 177.330 177.330 177.967 -0.637 17919 81669 1 199 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.636 -0.676 17919 81670 1 199 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.908 -0.058 17919 81671 1 199 . 1 1 52 52 ASP H H 52 8.160 8.160 8.919 -0.759 17919 81672 1 199 . 1 1 53 53 GLY N N 53 106.660 106.660 106.501 0.159 17919 81673 1 199 . 1 1 53 53 GLY C C 53 174.870 174.870 174.021 0.849 17919 81674 1 199 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.639 0.531 17919 81675 1 199 . 1 1 53 53 GLY H H 53 9.390 9.390 8.396 0.994 17919 81676 1 199 . 1 1 54 54 ARG N N 54 119.050 119.050 120.526 -1.476 17919 81677 1 199 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.595 0.100 17919 81678 1 199 . 1 1 54 54 ARG C C 54 175.350 175.350 175.461 -0.111 17919 81679 1 199 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.858 -0.468 17919 81680 1 199 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.009 0.641 17919 81681 1 199 . 1 1 54 54 ARG H H 54 7.460 7.460 7.374 0.086 17919 81682 1 199 . 1 1 55 55 THR N N 55 108.400 108.400 113.438 -5.038 17919 81683 1 199 . 1 1 55 55 THR HA H 55 5.240 5.240 4.834 0.406 17919 81684 1 199 . 1 1 55 55 THR C C 55 176.560 176.560 176.150 0.410 17919 81685 1 199 . 1 1 55 55 THR CA C 55 59.690 59.690 60.371 -0.681 17919 81686 1 199 . 1 1 55 55 THR CB C 55 72.260 72.260 70.636 1.624 17919 81687 1 199 . 1 1 55 55 THR H H 55 8.730 8.730 8.183 0.547 17919 81688 1 199 . 1 1 56 56 LEU N N 56 117.920 117.920 121.882 -3.962 17919 81689 1 199 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.165 -0.105 17919 81690 1 199 . 1 1 56 56 LEU C C 56 180.810 180.810 178.738 2.072 17919 81691 1 199 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.168 0.542 17919 81692 1 199 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.521 -1.151 17919 81693 1 199 . 1 1 56 56 LEU H H 56 8.140 8.140 8.931 -0.791 17919 81694 1 199 . 1 1 57 57 SER N N 57 113.330 113.330 114.564 -1.234 17919 81695 1 199 . 1 1 57 57 SER HA H 57 4.370 4.370 4.217 0.153 17919 81696 1 199 . 1 1 57 57 SER C C 57 178.310 178.310 176.762 1.548 17919 81697 1 199 . 1 1 57 57 SER CA C 57 61.080 61.080 61.168 -0.088 17919 81698 1 199 . 1 1 57 57 SER CB C 57 62.530 62.530 62.779 -0.249 17919 81699 1 199 . 1 1 57 57 SER H H 57 8.470 8.470 8.580 -0.110 17919 81700 1 199 . 1 1 58 58 ASP N N 58 124.190 124.190 122.986 1.204 17919 81701 1 199 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.303 -0.007 17919 81702 1 199 . 1 1 58 58 ASP C C 58 177.400 177.400 177.632 -0.232 17919 81703 1 199 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.834 0.346 17919 81704 1 199 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.733 -0.632 17919 81705 1 199 . 1 1 58 58 ASP H H 58 7.930 7.930 7.599 0.331 17919 81706 1 199 . 1 1 59 59 TYR N N 59 115.510 115.510 114.904 0.606 17919 81707 1 199 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.483 0.187 17919 81708 1 199 . 1 1 59 59 TYR C C 59 174.700 174.700 175.381 -0.681 17919 81709 1 199 . 1 1 59 59 TYR CA C 59 58.250 58.250 58.894 -0.644 17919 81710 1 199 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.476 1.594 17919 81711 1 199 . 1 1 59 59 TYR H H 59 7.250 7.250 7.388 -0.138 17919 81712 1 199 . 1 1 60 60 ASN N N 60 115.900 115.900 116.138 -0.238 17919 81713 1 199 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.348 0.007 17919 81714 1 199 . 1 1 60 60 ASN C C 60 174.340 174.340 174.468 -0.128 17919 81715 1 199 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.433 -0.313 17919 81716 1 199 . 1 1 60 60 ASN CB C 60 37.410 37.410 36.968 0.442 17919 81717 1 199 . 1 1 60 60 ASN H H 60 8.150 8.150 7.875 0.275 17919 81718 1 199 . 1 1 61 61 ILE N N 61 118.600 118.600 120.218 -1.618 17919 81719 1 199 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.954 -0.561 17919 81720 1 199 . 1 1 61 61 ILE C C 61 174.610 174.610 175.069 -0.459 17919 81721 1 199 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.026 0.394 17919 81722 1 199 . 1 1 61 61 ILE CB C 61 36.740 36.740 38.043 -1.303 17919 81723 1 199 . 1 1 61 61 ILE H H 61 7.250 7.250 8.200 -0.950 17919 81724 1 199 . 1 1 62 62 GLN N N 62 124.740 124.740 126.116 -1.376 17919 81725 1 199 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.710 -0.204 17919 81726 1 199 . 1 1 62 62 GLN C C 62 175.970 175.970 174.971 0.999 17919 81727 1 199 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.654 0.006 17919 81728 1 199 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.551 0.099 17919 81729 1 199 . 1 1 62 62 GLN H H 62 7.610 7.610 8.110 -0.500 17919 81730 1 199 . 1 1 63 63 LYS N N 63 120.300 120.300 120.098 0.202 17919 81731 1 199 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.181 -0.180 17919 81732 1 199 . 1 1 63 63 LYS C C 63 175.810 175.810 177.153 -1.343 17919 81733 1 199 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.217 0.573 17919 81734 1 199 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.293 0.357 17919 81735 1 199 . 1 1 63 63 LYS H H 63 8.490 8.490 8.373 0.117 17919 81736 1 199 . 1 1 64 64 GLU N N 64 113.950 113.950 118.326 -4.376 17919 81737 1 199 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.774 -0.309 17919 81738 1 199 . 1 1 64 64 GLU C C 64 175.250 175.250 176.075 -0.825 17919 81739 1 199 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.553 0.337 17919 81740 1 199 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.747 -2.846 17919 81741 1 199 . 1 1 64 64 GLU H H 64 9.280 9.280 8.847 0.433 17919 81742 1 199 . 1 1 65 65 SER N N 65 114.730 114.730 115.240 -0.510 17919 81743 1 199 . 1 1 65 65 SER HA H 65 4.640 4.640 4.412 0.228 17919 81744 1 199 . 1 1 65 65 SER C C 65 172.160 172.160 173.266 -1.106 17919 81745 1 199 . 1 1 65 65 SER CA C 65 60.890 60.890 60.608 0.282 17919 81746 1 199 . 1 1 65 65 SER CB C 65 64.910 64.910 63.987 0.923 17919 81747 1 199 . 1 1 65 65 SER H H 65 7.670 7.670 7.262 0.408 17919 81748 1 199 . 1 1 66 66 THR N N 66 117.110 117.110 119.456 -2.346 17919 81749 1 199 . 1 1 66 66 THR HA H 66 5.270 5.270 5.201 0.069 17919 81750 1 199 . 1 1 66 66 THR C C 66 173.950 173.950 173.809 0.141 17919 81751 1 199 . 1 1 66 66 THR CA C 66 62.340 62.340 61.835 0.505 17919 81752 1 199 . 1 1 66 66 THR CB C 66 70.080 70.080 70.656 -0.576 17919 81753 1 199 . 1 1 66 66 THR H H 66 8.730 8.730 8.458 0.272 17919 81754 1 199 . 1 1 67 67 LEU N N 67 127.110 127.110 125.705 1.405 17919 81755 1 199 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.743 0.317 17919 81756 1 199 . 1 1 67 67 LEU C C 67 175.770 175.770 175.134 0.636 17919 81757 1 199 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.624 0.276 17919 81758 1 199 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.149 0.111 17919 81759 1 199 . 1 1 67 67 LEU H H 67 9.410 9.410 9.108 0.302 17919 81760 1 199 . 1 1 68 68 HIS N N 68 118.380 118.380 119.132 -0.752 17919 81761 1 199 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.073 0.167 17919 81762 1 199 . 1 1 68 68 HIS C C 68 173.150 173.150 173.781 -0.631 17919 81763 1 199 . 1 1 68 68 HIS CA C 68 55.000 55.000 55.104 -0.104 17919 81764 1 199 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.349 -1.819 17919 81765 1 199 . 1 1 68 68 HIS H H 68 9.230 9.230 8.627 0.603 17919 81766 1 199 . 1 1 69 69 LEU N N 69 124.460 124.460 126.203 -1.743 17919 81767 1 199 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.235 -0.045 17919 81768 1 199 . 1 1 69 69 LEU C C 69 175.270 175.270 174.478 0.792 17919 81769 1 199 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.841 0.049 17919 81770 1 199 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.349 0.031 17919 81771 1 199 . 1 1 69 69 LEU H H 69 8.340 8.340 8.475 -0.135 17919 81772 1 199 . 1 1 70 70 VAL N N 70 126.940 126.940 124.131 2.809 17919 81773 1 199 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.452 -0.102 17919 81774 1 199 . 1 1 70 70 VAL C C 70 174.000 174.000 173.806 0.194 17919 81775 1 199 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.802 0.998 17919 81776 1 199 . 1 1 70 70 VAL CB C 70 34.910 34.910 36.397 -1.487 17919 81777 1 199 . 1 1 70 70 VAL H H 70 9.200 9.200 8.908 0.292 17919 81778 1 199 . 1 1 71 71 LEU N N 71 123.130 123.130 124.524 -1.394 17919 81779 1 199 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.308 -0.248 17919 81780 1 199 . 1 1 71 71 LEU C C 71 177.830 177.830 176.773 1.057 17919 81781 1 199 . 1 1 71 71 LEU CA C 71 53.940 53.940 52.658 1.282 17919 81782 1 199 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.389 -0.539 17919 81783 1 199 . 1 1 71 71 LEU H H 71 8.120 8.120 8.264 -0.144 17919 81784 1 199 . 1 1 72 72 ARG N N 72 123.490 123.490 123.674 -0.184 17919 81785 1 199 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.166 0.135 17919 81786 1 199 . 1 1 72 72 ARG C C 72 175.350 175.350 176.063 -0.713 17919 81787 1 199 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.640 -1.030 17919 81788 1 199 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.264 1.086 17919 81789 1 199 . 1 1 72 72 ARG H H 72 8.580 8.580 8.055 0.525 17919 81790 1 200 . 1 1 2 2 GLN N N 2 123.220 123.220 119.419 3.801 17919 81791 1 200 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.310 -0.061 17919 81792 1 200 . 1 1 2 2 GLN C C 2 175.920 175.920 175.786 0.134 17919 81793 1 200 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.709 0.371 17919 81794 1 200 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.404 0.356 17919 81795 1 200 . 1 1 2 2 GLN H H 2 8.900 8.900 8.305 0.595 17919 81796 1 200 . 1 1 3 3 ILE N N 3 115.340 115.340 116.524 -1.184 17919 81797 1 200 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.756 -0.543 17919 81798 1 200 . 1 1 3 3 ILE C C 3 172.450 172.450 173.877 -1.427 17919 81799 1 200 . 1 1 3 3 ILE CA C 3 59.570 59.570 58.962 0.607 17919 81800 1 200 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.560 0.650 17919 81801 1 200 . 1 1 3 3 ILE H H 3 8.320 8.320 8.531 -0.211 17919 81802 1 200 . 1 1 4 4 PHE N N 4 118.110 118.110 118.935 -0.825 17919 81803 1 200 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.294 0.336 17919 81804 1 200 . 1 1 4 4 PHE C C 4 175.320 175.320 175.153 0.167 17919 81805 1 200 . 1 1 4 4 PHE CA C 4 55.210 55.210 56.269 -1.058 17919 81806 1 200 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.204 -0.724 17919 81807 1 200 . 1 1 4 4 PHE H H 4 8.610 8.610 8.734 -0.124 17919 81808 1 200 . 1 1 5 5 VAL N N 5 121.000 121.000 122.557 -1.557 17919 81809 1 200 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.881 -0.156 17919 81810 1 200 . 1 1 5 5 VAL C C 5 174.870 174.870 174.394 0.476 17919 81811 1 200 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.309 -0.689 17919 81812 1 200 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.859 0.371 17919 81813 1 200 . 1 1 5 5 VAL H H 5 9.300 9.300 9.292 0.008 17919 81814 1 200 . 1 1 6 6 LYS N N 6 127.520 127.520 128.734 -1.214 17919 81815 1 200 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.305 0.062 17919 81816 1 200 . 1 1 6 6 LYS C C 6 177.140 177.140 175.269 1.871 17919 81817 1 200 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.201 0.319 17919 81818 1 200 . 1 1 6 6 LYS CB C 6 35.050 35.050 36.622 -1.572 17919 81819 1 200 . 1 1 6 6 LYS H H 6 8.820 8.820 9.322 -0.502 17919 81820 1 200 . 1 1 7 7 THR N N 7 115.400 115.400 114.887 0.513 17919 81821 1 200 . 1 1 7 7 THR HA H 7 4.970 4.970 4.941 0.029 17919 81822 1 200 . 1 1 7 7 THR C C 7 176.910 176.910 175.409 1.501 17919 81823 1 200 . 1 1 7 7 THR CA C 7 60.470 60.470 59.948 0.522 17919 81824 1 200 . 1 1 7 7 THR CB C 7 70.630 70.630 71.853 -1.223 17919 81825 1 200 . 1 1 7 7 THR H H 7 8.730 8.730 8.579 0.151 17919 81826 1 200 . 1 1 8 8 LEU N N 8 121.330 121.330 122.473 -1.143 17919 81827 1 200 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.350 -0.040 17919 81828 1 200 . 1 1 8 8 LEU C C 8 178.800 178.800 177.134 1.666 17919 81829 1 200 . 1 1 8 8 LEU CA C 8 57.580 57.580 56.592 0.988 17919 81830 1 200 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.384 -0.414 17919 81831 1 200 . 1 1 8 8 LEU H H 8 9.100 9.100 9.247 -0.147 17919 81832 1 200 . 1 1 9 9 THR N N 9 105.590 105.590 108.743 -3.153 17919 81833 1 200 . 1 1 9 9 THR HA H 9 4.428 4.428 4.327 0.101 17919 81834 1 200 . 1 1 9 9 THR C C 9 175.520 175.520 175.494 0.026 17919 81835 1 200 . 1 1 9 9 THR CA C 9 61.400 61.400 61.834 -0.434 17919 81836 1 200 . 1 1 9 9 THR CB C 9 69.140 69.140 67.878 1.262 17919 81837 1 200 . 1 1 9 9 THR H H 9 7.630 7.630 7.796 -0.166 17919 81838 1 200 . 1 1 10 10 GLY N N 10 108.890 108.890 109.301 -0.411 17919 81839 1 200 . 1 1 10 10 GLY C C 10 174.070 174.070 173.869 0.201 17919 81840 1 200 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.106 0.354 17919 81841 1 200 . 1 1 10 10 GLY H H 10 7.810 7.810 7.893 -0.083 17919 81842 1 200 . 1 1 11 11 LYS N N 11 121.600 121.600 121.418 0.182 17919 81843 1 200 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.679 -0.318 17919 81844 1 200 . 1 1 11 11 LYS C C 11 175.940 175.940 175.789 0.151 17919 81845 1 200 . 1 1 11 11 LYS CA C 11 56.280 56.280 54.982 1.298 17919 81846 1 200 . 1 1 11 11 LYS CB C 11 33.200 33.200 34.510 -1.310 17919 81847 1 200 . 1 1 11 11 LYS H H 11 7.280 7.280 8.135 -0.855 17919 81848 1 200 . 1 1 12 12 THR N N 12 120.440 120.440 120.167 0.273 17919 81849 1 200 . 1 1 12 12 THR HA H 12 5.046 5.046 5.341 -0.295 17919 81850 1 200 . 1 1 12 12 THR C C 12 174.320 174.320 174.169 0.151 17919 81851 1 200 . 1 1 12 12 THR CA C 12 62.390 62.390 61.298 1.091 17919 81852 1 200 . 1 1 12 12 THR CB C 12 69.910 69.910 70.269 -0.359 17919 81853 1 200 . 1 1 12 12 THR H H 12 8.650 8.650 8.383 0.267 17919 81854 1 200 . 1 1 13 13 ILE N N 13 127.110 127.110 122.715 4.395 17919 81855 1 200 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.845 -0.301 17919 81856 1 200 . 1 1 13 13 ILE C C 13 175.220 175.220 174.109 1.111 17919 81857 1 200 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.549 0.431 17919 81858 1 200 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.410 -0.460 17919 81859 1 200 . 1 1 13 13 ILE H H 13 9.450 9.450 9.137 0.313 17919 81860 1 200 . 1 1 14 14 THR N N 14 121.520 121.520 121.578 -0.058 17919 81861 1 200 . 1 1 14 14 THR HA H 14 4.964 4.964 4.801 0.163 17919 81862 1 200 . 1 1 14 14 THR C C 14 173.790 173.790 173.607 0.183 17919 81863 1 200 . 1 1 14 14 THR CA C 14 61.940 61.940 61.612 0.328 17919 81864 1 200 . 1 1 14 14 THR CB C 14 69.650 69.650 69.659 -0.009 17919 81865 1 200 . 1 1 14 14 THR H H 14 8.710 8.710 8.437 0.273 17919 81866 1 200 . 1 1 15 15 LEU N N 15 124.800 124.800 126.393 -1.593 17919 81867 1 200 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.806 -0.026 17919 81868 1 200 . 1 1 15 15 LEU C C 15 174.670 174.670 175.263 -0.593 17919 81869 1 200 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.338 -0.508 17919 81870 1 200 . 1 1 15 15 LEU CB C 15 47.070 47.070 46.433 0.637 17919 81871 1 200 . 1 1 15 15 LEU H H 15 8.710 8.710 8.479 0.231 17919 81872 1 200 . 1 1 16 16 GLU N N 16 122.160 122.160 122.871 -0.711 17919 81873 1 200 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.429 -0.512 17919 81874 1 200 . 1 1 16 16 GLU C C 16 175.860 175.860 175.729 0.131 17919 81875 1 200 . 1 1 16 16 GLU CA C 16 54.820 54.820 54.675 0.145 17919 81876 1 200 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.519 -1.069 17919 81877 1 200 . 1 1 16 16 GLU H H 16 8.140 8.140 8.579 -0.439 17919 81878 1 200 . 1 1 17 17 VAL N N 17 117.210 117.210 119.724 -2.514 17919 81879 1 200 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.864 -0.150 17919 81880 1 200 . 1 1 17 17 VAL C C 17 174.160 174.160 174.661 -0.501 17919 81881 1 200 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.386 -0.956 17919 81882 1 200 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.339 1.061 17919 81883 1 200 . 1 1 17 17 VAL H H 17 8.900 8.900 8.639 0.261 17919 81884 1 200 . 1 1 18 18 GLU N N 18 118.990 118.990 122.643 -3.653 17919 81885 1 200 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.792 0.287 17919 81886 1 200 . 1 1 18 18 GLU C C 18 176.160 176.160 175.906 0.254 17919 81887 1 200 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.416 -0.696 17919 81888 1 200 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.574 -0.264 17919 81889 1 200 . 1 1 18 18 GLU H H 18 8.640 8.640 8.082 0.558 17919 81890 1 200 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.296 -0.155 17919 81891 1 200 . 1 1 19 19 PRO C C 19 175.310 175.310 177.269 -1.959 17919 81892 1 200 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.663 -0.193 17919 81893 1 200 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.975 -0.025 17919 81894 1 200 . 1 1 20 20 SER N N 20 103.400 103.400 111.221 -7.821 17919 81895 1 200 . 1 1 20 20 SER HA H 20 4.370 4.370 4.389 -0.019 17919 81896 1 200 . 1 1 20 20 SER C C 20 174.660 174.660 174.012 0.648 17919 81897 1 200 . 1 1 20 20 SER CA C 20 57.400 57.400 58.526 -1.126 17919 81898 1 200 . 1 1 20 20 SER CB C 20 63.370 63.370 62.801 0.569 17919 81899 1 200 . 1 1 20 20 SER H H 20 7.040 7.040 8.317 -1.277 17919 81900 1 200 . 1 1 21 21 ASP N N 21 123.480 123.480 122.850 0.630 17919 81901 1 200 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.811 -0.116 17919 81902 1 200 . 1 1 21 21 ASP C C 21 176.360 176.360 175.978 0.382 17919 81903 1 200 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.505 1.195 17919 81904 1 200 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.678 -0.878 17919 81905 1 200 . 1 1 21 21 ASP H H 21 8.030 8.030 7.730 0.300 17919 81906 1 200 . 1 1 22 22 THR N N 22 108.800 108.800 112.949 -4.149 17919 81907 1 200 . 1 1 22 22 THR HA H 22 4.920 4.920 4.573 0.347 17919 81908 1 200 . 1 1 22 22 THR C C 22 176.750 176.750 175.861 0.889 17919 81909 1 200 . 1 1 22 22 THR CA C 22 59.690 59.690 61.605 -1.915 17919 81910 1 200 . 1 1 22 22 THR CB C 22 71.200 71.200 70.648 0.552 17919 81911 1 200 . 1 1 22 22 THR H H 22 7.900 7.900 8.243 -0.343 17919 81912 1 200 . 1 1 23 23 ILE N N 23 121.190 121.190 121.750 -0.560 17919 81913 1 200 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.982 -0.325 17919 81914 1 200 . 1 1 23 23 ILE C C 23 179.040 179.040 177.872 1.168 17919 81915 1 200 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.227 0.033 17919 81916 1 200 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.606 -2.256 17919 81917 1 200 . 1 1 23 23 ILE H H 23 8.560 8.560 8.322 0.238 17919 81918 1 200 . 1 1 24 24 GLU N N 24 120.830 120.830 121.675 -0.845 17919 81919 1 200 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.852 0.066 17919 81920 1 200 . 1 1 24 24 GLU C C 24 178.640 178.640 178.655 -0.015 17919 81921 1 200 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.133 0.087 17919 81922 1 200 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.431 -1.151 17919 81923 1 200 . 1 1 24 24 GLU H H 24 9.760 9.760 8.282 1.478 17919 81924 1 200 . 1 1 25 25 ASN N N 25 120.570 120.570 117.529 3.041 17919 81925 1 200 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.533 -0.008 17919 81926 1 200 . 1 1 25 25 ASN C C 25 178.380 178.380 177.876 0.504 17919 81927 1 200 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.027 0.033 17919 81928 1 200 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.702 -0.251 17919 81929 1 200 . 1 1 25 25 ASN H H 25 7.920 7.920 7.534 0.386 17919 81930 1 200 . 1 1 26 26 VAL N N 26 121.710 121.710 120.176 1.534 17919 81931 1 200 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.628 -0.231 17919 81932 1 200 . 1 1 26 26 VAL C C 26 177.950 177.950 177.964 -0.014 17919 81933 1 200 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.353 1.307 17919 81934 1 200 . 1 1 26 26 VAL CB C 26 30.840 30.840 30.825 0.015 17919 81935 1 200 . 1 1 26 26 VAL H H 26 8.070 8.070 8.318 -0.248 17919 81936 1 200 . 1 1 27 27 LYS N N 27 118.860 118.860 119.842 -0.982 17919 81937 1 200 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.154 0.426 17919 81938 1 200 . 1 1 27 27 LYS C C 27 180.550 180.550 179.150 1.400 17919 81939 1 200 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.741 -0.491 17919 81940 1 200 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.105 1.625 17919 81941 1 200 . 1 1 27 27 LYS H H 27 8.560 8.560 8.375 0.185 17919 81942 1 200 . 1 1 28 28 ALA N N 28 123.440 123.440 121.852 1.588 17919 81943 1 200 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.257 -0.097 17919 81944 1 200 . 1 1 28 28 ALA C C 28 180.300 180.300 179.090 1.210 17919 81945 1 200 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.473 0.897 17919 81946 1 200 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.497 -0.787 17919 81947 1 200 . 1 1 28 28 ALA H H 28 8.060 8.060 7.898 0.162 17919 81948 1 200 . 1 1 29 29 LYS N N 29 119.940 119.940 120.113 -0.173 17919 81949 1 200 . 1 1 29 29 LYS HA H 29 4.207 4.207 3.997 0.210 17919 81950 1 200 . 1 1 29 29 LYS C C 29 180.320 180.320 179.035 1.285 17919 81951 1 200 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.605 0.045 17919 81952 1 200 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.364 0.926 17919 81953 1 200 . 1 1 29 29 LYS H H 29 7.850 7.850 8.015 -0.165 17919 81954 1 200 . 1 1 30 30 ILE N N 30 121.080 121.080 120.051 1.029 17919 81955 1 200 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.639 -0.132 17919 81956 1 200 . 1 1 30 30 ILE C C 30 178.310 178.310 177.254 1.056 17919 81957 1 200 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.580 0.570 17919 81958 1 200 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.718 -0.918 17919 81959 1 200 . 1 1 30 30 ILE H H 30 8.280 8.280 8.308 -0.028 17919 81960 1 200 . 1 1 31 31 GLN N N 31 123.490 123.490 120.486 3.004 17919 81961 1 200 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.977 -0.148 17919 81962 1 200 . 1 1 31 31 GLN C C 31 178.890 178.890 178.227 0.663 17919 81963 1 200 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.513 0.487 17919 81964 1 200 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.435 -0.715 17919 81965 1 200 . 1 1 31 31 GLN H H 31 8.580 8.580 8.154 0.426 17919 81966 1 200 . 1 1 32 32 ASP N N 32 119.360 119.360 120.101 -0.741 17919 81967 1 200 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.344 0.010 17919 81968 1 200 . 1 1 32 32 ASP C C 32 177.250 177.250 178.253 -1.003 17919 81969 1 200 . 1 1 32 32 ASP CA C 32 57.190 57.190 57.096 0.094 17919 81970 1 200 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.801 -0.221 17919 81971 1 200 . 1 1 32 32 ASP H H 32 8.010 8.010 8.136 -0.126 17919 81972 1 200 . 1 1 33 33 LYS N N 33 115.130 115.130 118.241 -3.111 17919 81973 1 200 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.214 0.123 17919 81974 1 200 . 1 1 33 33 LYS C C 33 177.870 177.870 178.357 -0.487 17919 81975 1 200 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.124 -0.074 17919 81976 1 200 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.076 1.094 17919 81977 1 200 . 1 1 33 33 LYS H H 33 7.430 7.430 7.603 -0.173 17919 81978 1 200 . 1 1 34 34 GLU N N 34 113.870 113.870 114.118 -0.248 17919 81979 1 200 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.517 0.108 17919 81980 1 200 . 1 1 34 34 GLU C C 34 177.840 177.840 176.970 0.870 17919 81981 1 200 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.457 -0.287 17919 81982 1 200 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.927 0.733 17919 81983 1 200 . 1 1 34 34 GLU H H 34 8.740 8.740 8.238 0.502 17919 81984 1 200 . 1 1 35 35 GLY N N 35 108.650 108.650 109.096 -0.446 17919 81985 1 200 . 1 1 35 35 GLY C C 35 173.960 173.960 174.142 -0.182 17919 81986 1 200 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.899 0.181 17919 81987 1 200 . 1 1 35 35 GLY H H 35 8.530 8.530 8.441 0.089 17919 81988 1 200 . 1 1 36 36 ILE N N 36 119.880 119.880 121.551 -1.671 17919 81989 1 200 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.287 0.158 17919 81990 1 200 . 1 1 36 36 ILE C C 36 173.590 173.590 174.034 -0.444 17919 81991 1 200 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.043 -0.293 17919 81992 1 200 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.816 1.764 17919 81993 1 200 . 1 1 36 36 ILE H H 36 6.150 6.150 7.603 -1.453 17919 81994 1 200 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.471 0.163 17919 81995 1 200 . 1 1 37 37 PRO C C 37 176.940 176.940 176.056 0.884 17919 81996 1 200 . 1 1 37 37 PRO CA C 37 61.660 61.660 62.227 -0.567 17919 81997 1 200 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.513 0.337 17919 81998 1 200 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.113 0.004 17919 81999 1 200 . 1 1 38 38 PRO C C 38 178.320 178.320 178.646 -0.326 17919 82000 1 200 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.811 0.449 17919 82001 1 200 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.883 1.007 17919 82002 1 200 . 1 1 39 39 ASP N N 39 113.380 113.380 115.717 -2.337 17919 82003 1 200 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.346 0.084 17919 82004 1 200 . 1 1 39 39 ASP C C 39 177.090 177.090 177.315 -0.225 17919 82005 1 200 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.612 -0.972 17919 82006 1 200 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.412 -0.872 17919 82007 1 200 . 1 1 39 39 ASP H H 39 8.550 8.550 8.528 0.022 17919 82008 1 200 . 1 1 40 40 GLN N N 40 116.780 116.780 115.871 0.909 17919 82009 1 200 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.278 0.186 17919 82010 1 200 . 1 1 40 40 GLN C C 40 175.380 175.380 175.308 0.072 17919 82011 1 200 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.005 -0.365 17919 82012 1 200 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.160 0.980 17919 82013 1 200 . 1 1 40 40 GLN H H 40 7.820 7.820 7.742 0.078 17919 82014 1 200 . 1 1 41 41 GLN N N 41 117.720 117.720 116.058 1.662 17919 82015 1 200 . 1 1 41 41 GLN HA H 41 4.244 4.244 5.242 -0.998 17919 82016 1 200 . 1 1 41 41 GLN C C 41 176.300 176.300 174.496 1.804 17919 82017 1 200 . 1 1 41 41 GLN CA C 41 56.470 56.470 53.954 2.516 17919 82018 1 200 . 1 1 41 41 GLN CB C 41 31.650 31.650 32.104 -0.454 17919 82019 1 200 . 1 1 41 41 GLN H H 41 7.480 7.480 7.521 -0.041 17919 82020 1 200 . 1 1 42 42 ARG N N 42 122.680 122.680 122.221 0.459 17919 82021 1 200 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.617 -0.117 17919 82022 1 200 . 1 1 42 42 ARG C C 42 174.050 174.050 174.534 -0.484 17919 82023 1 200 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.791 0.259 17919 82024 1 200 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.060 -1.310 17919 82025 1 200 . 1 1 42 42 ARG H H 42 8.530 8.530 8.326 0.204 17919 82026 1 200 . 1 1 43 43 LEU N N 43 124.040 124.040 125.476 -1.436 17919 82027 1 200 . 1 1 43 43 LEU C C 43 175.290 175.290 175.403 -0.113 17919 82028 1 200 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.748 -0.769 17919 82029 1 200 . 1 1 43 43 LEU CB C 43 45.790 45.790 42.794 2.996 17919 82030 1 200 . 1 1 43 43 LEU H H 43 8.820 8.820 8.799 0.021 17919 82031 1 200 . 1 1 44 44 ILE N N 44 121.920 121.920 124.158 -2.238 17919 82032 1 200 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.893 0.099 17919 82033 1 200 . 1 1 44 44 ILE C C 44 176.060 176.060 174.628 1.432 17919 82034 1 200 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.219 -0.239 17919 82035 1 200 . 1 1 44 44 ILE CB C 44 41.420 41.420 38.672 2.748 17919 82036 1 200 . 1 1 44 44 ILE H H 44 9.030 9.030 9.163 -0.133 17919 82037 1 200 . 1 1 45 45 PHE N N 45 125.390 125.390 127.776 -2.386 17919 82038 1 200 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.955 0.090 17919 82039 1 200 . 1 1 45 45 PHE C C 45 174.470 174.470 174.868 -0.398 17919 82040 1 200 . 1 1 45 45 PHE CA C 45 57.020 57.020 55.966 1.054 17919 82041 1 200 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.310 0.449 17919 82042 1 200 . 1 1 45 45 PHE H H 45 8.830 8.830 8.983 -0.153 17919 82043 1 200 . 1 1 46 46 ALA N N 46 132.200 132.200 129.432 2.768 17919 82044 1 200 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.604 0.086 17919 82045 1 200 . 1 1 46 46 ALA C C 46 177.290 177.290 177.453 -0.163 17919 82046 1 200 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.755 -0.215 17919 82047 1 200 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.420 0.150 17919 82048 1 200 . 1 1 46 46 ALA H H 46 8.810 8.810 8.583 0.227 17919 82049 1 200 . 1 1 47 47 GLY N N 47 102.340 102.340 103.552 -1.212 17919 82050 1 200 . 1 1 47 47 GLY C C 47 173.810 173.810 174.188 -0.378 17919 82051 1 200 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.139 0.211 17919 82052 1 200 . 1 1 47 47 GLY H H 47 8.130 8.130 8.355 -0.225 17919 82053 1 200 . 1 1 48 48 LYS N N 48 121.570 121.570 122.229 -0.659 17919 82054 1 200 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.697 -0.075 17919 82055 1 200 . 1 1 48 48 LYS C C 48 174.700 174.700 174.778 -0.078 17919 82056 1 200 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.687 -0.137 17919 82057 1 200 . 1 1 48 48 LYS CB C 48 34.530 34.530 35.059 -0.529 17919 82058 1 200 . 1 1 48 48 LYS H H 48 7.980 7.980 8.065 -0.085 17919 82059 1 200 . 1 1 49 49 GLN N N 49 122.410 122.410 124.791 -2.381 17919 82060 1 200 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.620 -0.060 17919 82061 1 200 . 1 1 49 49 GLN C C 49 175.670 175.670 175.205 0.465 17919 82062 1 200 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.154 -0.414 17919 82063 1 200 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.191 -0.191 17919 82064 1 200 . 1 1 49 49 GLN H H 49 8.600 8.600 8.537 0.063 17919 82065 1 200 . 1 1 50 50 LEU N N 50 125.520 125.520 127.572 -2.052 17919 82066 1 200 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.212 -0.122 17919 82067 1 200 . 1 1 50 50 LEU C C 50 176.660 176.660 175.740 0.920 17919 82068 1 200 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.987 0.253 17919 82069 1 200 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.874 -1.304 17919 82070 1 200 . 1 1 50 50 LEU H H 50 8.530 8.530 8.680 -0.150 17919 82071 1 200 . 1 1 51 51 GLU N N 51 122.940 122.940 120.409 2.531 17919 82072 1 200 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.647 -0.159 17919 82073 1 200 . 1 1 51 51 GLU C C 51 175.870 175.870 176.944 -1.074 17919 82074 1 200 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.096 0.863 17919 82075 1 200 . 1 1 51 51 GLU CB C 51 31.570 31.570 33.800 -2.230 17919 82076 1 200 . 1 1 51 51 GLU H H 51 8.400 8.400 8.111 0.289 17919 82077 1 200 . 1 1 52 52 ASP N N 52 120.030 120.030 123.287 -3.257 17919 82078 1 200 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.423 -0.064 17919 82079 1 200 . 1 1 52 52 ASP C C 52 177.330 177.330 177.833 -0.503 17919 82080 1 200 . 1 1 52 52 ASP CA C 52 56.960 56.960 58.464 -1.504 17919 82081 1 200 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.750 0.100 17919 82082 1 200 . 1 1 52 52 ASP H H 52 8.160 8.160 8.852 -0.693 17919 82083 1 200 . 1 1 53 53 GLY N N 53 106.660 106.660 105.256 1.404 17919 82084 1 200 . 1 1 53 53 GLY C C 53 174.870 174.870 174.053 0.817 17919 82085 1 200 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.871 0.299 17919 82086 1 200 . 1 1 53 53 GLY H H 53 9.390 9.390 8.435 0.955 17919 82087 1 200 . 1 1 54 54 ARG N N 54 119.050 119.050 120.874 -1.824 17919 82088 1 200 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.711 -0.016 17919 82089 1 200 . 1 1 54 54 ARG C C 54 175.350 175.350 175.633 -0.283 17919 82090 1 200 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.305 0.085 17919 82091 1 200 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.520 -0.870 17919 82092 1 200 . 1 1 54 54 ARG H H 54 7.460 7.460 7.393 0.067 17919 82093 1 200 . 1 1 55 55 THR N N 55 108.400 108.400 112.334 -3.934 17919 82094 1 200 . 1 1 55 55 THR HA H 55 5.240 5.240 4.805 0.435 17919 82095 1 200 . 1 1 55 55 THR C C 55 176.560 176.560 176.057 0.503 17919 82096 1 200 . 1 1 55 55 THR CA C 55 59.690 59.690 60.490 -0.800 17919 82097 1 200 . 1 1 55 55 THR CB C 55 72.260 72.260 70.760 1.500 17919 82098 1 200 . 1 1 55 55 THR H H 55 8.730 8.730 9.068 -0.338 17919 82099 1 200 . 1 1 56 56 LEU N N 56 117.920 117.920 120.609 -2.689 17919 82100 1 200 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.173 -0.113 17919 82101 1 200 . 1 1 56 56 LEU C C 56 180.810 180.810 179.107 1.703 17919 82102 1 200 . 1 1 56 56 LEU CA C 56 58.710 58.710 57.849 0.861 17919 82103 1 200 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.586 -1.216 17919 82104 1 200 . 1 1 56 56 LEU H H 56 8.140 8.140 8.520 -0.380 17919 82105 1 200 . 1 1 57 57 SER N N 57 113.330 113.330 115.826 -2.496 17919 82106 1 200 . 1 1 57 57 SER HA H 57 4.370 4.370 4.115 0.255 17919 82107 1 200 . 1 1 57 57 SER C C 57 178.310 178.310 177.052 1.258 17919 82108 1 200 . 1 1 57 57 SER CA C 57 61.080 61.080 62.051 -0.971 17919 82109 1 200 . 1 1 57 57 SER CB C 57 62.530 62.530 62.753 -0.223 17919 82110 1 200 . 1 1 57 57 SER H H 57 8.470 8.470 8.479 -0.009 17919 82111 1 200 . 1 1 58 58 ASP N N 58 124.190 124.190 122.383 1.807 17919 82112 1 200 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.331 -0.035 17919 82113 1 200 . 1 1 58 58 ASP C C 58 177.400 177.400 177.630 -0.230 17919 82114 1 200 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.760 0.420 17919 82115 1 200 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.422 -0.322 17919 82116 1 200 . 1 1 58 58 ASP H H 58 7.930 7.930 7.852 0.078 17919 82117 1 200 . 1 1 59 59 TYR N N 59 115.510 115.510 115.679 -0.169 17919 82118 1 200 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.606 0.064 17919 82119 1 200 . 1 1 59 59 TYR C C 59 174.700 174.700 174.751 -0.051 17919 82120 1 200 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.294 0.956 17919 82121 1 200 . 1 1 59 59 TYR CB C 59 40.070 40.070 37.984 2.086 17919 82122 1 200 . 1 1 59 59 TYR H H 59 7.250 7.250 7.409 -0.159 17919 82123 1 200 . 1 1 60 60 ASN N N 60 115.900 115.900 114.474 1.426 17919 82124 1 200 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.403 -0.048 17919 82125 1 200 . 1 1 60 60 ASN C C 60 174.340 174.340 174.394 -0.054 17919 82126 1 200 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.562 -0.442 17919 82127 1 200 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.291 0.118 17919 82128 1 200 . 1 1 60 60 ASN H H 60 8.150 8.150 7.809 0.341 17919 82129 1 200 . 1 1 61 61 ILE N N 61 118.600 118.600 120.213 -1.613 17919 82130 1 200 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.748 -0.355 17919 82131 1 200 . 1 1 61 61 ILE C C 61 174.610 174.610 175.463 -0.853 17919 82132 1 200 . 1 1 61 61 ILE CA C 61 62.420 62.420 60.283 2.137 17919 82133 1 200 . 1 1 61 61 ILE CB C 61 36.740 36.740 36.813 -0.073 17919 82134 1 200 . 1 1 61 61 ILE H H 61 7.250 7.250 7.848 -0.598 17919 82135 1 200 . 1 1 62 62 GLN N N 62 124.740 124.740 125.304 -0.564 17919 82136 1 200 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.666 -0.160 17919 82137 1 200 . 1 1 62 62 GLN C C 62 175.970 175.970 176.112 -0.142 17919 82138 1 200 . 1 1 62 62 GLN CA C 62 53.660 53.660 52.858 0.803 17919 82139 1 200 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.067 0.583 17919 82140 1 200 . 1 1 62 62 GLN H H 62 7.610 7.610 7.808 -0.198 17919 82141 1 200 . 1 1 63 63 LYS N N 63 120.300 120.300 121.745 -1.445 17919 82142 1 200 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.061 -0.060 17919 82143 1 200 . 1 1 63 63 LYS C C 63 175.810 175.810 177.216 -1.406 17919 82144 1 200 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.580 0.210 17919 82145 1 200 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.391 1.259 17919 82146 1 200 . 1 1 63 63 LYS H H 63 8.490 8.490 8.560 -0.070 17919 82147 1 200 . 1 1 64 64 GLU N N 64 113.950 113.950 120.778 -6.828 17919 82148 1 200 . 1 1 64 64 GLU HA H 64 3.465 3.465 4.025 -0.560 17919 82149 1 200 . 1 1 64 64 GLU C C 64 175.250 175.250 176.309 -1.059 17919 82150 1 200 . 1 1 64 64 GLU CA C 64 57.890 57.890 58.178 -0.288 17919 82151 1 200 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.569 -2.669 17919 82152 1 200 . 1 1 64 64 GLU H H 64 9.280 9.280 8.794 0.486 17919 82153 1 200 . 1 1 65 65 SER N N 65 114.730 114.730 115.526 -0.796 17919 82154 1 200 . 1 1 65 65 SER HA H 65 4.640 4.640 4.498 0.142 17919 82155 1 200 . 1 1 65 65 SER C C 65 172.160 172.160 173.758 -1.598 17919 82156 1 200 . 1 1 65 65 SER CA C 65 60.890 60.890 59.979 0.911 17919 82157 1 200 . 1 1 65 65 SER CB C 65 64.910 64.910 64.108 0.802 17919 82158 1 200 . 1 1 65 65 SER H H 65 7.670 7.670 7.851 -0.181 17919 82159 1 200 . 1 1 66 66 THR N N 66 117.110 117.110 120.033 -2.923 17919 82160 1 200 . 1 1 66 66 THR HA H 66 5.270 5.270 5.248 0.022 17919 82161 1 200 . 1 1 66 66 THR C C 66 173.950 173.950 174.424 -0.474 17919 82162 1 200 . 1 1 66 66 THR CA C 66 62.340 62.340 61.931 0.409 17919 82163 1 200 . 1 1 66 66 THR CB C 66 70.080 70.080 70.190 -0.110 17919 82164 1 200 . 1 1 66 66 THR H H 66 8.730 8.730 8.505 0.225 17919 82165 1 200 . 1 1 67 67 LEU N N 67 127.110 127.110 127.917 -0.807 17919 82166 1 200 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.679 0.381 17919 82167 1 200 . 1 1 67 67 LEU C C 67 175.770 175.770 175.486 0.284 17919 82168 1 200 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.102 -0.202 17919 82169 1 200 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.633 0.627 17919 82170 1 200 . 1 1 67 67 LEU H H 67 9.410 9.410 9.279 0.131 17919 82171 1 200 . 1 1 68 68 HIS N N 68 118.380 118.380 121.786 -3.406 17919 82172 1 200 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.632 -0.392 17919 82173 1 200 . 1 1 68 68 HIS C C 68 173.150 173.150 173.649 -0.499 17919 82174 1 200 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.026 0.974 17919 82175 1 200 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.623 -2.093 17919 82176 1 200 . 1 1 68 68 HIS H H 68 9.230 9.230 8.925 0.305 17919 82177 1 200 . 1 1 69 69 LEU N N 69 124.460 124.460 128.974 -4.514 17919 82178 1 200 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.100 0.090 17919 82179 1 200 . 1 1 69 69 LEU C C 69 175.270 175.270 174.406 0.864 17919 82180 1 200 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.460 0.430 17919 82181 1 200 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.052 0.328 17919 82182 1 200 . 1 1 69 69 LEU H H 69 8.340 8.340 7.902 0.438 17919 82183 1 200 . 1 1 70 70 VAL N N 70 126.940 126.940 127.362 -0.422 17919 82184 1 200 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.457 -0.107 17919 82185 1 200 . 1 1 70 70 VAL C C 70 174.000 174.000 174.576 -0.576 17919 82186 1 200 . 1 1 70 70 VAL CA C 70 60.800 60.800 61.068 -0.268 17919 82187 1 200 . 1 1 70 70 VAL CB C 70 34.910 34.910 34.546 0.364 17919 82188 1 200 . 1 1 70 70 VAL H H 70 9.200 9.200 8.830 0.370 17919 82189 1 200 . 1 1 71 71 LEU N N 71 123.130 123.130 125.218 -2.088 17919 82190 1 200 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.051 0.009 17919 82191 1 200 . 1 1 71 71 LEU C C 71 177.830 177.830 176.803 1.027 17919 82192 1 200 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.085 0.855 17919 82193 1 200 . 1 1 71 71 LEU CB C 71 42.850 42.850 44.165 -1.315 17919 82194 1 200 . 1 1 71 71 LEU H H 71 8.120 8.120 8.410 -0.290 17919 82195 1 200 . 1 1 72 72 ARG N N 72 123.490 123.490 122.523 0.967 17919 82196 1 200 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.213 0.088 17919 82197 1 200 . 1 1 72 72 ARG C C 72 175.350 175.350 175.773 -0.423 17919 82198 1 200 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.109 -0.499 17919 82199 1 200 . 1 1 72 72 ARG CB C 72 31.350 31.350 31.084 0.266 17919 82200 1 200 . 1 1 72 72 ARG H H 72 8.580 8.580 8.105 0.475 17919 82201 1 201 . 1 1 2 2 GLN N N 2 123.220 123.220 120.332 2.888 17919 82202 1 201 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.179 0.070 17919 82203 1 201 . 1 1 2 2 GLN C C 2 175.920 175.920 174.987 0.933 17919 82204 1 201 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.516 0.564 17919 82205 1 201 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.574 0.186 17919 82206 1 201 . 1 1 2 2 GLN H H 2 8.900 8.900 8.285 0.615 17919 82207 1 201 . 1 1 3 3 ILE N N 3 115.340 115.340 118.863 -3.523 17919 82208 1 201 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.852 -0.639 17919 82209 1 201 . 1 1 3 3 ILE C C 3 172.450 172.450 173.503 -1.053 17919 82210 1 201 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.033 0.537 17919 82211 1 201 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.871 0.339 17919 82212 1 201 . 1 1 3 3 ILE H H 3 8.320 8.320 8.572 -0.252 17919 82213 1 201 . 1 1 4 4 PHE N N 4 118.110 118.110 119.631 -1.521 17919 82214 1 201 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.196 0.434 17919 82215 1 201 . 1 1 4 4 PHE C C 4 175.320 175.320 174.907 0.413 17919 82216 1 201 . 1 1 4 4 PHE CA C 4 55.210 55.210 56.347 -1.137 17919 82217 1 201 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.625 -0.145 17919 82218 1 201 . 1 1 4 4 PHE H H 4 8.610 8.610 8.525 0.085 17919 82219 1 201 . 1 1 5 5 VAL N N 5 121.000 121.000 123.467 -2.467 17919 82220 1 201 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.339 0.386 17919 82221 1 201 . 1 1 5 5 VAL C C 5 174.870 174.870 174.221 0.649 17919 82222 1 201 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.726 -1.106 17919 82223 1 201 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.267 0.962 17919 82224 1 201 . 1 1 5 5 VAL H H 5 9.300 9.300 9.363 -0.063 17919 82225 1 201 . 1 1 6 6 LYS N N 6 127.520 127.520 128.742 -1.222 17919 82226 1 201 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.056 0.311 17919 82227 1 201 . 1 1 6 6 LYS C C 6 177.140 177.140 176.591 0.549 17919 82228 1 201 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.658 -0.138 17919 82229 1 201 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.745 -0.695 17919 82230 1 201 . 1 1 6 6 LYS H H 6 8.820 8.820 9.132 -0.312 17919 82231 1 201 . 1 1 7 7 THR N N 7 115.400 115.400 118.294 -2.894 17919 82232 1 201 . 1 1 7 7 THR HA H 7 4.970 4.970 4.567 0.403 17919 82233 1 201 . 1 1 7 7 THR C C 7 176.910 176.910 175.177 1.733 17919 82234 1 201 . 1 1 7 7 THR CA C 7 60.470 60.470 60.929 -0.459 17919 82235 1 201 . 1 1 7 7 THR CB C 7 70.630 70.630 70.612 0.018 17919 82236 1 201 . 1 1 7 7 THR H H 7 8.730 8.730 8.578 0.152 17919 82237 1 201 . 1 1 8 8 LEU N N 8 121.330 121.330 119.770 1.560 17919 82238 1 201 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.570 -0.260 17919 82239 1 201 . 1 1 8 8 LEU C C 8 178.800 178.800 177.896 0.904 17919 82240 1 201 . 1 1 8 8 LEU CA C 8 57.580 57.580 56.730 0.850 17919 82241 1 201 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.278 -0.307 17919 82242 1 201 . 1 1 8 8 LEU H H 8 9.100 9.100 8.834 0.266 17919 82243 1 201 . 1 1 9 9 THR N N 9 105.590 105.590 110.403 -4.813 17919 82244 1 201 . 1 1 9 9 THR HA H 9 4.428 4.428 4.322 0.106 17919 82245 1 201 . 1 1 9 9 THR C C 9 175.520 175.520 175.873 -0.353 17919 82246 1 201 . 1 1 9 9 THR CA C 9 61.400 61.400 62.151 -0.751 17919 82247 1 201 . 1 1 9 9 THR CB C 9 69.140 69.140 69.748 -0.608 17919 82248 1 201 . 1 1 9 9 THR H H 9 7.630 7.630 7.681 -0.051 17919 82249 1 201 . 1 1 10 10 GLY N N 10 108.890 108.890 110.218 -1.328 17919 82250 1 201 . 1 1 10 10 GLY C C 10 174.070 174.070 174.261 -0.191 17919 82251 1 201 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.389 0.071 17919 82252 1 201 . 1 1 10 10 GLY H H 10 7.810 7.810 7.528 0.282 17919 82253 1 201 . 1 1 11 11 LYS N N 11 121.600 121.600 122.899 -1.299 17919 82254 1 201 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.401 -0.040 17919 82255 1 201 . 1 1 11 11 LYS C C 11 175.940 175.940 176.278 -0.338 17919 82256 1 201 . 1 1 11 11 LYS CA C 11 56.280 56.280 55.085 1.195 17919 82257 1 201 . 1 1 11 11 LYS CB C 11 33.200 33.200 32.463 0.737 17919 82258 1 201 . 1 1 11 11 LYS H H 11 7.280 7.280 7.610 -0.330 17919 82259 1 201 . 1 1 12 12 THR N N 12 120.440 120.440 121.438 -0.998 17919 82260 1 201 . 1 1 12 12 THR HA H 12 5.046 5.046 4.686 0.360 17919 82261 1 201 . 1 1 12 12 THR C C 12 174.320 174.320 174.705 -0.385 17919 82262 1 201 . 1 1 12 12 THR CA C 12 62.390 62.390 63.589 -1.199 17919 82263 1 201 . 1 1 12 12 THR CB C 12 69.910 69.910 69.476 0.434 17919 82264 1 201 . 1 1 12 12 THR H H 12 8.650 8.650 8.564 0.086 17919 82265 1 201 . 1 1 13 13 ILE N N 13 127.110 127.110 129.703 -2.593 17919 82266 1 201 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.386 0.158 17919 82267 1 201 . 1 1 13 13 ILE C C 13 175.220 175.220 175.029 0.191 17919 82268 1 201 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.785 -0.805 17919 82269 1 201 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.478 0.472 17919 82270 1 201 . 1 1 13 13 ILE H H 13 9.450 9.450 9.187 0.263 17919 82271 1 201 . 1 1 14 14 THR N N 14 121.520 121.520 121.265 0.255 17919 82272 1 201 . 1 1 14 14 THR HA H 14 4.964 4.964 4.855 0.109 17919 82273 1 201 . 1 1 14 14 THR C C 14 173.790 173.790 173.724 0.066 17919 82274 1 201 . 1 1 14 14 THR CA C 14 61.940 61.940 61.675 0.265 17919 82275 1 201 . 1 1 14 14 THR CB C 14 69.650 69.650 69.958 -0.308 17919 82276 1 201 . 1 1 14 14 THR H H 14 8.710 8.710 8.417 0.293 17919 82277 1 201 . 1 1 15 15 LEU N N 15 124.800 124.800 126.316 -1.516 17919 82278 1 201 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.640 0.140 17919 82279 1 201 . 1 1 15 15 LEU C C 15 174.670 174.670 174.893 -0.223 17919 82280 1 201 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.627 -0.797 17919 82281 1 201 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.566 1.504 17919 82282 1 201 . 1 1 15 15 LEU H H 15 8.710 8.710 8.532 0.178 17919 82283 1 201 . 1 1 16 16 GLU N N 16 122.160 122.160 121.786 0.374 17919 82284 1 201 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.150 -0.233 17919 82285 1 201 . 1 1 16 16 GLU C C 16 175.860 175.860 176.087 -0.227 17919 82286 1 201 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.356 -0.536 17919 82287 1 201 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.862 -1.412 17919 82288 1 201 . 1 1 16 16 GLU H H 16 8.140 8.140 8.666 -0.526 17919 82289 1 201 . 1 1 17 17 VAL N N 17 117.210 117.210 118.062 -0.852 17919 82290 1 201 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.952 -0.238 17919 82291 1 201 . 1 1 17 17 VAL C C 17 174.160 174.160 174.774 -0.614 17919 82292 1 201 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.639 -0.209 17919 82293 1 201 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.699 0.702 17919 82294 1 201 . 1 1 17 17 VAL H H 17 8.900 8.900 8.435 0.465 17919 82295 1 201 . 1 1 18 18 GLU N N 18 118.990 118.990 122.017 -3.027 17919 82296 1 201 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.747 0.332 17919 82297 1 201 . 1 1 18 18 GLU C C 18 176.160 176.160 175.580 0.580 17919 82298 1 201 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.717 0.003 17919 82299 1 201 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.179 0.131 17919 82300 1 201 . 1 1 18 18 GLU H H 18 8.640 8.640 8.697 -0.057 17919 82301 1 201 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.251 -0.110 17919 82302 1 201 . 1 1 19 19 PRO C C 19 175.310 175.310 177.568 -2.258 17919 82303 1 201 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.293 0.177 17919 82304 1 201 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.034 -0.084 17919 82305 1 201 . 1 1 20 20 SER N N 20 103.400 103.400 109.822 -6.422 17919 82306 1 201 . 1 1 20 20 SER HA H 20 4.370 4.370 4.306 0.064 17919 82307 1 201 . 1 1 20 20 SER C C 20 174.660 174.660 173.879 0.781 17919 82308 1 201 . 1 1 20 20 SER CA C 20 57.400 57.400 58.369 -0.969 17919 82309 1 201 . 1 1 20 20 SER CB C 20 63.370 63.370 63.120 0.250 17919 82310 1 201 . 1 1 20 20 SER H H 20 7.040 7.040 7.966 -0.926 17919 82311 1 201 . 1 1 21 21 ASP N N 21 123.480 123.480 123.803 -0.323 17919 82312 1 201 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.744 -0.049 17919 82313 1 201 . 1 1 21 21 ASP C C 21 176.360 176.360 176.002 0.358 17919 82314 1 201 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.935 0.765 17919 82315 1 201 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.395 -0.595 17919 82316 1 201 . 1 1 21 21 ASP H H 21 8.030 8.030 7.720 0.310 17919 82317 1 201 . 1 1 22 22 THR N N 22 108.800 108.800 112.576 -3.776 17919 82318 1 201 . 1 1 22 22 THR HA H 22 4.920 4.920 4.863 0.057 17919 82319 1 201 . 1 1 22 22 THR C C 22 176.750 176.750 176.070 0.680 17919 82320 1 201 . 1 1 22 22 THR CA C 22 59.690 59.690 61.371 -1.681 17919 82321 1 201 . 1 1 22 22 THR CB C 22 71.200 71.200 70.517 0.683 17919 82322 1 201 . 1 1 22 22 THR H H 22 7.900 7.900 8.069 -0.169 17919 82323 1 201 . 1 1 23 23 ILE N N 23 121.190 121.190 121.926 -0.736 17919 82324 1 201 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.781 -0.124 17919 82325 1 201 . 1 1 23 23 ILE C C 23 179.040 179.040 177.351 1.689 17919 82326 1 201 . 1 1 23 23 ILE CA C 23 62.260 62.260 64.382 -2.122 17919 82327 1 201 . 1 1 23 23 ILE CB C 23 34.350 34.350 37.429 -3.079 17919 82328 1 201 . 1 1 23 23 ILE H H 23 8.560 8.560 8.729 -0.169 17919 82329 1 201 . 1 1 24 24 GLU N N 24 120.830 120.830 121.878 -1.048 17919 82330 1 201 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.849 0.068 17919 82331 1 201 . 1 1 24 24 GLU C C 24 178.640 178.640 178.388 0.252 17919 82332 1 201 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.930 0.290 17919 82333 1 201 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.503 -1.222 17919 82334 1 201 . 1 1 24 24 GLU H H 24 9.760 9.760 8.269 1.491 17919 82335 1 201 . 1 1 25 25 ASN N N 25 120.570 120.570 118.161 2.409 17919 82336 1 201 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.491 0.034 17919 82337 1 201 . 1 1 25 25 ASN C C 25 178.380 178.380 177.809 0.571 17919 82338 1 201 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.242 -0.182 17919 82339 1 201 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.666 -0.216 17919 82340 1 201 . 1 1 25 25 ASN H H 25 7.920 7.920 7.595 0.325 17919 82341 1 201 . 1 1 26 26 VAL N N 26 121.710 121.710 120.644 1.066 17919 82342 1 201 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.587 -0.190 17919 82343 1 201 . 1 1 26 26 VAL C C 26 177.950 177.950 178.007 -0.057 17919 82344 1 201 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.298 1.362 17919 82345 1 201 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.014 -0.174 17919 82346 1 201 . 1 1 26 26 VAL H H 26 8.070 8.070 8.126 -0.056 17919 82347 1 201 . 1 1 27 27 LYS N N 27 118.860 118.860 119.520 -0.660 17919 82348 1 201 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.150 0.430 17919 82349 1 201 . 1 1 27 27 LYS C C 27 180.550 180.550 179.154 1.396 17919 82350 1 201 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.775 -0.525 17919 82351 1 201 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.195 1.535 17919 82352 1 201 . 1 1 27 27 LYS H H 27 8.560 8.560 8.452 0.108 17919 82353 1 201 . 1 1 28 28 ALA N N 28 123.440 123.440 120.330 3.110 17919 82354 1 201 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.225 -0.065 17919 82355 1 201 . 1 1 28 28 ALA C C 28 180.300 180.300 179.166 1.134 17919 82356 1 201 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.279 1.091 17919 82357 1 201 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.452 -0.742 17919 82358 1 201 . 1 1 28 28 ALA H H 28 8.060 8.060 7.878 0.182 17919 82359 1 201 . 1 1 29 29 LYS N N 29 119.940 119.940 119.494 0.446 17919 82360 1 201 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.000 0.207 17919 82361 1 201 . 1 1 29 29 LYS C C 29 180.320 180.320 178.118 2.202 17919 82362 1 201 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.331 0.319 17919 82363 1 201 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.452 0.839 17919 82364 1 201 . 1 1 29 29 LYS H H 29 7.850 7.850 7.719 0.131 17919 82365 1 201 . 1 1 30 30 ILE N N 30 121.080 121.080 117.768 3.312 17919 82366 1 201 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.783 -0.276 17919 82367 1 201 . 1 1 30 30 ILE C C 30 178.310 178.310 178.237 0.073 17919 82368 1 201 . 1 1 30 30 ILE CA C 30 66.150 66.150 64.172 1.978 17919 82369 1 201 . 1 1 30 30 ILE CB C 30 36.800 36.800 38.129 -1.329 17919 82370 1 201 . 1 1 30 30 ILE H H 30 8.280 8.280 7.524 0.756 17919 82371 1 201 . 1 1 31 31 GLN N N 31 123.490 123.490 121.553 1.937 17919 82372 1 201 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.963 -0.134 17919 82373 1 201 . 1 1 31 31 GLN C C 31 178.890 178.890 177.647 1.243 17919 82374 1 201 . 1 1 31 31 GLN CA C 31 60.000 60.000 58.934 1.066 17919 82375 1 201 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.550 -0.830 17919 82376 1 201 . 1 1 31 31 GLN H H 31 8.580 8.580 8.286 0.294 17919 82377 1 201 . 1 1 32 32 ASP N N 32 119.360 119.360 118.060 1.300 17919 82378 1 201 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.494 -0.140 17919 82379 1 201 . 1 1 32 32 ASP C C 32 177.250 177.250 177.509 -0.259 17919 82380 1 201 . 1 1 32 32 ASP CA C 32 57.190 57.190 55.875 1.315 17919 82381 1 201 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.723 -0.143 17919 82382 1 201 . 1 1 32 32 ASP H H 32 8.010 8.010 7.732 0.278 17919 82383 1 201 . 1 1 33 33 LYS N N 33 115.130 115.130 117.773 -2.643 17919 82384 1 201 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.432 -0.095 17919 82385 1 201 . 1 1 33 33 LYS C C 33 177.870 177.870 177.381 0.489 17919 82386 1 201 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.312 0.738 17919 82387 1 201 . 1 1 33 33 LYS CB C 33 34.170 34.170 35.050 -0.880 17919 82388 1 201 . 1 1 33 33 LYS H H 33 7.430 7.430 7.900 -0.470 17919 82389 1 201 . 1 1 34 34 GLU N N 34 113.870 113.870 115.602 -1.732 17919 82390 1 201 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.498 0.127 17919 82391 1 201 . 1 1 34 34 GLU C C 34 177.840 177.840 176.294 1.546 17919 82392 1 201 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.203 -1.033 17919 82393 1 201 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.355 1.304 17919 82394 1 201 . 1 1 34 34 GLU H H 34 8.740 8.740 7.691 1.049 17919 82395 1 201 . 1 1 35 35 GLY N N 35 108.650 108.650 109.370 -0.720 17919 82396 1 201 . 1 1 35 35 GLY C C 35 173.960 173.960 174.630 -0.670 17919 82397 1 201 . 1 1 35 35 GLY CA C 35 46.080 46.080 46.105 -0.025 17919 82398 1 201 . 1 1 35 35 GLY H H 35 8.530 8.530 7.773 0.757 17919 82399 1 201 . 1 1 36 36 ILE N N 36 119.880 119.880 122.418 -2.538 17919 82400 1 201 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.247 0.198 17919 82401 1 201 . 1 1 36 36 ILE C C 36 173.590 173.590 174.592 -1.002 17919 82402 1 201 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.247 -0.497 17919 82403 1 201 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.725 1.855 17919 82404 1 201 . 1 1 36 36 ILE H H 36 6.150 6.150 7.752 -1.602 17919 82405 1 201 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.823 -0.189 17919 82406 1 201 . 1 1 37 37 PRO C C 37 176.940 176.940 176.160 0.780 17919 82407 1 201 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.166 0.494 17919 82408 1 201 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.263 0.587 17919 82409 1 201 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.161 -0.044 17919 82410 1 201 . 1 1 38 38 PRO C C 38 178.320 178.320 178.587 -0.267 17919 82411 1 201 . 1 1 38 38 PRO CA C 38 66.260 66.260 66.129 0.131 17919 82412 1 201 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.794 1.095 17919 82413 1 201 . 1 1 39 39 ASP N N 39 113.380 113.380 115.285 -1.905 17919 82414 1 201 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.429 0.001 17919 82415 1 201 . 1 1 39 39 ASP C C 39 177.090 177.090 177.326 -0.236 17919 82416 1 201 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.399 -0.759 17919 82417 1 201 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.286 -0.746 17919 82418 1 201 . 1 1 39 39 ASP H H 39 8.550 8.550 8.744 -0.194 17919 82419 1 201 . 1 1 40 40 GLN N N 40 116.780 116.780 118.036 -1.256 17919 82420 1 201 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.341 0.123 17919 82421 1 201 . 1 1 40 40 GLN C C 40 175.380 175.380 175.435 -0.055 17919 82422 1 201 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.175 -0.534 17919 82423 1 201 . 1 1 40 40 GLN CB C 40 30.140 30.140 30.011 0.129 17919 82424 1 201 . 1 1 40 40 GLN H H 40 7.820 7.820 8.179 -0.359 17919 82425 1 201 . 1 1 41 41 GLN N N 41 117.720 117.720 120.087 -2.367 17919 82426 1 201 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.298 -0.054 17919 82427 1 201 . 1 1 41 41 GLN C C 41 176.300 176.300 174.584 1.716 17919 82428 1 201 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.520 -0.050 17919 82429 1 201 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.786 1.864 17919 82430 1 201 . 1 1 41 41 GLN H H 41 7.480 7.480 7.448 0.032 17919 82431 1 201 . 1 1 42 42 ARG N N 42 122.680 122.680 123.663 -0.983 17919 82432 1 201 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.603 -0.103 17919 82433 1 201 . 1 1 42 42 ARG C C 42 174.050 174.050 173.836 0.214 17919 82434 1 201 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.943 0.107 17919 82435 1 201 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.957 -1.207 17919 82436 1 201 . 1 1 42 42 ARG H H 42 8.530 8.530 9.042 -0.512 17919 82437 1 201 . 1 1 43 43 LEU N N 43 124.040 124.040 127.293 -3.253 17919 82438 1 201 . 1 1 43 43 LEU C C 43 175.290 175.290 175.499 -0.209 17919 82439 1 201 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.441 -1.461 17919 82440 1 201 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.308 1.482 17919 82441 1 201 . 1 1 43 43 LEU H H 43 8.820 8.820 8.759 0.061 17919 82442 1 201 . 1 1 44 44 ILE N N 44 121.920 121.920 121.244 0.676 17919 82443 1 201 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.131 -0.139 17919 82444 1 201 . 1 1 44 44 ILE C C 44 176.060 176.060 174.288 1.772 17919 82445 1 201 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.770 -0.790 17919 82446 1 201 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.834 -0.414 17919 82447 1 201 . 1 1 44 44 ILE H H 44 9.030 9.030 8.642 0.388 17919 82448 1 201 . 1 1 45 45 PHE N N 45 125.390 125.390 124.825 0.565 17919 82449 1 201 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.941 0.104 17919 82450 1 201 . 1 1 45 45 PHE C C 45 174.470 174.470 174.185 0.285 17919 82451 1 201 . 1 1 45 45 PHE CA C 45 57.020 57.020 57.051 -0.031 17919 82452 1 201 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.154 0.606 17919 82453 1 201 . 1 1 45 45 PHE H H 45 8.830 8.830 8.962 -0.132 17919 82454 1 201 . 1 1 46 46 ALA N N 46 132.200 132.200 130.326 1.874 17919 82455 1 201 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.637 0.053 17919 82456 1 201 . 1 1 46 46 ALA C C 46 177.290 177.290 177.705 -0.415 17919 82457 1 201 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.847 -0.307 17919 82458 1 201 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.382 0.188 17919 82459 1 201 . 1 1 46 46 ALA H H 46 8.810 8.810 8.641 0.169 17919 82460 1 201 . 1 1 47 47 GLY N N 47 102.340 102.340 103.043 -0.703 17919 82461 1 201 . 1 1 47 47 GLY C C 47 173.810 173.810 174.671 -0.861 17919 82462 1 201 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.357 -0.007 17919 82463 1 201 . 1 1 47 47 GLY H H 47 8.130 8.130 8.584 -0.454 17919 82464 1 201 . 1 1 48 48 LYS N N 48 121.570 121.570 120.289 1.281 17919 82465 1 201 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.637 -0.015 17919 82466 1 201 . 1 1 48 48 LYS C C 48 174.700 174.700 175.663 -0.963 17919 82467 1 201 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.073 -0.523 17919 82468 1 201 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.147 0.383 17919 82469 1 201 . 1 1 48 48 LYS H H 48 7.980 7.980 7.747 0.233 17919 82470 1 201 . 1 1 49 49 GLN N N 49 122.410 122.410 124.372 -1.962 17919 82471 1 201 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.354 0.206 17919 82472 1 201 . 1 1 49 49 GLN C C 49 175.670 175.670 175.358 0.312 17919 82473 1 201 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.081 -0.341 17919 82474 1 201 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.663 -0.663 17919 82475 1 201 . 1 1 49 49 GLN H H 49 8.600 8.600 8.606 -0.006 17919 82476 1 201 . 1 1 50 50 LEU N N 50 125.520 125.520 127.640 -2.120 17919 82477 1 201 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.145 -0.055 17919 82478 1 201 . 1 1 50 50 LEU C C 50 176.660 176.660 176.068 0.592 17919 82479 1 201 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.155 1.085 17919 82480 1 201 . 1 1 50 50 LEU CB C 50 41.570 41.570 40.998 0.572 17919 82481 1 201 . 1 1 50 50 LEU H H 50 8.530 8.530 8.658 -0.128 17919 82482 1 201 . 1 1 51 51 GLU N N 51 122.940 122.940 123.375 -0.435 17919 82483 1 201 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.242 0.246 17919 82484 1 201 . 1 1 51 51 GLU C C 51 175.870 175.870 176.844 -0.974 17919 82485 1 201 . 1 1 51 51 GLU CA C 51 55.960 55.960 56.138 -0.178 17919 82486 1 201 . 1 1 51 51 GLU CB C 51 31.570 31.570 30.531 1.039 17919 82487 1 201 . 1 1 51 51 GLU H H 51 8.400 8.400 8.483 -0.083 17919 82488 1 201 . 1 1 52 52 ASP N N 52 120.030 120.030 124.096 -4.066 17919 82489 1 201 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.355 0.004 17919 82490 1 201 . 1 1 52 52 ASP C C 52 177.330 177.330 177.984 -0.654 17919 82491 1 201 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.905 -0.945 17919 82492 1 201 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.599 0.251 17919 82493 1 201 . 1 1 52 52 ASP H H 52 8.160 8.160 8.784 -0.624 17919 82494 1 201 . 1 1 53 53 GLY N N 53 106.660 106.660 103.919 2.741 17919 82495 1 201 . 1 1 53 53 GLY C C 53 174.870 174.870 174.538 0.332 17919 82496 1 201 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.743 0.426 17919 82497 1 201 . 1 1 53 53 GLY H H 53 9.390 9.390 8.289 1.101 17919 82498 1 201 . 1 1 54 54 ARG N N 54 119.050 119.050 119.460 -0.410 17919 82499 1 201 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.887 -0.192 17919 82500 1 201 . 1 1 54 54 ARG C C 54 175.350 175.350 175.218 0.132 17919 82501 1 201 . 1 1 54 54 ARG CA C 54 54.390 54.390 53.656 0.734 17919 82502 1 201 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.163 -0.513 17919 82503 1 201 . 1 1 54 54 ARG H H 54 7.460 7.460 7.426 0.034 17919 82504 1 201 . 1 1 55 55 THR N N 55 108.400 108.400 111.962 -3.562 17919 82505 1 201 . 1 1 55 55 THR HA H 55 5.240 5.240 5.143 0.097 17919 82506 1 201 . 1 1 55 55 THR C C 55 176.560 176.560 176.200 0.360 17919 82507 1 201 . 1 1 55 55 THR CA C 55 59.690 59.690 59.724 -0.035 17919 82508 1 201 . 1 1 55 55 THR CB C 55 72.260 72.260 71.887 0.373 17919 82509 1 201 . 1 1 55 55 THR H H 55 8.730 8.730 8.924 -0.194 17919 82510 1 201 . 1 1 56 56 LEU N N 56 117.920 117.920 121.044 -3.124 17919 82511 1 201 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.885 0.175 17919 82512 1 201 . 1 1 56 56 LEU C C 56 180.810 180.810 178.938 1.872 17919 82513 1 201 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.392 0.318 17919 82514 1 201 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.460 -1.090 17919 82515 1 201 . 1 1 56 56 LEU H H 56 8.140 8.140 8.351 -0.211 17919 82516 1 201 . 1 1 57 57 SER N N 57 113.330 113.330 113.628 -0.298 17919 82517 1 201 . 1 1 57 57 SER HA H 57 4.370 4.370 4.274 0.096 17919 82518 1 201 . 1 1 57 57 SER C C 57 178.310 178.310 177.105 1.205 17919 82519 1 201 . 1 1 57 57 SER CA C 57 61.080 61.080 61.313 -0.233 17919 82520 1 201 . 1 1 57 57 SER CB C 57 62.530 62.530 62.677 -0.147 17919 82521 1 201 . 1 1 57 57 SER H H 57 8.470 8.470 8.143 0.327 17919 82522 1 201 . 1 1 58 58 ASP N N 58 124.190 124.190 124.267 -0.077 17919 82523 1 201 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.354 -0.058 17919 82524 1 201 . 1 1 58 58 ASP C C 58 177.400 177.400 177.469 -0.069 17919 82525 1 201 . 1 1 58 58 ASP CA C 58 57.180 57.180 57.137 0.043 17919 82526 1 201 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.554 -0.454 17919 82527 1 201 . 1 1 58 58 ASP H H 58 7.930 7.930 7.816 0.114 17919 82528 1 201 . 1 1 59 59 TYR N N 59 115.510 115.510 115.841 -0.331 17919 82529 1 201 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.586 0.084 17919 82530 1 201 . 1 1 59 59 TYR C C 59 174.700 174.700 174.635 0.065 17919 82531 1 201 . 1 1 59 59 TYR CA C 59 58.250 58.250 58.219 0.031 17919 82532 1 201 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.472 1.598 17919 82533 1 201 . 1 1 59 59 TYR H H 59 7.250 7.250 7.580 -0.330 17919 82534 1 201 . 1 1 60 60 ASN N N 60 115.900 115.900 115.833 0.067 17919 82535 1 201 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.389 -0.034 17919 82536 1 201 . 1 1 60 60 ASN C C 60 174.340 174.340 174.507 -0.167 17919 82537 1 201 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.222 -0.102 17919 82538 1 201 . 1 1 60 60 ASN CB C 60 37.410 37.410 36.736 0.674 17919 82539 1 201 . 1 1 60 60 ASN H H 60 8.150 8.150 8.021 0.129 17919 82540 1 201 . 1 1 61 61 ILE N N 61 118.600 118.600 119.561 -0.961 17919 82541 1 201 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.610 -0.217 17919 82542 1 201 . 1 1 61 61 ILE C C 61 174.610 174.610 175.280 -0.670 17919 82543 1 201 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.443 0.977 17919 82544 1 201 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.677 -0.937 17919 82545 1 201 . 1 1 61 61 ILE H H 61 7.250 7.250 7.836 -0.586 17919 82546 1 201 . 1 1 62 62 GLN N N 62 124.740 124.740 125.851 -1.111 17919 82547 1 201 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.544 -0.038 17919 82548 1 201 . 1 1 62 62 GLN C C 62 175.970 175.970 175.029 0.941 17919 82549 1 201 . 1 1 62 62 GLN CA C 62 53.660 53.660 52.971 0.689 17919 82550 1 201 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.040 0.610 17919 82551 1 201 . 1 1 62 62 GLN H H 62 7.610 7.610 8.088 -0.478 17919 82552 1 201 . 1 1 63 63 LYS N N 63 120.300 120.300 118.112 2.188 17919 82553 1 201 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.260 -0.259 17919 82554 1 201 . 1 1 63 63 LYS C C 63 175.810 175.810 177.868 -2.058 17919 82555 1 201 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.952 -0.161 17919 82556 1 201 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.590 0.060 17919 82557 1 201 . 1 1 63 63 LYS H H 63 8.490 8.490 8.449 0.041 17919 82558 1 201 . 1 1 64 64 GLU N N 64 113.950 113.950 116.806 -2.856 17919 82559 1 201 . 1 1 64 64 GLU HA H 64 3.465 3.465 4.190 -0.725 17919 82560 1 201 . 1 1 64 64 GLU C C 64 175.250 175.250 175.998 -0.748 17919 82561 1 201 . 1 1 64 64 GLU CA C 64 57.890 57.890 58.074 -0.184 17919 82562 1 201 . 1 1 64 64 GLU CB C 64 25.900 25.900 29.166 -3.265 17919 82563 1 201 . 1 1 64 64 GLU H H 64 9.280 9.280 8.944 0.336 17919 82564 1 201 . 1 1 65 65 SER N N 65 114.730 114.730 116.530 -1.800 17919 82565 1 201 . 1 1 65 65 SER HA H 65 4.640 4.640 4.531 0.109 17919 82566 1 201 . 1 1 65 65 SER C C 65 172.160 172.160 173.853 -1.693 17919 82567 1 201 . 1 1 65 65 SER CA C 65 60.890 60.890 59.959 0.931 17919 82568 1 201 . 1 1 65 65 SER CB C 65 64.910 64.910 63.912 0.998 17919 82569 1 201 . 1 1 65 65 SER H H 65 7.670 7.670 7.646 0.024 17919 82570 1 201 . 1 1 66 66 THR N N 66 117.110 117.110 120.082 -2.972 17919 82571 1 201 . 1 1 66 66 THR HA H 66 5.270 5.270 5.167 0.103 17919 82572 1 201 . 1 1 66 66 THR C C 66 173.950 173.950 174.062 -0.112 17919 82573 1 201 . 1 1 66 66 THR CA C 66 62.340 62.340 62.028 0.312 17919 82574 1 201 . 1 1 66 66 THR CB C 66 70.080 70.080 70.308 -0.228 17919 82575 1 201 . 1 1 66 66 THR H H 66 8.730 8.730 8.418 0.312 17919 82576 1 201 . 1 1 67 67 LEU N N 67 127.110 127.110 126.199 0.911 17919 82577 1 201 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.577 0.483 17919 82578 1 201 . 1 1 67 67 LEU C C 67 175.770 175.770 175.398 0.372 17919 82579 1 201 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.765 0.135 17919 82580 1 201 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.523 -0.263 17919 82581 1 201 . 1 1 67 67 LEU H H 67 9.410 9.410 8.995 0.415 17919 82582 1 201 . 1 1 68 68 HIS N N 68 118.380 118.380 118.422 -0.042 17919 82583 1 201 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.416 -0.176 17919 82584 1 201 . 1 1 68 68 HIS C C 68 173.150 173.150 174.549 -1.399 17919 82585 1 201 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.392 0.608 17919 82586 1 201 . 1 1 68 68 HIS CB C 68 30.530 30.530 31.497 -0.967 17919 82587 1 201 . 1 1 68 68 HIS H H 68 9.230 9.230 8.425 0.805 17919 82588 1 201 . 1 1 69 69 LEU N N 69 124.460 124.460 126.676 -2.216 17919 82589 1 201 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.379 -0.189 17919 82590 1 201 . 1 1 69 69 LEU C C 69 175.270 175.270 175.317 -0.047 17919 82591 1 201 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.041 -0.151 17919 82592 1 201 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.430 -0.050 17919 82593 1 201 . 1 1 69 69 LEU H H 69 8.340 8.340 8.763 -0.423 17919 82594 1 201 . 1 1 70 70 VAL N N 70 126.940 126.940 122.705 4.235 17919 82595 1 201 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.601 -0.251 17919 82596 1 201 . 1 1 70 70 VAL C C 70 174.000 174.000 173.434 0.566 17919 82597 1 201 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.157 0.643 17919 82598 1 201 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.697 -0.787 17919 82599 1 201 . 1 1 70 70 VAL H H 70 9.200 9.200 9.193 0.007 17919 82600 1 201 . 1 1 71 71 LEU N N 71 123.130 123.130 124.141 -1.011 17919 82601 1 201 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.111 -0.051 17919 82602 1 201 . 1 1 71 71 LEU C C 71 177.830 177.830 177.267 0.563 17919 82603 1 201 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.334 0.606 17919 82604 1 201 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.210 -0.360 17919 82605 1 201 . 1 1 71 71 LEU H H 71 8.120 8.120 8.482 -0.362 17919 82606 1 201 . 1 1 72 72 ARG N N 72 123.490 123.490 123.306 0.184 17919 82607 1 201 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.601 -0.300 17919 82608 1 201 . 1 1 72 72 ARG C C 72 175.350 175.350 176.920 -1.570 17919 82609 1 201 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.751 -0.141 17919 82610 1 201 . 1 1 72 72 ARG CB C 72 31.350 31.350 29.356 1.994 17919 82611 1 201 . 1 1 72 72 ARG H H 72 8.580 8.580 8.441 0.139 17919 82612 1 202 . 1 1 2 2 GLN N N 2 123.220 123.220 121.174 2.046 17919 82613 1 202 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.388 -0.139 17919 82614 1 202 . 1 1 2 2 GLN C C 2 175.920 175.920 175.338 0.582 17919 82615 1 202 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.838 0.242 17919 82616 1 202 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.919 -0.159 17919 82617 1 202 . 1 1 2 2 GLN H H 2 8.900 8.900 8.370 0.530 17919 82618 1 202 . 1 1 3 3 ILE N N 3 115.340 115.340 117.091 -1.751 17919 82619 1 202 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.296 -0.083 17919 82620 1 202 . 1 1 3 3 ILE C C 3 172.450 172.450 173.142 -0.692 17919 82621 1 202 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.346 0.224 17919 82622 1 202 . 1 1 3 3 ILE CB C 3 42.210 42.210 42.242 -0.033 17919 82623 1 202 . 1 1 3 3 ILE H H 3 8.320 8.320 8.590 -0.270 17919 82624 1 202 . 1 1 4 4 PHE N N 4 118.110 118.110 118.351 -0.241 17919 82625 1 202 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.605 0.025 17919 82626 1 202 . 1 1 4 4 PHE C C 4 175.320 175.320 174.986 0.334 17919 82627 1 202 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.889 -0.679 17919 82628 1 202 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.186 -0.706 17919 82629 1 202 . 1 1 4 4 PHE H H 4 8.610 8.610 8.206 0.404 17919 82630 1 202 . 1 1 5 5 VAL N N 5 121.000 121.000 122.286 -1.286 17919 82631 1 202 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.701 0.024 17919 82632 1 202 . 1 1 5 5 VAL C C 5 174.870 174.870 175.215 -0.345 17919 82633 1 202 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.181 -0.561 17919 82634 1 202 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.274 -0.044 17919 82635 1 202 . 1 1 5 5 VAL H H 5 9.300 9.300 9.319 -0.019 17919 82636 1 202 . 1 1 6 6 LYS N N 6 127.520 127.520 127.592 -0.072 17919 82637 1 202 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.386 -0.019 17919 82638 1 202 . 1 1 6 6 LYS C C 6 177.140 177.140 176.617 0.523 17919 82639 1 202 . 1 1 6 6 LYS CA C 6 54.520 54.520 55.339 -0.819 17919 82640 1 202 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.761 0.289 17919 82641 1 202 . 1 1 6 6 LYS H H 6 8.820 8.820 9.315 -0.495 17919 82642 1 202 . 1 1 7 7 THR N N 7 115.400 115.400 115.586 -0.186 17919 82643 1 202 . 1 1 7 7 THR HA H 7 4.970 4.970 4.714 0.256 17919 82644 1 202 . 1 1 7 7 THR C C 7 176.910 176.910 176.264 0.646 17919 82645 1 202 . 1 1 7 7 THR CA C 7 60.470 60.470 59.903 0.567 17919 82646 1 202 . 1 1 7 7 THR CB C 7 70.630 70.630 70.967 -0.337 17919 82647 1 202 . 1 1 7 7 THR H H 7 8.730 8.730 8.726 0.004 17919 82648 1 202 . 1 1 8 8 LEU N N 8 121.330 121.330 123.031 -1.701 17919 82649 1 202 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.212 0.098 17919 82650 1 202 . 1 1 8 8 LEU C C 8 178.800 178.800 177.736 1.064 17919 82651 1 202 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.607 -0.027 17919 82652 1 202 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.168 -0.198 17919 82653 1 202 . 1 1 8 8 LEU H H 8 9.100 9.100 8.724 0.376 17919 82654 1 202 . 1 1 9 9 THR N N 9 105.590 105.590 109.806 -4.216 17919 82655 1 202 . 1 1 9 9 THR HA H 9 4.428 4.428 4.293 0.135 17919 82656 1 202 . 1 1 9 9 THR C C 9 175.520 175.520 175.372 0.148 17919 82657 1 202 . 1 1 9 9 THR CA C 9 61.400 61.400 61.837 -0.437 17919 82658 1 202 . 1 1 9 9 THR CB C 9 69.140 69.140 69.324 -0.184 17919 82659 1 202 . 1 1 9 9 THR H H 9 7.630 7.630 7.663 -0.033 17919 82660 1 202 . 1 1 10 10 GLY N N 10 108.890 108.890 112.236 -3.346 17919 82661 1 202 . 1 1 10 10 GLY C C 10 174.070 174.070 173.096 0.974 17919 82662 1 202 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.072 0.388 17919 82663 1 202 . 1 1 10 10 GLY H H 10 7.810 7.810 8.104 -0.294 17919 82664 1 202 . 1 1 11 11 LYS N N 11 121.600 121.600 119.669 1.931 17919 82665 1 202 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.727 -0.366 17919 82666 1 202 . 1 1 11 11 LYS C C 11 175.940 175.940 175.504 0.436 17919 82667 1 202 . 1 1 11 11 LYS CA C 11 56.280 56.280 54.479 1.801 17919 82668 1 202 . 1 1 11 11 LYS CB C 11 33.200 33.200 34.428 -1.228 17919 82669 1 202 . 1 1 11 11 LYS H H 11 7.280 7.280 7.498 -0.218 17919 82670 1 202 . 1 1 12 12 THR N N 12 120.440 120.440 121.921 -1.481 17919 82671 1 202 . 1 1 12 12 THR HA H 12 5.046 5.046 4.842 0.204 17919 82672 1 202 . 1 1 12 12 THR C C 12 174.320 174.320 174.975 -0.655 17919 82673 1 202 . 1 1 12 12 THR CA C 12 62.390 62.390 63.637 -1.247 17919 82674 1 202 . 1 1 12 12 THR CB C 12 69.910 69.910 68.815 1.095 17919 82675 1 202 . 1 1 12 12 THR H H 12 8.650 8.650 8.526 0.124 17919 82676 1 202 . 1 1 13 13 ILE N N 13 127.110 127.110 125.457 1.653 17919 82677 1 202 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.642 -0.098 17919 82678 1 202 . 1 1 13 13 ILE C C 13 175.220 175.220 175.313 -0.093 17919 82679 1 202 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.614 0.367 17919 82680 1 202 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.280 0.670 17919 82681 1 202 . 1 1 13 13 ILE H H 13 9.450 9.450 9.077 0.373 17919 82682 1 202 . 1 1 14 14 THR N N 14 121.520 121.520 122.955 -1.435 17919 82683 1 202 . 1 1 14 14 THR HA H 14 4.964 4.964 5.099 -0.135 17919 82684 1 202 . 1 1 14 14 THR C C 14 173.790 173.790 173.672 0.118 17919 82685 1 202 . 1 1 14 14 THR CA C 14 61.940 61.940 62.825 -0.885 17919 82686 1 202 . 1 1 14 14 THR CB C 14 69.650 69.650 69.869 -0.219 17919 82687 1 202 . 1 1 14 14 THR H H 14 8.710 8.710 8.661 0.049 17919 82688 1 202 . 1 1 15 15 LEU N N 15 124.800 124.800 124.586 0.214 17919 82689 1 202 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.783 -0.003 17919 82690 1 202 . 1 1 15 15 LEU C C 15 174.670 174.670 175.146 -0.476 17919 82691 1 202 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.468 -0.637 17919 82692 1 202 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.299 1.771 17919 82693 1 202 . 1 1 15 15 LEU H H 15 8.710 8.710 8.902 -0.192 17919 82694 1 202 . 1 1 16 16 GLU N N 16 122.160 122.160 123.334 -1.174 17919 82695 1 202 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.855 0.062 17919 82696 1 202 . 1 1 16 16 GLU C C 16 175.860 175.860 175.845 0.015 17919 82697 1 202 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.407 -0.587 17919 82698 1 202 . 1 1 16 16 GLU CB C 16 29.450 29.450 29.366 0.084 17919 82699 1 202 . 1 1 16 16 GLU H H 16 8.140 8.140 8.656 -0.516 17919 82700 1 202 . 1 1 17 17 VAL N N 17 117.210 117.210 117.631 -0.421 17919 82701 1 202 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.962 -0.248 17919 82702 1 202 . 1 1 17 17 VAL C C 17 174.160 174.160 174.918 -0.758 17919 82703 1 202 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.073 -0.643 17919 82704 1 202 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.623 0.777 17919 82705 1 202 . 1 1 17 17 VAL H H 17 8.900 8.900 8.939 -0.039 17919 82706 1 202 . 1 1 18 18 GLU N N 18 118.990 118.990 123.702 -4.712 17919 82707 1 202 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.750 0.329 17919 82708 1 202 . 1 1 18 18 GLU C C 18 176.160 176.160 175.046 1.114 17919 82709 1 202 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.723 -0.003 17919 82710 1 202 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.714 -0.404 17919 82711 1 202 . 1 1 18 18 GLU H H 18 8.640 8.640 8.489 0.151 17919 82712 1 202 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.307 -0.166 17919 82713 1 202 . 1 1 19 19 PRO C C 19 175.310 175.310 177.474 -2.164 17919 82714 1 202 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.169 0.301 17919 82715 1 202 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.830 0.120 17919 82716 1 202 . 1 1 20 20 SER N N 20 103.400 103.400 109.674 -6.274 17919 82717 1 202 . 1 1 20 20 SER HA H 20 4.370 4.370 4.235 0.135 17919 82718 1 202 . 1 1 20 20 SER C C 20 174.660 174.660 174.314 0.346 17919 82719 1 202 . 1 1 20 20 SER CA C 20 57.400 57.400 59.206 -1.806 17919 82720 1 202 . 1 1 20 20 SER CB C 20 63.370 63.370 62.414 0.956 17919 82721 1 202 . 1 1 20 20 SER H H 20 7.040 7.040 8.082 -1.042 17919 82722 1 202 . 1 1 21 21 ASP N N 21 123.480 123.480 124.227 -0.747 17919 82723 1 202 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.578 0.117 17919 82724 1 202 . 1 1 21 21 ASP C C 21 176.360 176.360 176.716 -0.356 17919 82725 1 202 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.967 0.733 17919 82726 1 202 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.312 -0.513 17919 82727 1 202 . 1 1 21 21 ASP H H 21 8.030 8.030 7.831 0.199 17919 82728 1 202 . 1 1 22 22 THR N N 22 108.800 108.800 113.949 -5.149 17919 82729 1 202 . 1 1 22 22 THR HA H 22 4.920 4.920 4.577 0.343 17919 82730 1 202 . 1 1 22 22 THR C C 22 176.750 176.750 176.314 0.436 17919 82731 1 202 . 1 1 22 22 THR CA C 22 59.690 59.690 62.015 -2.325 17919 82732 1 202 . 1 1 22 22 THR CB C 22 71.200 71.200 70.262 0.938 17919 82733 1 202 . 1 1 22 22 THR H H 22 7.900 7.900 8.370 -0.470 17919 82734 1 202 . 1 1 23 23 ILE N N 23 121.190 121.190 122.945 -1.755 17919 82735 1 202 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.679 -0.022 17919 82736 1 202 . 1 1 23 23 ILE C C 23 179.040 179.040 177.961 1.079 17919 82737 1 202 . 1 1 23 23 ILE CA C 23 62.260 62.260 65.094 -2.834 17919 82738 1 202 . 1 1 23 23 ILE CB C 23 34.350 34.350 37.640 -3.290 17919 82739 1 202 . 1 1 23 23 ILE H H 23 8.560 8.560 9.011 -0.451 17919 82740 1 202 . 1 1 24 24 GLU N N 24 120.830 120.830 119.463 1.367 17919 82741 1 202 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.916 0.001 17919 82742 1 202 . 1 1 24 24 GLU C C 24 178.640 178.640 178.871 -0.231 17919 82743 1 202 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.172 0.048 17919 82744 1 202 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.178 -0.898 17919 82745 1 202 . 1 1 24 24 GLU H H 24 9.760 9.760 8.316 1.444 17919 82746 1 202 . 1 1 25 25 ASN N N 25 120.570 120.570 118.804 1.766 17919 82747 1 202 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.513 0.012 17919 82748 1 202 . 1 1 25 25 ASN C C 25 178.380 178.380 177.993 0.387 17919 82749 1 202 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.152 -0.092 17919 82750 1 202 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.446 0.004 17919 82751 1 202 . 1 1 25 25 ASN H H 25 7.920 7.920 7.609 0.310 17919 82752 1 202 . 1 1 26 26 VAL N N 26 121.710 121.710 121.309 0.401 17919 82753 1 202 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.599 -0.202 17919 82754 1 202 . 1 1 26 26 VAL C C 26 177.950 177.950 177.593 0.357 17919 82755 1 202 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.698 0.962 17919 82756 1 202 . 1 1 26 26 VAL CB C 26 30.840 30.840 30.960 -0.120 17919 82757 1 202 . 1 1 26 26 VAL H H 26 8.070 8.070 8.624 -0.554 17919 82758 1 202 . 1 1 27 27 LYS N N 27 118.860 118.860 119.442 -0.582 17919 82759 1 202 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.039 0.541 17919 82760 1 202 . 1 1 27 27 LYS C C 27 180.550 180.550 179.126 1.424 17919 82761 1 202 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.574 -0.324 17919 82762 1 202 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.120 1.610 17919 82763 1 202 . 1 1 27 27 LYS H H 27 8.560 8.560 8.374 0.186 17919 82764 1 202 . 1 1 28 28 ALA N N 28 123.440 123.440 122.677 0.763 17919 82765 1 202 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.142 0.018 17919 82766 1 202 . 1 1 28 28 ALA C C 28 180.300 180.300 179.085 1.215 17919 82767 1 202 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.974 0.396 17919 82768 1 202 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.427 -0.718 17919 82769 1 202 . 1 1 28 28 ALA H H 28 8.060 8.060 8.332 -0.272 17919 82770 1 202 . 1 1 29 29 LYS N N 29 119.940 119.940 118.859 1.081 17919 82771 1 202 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.059 0.148 17919 82772 1 202 . 1 1 29 29 LYS C C 29 180.320 180.320 179.259 1.061 17919 82773 1 202 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.171 0.479 17919 82774 1 202 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.369 0.921 17919 82775 1 202 . 1 1 29 29 LYS H H 29 7.850 7.850 7.793 0.057 17919 82776 1 202 . 1 1 30 30 ILE N N 30 121.080 121.080 120.648 0.432 17919 82777 1 202 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.666 -0.159 17919 82778 1 202 . 1 1 30 30 ILE C C 30 178.310 178.310 177.273 1.037 17919 82779 1 202 . 1 1 30 30 ILE CA C 30 66.150 66.150 64.986 1.164 17919 82780 1 202 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.733 -0.933 17919 82781 1 202 . 1 1 30 30 ILE H H 30 8.280 8.280 8.462 -0.182 17919 82782 1 202 . 1 1 31 31 GLN N N 31 123.490 123.490 120.780 2.710 17919 82783 1 202 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.920 -0.091 17919 82784 1 202 . 1 1 31 31 GLN C C 31 178.890 178.890 178.265 0.625 17919 82785 1 202 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.480 0.520 17919 82786 1 202 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.394 -0.674 17919 82787 1 202 . 1 1 31 31 GLN H H 31 8.580 8.580 8.046 0.534 17919 82788 1 202 . 1 1 32 32 ASP N N 32 119.360 119.360 119.831 -0.471 17919 82789 1 202 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.398 -0.044 17919 82790 1 202 . 1 1 32 32 ASP C C 32 177.250 177.250 177.924 -0.674 17919 82791 1 202 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.886 0.304 17919 82792 1 202 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.782 -0.202 17919 82793 1 202 . 1 1 32 32 ASP H H 32 8.010 8.010 8.007 0.003 17919 82794 1 202 . 1 1 33 33 LYS N N 33 115.130 115.130 117.235 -2.105 17919 82795 1 202 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.357 -0.020 17919 82796 1 202 . 1 1 33 33 LYS C C 33 177.870 177.870 178.077 -0.207 17919 82797 1 202 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.198 -0.148 17919 82798 1 202 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.508 0.662 17919 82799 1 202 . 1 1 33 33 LYS H H 33 7.430 7.430 7.562 -0.132 17919 82800 1 202 . 1 1 34 34 GLU N N 34 113.870 113.870 115.315 -1.445 17919 82801 1 202 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.525 0.100 17919 82802 1 202 . 1 1 34 34 GLU C C 34 177.840 177.840 177.238 0.602 17919 82803 1 202 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.724 -0.554 17919 82804 1 202 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.711 0.949 17919 82805 1 202 . 1 1 34 34 GLU H H 34 8.740 8.740 8.277 0.463 17919 82806 1 202 . 1 1 35 35 GLY N N 35 108.650 108.650 108.997 -0.347 17919 82807 1 202 . 1 1 35 35 GLY C C 35 173.960 173.960 174.208 -0.248 17919 82808 1 202 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.631 0.449 17919 82809 1 202 . 1 1 35 35 GLY H H 35 8.530 8.530 8.232 0.298 17919 82810 1 202 . 1 1 36 36 ILE N N 36 119.880 119.880 121.225 -1.345 17919 82811 1 202 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.295 0.150 17919 82812 1 202 . 1 1 36 36 ILE C C 36 173.590 173.590 174.051 -0.461 17919 82813 1 202 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.759 -0.009 17919 82814 1 202 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.539 2.041 17919 82815 1 202 . 1 1 36 36 ILE H H 36 6.150 6.150 7.447 -1.297 17919 82816 1 202 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.543 0.091 17919 82817 1 202 . 1 1 37 37 PRO C C 37 176.940 176.940 176.032 0.908 17919 82818 1 202 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.783 -0.123 17919 82819 1 202 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.332 0.518 17919 82820 1 202 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.124 -0.007 17919 82821 1 202 . 1 1 38 38 PRO C C 38 178.320 178.320 178.206 0.114 17919 82822 1 202 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.885 0.375 17919 82823 1 202 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.966 0.924 17919 82824 1 202 . 1 1 39 39 ASP N N 39 113.380 113.380 114.636 -1.256 17919 82825 1 202 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.458 -0.028 17919 82826 1 202 . 1 1 39 39 ASP C C 39 177.090 177.090 177.404 -0.314 17919 82827 1 202 . 1 1 39 39 ASP CA C 39 55.640 55.640 55.915 -0.275 17919 82828 1 202 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.356 -0.816 17919 82829 1 202 . 1 1 39 39 ASP H H 39 8.550 8.550 8.666 -0.116 17919 82830 1 202 . 1 1 40 40 GLN N N 40 116.780 116.780 117.168 -0.388 17919 82831 1 202 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.353 0.111 17919 82832 1 202 . 1 1 40 40 GLN C C 40 175.380 175.380 175.570 -0.190 17919 82833 1 202 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.970 -1.330 17919 82834 1 202 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.836 0.304 17919 82835 1 202 . 1 1 40 40 GLN H H 40 7.820 7.820 7.707 0.113 17919 82836 1 202 . 1 1 41 41 GLN N N 41 117.720 117.720 118.716 -0.996 17919 82837 1 202 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.513 -0.269 17919 82838 1 202 . 1 1 41 41 GLN C C 41 176.300 176.300 175.110 1.190 17919 82839 1 202 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.209 0.261 17919 82840 1 202 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.795 1.855 17919 82841 1 202 . 1 1 41 41 GLN H H 41 7.480 7.480 7.231 0.249 17919 82842 1 202 . 1 1 42 42 ARG N N 42 122.680 122.680 122.203 0.477 17919 82843 1 202 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.813 -0.313 17919 82844 1 202 . 1 1 42 42 ARG C C 42 174.050 174.050 173.815 0.235 17919 82845 1 202 . 1 1 42 42 ARG CA C 42 55.050 55.050 53.467 1.583 17919 82846 1 202 . 1 1 42 42 ARG CB C 42 31.750 31.750 34.057 -2.307 17919 82847 1 202 . 1 1 42 42 ARG H H 42 8.530 8.530 8.839 -0.309 17919 82848 1 202 . 1 1 43 43 LEU N N 43 124.040 124.040 121.718 2.322 17919 82849 1 202 . 1 1 43 43 LEU C C 43 175.290 175.290 175.185 0.105 17919 82850 1 202 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.352 -0.372 17919 82851 1 202 . 1 1 43 43 LEU CB C 43 45.790 45.790 45.087 0.703 17919 82852 1 202 . 1 1 43 43 LEU H H 43 8.820 8.820 8.750 0.070 17919 82853 1 202 . 1 1 44 44 ILE N N 44 121.920 121.920 122.211 -0.291 17919 82854 1 202 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.667 0.325 17919 82855 1 202 . 1 1 44 44 ILE C C 44 176.060 176.060 174.237 1.823 17919 82856 1 202 . 1 1 44 44 ILE CA C 44 58.980 58.980 58.373 0.607 17919 82857 1 202 . 1 1 44 44 ILE CB C 44 41.420 41.420 38.408 3.012 17919 82858 1 202 . 1 1 44 44 ILE H H 44 9.030 9.030 8.702 0.328 17919 82859 1 202 . 1 1 45 45 PHE N N 45 125.390 125.390 127.766 -2.376 17919 82860 1 202 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.884 0.161 17919 82861 1 202 . 1 1 45 45 PHE C C 45 174.470 174.470 174.611 -0.141 17919 82862 1 202 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.189 0.831 17919 82863 1 202 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.754 1.006 17919 82864 1 202 . 1 1 45 45 PHE H H 45 8.830 8.830 8.913 -0.083 17919 82865 1 202 . 1 1 46 46 ALA N N 46 132.200 132.200 129.782 2.418 17919 82866 1 202 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.673 0.017 17919 82867 1 202 . 1 1 46 46 ALA C C 46 177.290 177.290 177.635 -0.345 17919 82868 1 202 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.329 0.211 17919 82869 1 202 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.505 0.066 17919 82870 1 202 . 1 1 46 46 ALA H H 46 8.810 8.810 8.679 0.131 17919 82871 1 202 . 1 1 47 47 GLY N N 47 102.340 102.340 103.197 -0.857 17919 82872 1 202 . 1 1 47 47 GLY C C 47 173.810 173.810 174.131 -0.321 17919 82873 1 202 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.967 0.383 17919 82874 1 202 . 1 1 47 47 GLY H H 47 8.130 8.130 8.489 -0.359 17919 82875 1 202 . 1 1 48 48 LYS N N 48 121.570 121.570 121.044 0.526 17919 82876 1 202 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.552 0.070 17919 82877 1 202 . 1 1 48 48 LYS C C 48 174.700 174.700 175.052 -0.352 17919 82878 1 202 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.027 -0.477 17919 82879 1 202 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.346 0.184 17919 82880 1 202 . 1 1 48 48 LYS H H 48 7.980 7.980 7.916 0.064 17919 82881 1 202 . 1 1 49 49 GLN N N 49 122.410 122.410 126.114 -3.704 17919 82882 1 202 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.602 -0.042 17919 82883 1 202 . 1 1 49 49 GLN C C 49 175.670 175.670 175.936 -0.266 17919 82884 1 202 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.004 -0.264 17919 82885 1 202 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.298 -0.298 17919 82886 1 202 . 1 1 49 49 GLN H H 49 8.600 8.600 8.612 -0.012 17919 82887 1 202 . 1 1 50 50 LEU N N 50 125.520 125.520 127.621 -2.101 17919 82888 1 202 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.093 -0.003 17919 82889 1 202 . 1 1 50 50 LEU C C 50 176.660 176.660 176.701 -0.041 17919 82890 1 202 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.302 -0.062 17919 82891 1 202 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.274 -0.704 17919 82892 1 202 . 1 1 50 50 LEU H H 50 8.530 8.530 8.008 0.522 17919 82893 1 202 . 1 1 51 51 GLU N N 51 122.940 122.940 121.405 1.535 17919 82894 1 202 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.498 -0.010 17919 82895 1 202 . 1 1 51 51 GLU C C 51 175.870 175.870 176.619 -0.749 17919 82896 1 202 . 1 1 51 51 GLU CA C 51 55.960 55.960 54.865 1.095 17919 82897 1 202 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.074 -0.504 17919 82898 1 202 . 1 1 51 51 GLU H H 51 8.400 8.400 8.511 -0.111 17919 82899 1 202 . 1 1 52 52 ASP N N 52 120.030 120.030 125.113 -5.083 17919 82900 1 202 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.522 -0.163 17919 82901 1 202 . 1 1 52 52 ASP C C 52 177.330 177.330 177.625 -0.295 17919 82902 1 202 . 1 1 52 52 ASP CA C 52 56.960 56.960 56.745 0.215 17919 82903 1 202 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.912 -0.062 17919 82904 1 202 . 1 1 52 52 ASP H H 52 8.160 8.160 8.796 -0.636 17919 82905 1 202 . 1 1 53 53 GLY N N 53 106.660 106.660 104.842 1.818 17919 82906 1 202 . 1 1 53 53 GLY C C 53 174.870 174.870 174.297 0.573 17919 82907 1 202 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.536 0.634 17919 82908 1 202 . 1 1 53 53 GLY H H 53 9.390 9.390 8.292 1.098 17919 82909 1 202 . 1 1 54 54 ARG N N 54 119.050 119.050 120.234 -1.184 17919 82910 1 202 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.587 0.108 17919 82911 1 202 . 1 1 54 54 ARG C C 54 175.350 175.350 176.061 -0.711 17919 82912 1 202 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.999 -0.609 17919 82913 1 202 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.090 0.560 17919 82914 1 202 . 1 1 54 54 ARG H H 54 7.460 7.460 7.340 0.120 17919 82915 1 202 . 1 1 55 55 THR N N 55 108.400 108.400 111.851 -3.451 17919 82916 1 202 . 1 1 55 55 THR HA H 55 5.240 5.240 5.076 0.164 17919 82917 1 202 . 1 1 55 55 THR C C 55 176.560 176.560 176.356 0.204 17919 82918 1 202 . 1 1 55 55 THR CA C 55 59.690 59.690 60.155 -0.465 17919 82919 1 202 . 1 1 55 55 THR CB C 55 72.260 72.260 71.201 1.059 17919 82920 1 202 . 1 1 55 55 THR H H 55 8.730 8.730 8.939 -0.209 17919 82921 1 202 . 1 1 56 56 LEU N N 56 117.920 117.920 122.610 -4.690 17919 82922 1 202 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.866 0.194 17919 82923 1 202 . 1 1 56 56 LEU C C 56 180.810 180.810 178.727 2.083 17919 82924 1 202 . 1 1 56 56 LEU CA C 56 58.710 58.710 59.281 -0.571 17919 82925 1 202 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.619 -1.249 17919 82926 1 202 . 1 1 56 56 LEU H H 56 8.140 8.140 8.674 -0.534 17919 82927 1 202 . 1 1 57 57 SER N N 57 113.330 113.330 113.836 -0.506 17919 82928 1 202 . 1 1 57 57 SER HA H 57 4.370 4.370 4.132 0.238 17919 82929 1 202 . 1 1 57 57 SER C C 57 178.310 178.310 176.957 1.353 17919 82930 1 202 . 1 1 57 57 SER CA C 57 61.080 61.080 61.740 -0.660 17919 82931 1 202 . 1 1 57 57 SER CB C 57 62.530 62.530 62.965 -0.435 17919 82932 1 202 . 1 1 57 57 SER H H 57 8.470 8.470 7.805 0.665 17919 82933 1 202 . 1 1 58 58 ASP N N 58 124.190 124.190 122.755 1.435 17919 82934 1 202 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.285 0.011 17919 82935 1 202 . 1 1 58 58 ASP C C 58 177.400 177.400 177.817 -0.417 17919 82936 1 202 . 1 1 58 58 ASP CA C 58 57.180 57.180 57.023 0.157 17919 82937 1 202 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.399 -0.299 17919 82938 1 202 . 1 1 58 58 ASP H H 58 7.930 7.930 8.070 -0.140 17919 82939 1 202 . 1 1 59 59 TYR N N 59 115.510 115.510 115.890 -0.380 17919 82940 1 202 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.487 0.183 17919 82941 1 202 . 1 1 59 59 TYR C C 59 174.700 174.700 175.166 -0.466 17919 82942 1 202 . 1 1 59 59 TYR CA C 59 58.250 58.250 58.479 -0.229 17919 82943 1 202 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.900 1.170 17919 82944 1 202 . 1 1 59 59 TYR H H 59 7.250 7.250 7.417 -0.167 17919 82945 1 202 . 1 1 60 60 ASN N N 60 115.900 115.900 117.468 -1.568 17919 82946 1 202 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.382 -0.027 17919 82947 1 202 . 1 1 60 60 ASN C C 60 174.340 174.340 174.555 -0.215 17919 82948 1 202 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.374 -0.255 17919 82949 1 202 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.089 0.321 17919 82950 1 202 . 1 1 60 60 ASN H H 60 8.150 8.150 8.155 -0.005 17919 82951 1 202 . 1 1 61 61 ILE N N 61 118.600 118.600 119.794 -1.194 17919 82952 1 202 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.874 -0.481 17919 82953 1 202 . 1 1 61 61 ILE C C 61 174.610 174.610 174.884 -0.274 17919 82954 1 202 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.535 0.885 17919 82955 1 202 . 1 1 61 61 ILE CB C 61 36.740 36.740 38.563 -1.823 17919 82956 1 202 . 1 1 61 61 ILE H H 61 7.250 7.250 8.131 -0.881 17919 82957 1 202 . 1 1 62 62 GLN N N 62 124.740 124.740 124.386 0.354 17919 82958 1 202 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.797 -0.291 17919 82959 1 202 . 1 1 62 62 GLN C C 62 175.970 175.970 175.954 0.016 17919 82960 1 202 . 1 1 62 62 GLN CA C 62 53.660 53.660 52.601 1.059 17919 82961 1 202 . 1 1 62 62 GLN CB C 62 31.650 31.650 32.370 -0.720 17919 82962 1 202 . 1 1 62 62 GLN H H 62 7.610 7.610 8.150 -0.540 17919 82963 1 202 . 1 1 63 63 LYS N N 63 120.300 120.300 121.638 -1.338 17919 82964 1 202 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.149 -0.148 17919 82965 1 202 . 1 1 63 63 LYS C C 63 175.810 175.810 176.864 -1.054 17919 82966 1 202 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.343 0.447 17919 82967 1 202 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.279 0.371 17919 82968 1 202 . 1 1 63 63 LYS H H 63 8.490 8.490 8.648 -0.158 17919 82969 1 202 . 1 1 64 64 GLU N N 64 113.950 113.950 116.675 -2.725 17919 82970 1 202 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.742 -0.277 17919 82971 1 202 . 1 1 64 64 GLU C C 64 175.250 175.250 175.848 -0.598 17919 82972 1 202 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.988 -0.098 17919 82973 1 202 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.872 -2.972 17919 82974 1 202 . 1 1 64 64 GLU H H 64 9.280 9.280 8.808 0.472 17919 82975 1 202 . 1 1 65 65 SER N N 65 114.730 114.730 115.712 -0.982 17919 82976 1 202 . 1 1 65 65 SER HA H 65 4.640 4.640 4.460 0.180 17919 82977 1 202 . 1 1 65 65 SER C C 65 172.160 172.160 173.632 -1.472 17919 82978 1 202 . 1 1 65 65 SER CA C 65 60.890 60.890 60.915 -0.025 17919 82979 1 202 . 1 1 65 65 SER CB C 65 64.910 64.910 63.886 1.024 17919 82980 1 202 . 1 1 65 65 SER H H 65 7.670 7.670 7.647 0.023 17919 82981 1 202 . 1 1 66 66 THR N N 66 117.110 117.110 119.233 -2.123 17919 82982 1 202 . 1 1 66 66 THR HA H 66 5.270 5.270 5.356 -0.086 17919 82983 1 202 . 1 1 66 66 THR C C 66 173.950 173.950 174.001 -0.051 17919 82984 1 202 . 1 1 66 66 THR CA C 66 62.340 62.340 61.904 0.436 17919 82985 1 202 . 1 1 66 66 THR CB C 66 70.080 70.080 70.200 -0.120 17919 82986 1 202 . 1 1 66 66 THR H H 66 8.730 8.730 8.325 0.405 17919 82987 1 202 . 1 1 67 67 LEU N N 67 127.110 127.110 127.618 -0.508 17919 82988 1 202 . 1 1 67 67 LEU HA H 67 5.060 5.060 5.101 -0.041 17919 82989 1 202 . 1 1 67 67 LEU C C 67 175.770 175.770 175.390 0.380 17919 82990 1 202 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.730 0.170 17919 82991 1 202 . 1 1 67 67 LEU CB C 67 44.260 44.260 45.027 -0.767 17919 82992 1 202 . 1 1 67 67 LEU H H 67 9.410 9.410 9.105 0.305 17919 82993 1 202 . 1 1 68 68 HIS N N 68 118.380 118.380 117.942 0.438 17919 82994 1 202 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.607 -0.367 17919 82995 1 202 . 1 1 68 68 HIS C C 68 173.150 173.150 173.210 -0.060 17919 82996 1 202 . 1 1 68 68 HIS CA C 68 55.000 55.000 53.394 1.607 17919 82997 1 202 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.761 -2.231 17919 82998 1 202 . 1 1 68 68 HIS H H 68 9.230 9.230 8.850 0.380 17919 82999 1 202 . 1 1 69 69 LEU N N 69 124.460 124.460 126.534 -2.074 17919 83000 1 202 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.166 0.024 17919 83001 1 202 . 1 1 69 69 LEU C C 69 175.270 175.270 174.941 0.329 17919 83002 1 202 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.957 -0.067 17919 83003 1 202 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.002 0.378 17919 83004 1 202 . 1 1 69 69 LEU H H 69 8.340 8.340 8.467 -0.127 17919 83005 1 202 . 1 1 70 70 VAL N N 70 126.940 126.940 119.811 7.129 17919 83006 1 202 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.615 -0.265 17919 83007 1 202 . 1 1 70 70 VAL C C 70 174.000 174.000 173.639 0.361 17919 83008 1 202 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.748 1.052 17919 83009 1 202 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.309 -0.398 17919 83010 1 202 . 1 1 70 70 VAL H H 70 9.200 9.200 8.658 0.542 17919 83011 1 202 . 1 1 71 71 LEU N N 71 123.130 123.130 119.677 3.453 17919 83012 1 202 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.124 -0.064 17919 83013 1 202 . 1 1 71 71 LEU C C 71 177.830 177.830 177.709 0.121 17919 83014 1 202 . 1 1 71 71 LEU CA C 71 53.940 53.940 52.660 1.280 17919 83015 1 202 . 1 1 71 71 LEU CB C 71 42.850 42.850 44.129 -1.279 17919 83016 1 202 . 1 1 71 71 LEU H H 71 8.120 8.120 8.295 -0.175 17919 83017 1 202 . 1 1 72 72 ARG N N 72 123.490 123.490 123.824 -0.334 17919 83018 1 202 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.204 0.097 17919 83019 1 202 . 1 1 72 72 ARG C C 72 175.350 175.350 175.296 0.054 17919 83020 1 202 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.921 -1.311 17919 83021 1 202 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.576 0.774 17919 83022 1 202 . 1 1 72 72 ARG H H 72 8.580 8.580 8.300 0.280 17919 83023 1 203 . 1 1 2 2 GLN N N 2 123.220 123.220 120.113 3.107 17919 83024 1 203 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.378 -0.129 17919 83025 1 203 . 1 1 2 2 GLN C C 2 175.920 175.920 175.836 0.084 17919 83026 1 203 . 1 1 2 2 GLN CA C 2 55.080 55.080 55.130 -0.050 17919 83027 1 203 . 1 1 2 2 GLN CB C 2 30.760 30.760 29.820 0.940 17919 83028 1 203 . 1 1 2 2 GLN H H 2 8.900 8.900 8.372 0.528 17919 83029 1 203 . 1 1 3 3 ILE N N 3 115.340 115.340 116.741 -1.401 17919 83030 1 203 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.166 0.047 17919 83031 1 203 . 1 1 3 3 ILE C C 3 172.450 172.450 173.673 -1.223 17919 83032 1 203 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.130 0.440 17919 83033 1 203 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.716 0.494 17919 83034 1 203 . 1 1 3 3 ILE H H 3 8.320 8.320 8.516 -0.196 17919 83035 1 203 . 1 1 4 4 PHE N N 4 118.110 118.110 119.134 -1.024 17919 83036 1 203 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.664 -0.034 17919 83037 1 203 . 1 1 4 4 PHE C C 4 175.320 175.320 175.138 0.182 17919 83038 1 203 . 1 1 4 4 PHE CA C 4 55.210 55.210 54.682 0.528 17919 83039 1 203 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.768 -0.288 17919 83040 1 203 . 1 1 4 4 PHE H H 4 8.610 8.610 8.448 0.162 17919 83041 1 203 . 1 1 5 5 VAL N N 5 121.000 121.000 122.577 -1.577 17919 83042 1 203 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.625 0.100 17919 83043 1 203 . 1 1 5 5 VAL C C 5 174.870 174.870 175.293 -0.423 17919 83044 1 203 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.172 -0.552 17919 83045 1 203 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.784 0.446 17919 83046 1 203 . 1 1 5 5 VAL H H 5 9.300 9.300 9.454 -0.154 17919 83047 1 203 . 1 1 6 6 LYS N N 6 127.520 127.520 128.836 -1.316 17919 83048 1 203 . 1 1 6 6 LYS HA H 6 5.367 5.367 4.890 0.477 17919 83049 1 203 . 1 1 6 6 LYS C C 6 177.140 177.140 176.772 0.368 17919 83050 1 203 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.654 -0.134 17919 83051 1 203 . 1 1 6 6 LYS CB C 6 35.050 35.050 33.812 1.238 17919 83052 1 203 . 1 1 6 6 LYS H H 6 8.820 8.820 9.267 -0.447 17919 83053 1 203 . 1 1 7 7 THR N N 7 115.400 115.400 115.315 0.085 17919 83054 1 203 . 1 1 7 7 THR HA H 7 4.970 4.970 4.711 0.259 17919 83055 1 203 . 1 1 7 7 THR C C 7 176.910 176.910 176.974 -0.064 17919 83056 1 203 . 1 1 7 7 THR CA C 7 60.470 60.470 60.195 0.275 17919 83057 1 203 . 1 1 7 7 THR CB C 7 70.630 70.630 70.807 -0.177 17919 83058 1 203 . 1 1 7 7 THR H H 7 8.730 8.730 8.785 -0.055 17919 83059 1 203 . 1 1 8 8 LEU N N 8 121.330 121.330 117.495 3.835 17919 83060 1 203 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.579 -0.269 17919 83061 1 203 . 1 1 8 8 LEU C C 8 178.800 178.800 177.527 1.273 17919 83062 1 203 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.878 -0.298 17919 83063 1 203 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.461 0.510 17919 83064 1 203 . 1 1 8 8 LEU H H 8 9.100 9.100 8.706 0.394 17919 83065 1 203 . 1 1 9 9 THR N N 9 105.590 105.590 107.227 -1.637 17919 83066 1 203 . 1 1 9 9 THR HA H 9 4.428 4.428 4.294 0.134 17919 83067 1 203 . 1 1 9 9 THR C C 9 175.520 175.520 175.628 -0.108 17919 83068 1 203 . 1 1 9 9 THR CA C 9 61.400 61.400 61.690 -0.290 17919 83069 1 203 . 1 1 9 9 THR CB C 9 69.140 69.140 68.878 0.262 17919 83070 1 203 . 1 1 9 9 THR H H 9 7.630 7.630 7.591 0.039 17919 83071 1 203 . 1 1 10 10 GLY N N 10 108.890 108.890 110.836 -1.946 17919 83072 1 203 . 1 1 10 10 GLY C C 10 174.070 174.070 173.770 0.300 17919 83073 1 203 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.210 0.250 17919 83074 1 203 . 1 1 10 10 GLY H H 10 7.810 7.810 8.068 -0.258 17919 83075 1 203 . 1 1 11 11 LYS N N 11 121.600 121.600 121.676 -0.076 17919 83076 1 203 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.354 0.007 17919 83077 1 203 . 1 1 11 11 LYS C C 11 175.940 175.940 175.588 0.352 17919 83078 1 203 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.499 -0.219 17919 83079 1 203 . 1 1 11 11 LYS CB C 11 33.200 33.200 32.929 0.271 17919 83080 1 203 . 1 1 11 11 LYS H H 11 7.280 7.280 7.567 -0.287 17919 83081 1 203 . 1 1 12 12 THR N N 12 120.440 120.440 116.337 4.103 17919 83082 1 203 . 1 1 12 12 THR HA H 12 5.046 5.046 5.377 -0.331 17919 83083 1 203 . 1 1 12 12 THR C C 12 174.320 174.320 174.309 0.011 17919 83084 1 203 . 1 1 12 12 THR CA C 12 62.390 62.390 61.796 0.594 17919 83085 1 203 . 1 1 12 12 THR CB C 12 69.910 69.910 70.602 -0.692 17919 83086 1 203 . 1 1 12 12 THR H H 12 8.650 8.650 8.184 0.466 17919 83087 1 203 . 1 1 13 13 ILE N N 13 127.110 127.110 126.121 0.989 17919 83088 1 203 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.424 0.120 17919 83089 1 203 . 1 1 13 13 ILE C C 13 175.220 175.220 174.761 0.459 17919 83090 1 203 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.343 -0.363 17919 83091 1 203 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.951 -0.001 17919 83092 1 203 . 1 1 13 13 ILE H H 13 9.450 9.450 9.186 0.264 17919 83093 1 203 . 1 1 14 14 THR N N 14 121.520 121.520 122.900 -1.380 17919 83094 1 203 . 1 1 14 14 THR HA H 14 4.964 4.964 5.276 -0.312 17919 83095 1 203 . 1 1 14 14 THR C C 14 173.790 173.790 174.002 -0.212 17919 83096 1 203 . 1 1 14 14 THR CA C 14 61.940 61.940 62.032 -0.092 17919 83097 1 203 . 1 1 14 14 THR CB C 14 69.650 69.650 69.724 -0.074 17919 83098 1 203 . 1 1 14 14 THR H H 14 8.710 8.710 8.529 0.181 17919 83099 1 203 . 1 1 15 15 LEU N N 15 124.800 124.800 128.622 -3.822 17919 83100 1 203 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.672 0.108 17919 83101 1 203 . 1 1 15 15 LEU C C 15 174.670 174.670 175.622 -0.952 17919 83102 1 203 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.618 -0.788 17919 83103 1 203 . 1 1 15 15 LEU CB C 15 47.070 47.070 44.443 2.627 17919 83104 1 203 . 1 1 15 15 LEU H H 15 8.710 8.710 9.090 -0.380 17919 83105 1 203 . 1 1 16 16 GLU N N 16 122.160 122.160 123.939 -1.779 17919 83106 1 203 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.643 0.274 17919 83107 1 203 . 1 1 16 16 GLU C C 16 175.860 175.860 176.118 -0.258 17919 83108 1 203 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.994 -1.174 17919 83109 1 203 . 1 1 16 16 GLU CB C 16 29.450 29.450 29.496 -0.046 17919 83110 1 203 . 1 1 16 16 GLU H H 16 8.140 8.140 8.708 -0.568 17919 83111 1 203 . 1 1 17 17 VAL N N 17 117.210 117.210 119.788 -2.578 17919 83112 1 203 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.875 -0.161 17919 83113 1 203 . 1 1 17 17 VAL C C 17 174.160 174.160 174.625 -0.465 17919 83114 1 203 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.982 -0.552 17919 83115 1 203 . 1 1 17 17 VAL CB C 17 36.400 36.400 36.170 0.230 17919 83116 1 203 . 1 1 17 17 VAL H H 17 8.900 8.900 8.989 -0.089 17919 83117 1 203 . 1 1 18 18 GLU N N 18 118.990 118.990 121.604 -2.614 17919 83118 1 203 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.834 0.245 17919 83119 1 203 . 1 1 18 18 GLU C C 18 176.160 176.160 175.617 0.543 17919 83120 1 203 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.848 -0.128 17919 83121 1 203 . 1 1 18 18 GLU CB C 18 30.310 30.310 31.289 -0.979 17919 83122 1 203 . 1 1 18 18 GLU H H 18 8.640 8.640 8.125 0.515 17919 83123 1 203 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.254 -0.113 17919 83124 1 203 . 1 1 19 19 PRO C C 19 175.310 175.310 177.807 -2.497 17919 83125 1 203 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.485 -0.015 17919 83126 1 203 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.917 0.033 17919 83127 1 203 . 1 1 20 20 SER N N 20 103.400 103.400 110.972 -7.572 17919 83128 1 203 . 1 1 20 20 SER HA H 20 4.370 4.370 4.288 0.082 17919 83129 1 203 . 1 1 20 20 SER C C 20 174.660 174.660 174.434 0.226 17919 83130 1 203 . 1 1 20 20 SER CA C 20 57.400 57.400 58.849 -1.449 17919 83131 1 203 . 1 1 20 20 SER CB C 20 63.370 63.370 62.783 0.586 17919 83132 1 203 . 1 1 20 20 SER H H 20 7.040 7.040 8.065 -1.025 17919 83133 1 203 . 1 1 21 21 ASP N N 21 123.480 123.480 123.234 0.246 17919 83134 1 203 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.714 -0.019 17919 83135 1 203 . 1 1 21 21 ASP C C 21 176.360 176.360 175.855 0.505 17919 83136 1 203 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.258 0.442 17919 83137 1 203 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.344 -0.545 17919 83138 1 203 . 1 1 21 21 ASP H H 21 8.030 8.030 7.779 0.251 17919 83139 1 203 . 1 1 22 22 THR N N 22 108.800 108.800 111.921 -3.121 17919 83140 1 203 . 1 1 22 22 THR HA H 22 4.920 4.920 4.933 -0.013 17919 83141 1 203 . 1 1 22 22 THR C C 22 176.750 176.750 176.050 0.700 17919 83142 1 203 . 1 1 22 22 THR CA C 22 59.690 59.690 60.599 -0.909 17919 83143 1 203 . 1 1 22 22 THR CB C 22 71.200 71.200 71.263 -0.063 17919 83144 1 203 . 1 1 22 22 THR H H 22 7.900 7.900 8.002 -0.102 17919 83145 1 203 . 1 1 23 23 ILE N N 23 121.190 121.190 121.986 -0.796 17919 83146 1 203 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.831 -0.174 17919 83147 1 203 . 1 1 23 23 ILE C C 23 179.040 179.040 177.684 1.356 17919 83148 1 203 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.682 -0.422 17919 83149 1 203 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.436 -2.086 17919 83150 1 203 . 1 1 23 23 ILE H H 23 8.560 8.560 8.651 -0.091 17919 83151 1 203 . 1 1 24 24 GLU N N 24 120.830 120.830 121.849 -1.019 17919 83152 1 203 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.844 0.073 17919 83153 1 203 . 1 1 24 24 GLU C C 24 178.640 178.640 178.686 -0.046 17919 83154 1 203 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.239 -0.019 17919 83155 1 203 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.395 -1.115 17919 83156 1 203 . 1 1 24 24 GLU H H 24 9.760 9.760 8.433 1.327 17919 83157 1 203 . 1 1 25 25 ASN N N 25 120.570 120.570 117.920 2.650 17919 83158 1 203 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.491 0.034 17919 83159 1 203 . 1 1 25 25 ASN C C 25 178.380 178.380 178.040 0.340 17919 83160 1 203 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.089 -0.029 17919 83161 1 203 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.664 -0.214 17919 83162 1 203 . 1 1 25 25 ASN H H 25 7.920 7.920 7.725 0.195 17919 83163 1 203 . 1 1 26 26 VAL N N 26 121.710 121.710 119.899 1.811 17919 83164 1 203 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.684 -0.287 17919 83165 1 203 . 1 1 26 26 VAL C C 26 177.950 177.950 178.024 -0.074 17919 83166 1 203 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.365 1.295 17919 83167 1 203 . 1 1 26 26 VAL CB C 26 30.840 30.840 30.977 -0.137 17919 83168 1 203 . 1 1 26 26 VAL H H 26 8.070 8.070 8.321 -0.251 17919 83169 1 203 . 1 1 27 27 LYS N N 27 118.860 118.860 120.444 -1.584 17919 83170 1 203 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.175 0.405 17919 83171 1 203 . 1 1 27 27 LYS C C 27 180.550 180.550 179.165 1.385 17919 83172 1 203 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.746 -0.496 17919 83173 1 203 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.256 1.474 17919 83174 1 203 . 1 1 27 27 LYS H H 27 8.560 8.560 8.284 0.276 17919 83175 1 203 . 1 1 28 28 ALA N N 28 123.440 123.440 121.949 1.491 17919 83176 1 203 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.123 0.037 17919 83177 1 203 . 1 1 28 28 ALA C C 28 180.300 180.300 179.241 1.059 17919 83178 1 203 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.121 0.249 17919 83179 1 203 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.434 -0.725 17919 83180 1 203 . 1 1 28 28 ALA H H 28 8.060 8.060 8.216 -0.156 17919 83181 1 203 . 1 1 29 29 LYS N N 29 119.940 119.940 118.961 0.979 17919 83182 1 203 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.079 0.128 17919 83183 1 203 . 1 1 29 29 LYS C C 29 180.320 180.320 179.008 1.312 17919 83184 1 203 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.193 0.457 17919 83185 1 203 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.411 0.879 17919 83186 1 203 . 1 1 29 29 LYS H H 29 7.850 7.850 7.539 0.311 17919 83187 1 203 . 1 1 30 30 ILE N N 30 121.080 121.080 120.583 0.497 17919 83188 1 203 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.650 -0.143 17919 83189 1 203 . 1 1 30 30 ILE C C 30 178.310 178.310 177.473 0.837 17919 83190 1 203 . 1 1 30 30 ILE CA C 30 66.150 66.150 64.980 1.170 17919 83191 1 203 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.959 -1.159 17919 83192 1 203 . 1 1 30 30 ILE H H 30 8.280 8.280 8.177 0.103 17919 83193 1 203 . 1 1 31 31 GLN N N 31 123.490 123.490 120.451 3.039 17919 83194 1 203 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.891 -0.062 17919 83195 1 203 . 1 1 31 31 GLN C C 31 178.890 178.890 178.220 0.670 17919 83196 1 203 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.495 0.505 17919 83197 1 203 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.424 -0.704 17919 83198 1 203 . 1 1 31 31 GLN H H 31 8.580 8.580 8.291 0.289 17919 83199 1 203 . 1 1 32 32 ASP N N 32 119.360 119.360 119.454 -0.094 17919 83200 1 203 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.381 -0.027 17919 83201 1 203 . 1 1 32 32 ASP C C 32 177.250 177.250 177.898 -0.648 17919 83202 1 203 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.949 0.241 17919 83203 1 203 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.801 -0.221 17919 83204 1 203 . 1 1 32 32 ASP H H 32 8.010 8.010 8.009 0.001 17919 83205 1 203 . 1 1 33 33 LYS N N 33 115.130 115.130 117.949 -2.819 17919 83206 1 203 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.313 0.024 17919 83207 1 203 . 1 1 33 33 LYS C C 33 177.870 177.870 177.717 0.153 17919 83208 1 203 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.881 0.169 17919 83209 1 203 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.273 0.897 17919 83210 1 203 . 1 1 33 33 LYS H H 33 7.430 7.430 7.459 -0.029 17919 83211 1 203 . 1 1 34 34 GLU N N 34 113.870 113.870 114.557 -0.687 17919 83212 1 203 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.526 0.099 17919 83213 1 203 . 1 1 34 34 GLU C C 34 177.840 177.840 177.235 0.605 17919 83214 1 203 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.983 -0.813 17919 83215 1 203 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.948 0.712 17919 83216 1 203 . 1 1 34 34 GLU H H 34 8.740 8.740 7.820 0.920 17919 83217 1 203 . 1 1 35 35 GLY N N 35 108.650 108.650 109.323 -0.673 17919 83218 1 203 . 1 1 35 35 GLY C C 35 173.960 173.960 174.120 -0.160 17919 83219 1 203 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.834 0.246 17919 83220 1 203 . 1 1 35 35 GLY H H 35 8.530 8.530 8.364 0.166 17919 83221 1 203 . 1 1 36 36 ILE N N 36 119.880 119.880 121.051 -1.171 17919 83222 1 203 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.273 0.172 17919 83223 1 203 . 1 1 36 36 ILE C C 36 173.590 173.590 174.101 -0.511 17919 83224 1 203 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.756 -0.006 17919 83225 1 203 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.969 1.611 17919 83226 1 203 . 1 1 36 36 ILE H H 36 6.150 6.150 7.501 -1.351 17919 83227 1 203 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.444 0.190 17919 83228 1 203 . 1 1 37 37 PRO C C 37 176.940 176.940 176.122 0.818 17919 83229 1 203 . 1 1 37 37 PRO CA C 37 61.660 61.660 62.138 -0.478 17919 83230 1 203 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.493 0.357 17919 83231 1 203 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.150 -0.033 17919 83232 1 203 . 1 1 38 38 PRO C C 38 178.320 178.320 178.140 0.180 17919 83233 1 203 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.910 0.350 17919 83234 1 203 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.722 1.168 17919 83235 1 203 . 1 1 39 39 ASP N N 39 113.380 113.380 115.093 -1.713 17919 83236 1 203 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.353 0.077 17919 83237 1 203 . 1 1 39 39 ASP C C 39 177.090 177.090 177.314 -0.224 17919 83238 1 203 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.712 -1.071 17919 83239 1 203 . 1 1 39 39 ASP CB C 39 39.540 39.540 39.083 0.458 17919 83240 1 203 . 1 1 39 39 ASP H H 39 8.550 8.550 8.806 -0.256 17919 83241 1 203 . 1 1 40 40 GLN N N 40 116.780 116.780 118.675 -1.895 17919 83242 1 203 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.299 0.165 17919 83243 1 203 . 1 1 40 40 GLN C C 40 175.380 175.380 176.202 -0.822 17919 83244 1 203 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.545 -0.905 17919 83245 1 203 . 1 1 40 40 GLN CB C 40 30.140 30.140 30.298 -0.158 17919 83246 1 203 . 1 1 40 40 GLN H H 40 7.820 7.820 7.855 -0.035 17919 83247 1 203 . 1 1 41 41 GLN N N 41 117.720 117.720 119.622 -1.902 17919 83248 1 203 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.219 0.025 17919 83249 1 203 . 1 1 41 41 GLN C C 41 176.300 176.300 175.312 0.988 17919 83250 1 203 . 1 1 41 41 GLN CA C 41 56.470 56.470 57.146 -0.676 17919 83251 1 203 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.179 2.471 17919 83252 1 203 . 1 1 41 41 GLN H H 41 7.480 7.480 7.691 -0.211 17919 83253 1 203 . 1 1 42 42 ARG N N 42 122.680 122.680 122.094 0.586 17919 83254 1 203 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.632 -0.132 17919 83255 1 203 . 1 1 42 42 ARG C C 42 174.050 174.050 174.704 -0.654 17919 83256 1 203 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.991 0.059 17919 83257 1 203 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.015 -1.265 17919 83258 1 203 . 1 1 42 42 ARG H H 42 8.530 8.530 8.948 -0.418 17919 83259 1 203 . 1 1 43 43 LEU N N 43 124.040 124.040 125.371 -1.331 17919 83260 1 203 . 1 1 43 43 LEU C C 43 175.290 175.290 175.767 -0.477 17919 83261 1 203 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.584 -0.604 17919 83262 1 203 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.084 1.706 17919 83263 1 203 . 1 1 43 43 LEU H H 43 8.820 8.820 8.848 -0.028 17919 83264 1 203 . 1 1 44 44 ILE N N 44 121.920 121.920 120.122 1.798 17919 83265 1 203 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.910 0.082 17919 83266 1 203 . 1 1 44 44 ILE C C 44 176.060 176.060 174.768 1.292 17919 83267 1 203 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.455 -1.475 17919 83268 1 203 . 1 1 44 44 ILE CB C 44 41.420 41.420 42.052 -0.632 17919 83269 1 203 . 1 1 44 44 ILE H H 44 9.030 9.030 8.404 0.626 17919 83270 1 203 . 1 1 45 45 PHE N N 45 125.390 125.390 128.674 -3.284 17919 83271 1 203 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.971 0.074 17919 83272 1 203 . 1 1 45 45 PHE C C 45 174.470 174.470 175.545 -1.075 17919 83273 1 203 . 1 1 45 45 PHE CA C 45 57.020 57.020 57.874 -0.854 17919 83274 1 203 . 1 1 45 45 PHE CB C 45 43.760 43.760 40.789 2.971 17919 83275 1 203 . 1 1 45 45 PHE H H 45 8.830 8.830 8.234 0.596 17919 83276 1 203 . 1 1 46 46 ALA N N 46 132.200 132.200 122.973 9.227 17919 83277 1 203 . 1 1 46 46 ALA HA H 46 3.690 3.690 4.182 -0.492 17919 83278 1 203 . 1 1 46 46 ALA C C 46 177.290 177.290 177.366 -0.076 17919 83279 1 203 . 1 1 46 46 ALA CA C 46 52.540 52.540 51.172 1.368 17919 83280 1 203 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.389 0.181 17919 83281 1 203 . 1 1 46 46 ALA H H 46 8.810 8.810 8.043 0.767 17919 83282 1 203 . 1 1 47 47 GLY N N 47 102.340 102.340 107.910 -5.570 17919 83283 1 203 . 1 1 47 47 GLY C C 47 173.810 173.810 174.415 -0.605 17919 83284 1 203 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.452 -0.102 17919 83285 1 203 . 1 1 47 47 GLY H H 47 8.130 8.130 8.195 -0.065 17919 83286 1 203 . 1 1 48 48 LYS N N 48 121.570 121.570 120.351 1.219 17919 83287 1 203 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.540 0.082 17919 83288 1 203 . 1 1 48 48 LYS C C 48 174.700 174.700 175.067 -0.367 17919 83289 1 203 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.793 -0.243 17919 83290 1 203 . 1 1 48 48 LYS CB C 48 34.530 34.530 33.784 0.746 17919 83291 1 203 . 1 1 48 48 LYS H H 48 7.980 7.980 7.740 0.240 17919 83292 1 203 . 1 1 49 49 GLN N N 49 122.410 122.410 122.492 -0.082 17919 83293 1 203 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.581 -0.021 17919 83294 1 203 . 1 1 49 49 GLN C C 49 175.670 175.670 175.527 0.143 17919 83295 1 203 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.070 0.670 17919 83296 1 203 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.637 -0.637 17919 83297 1 203 . 1 1 49 49 GLN H H 49 8.600 8.600 8.384 0.216 17919 83298 1 203 . 1 1 50 50 LEU N N 50 125.520 125.520 124.036 1.484 17919 83299 1 203 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.236 -0.146 17919 83300 1 203 . 1 1 50 50 LEU C C 50 176.660 176.660 176.654 0.006 17919 83301 1 203 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.678 -0.438 17919 83302 1 203 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.742 -0.173 17919 83303 1 203 . 1 1 50 50 LEU H H 50 8.530 8.530 8.639 -0.109 17919 83304 1 203 . 1 1 51 51 GLU N N 51 122.940 122.940 122.468 0.472 17919 83305 1 203 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.612 -0.124 17919 83306 1 203 . 1 1 51 51 GLU C C 51 175.870 175.870 177.020 -1.150 17919 83307 1 203 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.128 0.832 17919 83308 1 203 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.837 -0.268 17919 83309 1 203 . 1 1 51 51 GLU H H 51 8.400 8.400 8.630 -0.230 17919 83310 1 203 . 1 1 52 52 ASP N N 52 120.030 120.030 124.040 -4.010 17919 83311 1 203 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.424 -0.065 17919 83312 1 203 . 1 1 52 52 ASP C C 52 177.330 177.330 177.761 -0.431 17919 83313 1 203 . 1 1 52 52 ASP CA C 52 56.960 56.960 58.299 -1.339 17919 83314 1 203 . 1 1 52 52 ASP CB C 52 40.850 40.850 41.062 -0.212 17919 83315 1 203 . 1 1 52 52 ASP H H 52 8.160 8.160 8.913 -0.753 17919 83316 1 203 . 1 1 53 53 GLY N N 53 106.660 106.660 105.891 0.769 17919 83317 1 203 . 1 1 53 53 GLY C C 53 174.870 174.870 173.709 1.161 17919 83318 1 203 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.644 0.526 17919 83319 1 203 . 1 1 53 53 GLY H H 53 9.390 9.390 8.390 1.000 17919 83320 1 203 . 1 1 54 54 ARG N N 54 119.050 119.050 121.552 -2.502 17919 83321 1 203 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.715 -0.020 17919 83322 1 203 . 1 1 54 54 ARG C C 54 175.350 175.350 175.000 0.350 17919 83323 1 203 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.309 0.081 17919 83324 1 203 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.591 -0.941 17919 83325 1 203 . 1 1 54 54 ARG H H 54 7.460 7.460 7.409 0.051 17919 83326 1 203 . 1 1 55 55 THR N N 55 108.400 108.400 113.305 -4.905 17919 83327 1 203 . 1 1 55 55 THR HA H 55 5.240 5.240 5.057 0.183 17919 83328 1 203 . 1 1 55 55 THR C C 55 176.560 176.560 175.932 0.628 17919 83329 1 203 . 1 1 55 55 THR CA C 55 59.690 59.690 60.401 -0.711 17919 83330 1 203 . 1 1 55 55 THR CB C 55 72.260 72.260 71.161 1.099 17919 83331 1 203 . 1 1 55 55 THR H H 55 8.730 8.730 8.757 -0.027 17919 83332 1 203 . 1 1 56 56 LEU N N 56 117.920 117.920 121.286 -3.366 17919 83333 1 203 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.116 -0.056 17919 83334 1 203 . 1 1 56 56 LEU C C 56 180.810 180.810 179.063 1.747 17919 83335 1 203 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.214 0.496 17919 83336 1 203 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.554 -1.184 17919 83337 1 203 . 1 1 56 56 LEU H H 56 8.140 8.140 8.595 -0.455 17919 83338 1 203 . 1 1 57 57 SER N N 57 113.330 113.330 115.222 -1.892 17919 83339 1 203 . 1 1 57 57 SER HA H 57 4.370 4.370 4.112 0.258 17919 83340 1 203 . 1 1 57 57 SER C C 57 178.310 178.310 177.051 1.259 17919 83341 1 203 . 1 1 57 57 SER CA C 57 61.080 61.080 61.975 -0.895 17919 83342 1 203 . 1 1 57 57 SER CB C 57 62.530 62.530 62.853 -0.323 17919 83343 1 203 . 1 1 57 57 SER H H 57 8.470 8.470 8.540 -0.070 17919 83344 1 203 . 1 1 58 58 ASP N N 58 124.190 124.190 121.531 2.659 17919 83345 1 203 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.425 -0.129 17919 83346 1 203 . 1 1 58 58 ASP C C 58 177.400 177.400 177.563 -0.163 17919 83347 1 203 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.696 0.484 17919 83348 1 203 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.319 -0.219 17919 83349 1 203 . 1 1 58 58 ASP H H 58 7.930 7.930 7.910 0.020 17919 83350 1 203 . 1 1 59 59 TYR N N 59 115.510 115.510 116.519 -1.009 17919 83351 1 203 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.599 0.071 17919 83352 1 203 . 1 1 59 59 TYR C C 59 174.700 174.700 174.445 0.255 17919 83353 1 203 . 1 1 59 59 TYR CA C 59 58.250 58.250 56.793 1.457 17919 83354 1 203 . 1 1 59 59 TYR CB C 59 40.070 40.070 37.822 2.248 17919 83355 1 203 . 1 1 59 59 TYR H H 59 7.250 7.250 7.289 -0.039 17919 83356 1 203 . 1 1 60 60 ASN N N 60 115.900 115.900 115.910 -0.010 17919 83357 1 203 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.380 -0.025 17919 83358 1 203 . 1 1 60 60 ASN C C 60 174.340 174.340 174.559 -0.219 17919 83359 1 203 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.326 -0.206 17919 83360 1 203 . 1 1 60 60 ASN CB C 60 37.410 37.410 36.349 1.061 17919 83361 1 203 . 1 1 60 60 ASN H H 60 8.150 8.150 7.845 0.305 17919 83362 1 203 . 1 1 61 61 ILE N N 61 118.600 118.600 119.176 -0.576 17919 83363 1 203 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.905 -0.512 17919 83364 1 203 . 1 1 61 61 ILE C C 61 174.610 174.610 175.456 -0.846 17919 83365 1 203 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.647 0.773 17919 83366 1 203 . 1 1 61 61 ILE CB C 61 36.740 36.740 38.272 -1.532 17919 83367 1 203 . 1 1 61 61 ILE H H 61 7.250 7.250 8.034 -0.784 17919 83368 1 203 . 1 1 62 62 GLN N N 62 124.740 124.740 125.131 -0.391 17919 83369 1 203 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.782 -0.276 17919 83370 1 203 . 1 1 62 62 GLN C C 62 175.970 175.970 175.562 0.408 17919 83371 1 203 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.361 0.299 17919 83372 1 203 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.683 -0.033 17919 83373 1 203 . 1 1 62 62 GLN H H 62 7.610 7.610 7.925 -0.315 17919 83374 1 203 . 1 1 63 63 LYS N N 63 120.300 120.300 121.155 -0.855 17919 83375 1 203 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.952 0.049 17919 83376 1 203 . 1 1 63 63 LYS C C 63 175.810 175.810 176.595 -0.785 17919 83377 1 203 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.821 -0.031 17919 83378 1 203 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.793 0.857 17919 83379 1 203 . 1 1 63 63 LYS H H 63 8.490 8.490 8.526 -0.036 17919 83380 1 203 . 1 1 64 64 GLU N N 64 113.950 113.950 117.127 -3.177 17919 83381 1 203 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.259 0.206 17919 83382 1 203 . 1 1 64 64 GLU C C 64 175.250 175.250 175.420 -0.170 17919 83383 1 203 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.781 0.109 17919 83384 1 203 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.811 -2.911 17919 83385 1 203 . 1 1 64 64 GLU H H 64 9.280 9.280 8.844 0.436 17919 83386 1 203 . 1 1 65 65 SER N N 65 114.730 114.730 115.432 -0.702 17919 83387 1 203 . 1 1 65 65 SER HA H 65 4.640 4.640 4.385 0.255 17919 83388 1 203 . 1 1 65 65 SER C C 65 172.160 172.160 173.542 -1.382 17919 83389 1 203 . 1 1 65 65 SER CA C 65 60.890 60.890 60.215 0.675 17919 83390 1 203 . 1 1 65 65 SER CB C 65 64.910 64.910 63.800 1.110 17919 83391 1 203 . 1 1 65 65 SER H H 65 7.670 7.670 7.462 0.208 17919 83392 1 203 . 1 1 66 66 THR N N 66 117.110 117.110 119.423 -2.313 17919 83393 1 203 . 1 1 66 66 THR HA H 66 5.270 5.270 5.083 0.187 17919 83394 1 203 . 1 1 66 66 THR C C 66 173.950 173.950 173.944 0.006 17919 83395 1 203 . 1 1 66 66 THR CA C 66 62.340 62.340 62.243 0.097 17919 83396 1 203 . 1 1 66 66 THR CB C 66 70.080 70.080 69.993 0.087 17919 83397 1 203 . 1 1 66 66 THR H H 66 8.730 8.730 8.182 0.548 17919 83398 1 203 . 1 1 67 67 LEU N N 67 127.110 127.110 127.362 -0.252 17919 83399 1 203 . 1 1 67 67 LEU HA H 67 5.060 5.060 5.037 0.023 17919 83400 1 203 . 1 1 67 67 LEU C C 67 175.770 175.770 175.045 0.725 17919 83401 1 203 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.403 0.497 17919 83402 1 203 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.932 -0.672 17919 83403 1 203 . 1 1 67 67 LEU H H 67 9.410 9.410 9.218 0.192 17919 83404 1 203 . 1 1 68 68 HIS N N 68 118.380 118.380 122.266 -3.886 17919 83405 1 203 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.395 -0.155 17919 83406 1 203 . 1 1 68 68 HIS C C 68 173.150 173.150 173.703 -0.553 17919 83407 1 203 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.268 0.732 17919 83408 1 203 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.704 -2.174 17919 83409 1 203 . 1 1 68 68 HIS H H 68 9.230 9.230 9.096 0.134 17919 83410 1 203 . 1 1 69 69 LEU N N 69 124.460 124.460 130.068 -5.608 17919 83411 1 203 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.860 0.330 17919 83412 1 203 . 1 1 69 69 LEU C C 69 175.270 175.270 174.737 0.533 17919 83413 1 203 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.975 -0.085 17919 83414 1 203 . 1 1 69 69 LEU CB C 69 44.380 44.380 43.415 0.965 17919 83415 1 203 . 1 1 69 69 LEU H H 69 8.340 8.340 7.972 0.368 17919 83416 1 203 . 1 1 70 70 VAL N N 70 126.940 126.940 126.575 0.365 17919 83417 1 203 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.467 -0.117 17919 83418 1 203 . 1 1 70 70 VAL C C 70 174.000 174.000 174.580 -0.580 17919 83419 1 203 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.796 0.004 17919 83420 1 203 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.437 -0.527 17919 83421 1 203 . 1 1 70 70 VAL H H 70 9.200 9.200 8.798 0.402 17919 83422 1 203 . 1 1 71 71 LEU N N 71 123.130 123.130 125.706 -2.576 17919 83423 1 203 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.049 0.011 17919 83424 1 203 . 1 1 71 71 LEU C C 71 177.830 177.830 176.917 0.913 17919 83425 1 203 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.102 0.837 17919 83426 1 203 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.204 -0.354 17919 83427 1 203 . 1 1 71 71 LEU H H 71 8.120 8.120 8.388 -0.268 17919 83428 1 203 . 1 1 72 72 ARG N N 72 123.490 123.490 123.785 -0.295 17919 83429 1 203 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.243 0.058 17919 83430 1 203 . 1 1 72 72 ARG C C 72 175.350 175.350 175.056 0.294 17919 83431 1 203 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.397 -0.787 17919 83432 1 203 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.734 0.616 17919 83433 1 203 . 1 1 72 72 ARG H H 72 8.580 8.580 8.216 0.364 17919 83434 1 204 . 1 1 2 2 GLN N N 2 123.220 123.220 120.201 3.019 17919 83435 1 204 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.505 -0.256 17919 83436 1 204 . 1 1 2 2 GLN C C 2 175.920 175.920 175.831 0.089 17919 83437 1 204 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.700 0.381 17919 83438 1 204 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.663 0.097 17919 83439 1 204 . 1 1 2 2 GLN H H 2 8.900 8.900 8.360 0.540 17919 83440 1 204 . 1 1 3 3 ILE N N 3 115.340 115.340 115.336 0.004 17919 83441 1 204 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.253 -0.040 17919 83442 1 204 . 1 1 3 3 ILE C C 3 172.450 172.450 173.252 -0.802 17919 83443 1 204 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.372 0.198 17919 83444 1 204 . 1 1 3 3 ILE CB C 3 42.210 42.210 42.132 0.078 17919 83445 1 204 . 1 1 3 3 ILE H H 3 8.320 8.320 8.691 -0.371 17919 83446 1 204 . 1 1 4 4 PHE N N 4 118.110 118.110 119.227 -1.117 17919 83447 1 204 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.450 0.180 17919 83448 1 204 . 1 1 4 4 PHE C C 4 175.320 175.320 174.989 0.331 17919 83449 1 204 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.318 -0.108 17919 83450 1 204 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.995 -0.515 17919 83451 1 204 . 1 1 4 4 PHE H H 4 8.610 8.610 8.759 -0.149 17919 83452 1 204 . 1 1 5 5 VAL N N 5 121.000 121.000 122.292 -1.292 17919 83453 1 204 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.731 -0.006 17919 83454 1 204 . 1 1 5 5 VAL C C 5 174.870 174.870 174.400 0.470 17919 83455 1 204 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.329 -0.709 17919 83456 1 204 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.953 0.277 17919 83457 1 204 . 1 1 5 5 VAL H H 5 9.300 9.300 9.362 -0.062 17919 83458 1 204 . 1 1 6 6 LYS N N 6 127.520 127.520 128.450 -0.930 17919 83459 1 204 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.280 0.087 17919 83460 1 204 . 1 1 6 6 LYS C C 6 177.140 177.140 175.491 1.649 17919 83461 1 204 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.391 0.129 17919 83462 1 204 . 1 1 6 6 LYS CB C 6 35.050 35.050 36.525 -1.475 17919 83463 1 204 . 1 1 6 6 LYS H H 6 8.820 8.820 9.033 -0.213 17919 83464 1 204 . 1 1 7 7 THR N N 7 115.400 115.400 115.784 -0.384 17919 83465 1 204 . 1 1 7 7 THR HA H 7 4.970 4.970 4.567 0.403 17919 83466 1 204 . 1 1 7 7 THR C C 7 176.910 176.910 175.351 1.559 17919 83467 1 204 . 1 1 7 7 THR CA C 7 60.470 60.470 59.809 0.661 17919 83468 1 204 . 1 1 7 7 THR CB C 7 70.630 70.630 71.037 -0.407 17919 83469 1 204 . 1 1 7 7 THR H H 7 8.730 8.730 8.704 0.026 17919 83470 1 204 . 1 1 8 8 LEU N N 8 121.330 121.330 121.209 0.121 17919 83471 1 204 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.449 -0.139 17919 83472 1 204 . 1 1 8 8 LEU C C 8 178.800 178.800 178.020 0.780 17919 83473 1 204 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.157 0.423 17919 83474 1 204 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.181 -0.211 17919 83475 1 204 . 1 1 8 8 LEU H H 8 9.100 9.100 8.967 0.133 17919 83476 1 204 . 1 1 9 9 THR N N 9 105.590 105.590 110.239 -4.649 17919 83477 1 204 . 1 1 9 9 THR HA H 9 4.428 4.428 4.288 0.140 17919 83478 1 204 . 1 1 9 9 THR C C 9 175.520 175.520 175.563 -0.043 17919 83479 1 204 . 1 1 9 9 THR CA C 9 61.400 61.400 62.900 -1.500 17919 83480 1 204 . 1 1 9 9 THR CB C 9 69.140 69.140 68.596 0.544 17919 83481 1 204 . 1 1 9 9 THR H H 9 7.630 7.630 8.079 -0.449 17919 83482 1 204 . 1 1 10 10 GLY N N 10 108.890 108.890 109.625 -0.735 17919 83483 1 204 . 1 1 10 10 GLY C C 10 174.070 174.070 174.021 0.049 17919 83484 1 204 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.797 0.663 17919 83485 1 204 . 1 1 10 10 GLY H H 10 7.810 7.810 7.876 -0.066 17919 83486 1 204 . 1 1 11 11 LYS N N 11 121.600 121.600 121.731 -0.131 17919 83487 1 204 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.264 0.097 17919 83488 1 204 . 1 1 11 11 LYS C C 11 175.940 175.940 175.391 0.549 17919 83489 1 204 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.877 -0.597 17919 83490 1 204 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.338 -0.138 17919 83491 1 204 . 1 1 11 11 LYS H H 11 7.280 7.280 7.789 -0.509 17919 83492 1 204 . 1 1 12 12 THR N N 12 120.440 120.440 119.456 0.984 17919 83493 1 204 . 1 1 12 12 THR HA H 12 5.046 5.046 5.176 -0.130 17919 83494 1 204 . 1 1 12 12 THR C C 12 174.320 174.320 174.148 0.172 17919 83495 1 204 . 1 1 12 12 THR CA C 12 62.390 62.390 61.234 1.156 17919 83496 1 204 . 1 1 12 12 THR CB C 12 69.910 69.910 70.201 -0.291 17919 83497 1 204 . 1 1 12 12 THR H H 12 8.650 8.650 8.151 0.499 17919 83498 1 204 . 1 1 13 13 ILE N N 13 127.110 127.110 120.722 6.388 17919 83499 1 204 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.723 -0.179 17919 83500 1 204 . 1 1 13 13 ILE C C 13 175.220 175.220 174.274 0.946 17919 83501 1 204 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.364 0.616 17919 83502 1 204 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.500 0.450 17919 83503 1 204 . 1 1 13 13 ILE H H 13 9.450 9.450 9.134 0.316 17919 83504 1 204 . 1 1 14 14 THR N N 14 121.520 121.520 120.957 0.563 17919 83505 1 204 . 1 1 14 14 THR HA H 14 4.964 4.964 5.246 -0.282 17919 83506 1 204 . 1 1 14 14 THR C C 14 173.790 173.790 174.227 -0.437 17919 83507 1 204 . 1 1 14 14 THR CA C 14 61.940 61.940 62.010 -0.070 17919 83508 1 204 . 1 1 14 14 THR CB C 14 69.650 69.650 70.217 -0.567 17919 83509 1 204 . 1 1 14 14 THR H H 14 8.710 8.710 8.336 0.374 17919 83510 1 204 . 1 1 15 15 LEU N N 15 124.800 124.800 125.497 -0.697 17919 83511 1 204 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.746 0.034 17919 83512 1 204 . 1 1 15 15 LEU C C 15 174.670 174.670 175.255 -0.585 17919 83513 1 204 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.622 -0.792 17919 83514 1 204 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.106 1.964 17919 83515 1 204 . 1 1 15 15 LEU H H 15 8.710 8.710 9.126 -0.416 17919 83516 1 204 . 1 1 16 16 GLU N N 16 122.160 122.160 124.045 -1.885 17919 83517 1 204 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.050 -0.133 17919 83518 1 204 . 1 1 16 16 GLU C C 16 175.860 175.860 175.813 0.047 17919 83519 1 204 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.471 -0.652 17919 83520 1 204 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.652 -1.202 17919 83521 1 204 . 1 1 16 16 GLU H H 16 8.140 8.140 8.718 -0.578 17919 83522 1 204 . 1 1 17 17 VAL N N 17 117.210 117.210 121.169 -3.959 17919 83523 1 204 . 1 1 17 17 VAL HA H 17 4.714 4.714 5.037 -0.323 17919 83524 1 204 . 1 1 17 17 VAL C C 17 174.160 174.160 174.891 -0.731 17919 83525 1 204 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.965 -0.535 17919 83526 1 204 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.675 0.725 17919 83527 1 204 . 1 1 17 17 VAL H H 17 8.900 8.900 8.943 -0.043 17919 83528 1 204 . 1 1 18 18 GLU N N 18 118.990 118.990 122.463 -3.473 17919 83529 1 204 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.779 0.300 17919 83530 1 204 . 1 1 18 18 GLU C C 18 176.160 176.160 175.070 1.090 17919 83531 1 204 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.839 -0.119 17919 83532 1 204 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.479 -0.169 17919 83533 1 204 . 1 1 18 18 GLU H H 18 8.640 8.640 8.585 0.055 17919 83534 1 204 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.202 -0.061 17919 83535 1 204 . 1 1 19 19 PRO C C 19 175.310 175.310 178.049 -2.739 17919 83536 1 204 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.842 -0.372 17919 83537 1 204 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.951 -0.001 17919 83538 1 204 . 1 1 20 20 SER N N 20 103.400 103.400 111.649 -8.249 17919 83539 1 204 . 1 1 20 20 SER HA H 20 4.370 4.370 4.327 0.043 17919 83540 1 204 . 1 1 20 20 SER C C 20 174.660 174.660 174.281 0.379 17919 83541 1 204 . 1 1 20 20 SER CA C 20 57.400 57.400 58.870 -1.470 17919 83542 1 204 . 1 1 20 20 SER CB C 20 63.370 63.370 62.816 0.554 17919 83543 1 204 . 1 1 20 20 SER H H 20 7.040 7.040 8.261 -1.221 17919 83544 1 204 . 1 1 21 21 ASP N N 21 123.480 123.480 123.773 -0.293 17919 83545 1 204 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.640 0.055 17919 83546 1 204 . 1 1 21 21 ASP C C 21 176.360 176.360 175.466 0.894 17919 83547 1 204 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.298 0.402 17919 83548 1 204 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.258 -0.458 17919 83549 1 204 . 1 1 21 21 ASP H H 21 8.030 8.030 7.668 0.362 17919 83550 1 204 . 1 1 22 22 THR N N 22 108.800 108.800 112.852 -4.052 17919 83551 1 204 . 1 1 22 22 THR HA H 22 4.920 4.920 4.784 0.136 17919 83552 1 204 . 1 1 22 22 THR C C 22 176.750 176.750 176.092 0.658 17919 83553 1 204 . 1 1 22 22 THR CA C 22 59.690 59.690 61.329 -1.639 17919 83554 1 204 . 1 1 22 22 THR CB C 22 71.200 71.200 70.943 0.257 17919 83555 1 204 . 1 1 22 22 THR H H 22 7.900 7.900 8.204 -0.304 17919 83556 1 204 . 1 1 23 23 ILE N N 23 121.190 121.190 122.130 -0.940 17919 83557 1 204 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.919 -0.262 17919 83558 1 204 . 1 1 23 23 ILE C C 23 179.040 179.040 177.752 1.288 17919 83559 1 204 . 1 1 23 23 ILE CA C 23 62.260 62.260 61.639 0.621 17919 83560 1 204 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.067 -1.717 17919 83561 1 204 . 1 1 23 23 ILE H H 23 8.560 8.560 8.570 -0.010 17919 83562 1 204 . 1 1 24 24 GLU N N 24 120.830 120.830 121.674 -0.844 17919 83563 1 204 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.990 -0.073 17919 83564 1 204 . 1 1 24 24 GLU C C 24 178.640 178.640 178.353 0.287 17919 83565 1 204 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.623 0.597 17919 83566 1 204 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.665 -1.385 17919 83567 1 204 . 1 1 24 24 GLU H H 24 9.760 9.760 7.901 1.859 17919 83568 1 204 . 1 1 25 25 ASN N N 25 120.570 120.570 118.331 2.239 17919 83569 1 204 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.504 0.021 17919 83570 1 204 . 1 1 25 25 ASN C C 25 178.380 178.380 177.837 0.543 17919 83571 1 204 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.277 -0.217 17919 83572 1 204 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.823 -0.373 17919 83573 1 204 . 1 1 25 25 ASN H H 25 7.920 7.920 7.724 0.196 17919 83574 1 204 . 1 1 26 26 VAL N N 26 121.710 121.710 119.236 2.474 17919 83575 1 204 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.728 -0.331 17919 83576 1 204 . 1 1 26 26 VAL C C 26 177.950 177.950 177.950 0.000 17919 83577 1 204 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.037 1.623 17919 83578 1 204 . 1 1 26 26 VAL CB C 26 30.840 30.840 30.943 -0.103 17919 83579 1 204 . 1 1 26 26 VAL H H 26 8.070 8.070 8.191 -0.121 17919 83580 1 204 . 1 1 27 27 LYS N N 27 118.860 118.860 119.953 -1.093 17919 83581 1 204 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.192 0.388 17919 83582 1 204 . 1 1 27 27 LYS C C 27 180.550 180.550 179.043 1.507 17919 83583 1 204 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.505 -0.255 17919 83584 1 204 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.242 1.488 17919 83585 1 204 . 1 1 27 27 LYS H H 27 8.560 8.560 7.864 0.696 17919 83586 1 204 . 1 1 28 28 ALA N N 28 123.440 123.440 122.362 1.078 17919 83587 1 204 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.162 -0.002 17919 83588 1 204 . 1 1 28 28 ALA C C 28 180.300 180.300 179.333 0.967 17919 83589 1 204 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.856 0.514 17919 83590 1 204 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.402 -0.692 17919 83591 1 204 . 1 1 28 28 ALA H H 28 8.060 8.060 7.927 0.133 17919 83592 1 204 . 1 1 29 29 LYS N N 29 119.940 119.940 119.365 0.575 17919 83593 1 204 . 1 1 29 29 LYS HA H 29 4.207 4.207 3.987 0.220 17919 83594 1 204 . 1 1 29 29 LYS C C 29 180.320 180.320 179.275 1.045 17919 83595 1 204 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.442 0.208 17919 83596 1 204 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.305 0.985 17919 83597 1 204 . 1 1 29 29 LYS H H 29 7.850 7.850 7.604 0.246 17919 83598 1 204 . 1 1 30 30 ILE N N 30 121.080 121.080 119.846 1.234 17919 83599 1 204 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.620 -0.113 17919 83600 1 204 . 1 1 30 30 ILE C C 30 178.310 178.310 177.448 0.862 17919 83601 1 204 . 1 1 30 30 ILE CA C 30 66.150 66.150 64.890 1.260 17919 83602 1 204 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.591 -0.791 17919 83603 1 204 . 1 1 30 30 ILE H H 30 8.280 8.280 7.499 0.781 17919 83604 1 204 . 1 1 31 31 GLN N N 31 123.490 123.490 120.310 3.180 17919 83605 1 204 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.935 -0.106 17919 83606 1 204 . 1 1 31 31 GLN C C 31 178.890 178.890 178.353 0.537 17919 83607 1 204 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.367 0.633 17919 83608 1 204 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.406 -0.686 17919 83609 1 204 . 1 1 31 31 GLN H H 31 8.580 8.580 7.886 0.694 17919 83610 1 204 . 1 1 32 32 ASP N N 32 119.360 119.360 118.496 0.864 17919 83611 1 204 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.411 -0.057 17919 83612 1 204 . 1 1 32 32 ASP C C 32 177.250 177.250 177.996 -0.746 17919 83613 1 204 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.709 0.481 17919 83614 1 204 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.850 -0.270 17919 83615 1 204 . 1 1 32 32 ASP H H 32 8.010 8.010 8.046 -0.036 17919 83616 1 204 . 1 1 33 33 LYS N N 33 115.130 115.130 118.997 -3.867 17919 83617 1 204 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.267 0.070 17919 83618 1 204 . 1 1 33 33 LYS C C 33 177.870 177.870 178.103 -0.233 17919 83619 1 204 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.119 -0.069 17919 83620 1 204 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.182 0.988 17919 83621 1 204 . 1 1 33 33 LYS H H 33 7.430 7.430 7.464 -0.034 17919 83622 1 204 . 1 1 34 34 GLU N N 34 113.870 113.870 113.974 -0.104 17919 83623 1 204 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.526 0.099 17919 83624 1 204 . 1 1 34 34 GLU C C 34 177.840 177.840 176.983 0.857 17919 83625 1 204 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.747 -0.577 17919 83626 1 204 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.852 0.808 17919 83627 1 204 . 1 1 34 34 GLU H H 34 8.740 8.740 8.221 0.519 17919 83628 1 204 . 1 1 35 35 GLY N N 35 108.650 108.650 109.185 -0.535 17919 83629 1 204 . 1 1 35 35 GLY C C 35 173.960 173.960 174.489 -0.529 17919 83630 1 204 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.782 0.298 17919 83631 1 204 . 1 1 35 35 GLY H H 35 8.530 8.530 8.179 0.351 17919 83632 1 204 . 1 1 36 36 ILE N N 36 119.880 119.880 121.733 -1.853 17919 83633 1 204 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.253 0.192 17919 83634 1 204 . 1 1 36 36 ILE C C 36 173.590 173.590 174.151 -0.561 17919 83635 1 204 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.309 -0.559 17919 83636 1 204 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.220 2.360 17919 83637 1 204 . 1 1 36 36 ILE H H 36 6.150 6.150 7.674 -1.524 17919 83638 1 204 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.531 0.103 17919 83639 1 204 . 1 1 37 37 PRO C C 37 176.940 176.940 175.973 0.967 17919 83640 1 204 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.810 -0.150 17919 83641 1 204 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.256 0.594 17919 83642 1 204 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.147 -0.030 17919 83643 1 204 . 1 1 38 38 PRO C C 38 178.320 178.320 178.510 -0.190 17919 83644 1 204 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.735 0.525 17919 83645 1 204 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.919 0.971 17919 83646 1 204 . 1 1 39 39 ASP N N 39 113.380 113.380 115.685 -2.305 17919 83647 1 204 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.351 0.079 17919 83648 1 204 . 1 1 39 39 ASP C C 39 177.090 177.090 177.601 -0.511 17919 83649 1 204 . 1 1 39 39 ASP CA C 39 55.640 55.640 57.157 -1.517 17919 83650 1 204 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.480 -0.940 17919 83651 1 204 . 1 1 39 39 ASP H H 39 8.550 8.550 8.681 -0.131 17919 83652 1 204 . 1 1 40 40 GLN N N 40 116.780 116.780 115.878 0.902 17919 83653 1 204 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.500 -0.036 17919 83654 1 204 . 1 1 40 40 GLN C C 40 175.380 175.380 175.638 -0.258 17919 83655 1 204 . 1 1 40 40 GLN CA C 40 55.640 55.640 54.902 0.738 17919 83656 1 204 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.368 0.772 17919 83657 1 204 . 1 1 40 40 GLN H H 40 7.820 7.820 8.115 -0.295 17919 83658 1 204 . 1 1 41 41 GLN N N 41 117.720 117.720 119.717 -1.997 17919 83659 1 204 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.458 -0.214 17919 83660 1 204 . 1 1 41 41 GLN C C 41 176.300 176.300 175.809 0.491 17919 83661 1 204 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.034 0.436 17919 83662 1 204 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.575 2.075 17919 83663 1 204 . 1 1 41 41 GLN H H 41 7.480 7.480 7.263 0.217 17919 83664 1 204 . 1 1 42 42 ARG N N 42 122.680 122.680 126.437 -3.757 17919 83665 1 204 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.651 -0.151 17919 83666 1 204 . 1 1 42 42 ARG C C 42 174.050 174.050 173.993 0.057 17919 83667 1 204 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.783 0.267 17919 83668 1 204 . 1 1 42 42 ARG CB C 42 31.750 31.750 31.949 -0.199 17919 83669 1 204 . 1 1 42 42 ARG H H 42 8.530 8.530 8.576 -0.046 17919 83670 1 204 . 1 1 43 43 LEU N N 43 124.040 124.040 127.485 -3.445 17919 83671 1 204 . 1 1 43 43 LEU C C 43 175.290 175.290 175.730 -0.440 17919 83672 1 204 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.559 -1.579 17919 83673 1 204 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.794 1.996 17919 83674 1 204 . 1 1 43 43 LEU H H 43 8.820 8.820 8.829 -0.009 17919 83675 1 204 . 1 1 44 44 ILE N N 44 121.920 121.920 122.665 -0.745 17919 83676 1 204 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.090 -0.098 17919 83677 1 204 . 1 1 44 44 ILE C C 44 176.060 176.060 174.399 1.661 17919 83678 1 204 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.227 -1.247 17919 83679 1 204 . 1 1 44 44 ILE CB C 44 41.420 41.420 40.961 0.459 17919 83680 1 204 . 1 1 44 44 ILE H H 44 9.030 9.030 8.569 0.461 17919 83681 1 204 . 1 1 45 45 PHE N N 45 125.390 125.390 127.688 -2.298 17919 83682 1 204 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.042 0.003 17919 83683 1 204 . 1 1 45 45 PHE C C 45 174.470 174.470 174.230 0.240 17919 83684 1 204 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.613 0.407 17919 83685 1 204 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.171 0.589 17919 83686 1 204 . 1 1 45 45 PHE H H 45 8.830 8.830 8.933 -0.103 17919 83687 1 204 . 1 1 46 46 ALA N N 46 132.200 132.200 130.576 1.624 17919 83688 1 204 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.681 0.009 17919 83689 1 204 . 1 1 46 46 ALA C C 46 177.290 177.290 177.750 -0.460 17919 83690 1 204 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.495 0.045 17919 83691 1 204 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.557 0.013 17919 83692 1 204 . 1 1 46 46 ALA H H 46 8.810 8.810 8.604 0.206 17919 83693 1 204 . 1 1 47 47 GLY N N 47 102.340 102.340 104.152 -1.812 17919 83694 1 204 . 1 1 47 47 GLY C C 47 173.810 173.810 174.713 -0.903 17919 83695 1 204 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.640 -0.290 17919 83696 1 204 . 1 1 47 47 GLY H H 47 8.130 8.130 8.519 -0.389 17919 83697 1 204 . 1 1 48 48 LYS N N 48 121.570 121.570 121.310 0.260 17919 83698 1 204 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.637 -0.015 17919 83699 1 204 . 1 1 48 48 LYS C C 48 174.700 174.700 175.097 -0.397 17919 83700 1 204 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.995 -0.445 17919 83701 1 204 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.430 0.100 17919 83702 1 204 . 1 1 48 48 LYS H H 48 7.980 7.980 7.915 0.065 17919 83703 1 204 . 1 1 49 49 GLN N N 49 122.410 122.410 123.442 -1.032 17919 83704 1 204 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.851 -0.291 17919 83705 1 204 . 1 1 49 49 GLN C C 49 175.670 175.670 175.742 -0.072 17919 83706 1 204 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.826 -0.086 17919 83707 1 204 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.747 -0.747 17919 83708 1 204 . 1 1 49 49 GLN H H 49 8.600 8.600 8.553 0.047 17919 83709 1 204 . 1 1 50 50 LEU N N 50 125.520 125.520 128.648 -3.128 17919 83710 1 204 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.708 -0.618 17919 83711 1 204 . 1 1 50 50 LEU C C 50 176.660 176.660 176.271 0.389 17919 83712 1 204 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.285 -0.045 17919 83713 1 204 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.705 -1.135 17919 83714 1 204 . 1 1 50 50 LEU H H 50 8.530 8.530 8.847 -0.317 17919 83715 1 204 . 1 1 51 51 GLU N N 51 122.940 122.940 122.797 0.143 17919 83716 1 204 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.553 -0.065 17919 83717 1 204 . 1 1 51 51 GLU C C 51 175.870 175.870 177.177 -1.307 17919 83718 1 204 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.537 0.423 17919 83719 1 204 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.827 -0.257 17919 83720 1 204 . 1 1 51 51 GLU H H 51 8.400 8.400 8.302 0.098 17919 83721 1 204 . 1 1 52 52 ASP N N 52 120.030 120.030 125.702 -5.672 17919 83722 1 204 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.326 0.033 17919 83723 1 204 . 1 1 52 52 ASP C C 52 177.330 177.330 178.226 -0.896 17919 83724 1 204 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.854 -0.894 17919 83725 1 204 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.687 0.163 17919 83726 1 204 . 1 1 52 52 ASP H H 52 8.160 8.160 8.887 -0.727 17919 83727 1 204 . 1 1 53 53 GLY N N 53 106.660 106.660 105.711 0.949 17919 83728 1 204 . 1 1 53 53 GLY C C 53 174.870 174.870 174.107 0.763 17919 83729 1 204 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.227 -0.057 17919 83730 1 204 . 1 1 53 53 GLY H H 53 9.390 9.390 8.619 0.771 17919 83731 1 204 . 1 1 54 54 ARG N N 54 119.050 119.050 120.836 -1.786 17919 83732 1 204 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.519 0.176 17919 83733 1 204 . 1 1 54 54 ARG C C 54 175.350 175.350 175.452 -0.102 17919 83734 1 204 . 1 1 54 54 ARG CA C 54 54.390 54.390 55.011 -0.621 17919 83735 1 204 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.588 0.062 17919 83736 1 204 . 1 1 54 54 ARG H H 54 7.460 7.460 7.660 -0.200 17919 83737 1 204 . 1 1 55 55 THR N N 55 108.400 108.400 115.320 -6.920 17919 83738 1 204 . 1 1 55 55 THR HA H 55 5.240 5.240 4.754 0.486 17919 83739 1 204 . 1 1 55 55 THR C C 55 176.560 176.560 175.733 0.827 17919 83740 1 204 . 1 1 55 55 THR CA C 55 59.690 59.690 61.407 -1.717 17919 83741 1 204 . 1 1 55 55 THR CB C 55 72.260 72.260 70.065 2.195 17919 83742 1 204 . 1 1 55 55 THR H H 55 8.730 8.730 8.358 0.372 17919 83743 1 204 . 1 1 56 56 LEU N N 56 117.920 117.920 122.430 -4.510 17919 83744 1 204 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.349 -0.289 17919 83745 1 204 . 1 1 56 56 LEU C C 56 180.810 180.810 177.988 2.822 17919 83746 1 204 . 1 1 56 56 LEU CA C 56 58.710 58.710 56.574 2.136 17919 83747 1 204 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.478 -1.108 17919 83748 1 204 . 1 1 56 56 LEU H H 56 8.140 8.140 8.644 -0.504 17919 83749 1 204 . 1 1 57 57 SER N N 57 113.330 113.330 115.653 -2.323 17919 83750 1 204 . 1 1 57 57 SER HA H 57 4.370 4.370 4.142 0.228 17919 83751 1 204 . 1 1 57 57 SER C C 57 178.310 178.310 176.784 1.526 17919 83752 1 204 . 1 1 57 57 SER CA C 57 61.080 61.080 62.167 -1.087 17919 83753 1 204 . 1 1 57 57 SER CB C 57 62.530 62.530 62.906 -0.376 17919 83754 1 204 . 1 1 57 57 SER H H 57 8.470 8.470 8.064 0.406 17919 83755 1 204 . 1 1 58 58 ASP N N 58 124.190 124.190 121.971 2.219 17919 83756 1 204 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.357 -0.061 17919 83757 1 204 . 1 1 58 58 ASP C C 58 177.400 177.400 177.457 -0.057 17919 83758 1 204 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.727 0.452 17919 83759 1 204 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.439 -0.339 17919 83760 1 204 . 1 1 58 58 ASP H H 58 7.930 7.930 7.959 -0.029 17919 83761 1 204 . 1 1 59 59 TYR N N 59 115.510 115.510 115.501 0.009 17919 83762 1 204 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.627 0.043 17919 83763 1 204 . 1 1 59 59 TYR C C 59 174.700 174.700 174.843 -0.143 17919 83764 1 204 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.550 0.701 17919 83765 1 204 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.361 1.709 17919 83766 1 204 . 1 1 59 59 TYR H H 59 7.250 7.250 7.540 -0.290 17919 83767 1 204 . 1 1 60 60 ASN N N 60 115.900 115.900 117.816 -1.916 17919 83768 1 204 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.340 0.015 17919 83769 1 204 . 1 1 60 60 ASN C C 60 174.340 174.340 174.815 -0.475 17919 83770 1 204 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.219 -0.099 17919 83771 1 204 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.048 0.362 17919 83772 1 204 . 1 1 60 60 ASN H H 60 8.150 8.150 7.767 0.383 17919 83773 1 204 . 1 1 61 61 ILE N N 61 118.600 118.600 118.543 0.057 17919 83774 1 204 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.722 -0.329 17919 83775 1 204 . 1 1 61 61 ILE C C 61 174.610 174.610 175.650 -1.040 17919 83776 1 204 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.691 0.728 17919 83777 1 204 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.979 -1.239 17919 83778 1 204 . 1 1 61 61 ILE H H 61 7.250 7.250 7.418 -0.168 17919 83779 1 204 . 1 1 62 62 GLN N N 62 124.740 124.740 124.903 -0.163 17919 83780 1 204 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.659 -0.153 17919 83781 1 204 . 1 1 62 62 GLN C C 62 175.970 175.970 175.533 0.437 17919 83782 1 204 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.801 -0.141 17919 83783 1 204 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.207 0.443 17919 83784 1 204 . 1 1 62 62 GLN H H 62 7.610 7.610 8.199 -0.589 17919 83785 1 204 . 1 1 63 63 LYS N N 63 120.300 120.300 122.699 -2.399 17919 83786 1 204 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.934 0.067 17919 83787 1 204 . 1 1 63 63 LYS C C 63 175.810 175.810 176.886 -1.076 17919 83788 1 204 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.029 -0.238 17919 83789 1 204 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.448 0.202 17919 83790 1 204 . 1 1 63 63 LYS H H 63 8.490 8.490 8.610 -0.120 17919 83791 1 204 . 1 1 64 64 GLU N N 64 113.950 113.950 119.098 -5.148 17919 83792 1 204 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.295 0.170 17919 83793 1 204 . 1 1 64 64 GLU C C 64 175.250 175.250 175.431 -0.181 17919 83794 1 204 . 1 1 64 64 GLU CA C 64 57.890 57.890 58.240 -0.350 17919 83795 1 204 . 1 1 64 64 GLU CB C 64 25.900 25.900 29.216 -3.316 17919 83796 1 204 . 1 1 64 64 GLU H H 64 9.280 9.280 8.629 0.651 17919 83797 1 204 . 1 1 65 65 SER N N 65 114.730 114.730 115.885 -1.155 17919 83798 1 204 . 1 1 65 65 SER HA H 65 4.640 4.640 4.470 0.170 17919 83799 1 204 . 1 1 65 65 SER C C 65 172.160 172.160 173.608 -1.448 17919 83800 1 204 . 1 1 65 65 SER CA C 65 60.890 60.890 60.694 0.196 17919 83801 1 204 . 1 1 65 65 SER CB C 65 64.910 64.910 63.821 1.089 17919 83802 1 204 . 1 1 65 65 SER H H 65 7.670 7.670 7.607 0.063 17919 83803 1 204 . 1 1 66 66 THR N N 66 117.110 117.110 119.754 -2.644 17919 83804 1 204 . 1 1 66 66 THR HA H 66 5.270 5.270 5.467 -0.197 17919 83805 1 204 . 1 1 66 66 THR C C 66 173.950 173.950 174.296 -0.346 17919 83806 1 204 . 1 1 66 66 THR CA C 66 62.340 62.340 62.006 0.334 17919 83807 1 204 . 1 1 66 66 THR CB C 66 70.080 70.080 70.138 -0.058 17919 83808 1 204 . 1 1 66 66 THR H H 66 8.730 8.730 8.319 0.411 17919 83809 1 204 . 1 1 67 67 LEU N N 67 127.110 127.110 126.610 0.500 17919 83810 1 204 . 1 1 67 67 LEU HA H 67 5.060 5.060 5.047 0.013 17919 83811 1 204 . 1 1 67 67 LEU C C 67 175.770 175.770 175.288 0.482 17919 83812 1 204 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.853 0.047 17919 83813 1 204 . 1 1 67 67 LEU CB C 67 44.260 44.260 45.182 -0.923 17919 83814 1 204 . 1 1 67 67 LEU H H 67 9.410 9.410 9.156 0.254 17919 83815 1 204 . 1 1 68 68 HIS N N 68 118.380 118.380 121.695 -3.315 17919 83816 1 204 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.492 -0.252 17919 83817 1 204 . 1 1 68 68 HIS C C 68 173.150 173.150 173.916 -0.766 17919 83818 1 204 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.342 0.658 17919 83819 1 204 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.539 -2.010 17919 83820 1 204 . 1 1 68 68 HIS H H 68 9.230 9.230 9.034 0.196 17919 83821 1 204 . 1 1 69 69 LEU N N 69 124.460 124.460 130.442 -5.982 17919 83822 1 204 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.059 0.131 17919 83823 1 204 . 1 1 69 69 LEU C C 69 175.270 175.270 174.698 0.572 17919 83824 1 204 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.763 0.127 17919 83825 1 204 . 1 1 69 69 LEU CB C 69 44.380 44.380 43.518 0.862 17919 83826 1 204 . 1 1 69 69 LEU H H 69 8.340 8.340 7.890 0.450 17919 83827 1 204 . 1 1 70 70 VAL N N 70 126.940 126.940 128.380 -1.440 17919 83828 1 204 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.460 -0.110 17919 83829 1 204 . 1 1 70 70 VAL C C 70 174.000 174.000 174.659 -0.659 17919 83830 1 204 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.825 -0.025 17919 83831 1 204 . 1 1 70 70 VAL CB C 70 34.910 34.910 34.951 -0.041 17919 83832 1 204 . 1 1 70 70 VAL H H 70 9.200 9.200 8.939 0.261 17919 83833 1 204 . 1 1 71 71 LEU N N 71 123.130 123.130 125.217 -2.087 17919 83834 1 204 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.679 0.381 17919 83835 1 204 . 1 1 71 71 LEU C C 71 177.830 177.830 178.048 -0.218 17919 83836 1 204 . 1 1 71 71 LEU CA C 71 53.940 53.940 54.420 -0.480 17919 83837 1 204 . 1 1 71 71 LEU CB C 71 42.850 42.850 41.720 1.130 17919 83838 1 204 . 1 1 71 71 LEU H H 71 8.120 8.120 8.637 -0.517 17919 83839 1 204 . 1 1 72 72 ARG N N 72 123.490 123.490 121.910 1.580 17919 83840 1 204 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.136 0.165 17919 83841 1 204 . 1 1 72 72 ARG C C 72 175.350 175.350 176.358 -1.008 17919 83842 1 204 . 1 1 72 72 ARG CA C 72 55.610 55.610 57.786 -2.176 17919 83843 1 204 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.513 0.837 17919 83844 1 204 . 1 1 72 72 ARG H H 72 8.580 8.580 8.498 0.082 17919 83845 1 205 . 1 1 2 2 GLN N N 2 123.220 123.220 121.699 1.521 17919 83846 1 205 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.391 -0.142 17919 83847 1 205 . 1 1 2 2 GLN C C 2 175.920 175.920 174.926 0.994 17919 83848 1 205 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.420 0.660 17919 83849 1 205 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.930 -0.170 17919 83850 1 205 . 1 1 2 2 GLN H H 2 8.900 8.900 8.413 0.487 17919 83851 1 205 . 1 1 3 3 ILE N N 3 115.340 115.340 118.538 -3.198 17919 83852 1 205 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.499 -0.286 17919 83853 1 205 . 1 1 3 3 ILE C C 3 172.450 172.450 172.962 -0.512 17919 83854 1 205 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.510 0.060 17919 83855 1 205 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.924 0.286 17919 83856 1 205 . 1 1 3 3 ILE H H 3 8.320 8.320 8.341 -0.021 17919 83857 1 205 . 1 1 4 4 PHE N N 4 118.110 118.110 119.990 -1.880 17919 83858 1 205 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.639 -0.009 17919 83859 1 205 . 1 1 4 4 PHE C C 4 175.320 175.320 175.156 0.164 17919 83860 1 205 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.456 -0.246 17919 83861 1 205 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.154 -0.674 17919 83862 1 205 . 1 1 4 4 PHE H H 4 8.610 8.610 8.305 0.305 17919 83863 1 205 . 1 1 5 5 VAL N N 5 121.000 121.000 121.229 -0.229 17919 83864 1 205 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.820 -0.095 17919 83865 1 205 . 1 1 5 5 VAL C C 5 174.870 174.870 174.949 -0.079 17919 83866 1 205 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.206 -0.586 17919 83867 1 205 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.856 -0.626 17919 83868 1 205 . 1 1 5 5 VAL H H 5 9.300 9.300 9.184 0.116 17919 83869 1 205 . 1 1 6 6 LYS N N 6 127.520 127.520 127.997 -0.477 17919 83870 1 205 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.304 0.063 17919 83871 1 205 . 1 1 6 6 LYS C C 6 177.140 177.140 176.609 0.531 17919 83872 1 205 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.626 -0.106 17919 83873 1 205 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.666 0.384 17919 83874 1 205 . 1 1 6 6 LYS H H 6 8.820 8.820 8.809 0.011 17919 83875 1 205 . 1 1 7 7 THR N N 7 115.400 115.400 117.185 -1.785 17919 83876 1 205 . 1 1 7 7 THR HA H 7 4.970 4.970 4.502 0.468 17919 83877 1 205 . 1 1 7 7 THR C C 7 176.910 176.910 176.236 0.674 17919 83878 1 205 . 1 1 7 7 THR CA C 7 60.470 60.470 60.601 -0.131 17919 83879 1 205 . 1 1 7 7 THR CB C 7 70.630 70.630 69.590 1.040 17919 83880 1 205 . 1 1 7 7 THR H H 7 8.730 8.730 8.346 0.384 17919 83881 1 205 . 1 1 8 8 LEU N N 8 121.330 121.330 120.777 0.553 17919 83882 1 205 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.392 -0.082 17919 83883 1 205 . 1 1 8 8 LEU C C 8 178.800 178.800 178.228 0.572 17919 83884 1 205 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.136 0.444 17919 83885 1 205 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.254 0.716 17919 83886 1 205 . 1 1 8 8 LEU H H 8 9.100 9.100 8.574 0.526 17919 83887 1 205 . 1 1 9 9 THR N N 9 105.590 105.590 109.982 -4.392 17919 83888 1 205 . 1 1 9 9 THR HA H 9 4.428 4.428 4.256 0.172 17919 83889 1 205 . 1 1 9 9 THR C C 9 175.520 175.520 175.742 -0.222 17919 83890 1 205 . 1 1 9 9 THR CA C 9 61.400 61.400 62.283 -0.883 17919 83891 1 205 . 1 1 9 9 THR CB C 9 69.140 69.140 68.788 0.352 17919 83892 1 205 . 1 1 9 9 THR H H 9 7.630 7.630 7.843 -0.213 17919 83893 1 205 . 1 1 10 10 GLY N N 10 108.890 108.890 111.593 -2.703 17919 83894 1 205 . 1 1 10 10 GLY C C 10 174.070 174.070 173.339 0.731 17919 83895 1 205 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.058 0.402 17919 83896 1 205 . 1 1 10 10 GLY H H 10 7.810 7.810 7.872 -0.062 17919 83897 1 205 . 1 1 11 11 LYS N N 11 121.600 121.600 121.167 0.433 17919 83898 1 205 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.300 0.061 17919 83899 1 205 . 1 1 11 11 LYS C C 11 175.940 175.940 175.815 0.125 17919 83900 1 205 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.216 0.064 17919 83901 1 205 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.349 -0.149 17919 83902 1 205 . 1 1 11 11 LYS H H 11 7.280 7.280 7.816 -0.536 17919 83903 1 205 . 1 1 12 12 THR N N 12 120.440 120.440 121.666 -1.226 17919 83904 1 205 . 1 1 12 12 THR HA H 12 5.046 5.046 4.910 0.136 17919 83905 1 205 . 1 1 12 12 THR C C 12 174.320 174.320 174.769 -0.449 17919 83906 1 205 . 1 1 12 12 THR CA C 12 62.390 62.390 62.268 0.122 17919 83907 1 205 . 1 1 12 12 THR CB C 12 69.910 69.910 69.500 0.410 17919 83908 1 205 . 1 1 12 12 THR H H 12 8.650 8.650 8.169 0.481 17919 83909 1 205 . 1 1 13 13 ILE N N 13 127.110 127.110 122.012 5.098 17919 83910 1 205 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.704 -0.160 17919 83911 1 205 . 1 1 13 13 ILE C C 13 175.220 175.220 174.807 0.413 17919 83912 1 205 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.205 0.775 17919 83913 1 205 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.114 -0.163 17919 83914 1 205 . 1 1 13 13 ILE H H 13 9.450 9.450 9.079 0.371 17919 83915 1 205 . 1 1 14 14 THR N N 14 121.520 121.520 120.742 0.778 17919 83916 1 205 . 1 1 14 14 THR HA H 14 4.964 4.964 4.739 0.225 17919 83917 1 205 . 1 1 14 14 THR C C 14 173.790 173.790 173.574 0.216 17919 83918 1 205 . 1 1 14 14 THR CA C 14 61.940 61.940 62.610 -0.670 17919 83919 1 205 . 1 1 14 14 THR CB C 14 69.650 69.650 69.742 -0.092 17919 83920 1 205 . 1 1 14 14 THR H H 14 8.710 8.710 8.532 0.178 17919 83921 1 205 . 1 1 15 15 LEU N N 15 124.800 124.800 125.550 -0.750 17919 83922 1 205 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.780 0.000 17919 83923 1 205 . 1 1 15 15 LEU C C 15 174.670 174.670 175.415 -0.745 17919 83924 1 205 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.484 -0.654 17919 83925 1 205 . 1 1 15 15 LEU CB C 15 47.070 47.070 43.964 3.106 17919 83926 1 205 . 1 1 15 15 LEU H H 15 8.710 8.710 8.523 0.187 17919 83927 1 205 . 1 1 16 16 GLU N N 16 122.160 122.160 122.975 -0.815 17919 83928 1 205 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.198 -0.281 17919 83929 1 205 . 1 1 16 16 GLU C C 16 175.860 175.860 176.137 -0.277 17919 83930 1 205 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.394 -0.574 17919 83931 1 205 . 1 1 16 16 GLU CB C 16 29.450 29.450 31.403 -1.953 17919 83932 1 205 . 1 1 16 16 GLU H H 16 8.140 8.140 8.643 -0.503 17919 83933 1 205 . 1 1 17 17 VAL N N 17 117.210 117.210 119.722 -2.512 17919 83934 1 205 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.814 -0.100 17919 83935 1 205 . 1 1 17 17 VAL C C 17 174.160 174.160 174.506 -0.346 17919 83936 1 205 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.430 -1.000 17919 83937 1 205 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.695 0.705 17919 83938 1 205 . 1 1 17 17 VAL H H 17 8.900 8.900 8.709 0.191 17919 83939 1 205 . 1 1 18 18 GLU N N 18 118.990 118.990 122.895 -3.905 17919 83940 1 205 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.866 0.213 17919 83941 1 205 . 1 1 18 18 GLU C C 18 176.160 176.160 175.564 0.596 17919 83942 1 205 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.332 0.388 17919 83943 1 205 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.603 -0.293 17919 83944 1 205 . 1 1 18 18 GLU H H 18 8.640 8.640 8.676 -0.036 17919 83945 1 205 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.336 -0.195 17919 83946 1 205 . 1 1 19 19 PRO C C 19 175.310 175.310 177.595 -2.285 17919 83947 1 205 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.077 0.393 17919 83948 1 205 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.728 0.222 17919 83949 1 205 . 1 1 20 20 SER N N 20 103.400 103.400 110.279 -6.879 17919 83950 1 205 . 1 1 20 20 SER HA H 20 4.370 4.370 4.246 0.124 17919 83951 1 205 . 1 1 20 20 SER C C 20 174.660 174.660 174.505 0.155 17919 83952 1 205 . 1 1 20 20 SER CA C 20 57.400 57.400 59.129 -1.729 17919 83953 1 205 . 1 1 20 20 SER CB C 20 63.370 63.370 62.173 1.197 17919 83954 1 205 . 1 1 20 20 SER H H 20 7.040 7.040 8.070 -1.030 17919 83955 1 205 . 1 1 21 21 ASP N N 21 123.480 123.480 124.135 -0.655 17919 83956 1 205 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.687 0.008 17919 83957 1 205 . 1 1 21 21 ASP C C 21 176.360 176.360 175.903 0.457 17919 83958 1 205 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.979 0.721 17919 83959 1 205 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.553 -0.753 17919 83960 1 205 . 1 1 21 21 ASP H H 21 8.030 8.030 7.822 0.208 17919 83961 1 205 . 1 1 22 22 THR N N 22 108.800 108.800 112.699 -3.899 17919 83962 1 205 . 1 1 22 22 THR HA H 22 4.920 4.920 4.965 -0.045 17919 83963 1 205 . 1 1 22 22 THR C C 22 176.750 176.750 176.069 0.681 17919 83964 1 205 . 1 1 22 22 THR CA C 22 59.690 59.690 60.615 -0.925 17919 83965 1 205 . 1 1 22 22 THR CB C 22 71.200 71.200 71.146 0.054 17919 83966 1 205 . 1 1 22 22 THR H H 22 7.900 7.900 8.321 -0.421 17919 83967 1 205 . 1 1 23 23 ILE N N 23 121.190 121.190 122.240 -1.050 17919 83968 1 205 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.791 -0.134 17919 83969 1 205 . 1 1 23 23 ILE C C 23 179.040 179.040 177.865 1.175 17919 83970 1 205 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.717 -0.457 17919 83971 1 205 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.223 -1.873 17919 83972 1 205 . 1 1 23 23 ILE H H 23 8.560 8.560 8.544 0.016 17919 83973 1 205 . 1 1 24 24 GLU N N 24 120.830 120.830 121.245 -0.415 17919 83974 1 205 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.803 0.114 17919 83975 1 205 . 1 1 24 24 GLU C C 24 178.640 178.640 178.610 0.030 17919 83976 1 205 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.223 -0.003 17919 83977 1 205 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.410 -1.130 17919 83978 1 205 . 1 1 24 24 GLU H H 24 9.760 9.760 8.302 1.458 17919 83979 1 205 . 1 1 25 25 ASN N N 25 120.570 120.570 117.613 2.957 17919 83980 1 205 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.522 0.003 17919 83981 1 205 . 1 1 25 25 ASN C C 25 178.380 178.380 177.969 0.411 17919 83982 1 205 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.919 0.141 17919 83983 1 205 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.647 -0.196 17919 83984 1 205 . 1 1 25 25 ASN H H 25 7.920 7.920 7.586 0.334 17919 83985 1 205 . 1 1 26 26 VAL N N 26 121.710 121.710 121.001 0.709 17919 83986 1 205 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.550 -0.153 17919 83987 1 205 . 1 1 26 26 VAL C C 26 177.950 177.950 177.777 0.173 17919 83988 1 205 . 1 1 26 26 VAL CA C 26 67.660 67.660 67.022 0.638 17919 83989 1 205 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.669 -0.829 17919 83990 1 205 . 1 1 26 26 VAL H H 26 8.070 8.070 7.948 0.122 17919 83991 1 205 . 1 1 27 27 LYS N N 27 118.860 118.860 119.833 -0.973 17919 83992 1 205 . 1 1 27 27 LYS HA H 27 4.580 4.580 3.987 0.593 17919 83993 1 205 . 1 1 27 27 LYS C C 27 180.550 180.550 179.070 1.480 17919 83994 1 205 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.695 -0.445 17919 83995 1 205 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.217 1.513 17919 83996 1 205 . 1 1 27 27 LYS H H 27 8.560 8.560 8.236 0.324 17919 83997 1 205 . 1 1 28 28 ALA N N 28 123.440 123.440 121.542 1.898 17919 83998 1 205 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.016 0.144 17919 83999 1 205 . 1 1 28 28 ALA C C 28 180.300 180.300 179.083 1.217 17919 84000 1 205 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.122 0.248 17919 84001 1 205 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.307 -0.597 17919 84002 1 205 . 1 1 28 28 ALA H H 28 8.060 8.060 8.275 -0.215 17919 84003 1 205 . 1 1 29 29 LYS N N 29 119.940 119.940 119.277 0.663 17919 84004 1 205 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.082 0.125 17919 84005 1 205 . 1 1 29 29 LYS C C 29 180.320 180.320 179.259 1.061 17919 84006 1 205 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.449 0.201 17919 84007 1 205 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.404 0.886 17919 84008 1 205 . 1 1 29 29 LYS H H 29 7.850 7.850 7.984 -0.134 17919 84009 1 205 . 1 1 30 30 ILE N N 30 121.080 121.080 120.505 0.575 17919 84010 1 205 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.601 -0.094 17919 84011 1 205 . 1 1 30 30 ILE C C 30 178.310 178.310 177.644 0.666 17919 84012 1 205 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.067 1.083 17919 84013 1 205 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.660 -0.861 17919 84014 1 205 . 1 1 30 30 ILE H H 30 8.280 8.280 8.256 0.024 17919 84015 1 205 . 1 1 31 31 GLN N N 31 123.490 123.490 120.295 3.195 17919 84016 1 205 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.943 -0.114 17919 84017 1 205 . 1 1 31 31 GLN C C 31 178.890 178.890 178.243 0.647 17919 84018 1 205 . 1 1 31 31 GLN CA C 31 60.000 60.000 58.797 1.203 17919 84019 1 205 . 1 1 31 31 GLN CB C 31 27.720 27.720 27.946 -0.226 17919 84020 1 205 . 1 1 31 31 GLN H H 31 8.580 8.580 7.948 0.632 17919 84021 1 205 . 1 1 32 32 ASP N N 32 119.360 119.360 118.703 0.657 17919 84022 1 205 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.464 -0.110 17919 84023 1 205 . 1 1 32 32 ASP C C 32 177.250 177.250 178.082 -0.832 17919 84024 1 205 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.253 0.937 17919 84025 1 205 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.617 -0.037 17919 84026 1 205 . 1 1 32 32 ASP H H 32 8.010 8.010 8.010 0.000 17919 84027 1 205 . 1 1 33 33 LYS N N 33 115.130 115.130 119.717 -4.587 17919 84028 1 205 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.203 0.134 17919 84029 1 205 . 1 1 33 33 LYS C C 33 177.870 177.870 178.094 -0.224 17919 84030 1 205 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.264 -0.214 17919 84031 1 205 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.143 1.027 17919 84032 1 205 . 1 1 33 33 LYS H H 33 7.430 7.430 7.652 -0.223 17919 84033 1 205 . 1 1 34 34 GLU N N 34 113.870 113.870 114.390 -0.520 17919 84034 1 205 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.538 0.087 17919 84035 1 205 . 1 1 34 34 GLU C C 34 177.840 177.840 176.477 1.363 17919 84036 1 205 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.414 -0.244 17919 84037 1 205 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.622 1.038 17919 84038 1 205 . 1 1 34 34 GLU H H 34 8.740 8.740 8.223 0.517 17919 84039 1 205 . 1 1 35 35 GLY N N 35 108.650 108.650 108.113 0.537 17919 84040 1 205 . 1 1 35 35 GLY C C 35 173.960 173.960 174.620 -0.660 17919 84041 1 205 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.855 0.225 17919 84042 1 205 . 1 1 35 35 GLY H H 35 8.530 8.530 7.649 0.881 17919 84043 1 205 . 1 1 36 36 ILE N N 36 119.880 119.880 121.873 -1.993 17919 84044 1 205 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.223 0.222 17919 84045 1 205 . 1 1 36 36 ILE C C 36 173.590 173.590 173.741 -0.151 17919 84046 1 205 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.696 -0.946 17919 84047 1 205 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.531 2.049 17919 84048 1 205 . 1 1 36 36 ILE H H 36 6.150 6.150 7.554 -1.404 17919 84049 1 205 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.783 -0.149 17919 84050 1 205 . 1 1 37 37 PRO C C 37 176.940 176.940 175.864 1.076 17919 84051 1 205 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.830 -0.170 17919 84052 1 205 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.764 0.086 17919 84053 1 205 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.304 -0.187 17919 84054 1 205 . 1 1 38 38 PRO C C 38 178.320 178.320 177.888 0.432 17919 84055 1 205 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.151 1.109 17919 84056 1 205 . 1 1 38 38 PRO CB C 38 32.890 32.890 32.096 0.794 17919 84057 1 205 . 1 1 39 39 ASP N N 39 113.380 113.380 115.192 -1.812 17919 84058 1 205 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.423 0.007 17919 84059 1 205 . 1 1 39 39 ASP C C 39 177.090 177.090 177.209 -0.119 17919 84060 1 205 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.520 -0.880 17919 84061 1 205 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.465 -0.924 17919 84062 1 205 . 1 1 39 39 ASP H H 39 8.550 8.550 8.726 -0.176 17919 84063 1 205 . 1 1 40 40 GLN N N 40 116.780 116.780 116.340 0.440 17919 84064 1 205 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.494 -0.030 17919 84065 1 205 . 1 1 40 40 GLN C C 40 175.380 175.380 176.358 -0.978 17919 84066 1 205 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.657 -0.017 17919 84067 1 205 . 1 1 40 40 GLN CB C 40 30.140 30.140 31.076 -0.936 17919 84068 1 205 . 1 1 40 40 GLN H H 40 7.820 7.820 7.669 0.151 17919 84069 1 205 . 1 1 41 41 GLN N N 41 117.720 117.720 120.482 -2.762 17919 84070 1 205 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.195 0.049 17919 84071 1 205 . 1 1 41 41 GLN C C 41 176.300 176.300 174.968 1.332 17919 84072 1 205 . 1 1 41 41 GLN CA C 41 56.470 56.470 57.419 -0.948 17919 84073 1 205 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.357 2.293 17919 84074 1 205 . 1 1 41 41 GLN H H 41 7.480 7.480 7.818 -0.338 17919 84075 1 205 . 1 1 42 42 ARG N N 42 122.680 122.680 122.416 0.264 17919 84076 1 205 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.731 -0.231 17919 84077 1 205 . 1 1 42 42 ARG C C 42 174.050 174.050 174.262 -0.212 17919 84078 1 205 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.390 0.660 17919 84079 1 205 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.442 -1.692 17919 84080 1 205 . 1 1 42 42 ARG H H 42 8.530 8.530 8.432 0.098 17919 84081 1 205 . 1 1 43 43 LEU N N 43 124.040 124.040 122.526 1.514 17919 84082 1 205 . 1 1 43 43 LEU C C 43 175.290 175.290 175.376 -0.086 17919 84083 1 205 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.644 -0.664 17919 84084 1 205 . 1 1 43 43 LEU CB C 43 45.790 45.790 45.027 0.763 17919 84085 1 205 . 1 1 43 43 LEU H H 43 8.820 8.820 8.797 0.023 17919 84086 1 205 . 1 1 44 44 ILE N N 44 121.920 121.920 120.293 1.627 17919 84087 1 205 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.215 -0.223 17919 84088 1 205 . 1 1 44 44 ILE C C 44 176.060 176.060 173.564 2.496 17919 84089 1 205 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.610 -0.630 17919 84090 1 205 . 1 1 44 44 ILE CB C 44 41.420 41.420 40.778 0.642 17919 84091 1 205 . 1 1 44 44 ILE H H 44 9.030 9.030 8.816 0.214 17919 84092 1 205 . 1 1 45 45 PHE N N 45 125.390 125.390 129.399 -4.009 17919 84093 1 205 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.022 0.023 17919 84094 1 205 . 1 1 45 45 PHE C C 45 174.470 174.470 174.896 -0.426 17919 84095 1 205 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.354 0.666 17919 84096 1 205 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.419 0.341 17919 84097 1 205 . 1 1 45 45 PHE H H 45 8.830 8.830 8.500 0.330 17919 84098 1 205 . 1 1 46 46 ALA N N 46 132.200 132.200 128.352 3.848 17919 84099 1 205 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.532 0.158 17919 84100 1 205 . 1 1 46 46 ALA C C 46 177.290 177.290 177.820 -0.530 17919 84101 1 205 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.173 0.367 17919 84102 1 205 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.508 0.062 17919 84103 1 205 . 1 1 46 46 ALA H H 46 8.810 8.810 8.446 0.364 17919 84104 1 205 . 1 1 47 47 GLY N N 47 102.340 102.340 104.670 -2.330 17919 84105 1 205 . 1 1 47 47 GLY C C 47 173.810 173.810 174.432 -0.622 17919 84106 1 205 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.954 0.396 17919 84107 1 205 . 1 1 47 47 GLY H H 47 8.130 8.130 8.420 -0.290 17919 84108 1 205 . 1 1 48 48 LYS N N 48 121.570 121.570 121.572 -0.002 17919 84109 1 205 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.564 0.058 17919 84110 1 205 . 1 1 48 48 LYS C C 48 174.700 174.700 175.041 -0.341 17919 84111 1 205 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.068 -0.518 17919 84112 1 205 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.312 0.218 17919 84113 1 205 . 1 1 48 48 LYS H H 48 7.980 7.980 7.862 0.118 17919 84114 1 205 . 1 1 49 49 GLN N N 49 122.410 122.410 123.377 -0.967 17919 84115 1 205 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.406 0.154 17919 84116 1 205 . 1 1 49 49 GLN C C 49 175.670 175.670 175.537 0.133 17919 84117 1 205 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.951 -0.211 17919 84118 1 205 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.368 -0.368 17919 84119 1 205 . 1 1 49 49 GLN H H 49 8.600 8.600 8.484 0.116 17919 84120 1 205 . 1 1 50 50 LEU N N 50 125.520 125.520 128.518 -2.998 17919 84121 1 205 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.334 -0.244 17919 84122 1 205 . 1 1 50 50 LEU C C 50 176.660 176.660 176.309 0.351 17919 84123 1 205 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.087 0.153 17919 84124 1 205 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.091 -0.521 17919 84125 1 205 . 1 1 50 50 LEU H H 50 8.530 8.530 8.867 -0.337 17919 84126 1 205 . 1 1 51 51 GLU N N 51 122.940 122.940 124.177 -1.237 17919 84127 1 205 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.397 0.091 17919 84128 1 205 . 1 1 51 51 GLU C C 51 175.870 175.870 177.232 -1.362 17919 84129 1 205 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.185 0.774 17919 84130 1 205 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.777 -0.207 17919 84131 1 205 . 1 1 51 51 GLU H H 51 8.400 8.400 8.345 0.055 17919 84132 1 205 . 1 1 52 52 ASP N N 52 120.030 120.030 126.324 -6.294 17919 84133 1 205 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.431 -0.072 17919 84134 1 205 . 1 1 52 52 ASP C C 52 177.330 177.330 177.319 0.011 17919 84135 1 205 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.739 -0.778 17919 84136 1 205 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.918 -0.068 17919 84137 1 205 . 1 1 52 52 ASP H H 52 8.160 8.160 8.855 -0.695 17919 84138 1 205 . 1 1 53 53 GLY N N 53 106.660 106.660 103.821 2.839 17919 84139 1 205 . 1 1 53 53 GLY C C 53 174.870 174.870 174.452 0.418 17919 84140 1 205 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.444 0.726 17919 84141 1 205 . 1 1 53 53 GLY H H 53 9.390 9.390 8.200 1.190 17919 84142 1 205 . 1 1 54 54 ARG N N 54 119.050 119.050 120.206 -1.156 17919 84143 1 205 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.580 0.115 17919 84144 1 205 . 1 1 54 54 ARG C C 54 175.350 175.350 175.755 -0.405 17919 84145 1 205 . 1 1 54 54 ARG CA C 54 54.390 54.390 53.732 0.658 17919 84146 1 205 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.105 0.546 17919 84147 1 205 . 1 1 54 54 ARG H H 54 7.460 7.460 7.355 0.105 17919 84148 1 205 . 1 1 55 55 THR N N 55 108.400 108.400 111.388 -2.988 17919 84149 1 205 . 1 1 55 55 THR HA H 55 5.240 5.240 5.230 0.010 17919 84150 1 205 . 1 1 55 55 THR C C 55 176.560 176.560 176.379 0.181 17919 84151 1 205 . 1 1 55 55 THR CA C 55 59.690 59.690 59.975 -0.285 17919 84152 1 205 . 1 1 55 55 THR CB C 55 72.260 72.260 71.373 0.887 17919 84153 1 205 . 1 1 55 55 THR H H 55 8.730 8.730 8.620 0.110 17919 84154 1 205 . 1 1 56 56 LEU N N 56 117.920 117.920 122.780 -4.860 17919 84155 1 205 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.967 0.093 17919 84156 1 205 . 1 1 56 56 LEU C C 56 180.810 180.810 179.085 1.725 17919 84157 1 205 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.275 0.435 17919 84158 1 205 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.570 -1.200 17919 84159 1 205 . 1 1 56 56 LEU H H 56 8.140 8.140 8.604 -0.464 17919 84160 1 205 . 1 1 57 57 SER N N 57 113.330 113.330 114.896 -1.566 17919 84161 1 205 . 1 1 57 57 SER HA H 57 4.370 4.370 4.130 0.240 17919 84162 1 205 . 1 1 57 57 SER C C 57 178.310 178.310 176.711 1.599 17919 84163 1 205 . 1 1 57 57 SER CA C 57 61.080 61.080 62.164 -1.084 17919 84164 1 205 . 1 1 57 57 SER CB C 57 62.530 62.530 62.697 -0.167 17919 84165 1 205 . 1 1 57 57 SER H H 57 8.470 8.470 8.068 0.402 17919 84166 1 205 . 1 1 58 58 ASP N N 58 124.190 124.190 121.475 2.715 17919 84167 1 205 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.297 -0.001 17919 84168 1 205 . 1 1 58 58 ASP C C 58 177.400 177.400 177.063 0.337 17919 84169 1 205 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.752 0.428 17919 84170 1 205 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.558 -0.458 17919 84171 1 205 . 1 1 58 58 ASP H H 58 7.930 7.930 7.707 0.223 17919 84172 1 205 . 1 1 59 59 TYR N N 59 115.510 115.510 115.505 0.005 17919 84173 1 205 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.569 0.101 17919 84174 1 205 . 1 1 59 59 TYR C C 59 174.700 174.700 174.969 -0.269 17919 84175 1 205 . 1 1 59 59 TYR CA C 59 58.250 58.250 56.835 1.415 17919 84176 1 205 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.023 2.046 17919 84177 1 205 . 1 1 59 59 TYR H H 59 7.250 7.250 7.334 -0.084 17919 84178 1 205 . 1 1 60 60 ASN N N 60 115.900 115.900 116.851 -0.951 17919 84179 1 205 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.388 -0.033 17919 84180 1 205 . 1 1 60 60 ASN C C 60 174.340 174.340 174.802 -0.462 17919 84181 1 205 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.258 -0.138 17919 84182 1 205 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.353 0.057 17919 84183 1 205 . 1 1 60 60 ASN H H 60 8.150 8.150 8.029 0.121 17919 84184 1 205 . 1 1 61 61 ILE N N 61 118.600 118.600 119.161 -0.561 17919 84185 1 205 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.883 -0.490 17919 84186 1 205 . 1 1 61 61 ILE C C 61 174.610 174.610 175.450 -0.840 17919 84187 1 205 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.605 0.815 17919 84188 1 205 . 1 1 61 61 ILE CB C 61 36.740 36.740 38.111 -1.371 17919 84189 1 205 . 1 1 61 61 ILE H H 61 7.250 7.250 7.477 -0.227 17919 84190 1 205 . 1 1 62 62 GLN N N 62 124.740 124.740 125.770 -1.030 17919 84191 1 205 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.737 -0.231 17919 84192 1 205 . 1 1 62 62 GLN C C 62 175.970 175.970 175.031 0.939 17919 84193 1 205 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.670 -0.010 17919 84194 1 205 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.694 -0.044 17919 84195 1 205 . 1 1 62 62 GLN H H 62 7.610 7.610 8.089 -0.479 17919 84196 1 205 . 1 1 63 63 LYS N N 63 120.300 120.300 120.874 -0.574 17919 84197 1 205 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.153 -0.152 17919 84198 1 205 . 1 1 63 63 LYS C C 63 175.810 175.810 177.178 -1.368 17919 84199 1 205 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.469 0.321 17919 84200 1 205 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.296 0.354 17919 84201 1 205 . 1 1 63 63 LYS H H 63 8.490 8.490 8.644 -0.154 17919 84202 1 205 . 1 1 64 64 GLU N N 64 113.950 113.950 116.182 -2.232 17919 84203 1 205 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.829 -0.364 17919 84204 1 205 . 1 1 64 64 GLU C C 64 175.250 175.250 175.939 -0.689 17919 84205 1 205 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.727 0.163 17919 84206 1 205 . 1 1 64 64 GLU CB C 64 25.900 25.900 29.089 -3.189 17919 84207 1 205 . 1 1 64 64 GLU H H 64 9.280 9.280 8.688 0.592 17919 84208 1 205 . 1 1 65 65 SER N N 65 114.730 114.730 115.165 -0.435 17919 84209 1 205 . 1 1 65 65 SER HA H 65 4.640 4.640 4.508 0.132 17919 84210 1 205 . 1 1 65 65 SER C C 65 172.160 172.160 173.971 -1.811 17919 84211 1 205 . 1 1 65 65 SER CA C 65 60.890 60.890 60.514 0.376 17919 84212 1 205 . 1 1 65 65 SER CB C 65 64.910 64.910 64.302 0.608 17919 84213 1 205 . 1 1 65 65 SER H H 65 7.670 7.670 7.333 0.337 17919 84214 1 205 . 1 1 66 66 THR N N 66 117.110 117.110 119.744 -2.634 17919 84215 1 205 . 1 1 66 66 THR HA H 66 5.270 5.270 5.303 -0.033 17919 84216 1 205 . 1 1 66 66 THR C C 66 173.950 173.950 173.975 -0.025 17919 84217 1 205 . 1 1 66 66 THR CA C 66 62.340 62.340 61.446 0.894 17919 84218 1 205 . 1 1 66 66 THR CB C 66 70.080 70.080 71.164 -1.084 17919 84219 1 205 . 1 1 66 66 THR H H 66 8.730 8.730 8.564 0.166 17919 84220 1 205 . 1 1 67 67 LEU N N 67 127.110 127.110 127.033 0.077 17919 84221 1 205 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.880 0.180 17919 84222 1 205 . 1 1 67 67 LEU C C 67 175.770 175.770 175.442 0.328 17919 84223 1 205 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.931 -0.031 17919 84224 1 205 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.422 -0.162 17919 84225 1 205 . 1 1 67 67 LEU H H 67 9.410 9.410 8.713 0.697 17919 84226 1 205 . 1 1 68 68 HIS N N 68 118.380 118.380 119.422 -1.042 17919 84227 1 205 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.266 -0.026 17919 84228 1 205 . 1 1 68 68 HIS C C 68 173.150 173.150 174.211 -1.061 17919 84229 1 205 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.487 0.513 17919 84230 1 205 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.818 -2.288 17919 84231 1 205 . 1 1 68 68 HIS H H 68 9.230 9.230 8.850 0.380 17919 84232 1 205 . 1 1 69 69 LEU N N 69 124.460 124.460 127.583 -3.123 17919 84233 1 205 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.861 0.329 17919 84234 1 205 . 1 1 69 69 LEU C C 69 175.270 175.270 174.577 0.693 17919 84235 1 205 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.412 -0.522 17919 84236 1 205 . 1 1 69 69 LEU CB C 69 44.380 44.380 43.413 0.967 17919 84237 1 205 . 1 1 69 69 LEU H H 69 8.340 8.340 8.540 -0.200 17919 84238 1 205 . 1 1 70 70 VAL N N 70 126.940 126.940 124.517 2.423 17919 84239 1 205 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.401 -0.051 17919 84240 1 205 . 1 1 70 70 VAL C C 70 174.000 174.000 174.458 -0.458 17919 84241 1 205 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.674 0.126 17919 84242 1 205 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.747 -0.837 17919 84243 1 205 . 1 1 70 70 VAL H H 70 9.200 9.200 8.253 0.947 17919 84244 1 205 . 1 1 71 71 LEU N N 71 123.130 123.130 124.744 -1.614 17919 84245 1 205 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.374 -0.314 17919 84246 1 205 . 1 1 71 71 LEU C C 71 177.830 177.830 176.830 1.000 17919 84247 1 205 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.235 0.705 17919 84248 1 205 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.879 -1.029 17919 84249 1 205 . 1 1 71 71 LEU H H 71 8.120 8.120 8.376 -0.256 17919 84250 1 205 . 1 1 72 72 ARG N N 72 123.490 123.490 121.695 1.795 17919 84251 1 205 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.630 -0.329 17919 84252 1 205 . 1 1 72 72 ARG C C 72 175.350 175.350 177.010 -1.660 17919 84253 1 205 . 1 1 72 72 ARG CA C 72 55.610 55.610 53.737 1.873 17919 84254 1 205 . 1 1 72 72 ARG CB C 72 31.350 31.350 32.378 -1.028 17919 84255 1 205 . 1 1 72 72 ARG H H 72 8.580 8.580 8.318 0.262 17919 84256 1 206 . 1 1 2 2 GLN N N 2 123.220 123.220 119.446 3.774 17919 84257 1 206 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.359 -0.110 17919 84258 1 206 . 1 1 2 2 GLN C C 2 175.920 175.920 175.949 -0.029 17919 84259 1 206 . 1 1 2 2 GLN CA C 2 55.080 55.080 55.203 -0.123 17919 84260 1 206 . 1 1 2 2 GLN CB C 2 30.760 30.760 29.854 0.906 17919 84261 1 206 . 1 1 2 2 GLN H H 2 8.900 8.900 8.322 0.578 17919 84262 1 206 . 1 1 3 3 ILE N N 3 115.340 115.340 116.001 -0.661 17919 84263 1 206 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.783 -0.570 17919 84264 1 206 . 1 1 3 3 ILE C C 3 172.450 172.450 173.694 -1.244 17919 84265 1 206 . 1 1 3 3 ILE CA C 3 59.570 59.570 58.898 0.672 17919 84266 1 206 . 1 1 3 3 ILE CB C 3 42.210 42.210 42.066 0.144 17919 84267 1 206 . 1 1 3 3 ILE H H 3 8.320 8.320 8.239 0.081 17919 84268 1 206 . 1 1 4 4 PHE N N 4 118.110 118.110 119.810 -1.700 17919 84269 1 206 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.417 0.213 17919 84270 1 206 . 1 1 4 4 PHE C C 4 175.320 175.320 175.165 0.155 17919 84271 1 206 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.201 0.009 17919 84272 1 206 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.513 -0.033 17919 84273 1 206 . 1 1 4 4 PHE H H 4 8.610 8.610 8.496 0.114 17919 84274 1 206 . 1 1 5 5 VAL N N 5 121.000 121.000 122.271 -1.271 17919 84275 1 206 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.733 -0.008 17919 84276 1 206 . 1 1 5 5 VAL C C 5 174.870 174.870 175.163 -0.293 17919 84277 1 206 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.047 -0.427 17919 84278 1 206 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.763 0.467 17919 84279 1 206 . 1 1 5 5 VAL H H 5 9.300 9.300 9.287 0.013 17919 84280 1 206 . 1 1 6 6 LYS N N 6 127.520 127.520 128.944 -1.424 17919 84281 1 206 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.209 0.158 17919 84282 1 206 . 1 1 6 6 LYS C C 6 177.140 177.140 176.403 0.737 17919 84283 1 206 . 1 1 6 6 LYS CA C 6 54.520 54.520 55.500 -0.980 17919 84284 1 206 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.240 0.810 17919 84285 1 206 . 1 1 6 6 LYS H H 6 8.820 8.820 8.995 -0.175 17919 84286 1 206 . 1 1 7 7 THR N N 7 115.400 115.400 116.660 -1.260 17919 84287 1 206 . 1 1 7 7 THR HA H 7 4.970 4.970 4.633 0.337 17919 84288 1 206 . 1 1 7 7 THR C C 7 176.910 176.910 175.407 1.503 17919 84289 1 206 . 1 1 7 7 THR CA C 7 60.470 60.470 59.530 0.940 17919 84290 1 206 . 1 1 7 7 THR CB C 7 70.630 70.630 71.099 -0.469 17919 84291 1 206 . 1 1 7 7 THR H H 7 8.730 8.730 8.616 0.114 17919 84292 1 206 . 1 1 8 8 LEU N N 8 121.330 121.330 121.570 -0.240 17919 84293 1 206 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.295 0.015 17919 84294 1 206 . 1 1 8 8 LEU C C 8 178.800 178.800 178.045 0.755 17919 84295 1 206 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.355 0.225 17919 84296 1 206 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.177 -0.207 17919 84297 1 206 . 1 1 8 8 LEU H H 8 9.100 9.100 8.766 0.334 17919 84298 1 206 . 1 1 9 9 THR N N 9 105.590 105.590 107.987 -2.397 17919 84299 1 206 . 1 1 9 9 THR HA H 9 4.428 4.428 4.145 0.283 17919 84300 1 206 . 1 1 9 9 THR C C 9 175.520 175.520 175.772 -0.252 17919 84301 1 206 . 1 1 9 9 THR CA C 9 61.400 61.400 62.896 -1.496 17919 84302 1 206 . 1 1 9 9 THR CB C 9 69.140 69.140 68.443 0.697 17919 84303 1 206 . 1 1 9 9 THR H H 9 7.630 7.630 7.770 -0.140 17919 84304 1 206 . 1 1 10 10 GLY N N 10 108.890 108.890 108.903 -0.013 17919 84305 1 206 . 1 1 10 10 GLY C C 10 174.070 174.070 174.086 -0.016 17919 84306 1 206 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.906 0.554 17919 84307 1 206 . 1 1 10 10 GLY H H 10 7.810 7.810 7.909 -0.099 17919 84308 1 206 . 1 1 11 11 LYS N N 11 121.600 121.600 121.406 0.194 17919 84309 1 206 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.424 -0.063 17919 84310 1 206 . 1 1 11 11 LYS C C 11 175.940 175.940 175.297 0.643 17919 84311 1 206 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.037 0.243 17919 84312 1 206 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.358 -0.158 17919 84313 1 206 . 1 1 11 11 LYS H H 11 7.280 7.280 7.641 -0.361 17919 84314 1 206 . 1 1 12 12 THR N N 12 120.440 120.440 113.561 6.879 17919 84315 1 206 . 1 1 12 12 THR HA H 12 5.046 5.046 5.390 -0.344 17919 84316 1 206 . 1 1 12 12 THR C C 12 174.320 174.320 174.446 -0.126 17919 84317 1 206 . 1 1 12 12 THR CA C 12 62.390 62.390 60.652 1.738 17919 84318 1 206 . 1 1 12 12 THR CB C 12 69.910 69.910 70.049 -0.139 17919 84319 1 206 . 1 1 12 12 THR H H 12 8.650 8.650 8.179 0.471 17919 84320 1 206 . 1 1 13 13 ILE N N 13 127.110 127.110 120.460 6.650 17919 84321 1 206 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.690 -0.146 17919 84322 1 206 . 1 1 13 13 ILE C C 13 175.220 175.220 174.873 0.347 17919 84323 1 206 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.602 0.378 17919 84324 1 206 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.516 -0.566 17919 84325 1 206 . 1 1 13 13 ILE H H 13 9.450 9.450 9.025 0.425 17919 84326 1 206 . 1 1 14 14 THR N N 14 121.520 121.520 123.026 -1.506 17919 84327 1 206 . 1 1 14 14 THR HA H 14 4.964 4.964 5.026 -0.062 17919 84328 1 206 . 1 1 14 14 THR C C 14 173.790 173.790 173.625 0.165 17919 84329 1 206 . 1 1 14 14 THR CA C 14 61.940 61.940 62.749 -0.809 17919 84330 1 206 . 1 1 14 14 THR CB C 14 69.650 69.650 69.605 0.045 17919 84331 1 206 . 1 1 14 14 THR H H 14 8.710 8.710 8.590 0.120 17919 84332 1 206 . 1 1 15 15 LEU N N 15 124.800 124.800 125.007 -0.207 17919 84333 1 206 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.727 0.053 17919 84334 1 206 . 1 1 15 15 LEU C C 15 174.670 174.670 174.697 -0.027 17919 84335 1 206 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.646 -0.816 17919 84336 1 206 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.378 1.692 17919 84337 1 206 . 1 1 15 15 LEU H H 15 8.710 8.710 8.529 0.181 17919 84338 1 206 . 1 1 16 16 GLU N N 16 122.160 122.160 123.946 -1.786 17919 84339 1 206 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.994 -0.077 17919 84340 1 206 . 1 1 16 16 GLU C C 16 175.860 175.860 175.673 0.187 17919 84341 1 206 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.357 -0.537 17919 84342 1 206 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.539 -1.089 17919 84343 1 206 . 1 1 16 16 GLU H H 16 8.140 8.140 8.496 -0.356 17919 84344 1 206 . 1 1 17 17 VAL N N 17 117.210 117.210 119.197 -1.987 17919 84345 1 206 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.798 -0.084 17919 84346 1 206 . 1 1 17 17 VAL C C 17 174.160 174.160 174.727 -0.567 17919 84347 1 206 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.654 -1.224 17919 84348 1 206 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.197 1.203 17919 84349 1 206 . 1 1 17 17 VAL H H 17 8.900 8.900 8.607 0.293 17919 84350 1 206 . 1 1 18 18 GLU N N 18 118.990 118.990 121.798 -2.808 17919 84351 1 206 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.896 0.183 17919 84352 1 206 . 1 1 18 18 GLU C C 18 176.160 176.160 175.644 0.516 17919 84353 1 206 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.986 -0.266 17919 84354 1 206 . 1 1 18 18 GLU CB C 18 30.310 30.310 31.519 -1.209 17919 84355 1 206 . 1 1 18 18 GLU H H 18 8.640 8.640 9.411 -0.771 17919 84356 1 206 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.217 -0.076 17919 84357 1 206 . 1 1 19 19 PRO C C 19 175.310 175.310 178.126 -2.816 17919 84358 1 206 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.675 -0.205 17919 84359 1 206 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.743 0.207 17919 84360 1 206 . 1 1 20 20 SER N N 20 103.400 103.400 109.998 -6.598 17919 84361 1 206 . 1 1 20 20 SER HA H 20 4.370 4.370 4.151 0.219 17919 84362 1 206 . 1 1 20 20 SER C C 20 174.660 174.660 174.702 -0.042 17919 84363 1 206 . 1 1 20 20 SER CA C 20 57.400 57.400 59.724 -2.325 17919 84364 1 206 . 1 1 20 20 SER CB C 20 63.370 63.370 62.536 0.834 17919 84365 1 206 . 1 1 20 20 SER H H 20 7.040 7.040 8.152 -1.112 17919 84366 1 206 . 1 1 21 21 ASP N N 21 123.480 123.480 123.354 0.126 17919 84367 1 206 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.677 0.018 17919 84368 1 206 . 1 1 21 21 ASP C C 21 176.360 176.360 176.467 -0.107 17919 84369 1 206 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.743 0.957 17919 84370 1 206 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.803 -1.003 17919 84371 1 206 . 1 1 21 21 ASP H H 21 8.030 8.030 8.088 -0.058 17919 84372 1 206 . 1 1 22 22 THR N N 22 108.800 108.800 110.993 -2.193 17919 84373 1 206 . 1 1 22 22 THR HA H 22 4.920 4.920 4.857 0.063 17919 84374 1 206 . 1 1 22 22 THR C C 22 176.750 176.750 175.776 0.974 17919 84375 1 206 . 1 1 22 22 THR CA C 22 59.690 59.690 61.082 -1.392 17919 84376 1 206 . 1 1 22 22 THR CB C 22 71.200 71.200 71.159 0.041 17919 84377 1 206 . 1 1 22 22 THR H H 22 7.900 7.900 8.263 -0.363 17919 84378 1 206 . 1 1 23 23 ILE N N 23 121.190 121.190 121.824 -0.634 17919 84379 1 206 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.999 -0.342 17919 84380 1 206 . 1 1 23 23 ILE C C 23 179.040 179.040 177.868 1.172 17919 84381 1 206 . 1 1 23 23 ILE CA C 23 62.260 62.260 61.907 0.353 17919 84382 1 206 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.586 -2.236 17919 84383 1 206 . 1 1 23 23 ILE H H 23 8.560 8.560 8.687 -0.127 17919 84384 1 206 . 1 1 24 24 GLU N N 24 120.830 120.830 121.260 -0.430 17919 84385 1 206 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.839 0.078 17919 84386 1 206 . 1 1 24 24 GLU C C 24 178.640 178.640 178.307 0.333 17919 84387 1 206 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.212 0.008 17919 84388 1 206 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.438 -1.157 17919 84389 1 206 . 1 1 24 24 GLU H H 24 9.760 9.760 8.194 1.566 17919 84390 1 206 . 1 1 25 25 ASN N N 25 120.570 120.570 117.980 2.590 17919 84391 1 206 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.469 0.056 17919 84392 1 206 . 1 1 25 25 ASN C C 25 178.380 178.380 178.019 0.361 17919 84393 1 206 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.113 -0.053 17919 84394 1 206 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.757 -0.307 17919 84395 1 206 . 1 1 25 25 ASN H H 25 7.920 7.920 7.556 0.364 17919 84396 1 206 . 1 1 26 26 VAL N N 26 121.710 121.710 119.981 1.729 17919 84397 1 206 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.595 -0.198 17919 84398 1 206 . 1 1 26 26 VAL C C 26 177.950 177.950 177.800 0.150 17919 84399 1 206 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.321 1.339 17919 84400 1 206 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.521 -0.681 17919 84401 1 206 . 1 1 26 26 VAL H H 26 8.070 8.070 8.287 -0.217 17919 84402 1 206 . 1 1 27 27 LYS N N 27 118.860 118.860 120.083 -1.223 17919 84403 1 206 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.206 0.374 17919 84404 1 206 . 1 1 27 27 LYS C C 27 180.550 180.550 178.697 1.853 17919 84405 1 206 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.705 -0.455 17919 84406 1 206 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.326 1.404 17919 84407 1 206 . 1 1 27 27 LYS H H 27 8.560 8.560 8.231 0.329 17919 84408 1 206 . 1 1 28 28 ALA N N 28 123.440 123.440 121.059 2.381 17919 84409 1 206 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.259 -0.099 17919 84410 1 206 . 1 1 28 28 ALA C C 28 180.300 180.300 179.227 1.073 17919 84411 1 206 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.609 0.761 17919 84412 1 206 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.431 -0.721 17919 84413 1 206 . 1 1 28 28 ALA H H 28 8.060 8.060 7.741 0.319 17919 84414 1 206 . 1 1 29 29 LYS N N 29 119.940 119.940 118.599 1.341 17919 84415 1 206 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.222 -0.015 17919 84416 1 206 . 1 1 29 29 LYS C C 29 180.320 180.320 178.726 1.594 17919 84417 1 206 . 1 1 29 29 LYS CA C 29 59.650 59.650 57.714 1.936 17919 84418 1 206 . 1 1 29 29 LYS CB C 29 33.290 33.290 31.864 1.426 17919 84419 1 206 . 1 1 29 29 LYS H H 29 7.850 7.850 7.679 0.171 17919 84420 1 206 . 1 1 30 30 ILE N N 30 121.080 121.080 121.248 -0.168 17919 84421 1 206 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.752 -0.245 17919 84422 1 206 . 1 1 30 30 ILE C C 30 178.310 178.310 177.456 0.854 17919 84423 1 206 . 1 1 30 30 ILE CA C 30 66.150 66.150 63.468 2.683 17919 84424 1 206 . 1 1 30 30 ILE CB C 30 36.800 36.800 36.481 0.319 17919 84425 1 206 . 1 1 30 30 ILE H H 30 8.280 8.280 8.208 0.072 17919 84426 1 206 . 1 1 31 31 GLN N N 31 123.490 123.490 121.142 2.348 17919 84427 1 206 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.072 -0.242 17919 84428 1 206 . 1 1 31 31 GLN C C 31 178.890 178.890 178.559 0.331 17919 84429 1 206 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.276 0.723 17919 84430 1 206 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.496 -0.776 17919 84431 1 206 . 1 1 31 31 GLN H H 31 8.580 8.580 8.540 0.040 17919 84432 1 206 . 1 1 32 32 ASP N N 32 119.360 119.360 118.809 0.551 17919 84433 1 206 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.389 -0.035 17919 84434 1 206 . 1 1 32 32 ASP C C 32 177.250 177.250 177.943 -0.693 17919 84435 1 206 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.761 0.429 17919 84436 1 206 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.810 -0.230 17919 84437 1 206 . 1 1 32 32 ASP H H 32 8.010 8.010 8.049 -0.039 17919 84438 1 206 . 1 1 33 33 LYS N N 33 115.130 115.130 118.377 -3.247 17919 84439 1 206 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.303 0.034 17919 84440 1 206 . 1 1 33 33 LYS C C 33 177.870 177.870 178.152 -0.282 17919 84441 1 206 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.960 0.090 17919 84442 1 206 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.268 0.902 17919 84443 1 206 . 1 1 33 33 LYS H H 33 7.430 7.430 7.576 -0.146 17919 84444 1 206 . 1 1 34 34 GLU N N 34 113.870 113.870 115.240 -1.370 17919 84445 1 206 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.507 0.118 17919 84446 1 206 . 1 1 34 34 GLU C C 34 177.840 177.840 177.202 0.638 17919 84447 1 206 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.443 -1.273 17919 84448 1 206 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.443 1.217 17919 84449 1 206 . 1 1 34 34 GLU H H 34 8.740 8.740 8.337 0.403 17919 84450 1 206 . 1 1 35 35 GLY N N 35 108.650 108.650 109.640 -0.990 17919 84451 1 206 . 1 1 35 35 GLY C C 35 173.960 173.960 174.214 -0.254 17919 84452 1 206 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.396 0.684 17919 84453 1 206 . 1 1 35 35 GLY H H 35 8.530 8.530 8.120 0.410 17919 84454 1 206 . 1 1 36 36 ILE N N 36 119.880 119.880 116.960 2.920 17919 84455 1 206 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.686 -0.241 17919 84456 1 206 . 1 1 36 36 ILE C C 36 173.590 173.590 173.884 -0.294 17919 84457 1 206 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.304 0.446 17919 84458 1 206 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.944 1.636 17919 84459 1 206 . 1 1 36 36 ILE H H 36 6.150 6.150 7.539 -1.389 17919 84460 1 206 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.609 0.025 17919 84461 1 206 . 1 1 37 37 PRO C C 37 176.940 176.940 176.558 0.382 17919 84462 1 206 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.760 -0.100 17919 84463 1 206 . 1 1 37 37 PRO CB C 37 31.850 31.850 30.724 1.125 17919 84464 1 206 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.227 -0.110 17919 84465 1 206 . 1 1 38 38 PRO C C 38 178.320 178.320 178.313 0.007 17919 84466 1 206 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.535 0.725 17919 84467 1 206 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.739 1.151 17919 84468 1 206 . 1 1 39 39 ASP N N 39 113.380 113.380 118.027 -4.647 17919 84469 1 206 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.431 -0.001 17919 84470 1 206 . 1 1 39 39 ASP C C 39 177.090 177.090 177.588 -0.498 17919 84471 1 206 . 1 1 39 39 ASP CA C 39 55.640 55.640 57.024 -1.384 17919 84472 1 206 . 1 1 39 39 ASP CB C 39 39.540 39.540 39.760 -0.220 17919 84473 1 206 . 1 1 39 39 ASP H H 39 8.550 8.550 8.662 -0.112 17919 84474 1 206 . 1 1 40 40 GLN N N 40 116.780 116.780 116.167 0.613 17919 84475 1 206 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.279 0.185 17919 84476 1 206 . 1 1 40 40 GLN C C 40 175.380 175.380 175.722 -0.342 17919 84477 1 206 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.872 -0.232 17919 84478 1 206 . 1 1 40 40 GLN CB C 40 30.140 30.140 28.885 1.255 17919 84479 1 206 . 1 1 40 40 GLN H H 40 7.820 7.820 7.894 -0.074 17919 84480 1 206 . 1 1 41 41 GLN N N 41 117.720 117.720 119.010 -1.290 17919 84481 1 206 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.854 -0.610 17919 84482 1 206 . 1 1 41 41 GLN C C 41 176.300 176.300 175.302 0.998 17919 84483 1 206 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.453 1.016 17919 84484 1 206 . 1 1 41 41 GLN CB C 41 31.650 31.650 30.759 0.891 17919 84485 1 206 . 1 1 41 41 GLN H H 41 7.480 7.480 7.763 -0.283 17919 84486 1 206 . 1 1 42 42 ARG N N 42 122.680 122.680 122.308 0.372 17919 84487 1 206 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.677 -0.177 17919 84488 1 206 . 1 1 42 42 ARG C C 42 174.050 174.050 174.347 -0.297 17919 84489 1 206 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.198 -0.148 17919 84490 1 206 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.202 -1.452 17919 84491 1 206 . 1 1 42 42 ARG H H 42 8.530 8.530 9.056 -0.526 17919 84492 1 206 . 1 1 43 43 LEU N N 43 124.040 124.040 124.875 -0.835 17919 84493 1 206 . 1 1 43 43 LEU C C 43 175.290 175.290 175.932 -0.642 17919 84494 1 206 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.607 -1.627 17919 84495 1 206 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.122 1.668 17919 84496 1 206 . 1 1 43 43 LEU H H 43 8.820 8.820 8.873 -0.053 17919 84497 1 206 . 1 1 44 44 ILE N N 44 121.920 121.920 122.149 -0.229 17919 84498 1 206 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.123 -0.131 17919 84499 1 206 . 1 1 44 44 ILE C C 44 176.060 176.060 174.124 1.936 17919 84500 1 206 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.560 -1.580 17919 84501 1 206 . 1 1 44 44 ILE CB C 44 41.420 41.420 42.196 -0.776 17919 84502 1 206 . 1 1 44 44 ILE H H 44 9.030 9.030 8.943 0.087 17919 84503 1 206 . 1 1 45 45 PHE N N 45 125.390 125.390 127.183 -1.793 17919 84504 1 206 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.066 -0.021 17919 84505 1 206 . 1 1 45 45 PHE C C 45 174.470 174.470 174.647 -0.177 17919 84506 1 206 . 1 1 45 45 PHE CA C 45 57.020 57.020 55.961 1.059 17919 84507 1 206 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.953 0.806 17919 84508 1 206 . 1 1 45 45 PHE H H 45 8.830 8.830 8.921 -0.091 17919 84509 1 206 . 1 1 46 46 ALA N N 46 132.200 132.200 128.204 3.996 17919 84510 1 206 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.592 0.098 17919 84511 1 206 . 1 1 46 46 ALA C C 46 177.290 177.290 177.913 -0.623 17919 84512 1 206 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.583 -0.042 17919 84513 1 206 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.839 -0.269 17919 84514 1 206 . 1 1 46 46 ALA H H 46 8.810 8.810 8.664 0.146 17919 84515 1 206 . 1 1 47 47 GLY N N 47 102.340 102.340 102.575 -0.235 17919 84516 1 206 . 1 1 47 47 GLY C C 47 173.810 173.810 174.421 -0.611 17919 84517 1 206 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.974 0.376 17919 84518 1 206 . 1 1 47 47 GLY H H 47 8.130 8.130 8.425 -0.295 17919 84519 1 206 . 1 1 48 48 LYS N N 48 121.570 121.570 121.434 0.136 17919 84520 1 206 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.606 0.016 17919 84521 1 206 . 1 1 48 48 LYS C C 48 174.700 174.700 175.493 -0.793 17919 84522 1 206 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.904 -0.354 17919 84523 1 206 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.395 0.135 17919 84524 1 206 . 1 1 48 48 LYS H H 48 7.980 7.980 7.770 0.210 17919 84525 1 206 . 1 1 49 49 GLN N N 49 122.410 122.410 122.750 -0.340 17919 84526 1 206 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.542 0.018 17919 84527 1 206 . 1 1 49 49 GLN C C 49 175.670 175.670 175.974 -0.304 17919 84528 1 206 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.954 -0.214 17919 84529 1 206 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.070 -0.070 17919 84530 1 206 . 1 1 49 49 GLN H H 49 8.600 8.600 8.507 0.093 17919 84531 1 206 . 1 1 50 50 LEU N N 50 125.520 125.520 127.270 -1.750 17919 84532 1 206 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.050 0.040 17919 84533 1 206 . 1 1 50 50 LEU C C 50 176.660 176.660 175.957 0.703 17919 84534 1 206 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.082 0.158 17919 84535 1 206 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.068 -0.498 17919 84536 1 206 . 1 1 50 50 LEU H H 50 8.530 8.530 8.387 0.143 17919 84537 1 206 . 1 1 51 51 GLU N N 51 122.940 122.940 123.066 -0.126 17919 84538 1 206 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.488 -0.000 17919 84539 1 206 . 1 1 51 51 GLU C C 51 175.870 175.870 176.922 -1.052 17919 84540 1 206 . 1 1 51 51 GLU CA C 51 55.960 55.960 54.959 1.001 17919 84541 1 206 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.268 -0.698 17919 84542 1 206 . 1 1 51 51 GLU H H 51 8.400 8.400 8.092 0.308 17919 84543 1 206 . 1 1 52 52 ASP N N 52 120.030 120.030 127.069 -7.039 17919 84544 1 206 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.484 -0.125 17919 84545 1 206 . 1 1 52 52 ASP C C 52 177.330 177.330 177.751 -0.421 17919 84546 1 206 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.253 -0.293 17919 84547 1 206 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.787 0.063 17919 84548 1 206 . 1 1 52 52 ASP H H 52 8.160 8.160 8.805 -0.645 17919 84549 1 206 . 1 1 53 53 GLY N N 53 106.660 106.660 106.830 -0.170 17919 84550 1 206 . 1 1 53 53 GLY C C 53 174.870 174.870 174.189 0.681 17919 84551 1 206 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.090 0.080 17919 84552 1 206 . 1 1 53 53 GLY H H 53 9.390 9.390 8.603 0.787 17919 84553 1 206 . 1 1 54 54 ARG N N 54 119.050 119.050 120.556 -1.506 17919 84554 1 206 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.755 -0.060 17919 84555 1 206 . 1 1 54 54 ARG C C 54 175.350 175.350 175.411 -0.061 17919 84556 1 206 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.121 0.269 17919 84557 1 206 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.033 -0.383 17919 84558 1 206 . 1 1 54 54 ARG H H 54 7.460 7.460 7.444 0.016 17919 84559 1 206 . 1 1 55 55 THR N N 55 108.400 108.400 112.947 -4.547 17919 84560 1 206 . 1 1 55 55 THR HA H 55 5.240 5.240 5.094 0.146 17919 84561 1 206 . 1 1 55 55 THR C C 55 176.560 176.560 176.001 0.559 17919 84562 1 206 . 1 1 55 55 THR CA C 55 59.690 59.690 60.457 -0.767 17919 84563 1 206 . 1 1 55 55 THR CB C 55 72.260 72.260 70.889 1.371 17919 84564 1 206 . 1 1 55 55 THR H H 55 8.730 8.730 8.838 -0.108 17919 84565 1 206 . 1 1 56 56 LEU N N 56 117.920 117.920 123.522 -5.602 17919 84566 1 206 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.935 0.125 17919 84567 1 206 . 1 1 56 56 LEU C C 56 180.810 180.810 179.064 1.746 17919 84568 1 206 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.995 -0.285 17919 84569 1 206 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.145 -0.775 17919 84570 1 206 . 1 1 56 56 LEU H H 56 8.140 8.140 8.777 -0.637 17919 84571 1 206 . 1 1 57 57 SER N N 57 113.330 113.330 114.229 -0.899 17919 84572 1 206 . 1 1 57 57 SER HA H 57 4.370 4.370 4.024 0.346 17919 84573 1 206 . 1 1 57 57 SER C C 57 178.310 178.310 176.989 1.321 17919 84574 1 206 . 1 1 57 57 SER CA C 57 61.080 61.080 61.727 -0.647 17919 84575 1 206 . 1 1 57 57 SER CB C 57 62.530 62.530 62.706 -0.176 17919 84576 1 206 . 1 1 57 57 SER H H 57 8.470 8.470 8.055 0.415 17919 84577 1 206 . 1 1 58 58 ASP N N 58 124.190 124.190 122.115 2.075 17919 84578 1 206 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.311 -0.015 17919 84579 1 206 . 1 1 58 58 ASP C C 58 177.400 177.400 177.724 -0.324 17919 84580 1 206 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.709 0.471 17919 84581 1 206 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.423 -0.323 17919 84582 1 206 . 1 1 58 58 ASP H H 58 7.930 7.930 7.734 0.196 17919 84583 1 206 . 1 1 59 59 TYR N N 59 115.510 115.510 116.001 -0.491 17919 84584 1 206 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.646 0.024 17919 84585 1 206 . 1 1 59 59 TYR C C 59 174.700 174.700 174.493 0.207 17919 84586 1 206 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.272 0.978 17919 84587 1 206 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.294 1.776 17919 84588 1 206 . 1 1 59 59 TYR H H 59 7.250 7.250 7.354 -0.104 17919 84589 1 206 . 1 1 60 60 ASN N N 60 115.900 115.900 114.323 1.577 17919 84590 1 206 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.341 0.014 17919 84591 1 206 . 1 1 60 60 ASN C C 60 174.340 174.340 174.805 -0.465 17919 84592 1 206 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.088 0.032 17919 84593 1 206 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.066 0.344 17919 84594 1 206 . 1 1 60 60 ASN H H 60 8.150 8.150 7.902 0.248 17919 84595 1 206 . 1 1 61 61 ILE N N 61 118.600 118.600 118.238 0.362 17919 84596 1 206 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.648 -0.255 17919 84597 1 206 . 1 1 61 61 ILE C C 61 174.610 174.610 176.096 -1.486 17919 84598 1 206 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.936 0.484 17919 84599 1 206 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.419 -0.679 17919 84600 1 206 . 1 1 61 61 ILE H H 61 7.250 7.250 7.555 -0.305 17919 84601 1 206 . 1 1 62 62 GLN N N 62 124.740 124.740 125.019 -0.279 17919 84602 1 206 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.629 -0.123 17919 84603 1 206 . 1 1 62 62 GLN C C 62 175.970 175.970 175.714 0.256 17919 84604 1 206 . 1 1 62 62 GLN CA C 62 53.660 53.660 54.201 -0.541 17919 84605 1 206 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.659 -0.009 17919 84606 1 206 . 1 1 62 62 GLN H H 62 7.610 7.610 7.873 -0.263 17919 84607 1 206 . 1 1 63 63 LYS N N 63 120.300 120.300 122.397 -2.097 17919 84608 1 206 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.039 -0.038 17919 84609 1 206 . 1 1 63 63 LYS C C 63 175.810 175.810 176.747 -0.937 17919 84610 1 206 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.367 0.423 17919 84611 1 206 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.194 0.457 17919 84612 1 206 . 1 1 63 63 LYS H H 63 8.490 8.490 8.668 -0.178 17919 84613 1 206 . 1 1 64 64 GLU N N 64 113.950 113.950 117.797 -3.847 17919 84614 1 206 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.511 -0.046 17919 84615 1 206 . 1 1 64 64 GLU C C 64 175.250 175.250 175.651 -0.401 17919 84616 1 206 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.975 -0.085 17919 84617 1 206 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.957 -3.057 17919 84618 1 206 . 1 1 64 64 GLU H H 64 9.280 9.280 9.079 0.201 17919 84619 1 206 . 1 1 65 65 SER N N 65 114.730 114.730 115.468 -0.738 17919 84620 1 206 . 1 1 65 65 SER HA H 65 4.640 4.640 4.419 0.221 17919 84621 1 206 . 1 1 65 65 SER C C 65 172.160 172.160 173.965 -1.805 17919 84622 1 206 . 1 1 65 65 SER CA C 65 60.890 60.890 60.398 0.492 17919 84623 1 206 . 1 1 65 65 SER CB C 65 64.910 64.910 63.891 1.019 17919 84624 1 206 . 1 1 65 65 SER H H 65 7.670 7.670 7.629 0.041 17919 84625 1 206 . 1 1 66 66 THR N N 66 117.110 117.110 118.810 -1.700 17919 84626 1 206 . 1 1 66 66 THR HA H 66 5.270 5.270 5.269 0.001 17919 84627 1 206 . 1 1 66 66 THR C C 66 173.950 173.950 174.025 -0.075 17919 84628 1 206 . 1 1 66 66 THR CA C 66 62.340 62.340 62.200 0.140 17919 84629 1 206 . 1 1 66 66 THR CB C 66 70.080 70.080 69.951 0.129 17919 84630 1 206 . 1 1 66 66 THR H H 66 8.730 8.730 8.535 0.195 17919 84631 1 206 . 1 1 67 67 LEU N N 67 127.110 127.110 126.988 0.122 17919 84632 1 206 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.903 0.157 17919 84633 1 206 . 1 1 67 67 LEU C C 67 175.770 175.770 175.409 0.361 17919 84634 1 206 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.840 0.060 17919 84635 1 206 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.608 -0.348 17919 84636 1 206 . 1 1 67 67 LEU H H 67 9.410 9.410 9.244 0.166 17919 84637 1 206 . 1 1 68 68 HIS N N 68 118.380 118.380 121.775 -3.395 17919 84638 1 206 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.036 0.204 17919 84639 1 206 . 1 1 68 68 HIS C C 68 173.150 173.150 173.607 -0.457 17919 84640 1 206 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.701 0.299 17919 84641 1 206 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.654 -2.124 17919 84642 1 206 . 1 1 68 68 HIS H H 68 9.230 9.230 8.904 0.326 17919 84643 1 206 . 1 1 69 69 LEU N N 69 124.460 124.460 129.162 -4.702 17919 84644 1 206 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.973 0.217 17919 84645 1 206 . 1 1 69 69 LEU C C 69 175.270 175.270 175.106 0.164 17919 84646 1 206 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.100 -0.210 17919 84647 1 206 . 1 1 69 69 LEU CB C 69 44.380 44.380 43.428 0.952 17919 84648 1 206 . 1 1 69 69 LEU H H 69 8.340 8.340 7.784 0.556 17919 84649 1 206 . 1 1 70 70 VAL N N 70 126.940 126.940 127.461 -0.521 17919 84650 1 206 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.413 -0.063 17919 84651 1 206 . 1 1 70 70 VAL C C 70 174.000 174.000 174.188 -0.188 17919 84652 1 206 . 1 1 70 70 VAL CA C 70 60.800 60.800 61.090 -0.290 17919 84653 1 206 . 1 1 70 70 VAL CB C 70 34.910 34.910 34.840 0.070 17919 84654 1 206 . 1 1 70 70 VAL H H 70 9.200 9.200 9.243 -0.043 17919 84655 1 206 . 1 1 71 71 LEU N N 71 123.130 123.130 125.357 -2.227 17919 84656 1 206 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.190 -0.130 17919 84657 1 206 . 1 1 71 71 LEU C C 71 177.830 177.830 176.659 1.171 17919 84658 1 206 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.164 0.776 17919 84659 1 206 . 1 1 71 71 LEU CB C 71 42.850 42.850 44.851 -2.001 17919 84660 1 206 . 1 1 71 71 LEU H H 71 8.120 8.120 8.476 -0.356 17919 84661 1 206 . 1 1 72 72 ARG N N 72 123.490 123.490 123.699 -0.209 17919 84662 1 206 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.485 -0.184 17919 84663 1 206 . 1 1 72 72 ARG C C 72 175.350 175.350 174.863 0.487 17919 84664 1 206 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.899 -0.289 17919 84665 1 206 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.911 0.439 17919 84666 1 206 . 1 1 72 72 ARG H H 72 8.580 8.580 8.140 0.440 17919 84667 1 207 . 1 1 2 2 GLN N N 2 123.220 123.220 121.831 1.389 17919 84668 1 207 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.227 0.022 17919 84669 1 207 . 1 1 2 2 GLN C C 2 175.920 175.920 174.841 1.079 17919 84670 1 207 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.845 0.235 17919 84671 1 207 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.366 0.394 17919 84672 1 207 . 1 1 2 2 GLN H H 2 8.900 8.900 8.749 0.151 17919 84673 1 207 . 1 1 3 3 ILE N N 3 115.340 115.340 117.967 -2.627 17919 84674 1 207 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.509 -0.296 17919 84675 1 207 . 1 1 3 3 ILE C C 3 172.450 172.450 173.400 -0.950 17919 84676 1 207 . 1 1 3 3 ILE CA C 3 59.570 59.570 58.952 0.618 17919 84677 1 207 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.810 0.400 17919 84678 1 207 . 1 1 3 3 ILE H H 3 8.320 8.320 8.824 -0.504 17919 84679 1 207 . 1 1 4 4 PHE N N 4 118.110 118.110 119.449 -1.339 17919 84680 1 207 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.546 0.084 17919 84681 1 207 . 1 1 4 4 PHE C C 4 175.320 175.320 175.385 -0.065 17919 84682 1 207 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.638 -0.428 17919 84683 1 207 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.746 -0.266 17919 84684 1 207 . 1 1 4 4 PHE H H 4 8.610 8.610 8.542 0.068 17919 84685 1 207 . 1 1 5 5 VAL N N 5 121.000 121.000 122.194 -1.194 17919 84686 1 207 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.729 -0.004 17919 84687 1 207 . 1 1 5 5 VAL C C 5 174.870 174.870 174.320 0.550 17919 84688 1 207 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.330 -0.710 17919 84689 1 207 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.518 -0.288 17919 84690 1 207 . 1 1 5 5 VAL H H 5 9.300 9.300 9.294 0.006 17919 84691 1 207 . 1 1 6 6 LYS N N 6 127.520 127.520 128.880 -1.360 17919 84692 1 207 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.241 0.126 17919 84693 1 207 . 1 1 6 6 LYS C C 6 177.140 177.140 176.000 1.140 17919 84694 1 207 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.426 0.094 17919 84695 1 207 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.882 -0.832 17919 84696 1 207 . 1 1 6 6 LYS H H 6 8.820 8.820 9.386 -0.566 17919 84697 1 207 . 1 1 7 7 THR N N 7 115.400 115.400 117.626 -2.226 17919 84698 1 207 . 1 1 7 7 THR HA H 7 4.970 4.970 4.916 0.054 17919 84699 1 207 . 1 1 7 7 THR C C 7 176.910 176.910 176.282 0.628 17919 84700 1 207 . 1 1 7 7 THR CA C 7 60.470 60.470 60.205 0.266 17919 84701 1 207 . 1 1 7 7 THR CB C 7 70.630 70.630 70.815 -0.185 17919 84702 1 207 . 1 1 7 7 THR H H 7 8.730 8.730 8.800 -0.070 17919 84703 1 207 . 1 1 8 8 LEU N N 8 121.330 121.330 123.132 -1.802 17919 84704 1 207 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.317 -0.007 17919 84705 1 207 . 1 1 8 8 LEU C C 8 178.800 178.800 177.366 1.434 17919 84706 1 207 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.155 0.425 17919 84707 1 207 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.300 -0.330 17919 84708 1 207 . 1 1 8 8 LEU H H 8 9.100 9.100 8.920 0.180 17919 84709 1 207 . 1 1 9 9 THR N N 9 105.590 105.590 107.903 -2.313 17919 84710 1 207 . 1 1 9 9 THR HA H 9 4.428 4.428 4.335 0.093 17919 84711 1 207 . 1 1 9 9 THR C C 9 175.520 175.520 175.485 0.035 17919 84712 1 207 . 1 1 9 9 THR CA C 9 61.400 61.400 61.866 -0.466 17919 84713 1 207 . 1 1 9 9 THR CB C 9 69.140 69.140 68.992 0.148 17919 84714 1 207 . 1 1 9 9 THR H H 9 7.630 7.630 7.773 -0.143 17919 84715 1 207 . 1 1 10 10 GLY N N 10 108.890 108.890 112.085 -3.195 17919 84716 1 207 . 1 1 10 10 GLY C C 10 174.070 174.070 173.819 0.251 17919 84717 1 207 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.337 0.123 17919 84718 1 207 . 1 1 10 10 GLY H H 10 7.810 7.810 7.905 -0.095 17919 84719 1 207 . 1 1 11 11 LYS N N 11 121.600 121.600 120.439 1.161 17919 84720 1 207 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.642 -0.281 17919 84721 1 207 . 1 1 11 11 LYS C C 11 175.940 175.940 175.481 0.459 17919 84722 1 207 . 1 1 11 11 LYS CA C 11 56.280 56.280 54.980 1.300 17919 84723 1 207 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.689 -0.489 17919 84724 1 207 . 1 1 11 11 LYS H H 11 7.280 7.280 7.623 -0.343 17919 84725 1 207 . 1 1 12 12 THR N N 12 120.440 120.440 116.876 3.564 17919 84726 1 207 . 1 1 12 12 THR HA H 12 5.046 5.046 5.270 -0.224 17919 84727 1 207 . 1 1 12 12 THR C C 12 174.320 174.320 174.355 -0.035 17919 84728 1 207 . 1 1 12 12 THR CA C 12 62.390 62.390 61.961 0.429 17919 84729 1 207 . 1 1 12 12 THR CB C 12 69.910 69.910 70.695 -0.785 17919 84730 1 207 . 1 1 12 12 THR H H 12 8.650 8.650 8.275 0.375 17919 84731 1 207 . 1 1 13 13 ILE N N 13 127.110 127.110 128.192 -1.082 17919 84732 1 207 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.447 0.097 17919 84733 1 207 . 1 1 13 13 ILE C C 13 175.220 175.220 175.222 -0.002 17919 84734 1 207 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.330 -0.350 17919 84735 1 207 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.722 0.228 17919 84736 1 207 . 1 1 13 13 ILE H H 13 9.450 9.450 9.286 0.164 17919 84737 1 207 . 1 1 14 14 THR N N 14 121.520 121.520 123.513 -1.993 17919 84738 1 207 . 1 1 14 14 THR HA H 14 4.964 4.964 4.915 0.049 17919 84739 1 207 . 1 1 14 14 THR C C 14 173.790 173.790 173.620 0.170 17919 84740 1 207 . 1 1 14 14 THR CA C 14 61.940 61.940 62.169 -0.229 17919 84741 1 207 . 1 1 14 14 THR CB C 14 69.650 69.650 69.691 -0.041 17919 84742 1 207 . 1 1 14 14 THR H H 14 8.710 8.710 8.661 0.049 17919 84743 1 207 . 1 1 15 15 LEU N N 15 124.800 124.800 126.466 -1.666 17919 84744 1 207 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.775 0.005 17919 84745 1 207 . 1 1 15 15 LEU C C 15 174.670 174.670 174.947 -0.277 17919 84746 1 207 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.848 -1.018 17919 84747 1 207 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.995 1.075 17919 84748 1 207 . 1 1 15 15 LEU H H 15 8.710 8.710 8.895 -0.185 17919 84749 1 207 . 1 1 16 16 GLU N N 16 122.160 122.160 122.461 -0.301 17919 84750 1 207 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.462 -0.545 17919 84751 1 207 . 1 1 16 16 GLU C C 16 175.860 175.860 175.755 0.105 17919 84752 1 207 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.190 -0.370 17919 84753 1 207 . 1 1 16 16 GLU CB C 16 29.450 29.450 31.547 -2.097 17919 84754 1 207 . 1 1 16 16 GLU H H 16 8.140 8.140 8.650 -0.510 17919 84755 1 207 . 1 1 17 17 VAL N N 17 117.210 117.210 120.185 -2.975 17919 84756 1 207 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.990 -0.276 17919 84757 1 207 . 1 1 17 17 VAL C C 17 174.160 174.160 174.170 -0.010 17919 84758 1 207 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.169 -0.739 17919 84759 1 207 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.191 1.209 17919 84760 1 207 . 1 1 17 17 VAL H H 17 8.900 8.900 8.799 0.101 17919 84761 1 207 . 1 1 18 18 GLU N N 18 118.990 118.990 120.741 -1.751 17919 84762 1 207 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.873 0.206 17919 84763 1 207 . 1 1 18 18 GLU C C 18 176.160 176.160 176.084 0.076 17919 84764 1 207 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.769 -0.049 17919 84765 1 207 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.543 -0.233 17919 84766 1 207 . 1 1 18 18 GLU H H 18 8.640 8.640 9.360 -0.720 17919 84767 1 207 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.255 -0.114 17919 84768 1 207 . 1 1 19 19 PRO C C 19 175.310 175.310 176.747 -1.437 17919 84769 1 207 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.240 0.230 17919 84770 1 207 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.998 -0.048 17919 84771 1 207 . 1 1 20 20 SER N N 20 103.400 103.400 108.818 -5.418 17919 84772 1 207 . 1 1 20 20 SER HA H 20 4.370 4.370 4.317 0.053 17919 84773 1 207 . 1 1 20 20 SER C C 20 174.660 174.660 174.279 0.381 17919 84774 1 207 . 1 1 20 20 SER CA C 20 57.400 57.400 58.018 -0.618 17919 84775 1 207 . 1 1 20 20 SER CB C 20 63.370 63.370 62.762 0.608 17919 84776 1 207 . 1 1 20 20 SER H H 20 7.040 7.040 8.197 -1.157 17919 84777 1 207 . 1 1 21 21 ASP N N 21 123.480 123.480 124.627 -1.147 17919 84778 1 207 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.704 -0.009 17919 84779 1 207 . 1 1 21 21 ASP C C 21 176.360 176.360 175.434 0.926 17919 84780 1 207 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.364 0.336 17919 84781 1 207 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.227 -0.427 17919 84782 1 207 . 1 1 21 21 ASP H H 21 8.030 8.030 7.665 0.365 17919 84783 1 207 . 1 1 22 22 THR N N 22 108.800 108.800 110.704 -1.904 17919 84784 1 207 . 1 1 22 22 THR HA H 22 4.920 4.920 5.096 -0.176 17919 84785 1 207 . 1 1 22 22 THR C C 22 176.750 176.750 176.157 0.593 17919 84786 1 207 . 1 1 22 22 THR CA C 22 59.690 59.690 60.757 -1.067 17919 84787 1 207 . 1 1 22 22 THR CB C 22 71.200 71.200 70.629 0.571 17919 84788 1 207 . 1 1 22 22 THR H H 22 7.900 7.900 8.243 -0.343 17919 84789 1 207 . 1 1 23 23 ILE N N 23 121.190 121.190 122.470 -1.280 17919 84790 1 207 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.846 -0.189 17919 84791 1 207 . 1 1 23 23 ILE C C 23 179.040 179.040 177.503 1.537 17919 84792 1 207 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.410 -0.150 17919 84793 1 207 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.607 -2.257 17919 84794 1 207 . 1 1 23 23 ILE H H 23 8.560 8.560 8.713 -0.153 17919 84795 1 207 . 1 1 24 24 GLU N N 24 120.830 120.830 121.740 -0.910 17919 84796 1 207 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.855 0.062 17919 84797 1 207 . 1 1 24 24 GLU C C 24 178.640 178.640 178.601 0.039 17919 84798 1 207 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.178 0.042 17919 84799 1 207 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.451 -1.171 17919 84800 1 207 . 1 1 24 24 GLU H H 24 9.760 9.760 8.580 1.180 17919 84801 1 207 . 1 1 25 25 ASN N N 25 120.570 120.570 117.991 2.579 17919 84802 1 207 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.438 0.087 17919 84803 1 207 . 1 1 25 25 ASN C C 25 178.380 178.380 177.967 0.413 17919 84804 1 207 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.324 -0.264 17919 84805 1 207 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.651 -0.201 17919 84806 1 207 . 1 1 25 25 ASN H H 25 7.920 7.920 7.670 0.250 17919 84807 1 207 . 1 1 26 26 VAL N N 26 121.710 121.710 119.552 2.158 17919 84808 1 207 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.688 -0.291 17919 84809 1 207 . 1 1 26 26 VAL C C 26 177.950 177.950 177.615 0.335 17919 84810 1 207 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.359 1.301 17919 84811 1 207 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.594 -0.754 17919 84812 1 207 . 1 1 26 26 VAL H H 26 8.070 8.070 8.085 -0.015 17919 84813 1 207 . 1 1 27 27 LYS N N 27 118.860 118.860 120.550 -1.690 17919 84814 1 207 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.259 0.321 17919 84815 1 207 . 1 1 27 27 LYS C C 27 180.550 180.550 178.841 1.709 17919 84816 1 207 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.290 -0.040 17919 84817 1 207 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.328 1.402 17919 84818 1 207 . 1 1 27 27 LYS H H 27 8.560 8.560 8.435 0.125 17919 84819 1 207 . 1 1 28 28 ALA N N 28 123.440 123.440 123.617 -0.177 17919 84820 1 207 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.035 0.125 17919 84821 1 207 . 1 1 28 28 ALA C C 28 180.300 180.300 179.336 0.964 17919 84822 1 207 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.264 0.106 17919 84823 1 207 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.264 -0.554 17919 84824 1 207 . 1 1 28 28 ALA H H 28 8.060 8.060 8.556 -0.496 17919 84825 1 207 . 1 1 29 29 LYS N N 29 119.940 119.940 118.624 1.316 17919 84826 1 207 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.053 0.154 17919 84827 1 207 . 1 1 29 29 LYS C C 29 180.320 180.320 179.220 1.100 17919 84828 1 207 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.253 0.397 17919 84829 1 207 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.342 0.948 17919 84830 1 207 . 1 1 29 29 LYS H H 29 7.850 7.850 7.859 -0.009 17919 84831 1 207 . 1 1 30 30 ILE N N 30 121.080 121.080 120.783 0.297 17919 84832 1 207 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.594 -0.087 17919 84833 1 207 . 1 1 30 30 ILE C C 30 178.310 178.310 177.374 0.936 17919 84834 1 207 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.072 1.079 17919 84835 1 207 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.551 -0.751 17919 84836 1 207 . 1 1 30 30 ILE H H 30 8.280 8.280 7.752 0.528 17919 84837 1 207 . 1 1 31 31 GLN N N 31 123.490 123.490 120.241 3.249 17919 84838 1 207 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.143 -0.314 17919 84839 1 207 . 1 1 31 31 GLN C C 31 178.890 178.890 178.500 0.390 17919 84840 1 207 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.120 0.880 17919 84841 1 207 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.596 -0.876 17919 84842 1 207 . 1 1 31 31 GLN H H 31 8.580 8.580 8.140 0.440 17919 84843 1 207 . 1 1 32 32 ASP N N 32 119.360 119.360 120.154 -0.794 17919 84844 1 207 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.431 -0.077 17919 84845 1 207 . 1 1 32 32 ASP C C 32 177.250 177.250 178.048 -0.798 17919 84846 1 207 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.765 0.425 17919 84847 1 207 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.881 -0.301 17919 84848 1 207 . 1 1 32 32 ASP H H 32 8.010 8.010 8.187 -0.177 17919 84849 1 207 . 1 1 33 33 LYS N N 33 115.130 115.130 118.458 -3.328 17919 84850 1 207 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.193 0.144 17919 84851 1 207 . 1 1 33 33 LYS C C 33 177.870 177.870 178.301 -0.431 17919 84852 1 207 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.255 -0.205 17919 84853 1 207 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.295 0.875 17919 84854 1 207 . 1 1 33 33 LYS H H 33 7.430 7.430 7.512 -0.082 17919 84855 1 207 . 1 1 34 34 GLU N N 34 113.870 113.870 116.590 -2.720 17919 84856 1 207 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.372 0.253 17919 84857 1 207 . 1 1 34 34 GLU C C 34 177.840 177.840 177.071 0.769 17919 84858 1 207 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.163 0.007 17919 84859 1 207 . 1 1 34 34 GLU CB C 34 32.660 32.660 30.576 2.084 17919 84860 1 207 . 1 1 34 34 GLU H H 34 8.740 8.740 8.297 0.443 17919 84861 1 207 . 1 1 35 35 GLY N N 35 108.650 108.650 107.536 1.114 17919 84862 1 207 . 1 1 35 35 GLY C C 35 173.960 173.960 174.297 -0.337 17919 84863 1 207 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.158 0.922 17919 84864 1 207 . 1 1 35 35 GLY H H 35 8.530 8.530 7.978 0.552 17919 84865 1 207 . 1 1 36 36 ILE N N 36 119.880 119.880 117.657 2.223 17919 84866 1 207 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.639 -0.194 17919 84867 1 207 . 1 1 36 36 ILE C C 36 173.590 173.590 173.570 0.020 17919 84868 1 207 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.608 0.142 17919 84869 1 207 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.908 1.672 17919 84870 1 207 . 1 1 36 36 ILE H H 36 6.150 6.150 7.375 -1.225 17919 84871 1 207 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.773 -0.139 17919 84872 1 207 . 1 1 37 37 PRO C C 37 176.940 176.940 176.428 0.512 17919 84873 1 207 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.257 0.403 17919 84874 1 207 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.469 0.381 17919 84875 1 207 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.173 -0.056 17919 84876 1 207 . 1 1 38 38 PRO C C 38 178.320 178.320 177.971 0.349 17919 84877 1 207 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.639 0.621 17919 84878 1 207 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.930 0.960 17919 84879 1 207 . 1 1 39 39 ASP N N 39 113.380 113.380 115.689 -2.309 17919 84880 1 207 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.459 -0.029 17919 84881 1 207 . 1 1 39 39 ASP C C 39 177.090 177.090 177.336 -0.246 17919 84882 1 207 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.008 -0.367 17919 84883 1 207 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.792 -1.252 17919 84884 1 207 . 1 1 39 39 ASP H H 39 8.550 8.550 8.350 0.200 17919 84885 1 207 . 1 1 40 40 GLN N N 40 116.780 116.780 117.946 -1.166 17919 84886 1 207 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.146 0.318 17919 84887 1 207 . 1 1 40 40 GLN C C 40 175.380 175.380 176.028 -0.648 17919 84888 1 207 . 1 1 40 40 GLN CA C 40 55.640 55.640 57.047 -1.407 17919 84889 1 207 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.419 0.721 17919 84890 1 207 . 1 1 40 40 GLN H H 40 7.820 7.820 7.789 0.031 17919 84891 1 207 . 1 1 41 41 GLN N N 41 117.720 117.720 119.430 -1.710 17919 84892 1 207 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.400 -0.156 17919 84893 1 207 . 1 1 41 41 GLN C C 41 176.300 176.300 175.359 0.941 17919 84894 1 207 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.987 0.483 17919 84895 1 207 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.076 2.574 17919 84896 1 207 . 1 1 41 41 GLN H H 41 7.480 7.480 7.519 -0.039 17919 84897 1 207 . 1 1 42 42 ARG N N 42 122.680 122.680 127.245 -4.565 17919 84898 1 207 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.515 -0.015 17919 84899 1 207 . 1 1 42 42 ARG C C 42 174.050 174.050 173.797 0.253 17919 84900 1 207 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.145 -0.095 17919 84901 1 207 . 1 1 42 42 ARG CB C 42 31.750 31.750 31.678 0.072 17919 84902 1 207 . 1 1 42 42 ARG H H 42 8.530 8.530 8.478 0.052 17919 84903 1 207 . 1 1 43 43 LEU N N 43 124.040 124.040 128.824 -4.784 17919 84904 1 207 . 1 1 43 43 LEU C C 43 175.290 175.290 175.062 0.228 17919 84905 1 207 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.674 -0.694 17919 84906 1 207 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.959 0.831 17919 84907 1 207 . 1 1 43 43 LEU H H 43 8.820 8.820 8.717 0.103 17919 84908 1 207 . 1 1 44 44 ILE N N 44 121.920 121.920 120.245 1.675 17919 84909 1 207 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.999 -0.007 17919 84910 1 207 . 1 1 44 44 ILE C C 44 176.060 176.060 173.409 2.651 17919 84911 1 207 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.139 -0.159 17919 84912 1 207 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.650 -0.230 17919 84913 1 207 . 1 1 44 44 ILE H H 44 9.030 9.030 8.949 0.081 17919 84914 1 207 . 1 1 45 45 PHE N N 45 125.390 125.390 126.164 -0.774 17919 84915 1 207 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.029 0.016 17919 84916 1 207 . 1 1 45 45 PHE C C 45 174.470 174.470 175.179 -0.709 17919 84917 1 207 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.502 0.518 17919 84918 1 207 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.799 0.961 17919 84919 1 207 . 1 1 45 45 PHE H H 45 8.830 8.830 8.002 0.828 17919 84920 1 207 . 1 1 46 46 ALA N N 46 132.200 132.200 129.741 2.459 17919 84921 1 207 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.678 0.012 17919 84922 1 207 . 1 1 46 46 ALA C C 46 177.290 177.290 177.430 -0.140 17919 84923 1 207 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.749 -0.209 17919 84924 1 207 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.598 -0.028 17919 84925 1 207 . 1 1 46 46 ALA H H 46 8.810 8.810 8.467 0.343 17919 84926 1 207 . 1 1 47 47 GLY N N 47 102.340 102.340 103.689 -1.349 17919 84927 1 207 . 1 1 47 47 GLY C C 47 173.810 173.810 174.652 -0.842 17919 84928 1 207 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.448 -0.098 17919 84929 1 207 . 1 1 47 47 GLY H H 47 8.130 8.130 8.482 -0.352 17919 84930 1 207 . 1 1 48 48 LYS N N 48 121.570 121.570 121.730 -0.160 17919 84931 1 207 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.521 0.101 17919 84932 1 207 . 1 1 48 48 LYS C C 48 174.700 174.700 175.967 -1.267 17919 84933 1 207 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.135 -0.585 17919 84934 1 207 . 1 1 48 48 LYS CB C 48 34.530 34.530 33.450 1.080 17919 84935 1 207 . 1 1 48 48 LYS H H 48 7.980 7.980 7.673 0.307 17919 84936 1 207 . 1 1 49 49 GLN N N 49 122.410 122.410 123.562 -1.152 17919 84937 1 207 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.163 0.397 17919 84938 1 207 . 1 1 49 49 GLN C C 49 175.670 175.670 175.824 -0.154 17919 84939 1 207 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.321 -0.581 17919 84940 1 207 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.146 -0.146 17919 84941 1 207 . 1 1 49 49 GLN H H 49 8.600 8.600 8.614 -0.014 17919 84942 1 207 . 1 1 50 50 LEU N N 50 125.520 125.520 126.145 -0.625 17919 84943 1 207 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.229 -0.139 17919 84944 1 207 . 1 1 50 50 LEU C C 50 176.660 176.660 176.788 -0.128 17919 84945 1 207 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.974 0.266 17919 84946 1 207 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.875 -0.305 17919 84947 1 207 . 1 1 50 50 LEU H H 50 8.530 8.530 8.282 0.248 17919 84948 1 207 . 1 1 51 51 GLU N N 51 122.940 122.940 124.924 -1.984 17919 84949 1 207 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.406 0.082 17919 84950 1 207 . 1 1 51 51 GLU C C 51 175.870 175.870 176.597 -0.727 17919 84951 1 207 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.830 0.130 17919 84952 1 207 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.440 0.130 17919 84953 1 207 . 1 1 51 51 GLU H H 51 8.400 8.400 8.501 -0.101 17919 84954 1 207 . 1 1 52 52 ASP N N 52 120.030 120.030 126.871 -6.841 17919 84955 1 207 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.408 -0.049 17919 84956 1 207 . 1 1 52 52 ASP C C 52 177.330 177.330 177.378 -0.048 17919 84957 1 207 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.408 -0.448 17919 84958 1 207 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.742 0.108 17919 84959 1 207 . 1 1 52 52 ASP H H 52 8.160 8.160 8.761 -0.601 17919 84960 1 207 . 1 1 53 53 GLY N N 53 106.660 106.660 105.614 1.046 17919 84961 1 207 . 1 1 53 53 GLY C C 53 174.870 174.870 174.036 0.834 17919 84962 1 207 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.755 0.414 17919 84963 1 207 . 1 1 53 53 GLY H H 53 9.390 9.390 8.417 0.973 17919 84964 1 207 . 1 1 54 54 ARG N N 54 119.050 119.050 121.559 -2.509 17919 84965 1 207 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.678 0.017 17919 84966 1 207 . 1 1 54 54 ARG C C 54 175.350 175.350 174.913 0.437 17919 84967 1 207 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.364 0.026 17919 84968 1 207 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.596 -0.945 17919 84969 1 207 . 1 1 54 54 ARG H H 54 7.460 7.460 7.378 0.082 17919 84970 1 207 . 1 1 55 55 THR N N 55 108.400 108.400 113.941 -5.541 17919 84971 1 207 . 1 1 55 55 THR HA H 55 5.240 5.240 5.191 0.049 17919 84972 1 207 . 1 1 55 55 THR C C 55 176.560 176.560 176.155 0.405 17919 84973 1 207 . 1 1 55 55 THR CA C 55 59.690 59.690 60.273 -0.583 17919 84974 1 207 . 1 1 55 55 THR CB C 55 72.260 72.260 71.271 0.989 17919 84975 1 207 . 1 1 55 55 THR H H 55 8.730 8.730 9.125 -0.395 17919 84976 1 207 . 1 1 56 56 LEU N N 56 117.920 117.920 121.811 -3.891 17919 84977 1 207 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.922 0.138 17919 84978 1 207 . 1 1 56 56 LEU C C 56 180.810 180.810 178.960 1.850 17919 84979 1 207 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.258 0.452 17919 84980 1 207 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.464 -1.094 17919 84981 1 207 . 1 1 56 56 LEU H H 56 8.140 8.140 8.651 -0.511 17919 84982 1 207 . 1 1 57 57 SER N N 57 113.330 113.330 114.004 -0.674 17919 84983 1 207 . 1 1 57 57 SER HA H 57 4.370 4.370 4.307 0.063 17919 84984 1 207 . 1 1 57 57 SER C C 57 178.310 178.310 177.024 1.286 17919 84985 1 207 . 1 1 57 57 SER CA C 57 61.080 61.080 61.447 -0.367 17919 84986 1 207 . 1 1 57 57 SER CB C 57 62.530 62.530 62.389 0.141 17919 84987 1 207 . 1 1 57 57 SER H H 57 8.470 8.470 8.418 0.052 17919 84988 1 207 . 1 1 58 58 ASP N N 58 124.190 124.190 123.706 0.484 17919 84989 1 207 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.369 -0.073 17919 84990 1 207 . 1 1 58 58 ASP C C 58 177.400 177.400 177.028 0.372 17919 84991 1 207 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.815 0.365 17919 84992 1 207 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.400 -0.300 17919 84993 1 207 . 1 1 58 58 ASP H H 58 7.930 7.930 7.764 0.166 17919 84994 1 207 . 1 1 59 59 TYR N N 59 115.510 115.510 115.845 -0.335 17919 84995 1 207 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.643 0.027 17919 84996 1 207 . 1 1 59 59 TYR C C 59 174.700 174.700 175.146 -0.446 17919 84997 1 207 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.694 0.556 17919 84998 1 207 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.209 1.861 17919 84999 1 207 . 1 1 59 59 TYR H H 59 7.250 7.250 7.436 -0.186 17919 85000 1 207 . 1 1 60 60 ASN N N 60 115.900 115.900 117.218 -1.318 17919 85001 1 207 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.424 -0.069 17919 85002 1 207 . 1 1 60 60 ASN C C 60 174.340 174.340 174.781 -0.441 17919 85003 1 207 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.133 -0.014 17919 85004 1 207 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.316 0.094 17919 85005 1 207 . 1 1 60 60 ASN H H 60 8.150 8.150 7.926 0.224 17919 85006 1 207 . 1 1 61 61 ILE N N 61 118.600 118.600 119.654 -1.054 17919 85007 1 207 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.780 -0.387 17919 85008 1 207 . 1 1 61 61 ILE C C 61 174.610 174.610 175.218 -0.608 17919 85009 1 207 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.391 0.029 17919 85010 1 207 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.324 -0.584 17919 85011 1 207 . 1 1 61 61 ILE H H 61 7.250 7.250 8.392 -1.142 17919 85012 1 207 . 1 1 62 62 GLN N N 62 124.740 124.740 126.697 -1.957 17919 85013 1 207 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.716 -0.210 17919 85014 1 207 . 1 1 62 62 GLN C C 62 175.970 175.970 174.681 1.289 17919 85015 1 207 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.194 0.466 17919 85016 1 207 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.700 -0.050 17919 85017 1 207 . 1 1 62 62 GLN H H 62 7.610 7.610 8.253 -0.643 17919 85018 1 207 . 1 1 63 63 LYS N N 63 120.300 120.300 119.547 0.753 17919 85019 1 207 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.951 0.050 17919 85020 1 207 . 1 1 63 63 LYS C C 63 175.810 175.810 176.386 -0.576 17919 85021 1 207 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.462 -0.671 17919 85022 1 207 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.760 0.890 17919 85023 1 207 . 1 1 63 63 LYS H H 63 8.490 8.490 8.567 -0.077 17919 85024 1 207 . 1 1 64 64 GLU N N 64 113.950 113.950 119.411 -5.461 17919 85025 1 207 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.797 -0.332 17919 85026 1 207 . 1 1 64 64 GLU C C 64 175.250 175.250 176.198 -0.948 17919 85027 1 207 . 1 1 64 64 GLU CA C 64 57.890 57.890 58.169 -0.279 17919 85028 1 207 . 1 1 64 64 GLU CB C 64 25.900 25.900 27.943 -2.043 17919 85029 1 207 . 1 1 64 64 GLU H H 64 9.280 9.280 8.874 0.406 17919 85030 1 207 . 1 1 65 65 SER N N 65 114.730 114.730 114.657 0.073 17919 85031 1 207 . 1 1 65 65 SER HA H 65 4.640 4.640 4.511 0.129 17919 85032 1 207 . 1 1 65 65 SER C C 65 172.160 172.160 174.210 -2.050 17919 85033 1 207 . 1 1 65 65 SER CA C 65 60.890 60.890 60.585 0.305 17919 85034 1 207 . 1 1 65 65 SER CB C 65 64.910 64.910 64.448 0.462 17919 85035 1 207 . 1 1 65 65 SER H H 65 7.670 7.670 7.601 0.069 17919 85036 1 207 . 1 1 66 66 THR N N 66 117.110 117.110 118.570 -1.460 17919 85037 1 207 . 1 1 66 66 THR HA H 66 5.270 5.270 5.171 0.099 17919 85038 1 207 . 1 1 66 66 THR C C 66 173.950 173.950 174.447 -0.497 17919 85039 1 207 . 1 1 66 66 THR CA C 66 62.340 62.340 61.967 0.373 17919 85040 1 207 . 1 1 66 66 THR CB C 66 70.080 70.080 70.488 -0.408 17919 85041 1 207 . 1 1 66 66 THR H H 66 8.730 8.730 8.542 0.188 17919 85042 1 207 . 1 1 67 67 LEU N N 67 127.110 127.110 127.849 -0.739 17919 85043 1 207 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.895 0.165 17919 85044 1 207 . 1 1 67 67 LEU C C 67 175.770 175.770 175.596 0.174 17919 85045 1 207 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.151 -0.251 17919 85046 1 207 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.180 0.080 17919 85047 1 207 . 1 1 67 67 LEU H H 67 9.410 9.410 9.170 0.240 17919 85048 1 207 . 1 1 68 68 HIS N N 68 118.380 118.380 122.590 -4.210 17919 85049 1 207 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.587 -0.347 17919 85050 1 207 . 1 1 68 68 HIS C C 68 173.150 173.150 173.542 -0.392 17919 85051 1 207 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.211 0.789 17919 85052 1 207 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.650 -2.120 17919 85053 1 207 . 1 1 68 68 HIS H H 68 9.230 9.230 9.237 -0.007 17919 85054 1 207 . 1 1 69 69 LEU N N 69 124.460 124.460 128.633 -4.173 17919 85055 1 207 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.947 0.243 17919 85056 1 207 . 1 1 69 69 LEU C C 69 175.270 175.270 173.870 1.400 17919 85057 1 207 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.477 0.412 17919 85058 1 207 . 1 1 69 69 LEU CB C 69 44.380 44.380 45.834 -1.454 17919 85059 1 207 . 1 1 69 69 LEU H H 69 8.340 8.340 7.973 0.367 17919 85060 1 207 . 1 1 70 70 VAL N N 70 126.940 126.940 124.921 2.019 17919 85061 1 207 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.404 -0.054 17919 85062 1 207 . 1 1 70 70 VAL C C 70 174.000 174.000 174.352 -0.352 17919 85063 1 207 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.178 0.622 17919 85064 1 207 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.483 -0.573 17919 85065 1 207 . 1 1 70 70 VAL H H 70 9.200 9.200 9.044 0.156 17919 85066 1 207 . 1 1 71 71 LEU N N 71 123.130 123.130 124.729 -1.599 17919 85067 1 207 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.869 0.191 17919 85068 1 207 . 1 1 71 71 LEU C C 71 177.830 177.830 177.320 0.510 17919 85069 1 207 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.502 0.438 17919 85070 1 207 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.101 0.749 17919 85071 1 207 . 1 1 71 71 LEU H H 71 8.120 8.120 8.349 -0.229 17919 85072 1 207 . 1 1 72 72 ARG N N 72 123.490 123.490 124.878 -1.388 17919 85073 1 207 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.278 0.023 17919 85074 1 207 . 1 1 72 72 ARG C C 72 175.350 175.350 175.338 0.012 17919 85075 1 207 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.102 -0.492 17919 85076 1 207 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.671 0.679 17919 85077 1 207 . 1 1 72 72 ARG H H 72 8.580 8.580 8.395 0.185 17919 85078 1 208 . 1 1 2 2 GLN N N 2 123.220 123.220 119.503 3.717 17919 85079 1 208 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.317 -0.068 17919 85080 1 208 . 1 1 2 2 GLN C C 2 175.920 175.920 175.468 0.452 17919 85081 1 208 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.748 0.332 17919 85082 1 208 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.756 0.004 17919 85083 1 208 . 1 1 2 2 GLN H H 2 8.900 8.900 8.308 0.592 17919 85084 1 208 . 1 1 3 3 ILE N N 3 115.340 115.340 116.761 -1.421 17919 85085 1 208 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.385 -0.172 17919 85086 1 208 . 1 1 3 3 ILE C C 3 172.450 172.450 173.311 -0.861 17919 85087 1 208 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.044 0.526 17919 85088 1 208 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.617 0.593 17919 85089 1 208 . 1 1 3 3 ILE H H 3 8.320 8.320 8.631 -0.311 17919 85090 1 208 . 1 1 4 4 PHE N N 4 118.110 118.110 120.242 -2.132 17919 85091 1 208 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.571 0.059 17919 85092 1 208 . 1 1 4 4 PHE C C 4 175.320 175.320 175.182 0.138 17919 85093 1 208 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.749 -0.539 17919 85094 1 208 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.326 -0.846 17919 85095 1 208 . 1 1 4 4 PHE H H 4 8.610 8.610 8.396 0.214 17919 85096 1 208 . 1 1 5 5 VAL N N 5 121.000 121.000 122.785 -1.785 17919 85097 1 208 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.664 0.061 17919 85098 1 208 . 1 1 5 5 VAL C C 5 174.870 174.870 174.562 0.308 17919 85099 1 208 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.590 -0.970 17919 85100 1 208 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.498 -0.268 17919 85101 1 208 . 1 1 5 5 VAL H H 5 9.300 9.300 9.247 0.053 17919 85102 1 208 . 1 1 6 6 LYS N N 6 127.520 127.520 128.989 -1.469 17919 85103 1 208 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.188 0.179 17919 85104 1 208 . 1 1 6 6 LYS C C 6 177.140 177.140 176.344 0.796 17919 85105 1 208 . 1 1 6 6 LYS CA C 6 54.520 54.520 53.788 0.732 17919 85106 1 208 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.601 0.449 17919 85107 1 208 . 1 1 6 6 LYS H H 6 8.820 8.820 9.425 -0.605 17919 85108 1 208 . 1 1 7 7 THR N N 7 115.400 115.400 118.316 -2.916 17919 85109 1 208 . 1 1 7 7 THR HA H 7 4.970 4.970 4.722 0.248 17919 85110 1 208 . 1 1 7 7 THR C C 7 176.910 176.910 177.129 -0.219 17919 85111 1 208 . 1 1 7 7 THR CA C 7 60.470 60.470 61.949 -1.479 17919 85112 1 208 . 1 1 7 7 THR CB C 7 70.630 70.630 70.066 0.564 17919 85113 1 208 . 1 1 7 7 THR H H 7 8.730 8.730 8.962 -0.232 17919 85114 1 208 . 1 1 8 8 LEU N N 8 121.330 121.330 120.862 0.468 17919 85115 1 208 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.243 0.067 17919 85116 1 208 . 1 1 8 8 LEU C C 8 178.800 178.800 177.418 1.382 17919 85117 1 208 . 1 1 8 8 LEU CA C 8 57.580 57.580 58.231 -0.651 17919 85118 1 208 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.444 0.527 17919 85119 1 208 . 1 1 8 8 LEU H H 8 9.100 9.100 8.857 0.243 17919 85120 1 208 . 1 1 9 9 THR N N 9 105.590 105.590 108.009 -2.419 17919 85121 1 208 . 1 1 9 9 THR HA H 9 4.428 4.428 4.296 0.132 17919 85122 1 208 . 1 1 9 9 THR C C 9 175.520 175.520 175.753 -0.233 17919 85123 1 208 . 1 1 9 9 THR CA C 9 61.400 61.400 61.912 -0.512 17919 85124 1 208 . 1 1 9 9 THR CB C 9 69.140 69.140 68.689 0.451 17919 85125 1 208 . 1 1 9 9 THR H H 9 7.630 7.630 7.604 0.027 17919 85126 1 208 . 1 1 10 10 GLY N N 10 108.890 108.890 111.508 -2.618 17919 85127 1 208 . 1 1 10 10 GLY C C 10 174.070 174.070 173.514 0.556 17919 85128 1 208 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.082 0.378 17919 85129 1 208 . 1 1 10 10 GLY H H 10 7.810 7.810 8.363 -0.553 17919 85130 1 208 . 1 1 11 11 LYS N N 11 121.600 121.600 122.126 -0.526 17919 85131 1 208 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.205 0.156 17919 85132 1 208 . 1 1 11 11 LYS C C 11 175.940 175.940 175.857 0.083 17919 85133 1 208 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.874 -0.594 17919 85134 1 208 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.240 -0.040 17919 85135 1 208 . 1 1 11 11 LYS H H 11 7.280 7.280 8.150 -0.870 17919 85136 1 208 . 1 1 12 12 THR N N 12 120.440 120.440 121.089 -0.649 17919 85137 1 208 . 1 1 12 12 THR HA H 12 5.046 5.046 5.092 -0.046 17919 85138 1 208 . 1 1 12 12 THR C C 12 174.320 174.320 174.387 -0.067 17919 85139 1 208 . 1 1 12 12 THR CA C 12 62.390 62.390 62.133 0.257 17919 85140 1 208 . 1 1 12 12 THR CB C 12 69.910 69.910 69.923 -0.013 17919 85141 1 208 . 1 1 12 12 THR H H 12 8.650 8.650 8.340 0.310 17919 85142 1 208 . 1 1 13 13 ILE N N 13 127.110 127.110 127.970 -0.860 17919 85143 1 208 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.512 0.032 17919 85144 1 208 . 1 1 13 13 ILE C C 13 175.220 175.220 175.224 -0.004 17919 85145 1 208 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.429 -0.449 17919 85146 1 208 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.633 -0.683 17919 85147 1 208 . 1 1 13 13 ILE H H 13 9.450 9.450 9.201 0.249 17919 85148 1 208 . 1 1 14 14 THR N N 14 121.520 121.520 123.912 -2.392 17919 85149 1 208 . 1 1 14 14 THR HA H 14 4.964 4.964 4.830 0.134 17919 85150 1 208 . 1 1 14 14 THR C C 14 173.790 173.790 173.345 0.445 17919 85151 1 208 . 1 1 14 14 THR CA C 14 61.940 61.940 63.100 -1.160 17919 85152 1 208 . 1 1 14 14 THR CB C 14 69.650 69.650 69.662 -0.012 17919 85153 1 208 . 1 1 14 14 THR H H 14 8.710 8.710 8.727 -0.017 17919 85154 1 208 . 1 1 15 15 LEU N N 15 124.800 124.800 126.271 -1.471 17919 85155 1 208 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.789 -0.009 17919 85156 1 208 . 1 1 15 15 LEU C C 15 174.670 174.670 174.641 0.029 17919 85157 1 208 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.777 -0.947 17919 85158 1 208 . 1 1 15 15 LEU CB C 15 47.070 47.070 46.526 0.544 17919 85159 1 208 . 1 1 15 15 LEU H H 15 8.710 8.710 8.802 -0.092 17919 85160 1 208 . 1 1 16 16 GLU N N 16 122.160 122.160 122.943 -0.783 17919 85161 1 208 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.379 -0.462 17919 85162 1 208 . 1 1 16 16 GLU C C 16 175.860 175.860 175.642 0.218 17919 85163 1 208 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.180 -0.360 17919 85164 1 208 . 1 1 16 16 GLU CB C 16 29.450 29.450 31.266 -1.816 17919 85165 1 208 . 1 1 16 16 GLU H H 16 8.140 8.140 8.622 -0.482 17919 85166 1 208 . 1 1 17 17 VAL N N 17 117.210 117.210 120.610 -3.400 17919 85167 1 208 . 1 1 17 17 VAL HA H 17 4.714 4.714 5.148 -0.434 17919 85168 1 208 . 1 1 17 17 VAL C C 17 174.160 174.160 174.624 -0.464 17919 85169 1 208 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.171 -0.741 17919 85170 1 208 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.912 0.488 17919 85171 1 208 . 1 1 17 17 VAL H H 17 8.900 8.900 8.573 0.327 17919 85172 1 208 . 1 1 18 18 GLU N N 18 118.990 118.990 121.032 -2.042 17919 85173 1 208 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.838 0.241 17919 85174 1 208 . 1 1 18 18 GLU C C 18 176.160 176.160 175.843 0.317 17919 85175 1 208 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.879 -0.159 17919 85176 1 208 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.254 0.056 17919 85177 1 208 . 1 1 18 18 GLU H H 18 8.640 8.640 8.452 0.188 17919 85178 1 208 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.428 -0.287 17919 85179 1 208 . 1 1 19 19 PRO C C 19 175.310 175.310 177.117 -1.807 17919 85180 1 208 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.038 0.432 17919 85181 1 208 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.190 -0.240 17919 85182 1 208 . 1 1 20 20 SER N N 20 103.400 103.400 109.831 -6.431 17919 85183 1 208 . 1 1 20 20 SER HA H 20 4.370 4.370 4.448 -0.078 17919 85184 1 208 . 1 1 20 20 SER C C 20 174.660 174.660 174.325 0.335 17919 85185 1 208 . 1 1 20 20 SER CA C 20 57.400 57.400 58.493 -1.093 17919 85186 1 208 . 1 1 20 20 SER CB C 20 63.370 63.370 63.299 0.071 17919 85187 1 208 . 1 1 20 20 SER H H 20 7.040 7.040 8.034 -0.994 17919 85188 1 208 . 1 1 21 21 ASP N N 21 123.480 123.480 123.947 -0.467 17919 85189 1 208 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.746 -0.051 17919 85190 1 208 . 1 1 21 21 ASP C C 21 176.360 176.360 175.883 0.477 17919 85191 1 208 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.093 0.607 17919 85192 1 208 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.687 -0.887 17919 85193 1 208 . 1 1 21 21 ASP H H 21 8.030 8.030 7.574 0.456 17919 85194 1 208 . 1 1 22 22 THR N N 22 108.800 108.800 112.012 -3.212 17919 85195 1 208 . 1 1 22 22 THR HA H 22 4.920 4.920 4.714 0.206 17919 85196 1 208 . 1 1 22 22 THR C C 22 176.750 176.750 176.080 0.670 17919 85197 1 208 . 1 1 22 22 THR CA C 22 59.690 59.690 61.319 -1.629 17919 85198 1 208 . 1 1 22 22 THR CB C 22 71.200 71.200 70.310 0.890 17919 85199 1 208 . 1 1 22 22 THR H H 22 7.900 7.900 8.236 -0.336 17919 85200 1 208 . 1 1 23 23 ILE N N 23 121.190 121.190 121.446 -0.256 17919 85201 1 208 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.869 -0.212 17919 85202 1 208 . 1 1 23 23 ILE C C 23 179.040 179.040 177.632 1.408 17919 85203 1 208 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.558 -0.298 17919 85204 1 208 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.311 -1.961 17919 85205 1 208 . 1 1 23 23 ILE H H 23 8.560 8.560 9.011 -0.451 17919 85206 1 208 . 1 1 24 24 GLU N N 24 120.830 120.830 121.264 -0.434 17919 85207 1 208 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.893 0.024 17919 85208 1 208 . 1 1 24 24 GLU C C 24 178.640 178.640 178.522 0.118 17919 85209 1 208 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.267 -0.047 17919 85210 1 208 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.464 -1.184 17919 85211 1 208 . 1 1 24 24 GLU H H 24 9.760 9.760 8.592 1.168 17919 85212 1 208 . 1 1 25 25 ASN N N 25 120.570 120.570 118.295 2.275 17919 85213 1 208 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.477 0.048 17919 85214 1 208 . 1 1 25 25 ASN C C 25 178.380 178.380 177.812 0.568 17919 85215 1 208 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.212 -0.152 17919 85216 1 208 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.596 -0.146 17919 85217 1 208 . 1 1 25 25 ASN H H 25 7.920 7.920 7.736 0.184 17919 85218 1 208 . 1 1 26 26 VAL N N 26 121.710 121.710 120.750 0.960 17919 85219 1 208 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.635 -0.238 17919 85220 1 208 . 1 1 26 26 VAL C C 26 177.950 177.950 177.841 0.109 17919 85221 1 208 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.439 1.222 17919 85222 1 208 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.133 -0.293 17919 85223 1 208 . 1 1 26 26 VAL H H 26 8.070 8.070 8.092 -0.022 17919 85224 1 208 . 1 1 27 27 LYS N N 27 118.860 118.860 119.897 -1.037 17919 85225 1 208 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.102 0.478 17919 85226 1 208 . 1 1 27 27 LYS C C 27 180.550 180.550 179.217 1.333 17919 85227 1 208 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.782 -0.532 17919 85228 1 208 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.127 1.603 17919 85229 1 208 . 1 1 27 27 LYS H H 27 8.560 8.560 8.446 0.114 17919 85230 1 208 . 1 1 28 28 ALA N N 28 123.440 123.440 121.524 1.916 17919 85231 1 208 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.211 -0.051 17919 85232 1 208 . 1 1 28 28 ALA C C 28 180.300 180.300 179.324 0.976 17919 85233 1 208 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.664 0.706 17919 85234 1 208 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.576 -0.866 17919 85235 1 208 . 1 1 28 28 ALA H H 28 8.060 8.060 8.504 -0.444 17919 85236 1 208 . 1 1 29 29 LYS N N 29 119.940 119.940 119.536 0.404 17919 85237 1 208 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.091 0.116 17919 85238 1 208 . 1 1 29 29 LYS C C 29 180.320 180.320 179.189 1.131 17919 85239 1 208 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.250 0.400 17919 85240 1 208 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.475 0.815 17919 85241 1 208 . 1 1 29 29 LYS H H 29 7.850 7.850 7.966 -0.116 17919 85242 1 208 . 1 1 30 30 ILE N N 30 121.080 121.080 120.536 0.544 17919 85243 1 208 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.659 -0.152 17919 85244 1 208 . 1 1 30 30 ILE C C 30 178.310 178.310 177.208 1.102 17919 85245 1 208 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.178 0.972 17919 85246 1 208 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.967 -1.167 17919 85247 1 208 . 1 1 30 30 ILE H H 30 8.280 8.280 8.372 -0.092 17919 85248 1 208 . 1 1 31 31 GLN N N 31 123.490 123.490 120.421 3.069 17919 85249 1 208 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.866 -0.037 17919 85250 1 208 . 1 1 31 31 GLN C C 31 178.890 178.890 178.294 0.596 17919 85251 1 208 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.568 0.432 17919 85252 1 208 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.411 -0.691 17919 85253 1 208 . 1 1 31 31 GLN H H 31 8.580 8.580 8.150 0.430 17919 85254 1 208 . 1 1 32 32 ASP N N 32 119.360 119.360 119.571 -0.211 17919 85255 1 208 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.380 -0.026 17919 85256 1 208 . 1 1 32 32 ASP C C 32 177.250 177.250 178.091 -0.841 17919 85257 1 208 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.889 0.301 17919 85258 1 208 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.776 -0.196 17919 85259 1 208 . 1 1 32 32 ASP H H 32 8.010 8.010 7.874 0.136 17919 85260 1 208 . 1 1 33 33 LYS N N 33 115.130 115.130 117.121 -1.991 17919 85261 1 208 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.264 0.073 17919 85262 1 208 . 1 1 33 33 LYS C C 33 177.870 177.870 177.903 -0.033 17919 85263 1 208 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.563 -0.513 17919 85264 1 208 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.437 0.733 17919 85265 1 208 . 1 1 33 33 LYS H H 33 7.430 7.430 7.667 -0.236 17919 85266 1 208 . 1 1 34 34 GLU N N 34 113.870 113.870 113.831 0.039 17919 85267 1 208 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.475 0.150 17919 85268 1 208 . 1 1 34 34 GLU C C 34 177.840 177.840 176.960 0.880 17919 85269 1 208 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.261 -1.091 17919 85270 1 208 . 1 1 34 34 GLU CB C 34 32.660 32.660 32.451 0.209 17919 85271 1 208 . 1 1 34 34 GLU H H 34 8.740 8.740 8.074 0.666 17919 85272 1 208 . 1 1 35 35 GLY N N 35 108.650 108.650 108.923 -0.273 17919 85273 1 208 . 1 1 35 35 GLY C C 35 173.960 173.960 173.995 -0.035 17919 85274 1 208 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.417 0.663 17919 85275 1 208 . 1 1 35 35 GLY H H 35 8.530 8.530 8.580 -0.050 17919 85276 1 208 . 1 1 36 36 ILE N N 36 119.880 119.880 122.139 -2.259 17919 85277 1 208 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.283 0.162 17919 85278 1 208 . 1 1 36 36 ILE C C 36 173.590 173.590 174.040 -0.450 17919 85279 1 208 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.212 -0.462 17919 85280 1 208 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.264 2.316 17919 85281 1 208 . 1 1 36 36 ILE H H 36 6.150 6.150 7.632 -1.482 17919 85282 1 208 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.505 0.129 17919 85283 1 208 . 1 1 37 37 PRO C C 37 176.940 176.940 176.083 0.857 17919 85284 1 208 . 1 1 37 37 PRO CA C 37 61.660 61.660 62.021 -0.361 17919 85285 1 208 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.456 0.394 17919 85286 1 208 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.194 -0.077 17919 85287 1 208 . 1 1 38 38 PRO C C 38 178.320 178.320 178.393 -0.073 17919 85288 1 208 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.685 0.575 17919 85289 1 208 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.885 1.005 17919 85290 1 208 . 1 1 39 39 ASP N N 39 113.380 113.380 115.342 -1.962 17919 85291 1 208 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.422 0.008 17919 85292 1 208 . 1 1 39 39 ASP C C 39 177.090 177.090 177.366 -0.276 17919 85293 1 208 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.418 -0.778 17919 85294 1 208 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.173 -0.633 17919 85295 1 208 . 1 1 39 39 ASP H H 39 8.550 8.550 8.764 -0.214 17919 85296 1 208 . 1 1 40 40 GLN N N 40 116.780 116.780 116.139 0.641 17919 85297 1 208 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.413 0.051 17919 85298 1 208 . 1 1 40 40 GLN C C 40 175.380 175.380 175.939 -0.559 17919 85299 1 208 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.427 0.213 17919 85300 1 208 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.319 0.821 17919 85301 1 208 . 1 1 40 40 GLN H H 40 7.820 7.820 7.944 -0.124 17919 85302 1 208 . 1 1 41 41 GLN N N 41 117.720 117.720 119.822 -2.102 17919 85303 1 208 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.845 -0.601 17919 85304 1 208 . 1 1 41 41 GLN C C 41 176.300 176.300 175.190 1.110 17919 85305 1 208 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.741 0.729 17919 85306 1 208 . 1 1 41 41 GLN CB C 41 31.650 31.650 30.644 1.006 17919 85307 1 208 . 1 1 41 41 GLN H H 41 7.480 7.480 7.448 0.032 17919 85308 1 208 . 1 1 42 42 ARG N N 42 122.680 122.680 123.021 -0.341 17919 85309 1 208 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.717 -0.217 17919 85310 1 208 . 1 1 42 42 ARG C C 42 174.050 174.050 174.357 -0.307 17919 85311 1 208 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.713 0.337 17919 85312 1 208 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.512 -1.762 17919 85313 1 208 . 1 1 42 42 ARG H H 42 8.530 8.530 9.016 -0.486 17919 85314 1 208 . 1 1 43 43 LEU N N 43 124.040 124.040 125.352 -1.312 17919 85315 1 208 . 1 1 43 43 LEU C C 43 175.290 175.290 175.720 -0.430 17919 85316 1 208 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.949 -0.969 17919 85317 1 208 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.934 1.856 17919 85318 1 208 . 1 1 43 43 LEU H H 43 8.820 8.820 8.804 0.016 17919 85319 1 208 . 1 1 44 44 ILE N N 44 121.920 121.920 122.336 -0.416 17919 85320 1 208 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.853 0.139 17919 85321 1 208 . 1 1 44 44 ILE C C 44 176.060 176.060 174.240 1.820 17919 85322 1 208 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.336 -1.356 17919 85323 1 208 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.184 0.236 17919 85324 1 208 . 1 1 44 44 ILE H H 44 9.030 9.030 8.802 0.228 17919 85325 1 208 . 1 1 45 45 PHE N N 45 125.390 125.390 128.050 -2.660 17919 85326 1 208 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.017 0.028 17919 85327 1 208 . 1 1 45 45 PHE C C 45 174.470 174.470 174.584 -0.114 17919 85328 1 208 . 1 1 45 45 PHE CA C 45 57.020 57.020 55.659 1.361 17919 85329 1 208 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.928 0.832 17919 85330 1 208 . 1 1 45 45 PHE H H 45 8.830 8.830 8.622 0.208 17919 85331 1 208 . 1 1 46 46 ALA N N 46 132.200 132.200 130.637 1.563 17919 85332 1 208 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.738 -0.048 17919 85333 1 208 . 1 1 46 46 ALA C C 46 177.290 177.290 177.588 -0.298 17919 85334 1 208 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.501 0.039 17919 85335 1 208 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.559 0.011 17919 85336 1 208 . 1 1 46 46 ALA H H 46 8.810 8.810 8.695 0.115 17919 85337 1 208 . 1 1 47 47 GLY N N 47 102.340 102.340 106.510 -4.170 17919 85338 1 208 . 1 1 47 47 GLY C C 47 173.810 173.810 173.917 -0.107 17919 85339 1 208 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.398 -0.048 17919 85340 1 208 . 1 1 47 47 GLY H H 47 8.130 8.130 8.581 -0.451 17919 85341 1 208 . 1 1 48 48 LYS N N 48 121.570 121.570 120.167 1.403 17919 85342 1 208 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.616 0.006 17919 85343 1 208 . 1 1 48 48 LYS C C 48 174.700 174.700 174.473 0.227 17919 85344 1 208 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.846 -0.296 17919 85345 1 208 . 1 1 48 48 LYS CB C 48 34.530 34.530 35.064 -0.534 17919 85346 1 208 . 1 1 48 48 LYS H H 48 7.980 7.980 7.731 0.249 17919 85347 1 208 . 1 1 49 49 GLN N N 49 122.410 122.410 124.697 -2.287 17919 85348 1 208 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.418 0.142 17919 85349 1 208 . 1 1 49 49 GLN C C 49 175.670 175.670 175.490 0.180 17919 85350 1 208 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.920 -0.180 17919 85351 1 208 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.051 -0.051 17919 85352 1 208 . 1 1 49 49 GLN H H 49 8.600 8.600 8.495 0.105 17919 85353 1 208 . 1 1 50 50 LEU N N 50 125.520 125.520 128.087 -2.567 17919 85354 1 208 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.049 0.041 17919 85355 1 208 . 1 1 50 50 LEU C C 50 176.660 176.660 176.071 0.589 17919 85356 1 208 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.142 0.098 17919 85357 1 208 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.295 -0.725 17919 85358 1 208 . 1 1 50 50 LEU H H 50 8.530 8.530 8.491 0.039 17919 85359 1 208 . 1 1 51 51 GLU N N 51 122.940 122.940 122.949 -0.009 17919 85360 1 208 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.509 -0.021 17919 85361 1 208 . 1 1 51 51 GLU C C 51 175.870 175.870 176.905 -1.035 17919 85362 1 208 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.107 0.853 17919 85363 1 208 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.933 -0.363 17919 85364 1 208 . 1 1 51 51 GLU H H 51 8.400 8.400 8.638 -0.238 17919 85365 1 208 . 1 1 52 52 ASP N N 52 120.030 120.030 126.963 -6.933 17919 85366 1 208 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.456 -0.097 17919 85367 1 208 . 1 1 52 52 ASP C C 52 177.330 177.330 177.244 0.086 17919 85368 1 208 . 1 1 52 52 ASP CA C 52 56.960 56.960 56.870 0.090 17919 85369 1 208 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.723 0.127 17919 85370 1 208 . 1 1 52 52 ASP H H 52 8.160 8.160 8.807 -0.647 17919 85371 1 208 . 1 1 53 53 GLY N N 53 106.660 106.660 105.446 1.214 17919 85372 1 208 . 1 1 53 53 GLY C C 53 174.870 174.870 174.086 0.784 17919 85373 1 208 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.732 0.438 17919 85374 1 208 . 1 1 53 53 GLY H H 53 9.390 9.390 8.441 0.949 17919 85375 1 208 . 1 1 54 54 ARG N N 54 119.050 119.050 121.315 -2.265 17919 85376 1 208 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.675 0.020 17919 85377 1 208 . 1 1 54 54 ARG C C 54 175.350 175.350 175.475 -0.125 17919 85378 1 208 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.510 -0.120 17919 85379 1 208 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.972 -0.322 17919 85380 1 208 . 1 1 54 54 ARG H H 54 7.460 7.460 7.532 -0.072 17919 85381 1 208 . 1 1 55 55 THR N N 55 108.400 108.400 113.095 -4.695 17919 85382 1 208 . 1 1 55 55 THR HA H 55 5.240 5.240 4.954 0.286 17919 85383 1 208 . 1 1 55 55 THR C C 55 176.560 176.560 175.959 0.601 17919 85384 1 208 . 1 1 55 55 THR CA C 55 59.690 59.690 60.986 -1.296 17919 85385 1 208 . 1 1 55 55 THR CB C 55 72.260 72.260 70.738 1.522 17919 85386 1 208 . 1 1 55 55 THR H H 55 8.730 8.730 9.156 -0.426 17919 85387 1 208 . 1 1 56 56 LEU N N 56 117.920 117.920 123.120 -5.200 17919 85388 1 208 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.019 0.041 17919 85389 1 208 . 1 1 56 56 LEU C C 56 180.810 180.810 178.880 1.930 17919 85390 1 208 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.691 0.020 17919 85391 1 208 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.288 -0.918 17919 85392 1 208 . 1 1 56 56 LEU H H 56 8.140 8.140 8.687 -0.547 17919 85393 1 208 . 1 1 57 57 SER N N 57 113.330 113.330 114.478 -1.148 17919 85394 1 208 . 1 1 57 57 SER HA H 57 4.370 4.370 4.091 0.279 17919 85395 1 208 . 1 1 57 57 SER C C 57 178.310 178.310 176.893 1.417 17919 85396 1 208 . 1 1 57 57 SER CA C 57 61.080 61.080 61.946 -0.866 17919 85397 1 208 . 1 1 57 57 SER CB C 57 62.530 62.530 62.541 -0.011 17919 85398 1 208 . 1 1 57 57 SER H H 57 8.470 8.470 8.160 0.310 17919 85399 1 208 . 1 1 58 58 ASP N N 58 124.190 124.190 120.901 3.289 17919 85400 1 208 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.295 0.001 17919 85401 1 208 . 1 1 58 58 ASP C C 58 177.400 177.400 177.319 0.081 17919 85402 1 208 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.688 0.492 17919 85403 1 208 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.407 -0.307 17919 85404 1 208 . 1 1 58 58 ASP H H 58 7.930 7.930 7.834 0.096 17919 85405 1 208 . 1 1 59 59 TYR N N 59 115.510 115.510 115.782 -0.272 17919 85406 1 208 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.598 0.072 17919 85407 1 208 . 1 1 59 59 TYR C C 59 174.700 174.700 175.275 -0.575 17919 85408 1 208 . 1 1 59 59 TYR CA C 59 58.250 58.250 56.864 1.386 17919 85409 1 208 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.701 1.369 17919 85410 1 208 . 1 1 59 59 TYR H H 59 7.250 7.250 7.179 0.071 17919 85411 1 208 . 1 1 60 60 ASN N N 60 115.900 115.900 117.924 -2.024 17919 85412 1 208 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.385 -0.030 17919 85413 1 208 . 1 1 60 60 ASN C C 60 174.340 174.340 174.382 -0.042 17919 85414 1 208 . 1 1 60 60 ASN CA C 60 54.120 54.120 53.921 0.199 17919 85415 1 208 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.876 -0.466 17919 85416 1 208 . 1 1 60 60 ASN H H 60 8.150 8.150 8.000 0.150 17919 85417 1 208 . 1 1 61 61 ILE N N 61 118.600 118.600 119.728 -1.128 17919 85418 1 208 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.743 -0.350 17919 85419 1 208 . 1 1 61 61 ILE C C 61 174.610 174.610 175.183 -0.573 17919 85420 1 208 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.028 1.393 17919 85421 1 208 . 1 1 61 61 ILE CB C 61 36.740 36.740 36.461 0.279 17919 85422 1 208 . 1 1 61 61 ILE H H 61 7.250 7.250 8.003 -0.753 17919 85423 1 208 . 1 1 62 62 GLN N N 62 124.740 124.740 124.605 0.135 17919 85424 1 208 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.799 -0.293 17919 85425 1 208 . 1 1 62 62 GLN C C 62 175.970 175.970 175.799 0.171 17919 85426 1 208 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.676 -0.016 17919 85427 1 208 . 1 1 62 62 GLN CB C 62 31.650 31.650 32.684 -1.034 17919 85428 1 208 . 1 1 62 62 GLN H H 62 7.610 7.610 7.943 -0.333 17919 85429 1 208 . 1 1 63 63 LYS N N 63 120.300 120.300 120.696 -0.396 17919 85430 1 208 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.066 -0.065 17919 85431 1 208 . 1 1 63 63 LYS C C 63 175.810 175.810 176.811 -1.001 17919 85432 1 208 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.810 -0.020 17919 85433 1 208 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.219 0.431 17919 85434 1 208 . 1 1 63 63 LYS H H 63 8.490 8.490 8.583 -0.093 17919 85435 1 208 . 1 1 64 64 GLU N N 64 113.950 113.950 118.070 -4.120 17919 85436 1 208 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.887 -0.422 17919 85437 1 208 . 1 1 64 64 GLU C C 64 175.250 175.250 176.460 -1.210 17919 85438 1 208 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.788 0.101 17919 85439 1 208 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.623 -2.723 17919 85440 1 208 . 1 1 64 64 GLU H H 64 9.280 9.280 9.039 0.241 17919 85441 1 208 . 1 1 65 65 SER N N 65 114.730 114.730 114.983 -0.253 17919 85442 1 208 . 1 1 65 65 SER HA H 65 4.640 4.640 4.455 0.185 17919 85443 1 208 . 1 1 65 65 SER C C 65 172.160 172.160 173.715 -1.555 17919 85444 1 208 . 1 1 65 65 SER CA C 65 60.890 60.890 60.817 0.073 17919 85445 1 208 . 1 1 65 65 SER CB C 65 64.910 64.910 63.858 1.053 17919 85446 1 208 . 1 1 65 65 SER H H 65 7.670 7.670 7.648 0.022 17919 85447 1 208 . 1 1 66 66 THR N N 66 117.110 117.110 119.446 -2.336 17919 85448 1 208 . 1 1 66 66 THR HA H 66 5.270 5.270 5.187 0.083 17919 85449 1 208 . 1 1 66 66 THR C C 66 173.950 173.950 174.101 -0.151 17919 85450 1 208 . 1 1 66 66 THR CA C 66 62.340 62.340 61.959 0.381 17919 85451 1 208 . 1 1 66 66 THR CB C 66 70.080 70.080 69.842 0.238 17919 85452 1 208 . 1 1 66 66 THR H H 66 8.730 8.730 8.491 0.239 17919 85453 1 208 . 1 1 67 67 LEU N N 67 127.110 127.110 127.800 -0.690 17919 85454 1 208 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.835 0.225 17919 85455 1 208 . 1 1 67 67 LEU C C 67 175.770 175.770 175.408 0.362 17919 85456 1 208 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.126 -0.226 17919 85457 1 208 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.505 -0.245 17919 85458 1 208 . 1 1 67 67 LEU H H 67 9.410 9.410 9.218 0.192 17919 85459 1 208 . 1 1 68 68 HIS N N 68 118.380 118.380 123.060 -4.680 17919 85460 1 208 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.421 -0.181 17919 85461 1 208 . 1 1 68 68 HIS C C 68 173.150 173.150 173.674 -0.524 17919 85462 1 208 . 1 1 68 68 HIS CA C 68 55.000 55.000 53.592 1.408 17919 85463 1 208 . 1 1 68 68 HIS CB C 68 30.530 30.530 30.925 -0.395 17919 85464 1 208 . 1 1 68 68 HIS H H 68 9.230 9.230 9.164 0.066 17919 85465 1 208 . 1 1 69 69 LEU N N 69 124.460 124.460 130.942 -6.482 17919 85466 1 208 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.033 0.157 17919 85467 1 208 . 1 1 69 69 LEU C C 69 175.270 175.270 174.120 1.150 17919 85468 1 208 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.593 0.297 17919 85469 1 208 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.730 -0.350 17919 85470 1 208 . 1 1 69 69 LEU H H 69 8.340 8.340 9.193 -0.853 17919 85471 1 208 . 1 1 70 70 VAL N N 70 126.940 126.940 127.712 -0.772 17919 85472 1 208 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.417 -0.067 17919 85473 1 208 . 1 1 70 70 VAL C C 70 174.000 174.000 174.579 -0.579 17919 85474 1 208 . 1 1 70 70 VAL CA C 70 60.800 60.800 61.110 -0.310 17919 85475 1 208 . 1 1 70 70 VAL CB C 70 34.910 34.910 34.532 0.378 17919 85476 1 208 . 1 1 70 70 VAL H H 70 9.200 9.200 9.117 0.083 17919 85477 1 208 . 1 1 71 71 LEU N N 71 123.130 123.130 124.542 -1.412 17919 85478 1 208 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.275 -0.215 17919 85479 1 208 . 1 1 71 71 LEU C C 71 177.830 177.830 176.698 1.132 17919 85480 1 208 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.603 0.336 17919 85481 1 208 . 1 1 71 71 LEU CB C 71 42.850 42.850 44.148 -1.298 17919 85482 1 208 . 1 1 71 71 LEU H H 71 8.120 8.120 8.561 -0.441 17919 85483 1 208 . 1 1 72 72 ARG N N 72 123.490 123.490 121.175 2.315 17919 85484 1 208 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.734 -0.433 17919 85485 1 208 . 1 1 72 72 ARG C C 72 175.350 175.350 174.502 0.848 17919 85486 1 208 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.397 0.213 17919 85487 1 208 . 1 1 72 72 ARG CB C 72 31.350 31.350 32.617 -1.266 17919 85488 1 208 . 1 1 72 72 ARG H H 72 8.580 8.580 8.327 0.253 17919 85489 1 209 . 1 1 2 2 GLN N N 2 123.220 123.220 123.356 -0.136 17919 85490 1 209 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.404 -0.155 17919 85491 1 209 . 1 1 2 2 GLN C C 2 175.920 175.920 175.051 0.869 17919 85492 1 209 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.424 0.656 17919 85493 1 209 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.513 0.247 17919 85494 1 209 . 1 1 2 2 GLN H H 2 8.900 8.900 8.423 0.477 17919 85495 1 209 . 1 1 3 3 ILE N N 3 115.340 115.340 118.492 -3.152 17919 85496 1 209 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.731 -0.518 17919 85497 1 209 . 1 1 3 3 ILE C C 3 172.450 172.450 173.232 -0.782 17919 85498 1 209 . 1 1 3 3 ILE CA C 3 59.570 59.570 58.880 0.690 17919 85499 1 209 . 1 1 3 3 ILE CB C 3 42.210 42.210 42.080 0.130 17919 85500 1 209 . 1 1 3 3 ILE H H 3 8.320 8.320 8.214 0.106 17919 85501 1 209 . 1 1 4 4 PHE N N 4 118.110 118.110 119.133 -1.023 17919 85502 1 209 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.600 0.030 17919 85503 1 209 . 1 1 4 4 PHE C C 4 175.320 175.320 175.450 -0.130 17919 85504 1 209 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.588 -0.378 17919 85505 1 209 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.982 -0.502 17919 85506 1 209 . 1 1 4 4 PHE H H 4 8.610 8.610 8.848 -0.238 17919 85507 1 209 . 1 1 5 5 VAL N N 5 121.000 121.000 121.351 -0.351 17919 85508 1 209 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.752 -0.027 17919 85509 1 209 . 1 1 5 5 VAL C C 5 174.870 174.870 174.257 0.613 17919 85510 1 209 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.436 -0.816 17919 85511 1 209 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.368 -0.138 17919 85512 1 209 . 1 1 5 5 VAL H H 5 9.300 9.300 9.332 -0.032 17919 85513 1 209 . 1 1 6 6 LYS N N 6 127.520 127.520 129.332 -1.812 17919 85514 1 209 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.446 -0.079 17919 85515 1 209 . 1 1 6 6 LYS C C 6 177.140 177.140 175.661 1.479 17919 85516 1 209 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.316 0.203 17919 85517 1 209 . 1 1 6 6 LYS CB C 6 35.050 35.050 36.093 -1.043 17919 85518 1 209 . 1 1 6 6 LYS H H 6 8.820 8.820 9.389 -0.569 17919 85519 1 209 . 1 1 7 7 THR N N 7 115.400 115.400 121.560 -6.160 17919 85520 1 209 . 1 1 7 7 THR HA H 7 4.970 4.970 5.015 -0.045 17919 85521 1 209 . 1 1 7 7 THR C C 7 176.910 176.910 175.555 1.355 17919 85522 1 209 . 1 1 7 7 THR CA C 7 60.470 60.470 61.565 -1.095 17919 85523 1 209 . 1 1 7 7 THR CB C 7 70.630 70.630 70.778 -0.148 17919 85524 1 209 . 1 1 7 7 THR H H 7 8.730 8.730 9.148 -0.418 17919 85525 1 209 . 1 1 8 8 LEU N N 8 121.330 121.330 123.629 -2.299 17919 85526 1 209 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.199 0.111 17919 85527 1 209 . 1 1 8 8 LEU C C 8 178.800 178.800 177.127 1.673 17919 85528 1 209 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.581 -0.001 17919 85529 1 209 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.426 -0.456 17919 85530 1 209 . 1 1 8 8 LEU H H 8 9.100 9.100 8.566 0.534 17919 85531 1 209 . 1 1 9 9 THR N N 9 105.590 105.590 106.627 -1.037 17919 85532 1 209 . 1 1 9 9 THR HA H 9 4.428 4.428 4.398 0.030 17919 85533 1 209 . 1 1 9 9 THR C C 9 175.520 175.520 175.583 -0.063 17919 85534 1 209 . 1 1 9 9 THR CA C 9 61.400 61.400 61.560 -0.160 17919 85535 1 209 . 1 1 9 9 THR CB C 9 69.140 69.140 68.386 0.754 17919 85536 1 209 . 1 1 9 9 THR H H 9 7.630 7.630 7.677 -0.047 17919 85537 1 209 . 1 1 10 10 GLY N N 10 108.890 108.890 111.141 -2.251 17919 85538 1 209 . 1 1 10 10 GLY C C 10 174.070 174.070 173.422 0.648 17919 85539 1 209 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.151 0.309 17919 85540 1 209 . 1 1 10 10 GLY H H 10 7.810 7.810 8.166 -0.356 17919 85541 1 209 . 1 1 11 11 LYS N N 11 121.600 121.600 120.355 1.245 17919 85542 1 209 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.710 -0.349 17919 85543 1 209 . 1 1 11 11 LYS C C 11 175.940 175.940 175.091 0.849 17919 85544 1 209 . 1 1 11 11 LYS CA C 11 56.280 56.280 54.872 1.408 17919 85545 1 209 . 1 1 11 11 LYS CB C 11 33.200 33.200 34.594 -1.394 17919 85546 1 209 . 1 1 11 11 LYS H H 11 7.280 7.280 7.527 -0.247 17919 85547 1 209 . 1 1 12 12 THR N N 12 120.440 120.440 120.357 0.083 17919 85548 1 209 . 1 1 12 12 THR HA H 12 5.046 5.046 5.364 -0.318 17919 85549 1 209 . 1 1 12 12 THR C C 12 174.320 174.320 173.915 0.405 17919 85550 1 209 . 1 1 12 12 THR CA C 12 62.390 62.390 61.411 0.979 17919 85551 1 209 . 1 1 12 12 THR CB C 12 69.910 69.910 70.764 -0.854 17919 85552 1 209 . 1 1 12 12 THR H H 12 8.650 8.650 8.367 0.283 17919 85553 1 209 . 1 1 13 13 ILE N N 13 127.110 127.110 122.071 5.039 17919 85554 1 209 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.904 -0.360 17919 85555 1 209 . 1 1 13 13 ILE C C 13 175.220 175.220 174.195 1.025 17919 85556 1 209 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.161 0.819 17919 85557 1 209 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.559 -0.609 17919 85558 1 209 . 1 1 13 13 ILE H H 13 9.450 9.450 9.275 0.175 17919 85559 1 209 . 1 1 14 14 THR N N 14 121.520 121.520 119.478 2.042 17919 85560 1 209 . 1 1 14 14 THR HA H 14 4.964 4.964 5.165 -0.201 17919 85561 1 209 . 1 1 14 14 THR C C 14 173.790 173.790 173.715 0.075 17919 85562 1 209 . 1 1 14 14 THR CA C 14 61.940 61.940 60.485 1.455 17919 85563 1 209 . 1 1 14 14 THR CB C 14 69.650 69.650 69.891 -0.241 17919 85564 1 209 . 1 1 14 14 THR H H 14 8.710 8.710 8.410 0.300 17919 85565 1 209 . 1 1 15 15 LEU N N 15 124.800 124.800 126.509 -1.709 17919 85566 1 209 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.755 0.025 17919 85567 1 209 . 1 1 15 15 LEU C C 15 174.670 174.670 174.875 -0.205 17919 85568 1 209 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.279 -0.449 17919 85569 1 209 . 1 1 15 15 LEU CB C 15 47.070 47.070 46.165 0.905 17919 85570 1 209 . 1 1 15 15 LEU H H 15 8.710 8.710 8.818 -0.108 17919 85571 1 209 . 1 1 16 16 GLU N N 16 122.160 122.160 123.572 -1.412 17919 85572 1 209 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.267 -0.350 17919 85573 1 209 . 1 1 16 16 GLU C C 16 175.860 175.860 175.102 0.758 17919 85574 1 209 . 1 1 16 16 GLU CA C 16 54.820 54.820 54.892 -0.072 17919 85575 1 209 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.747 -1.297 17919 85576 1 209 . 1 1 16 16 GLU H H 16 8.140 8.140 8.340 -0.200 17919 85577 1 209 . 1 1 17 17 VAL N N 17 117.210 117.210 121.422 -4.212 17919 85578 1 209 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.607 0.107 17919 85579 1 209 . 1 1 17 17 VAL C C 17 174.160 174.160 174.437 -0.277 17919 85580 1 209 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.083 -0.653 17919 85581 1 209 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.624 0.776 17919 85582 1 209 . 1 1 17 17 VAL H H 17 8.900 8.900 8.678 0.222 17919 85583 1 209 . 1 1 18 18 GLU N N 18 118.990 118.990 121.414 -2.424 17919 85584 1 209 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.753 0.326 17919 85585 1 209 . 1 1 18 18 GLU C C 18 176.160 176.160 176.005 0.155 17919 85586 1 209 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.591 0.129 17919 85587 1 209 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.913 -0.604 17919 85588 1 209 . 1 1 18 18 GLU H H 18 8.640 8.640 8.385 0.255 17919 85589 1 209 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.452 -0.311 17919 85590 1 209 . 1 1 19 19 PRO C C 19 175.310 175.310 177.761 -2.451 17919 85591 1 209 . 1 1 19 19 PRO CA C 19 65.470 65.470 64.574 0.896 17919 85592 1 209 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.144 -0.194 17919 85593 1 209 . 1 1 20 20 SER N N 20 103.400 103.400 113.542 -10.142 17919 85594 1 209 . 1 1 20 20 SER HA H 20 4.370 4.370 4.341 0.029 17919 85595 1 209 . 1 1 20 20 SER C C 20 174.660 174.660 174.591 0.069 17919 85596 1 209 . 1 1 20 20 SER CA C 20 57.400 57.400 59.234 -1.835 17919 85597 1 209 . 1 1 20 20 SER CB C 20 63.370 63.370 62.955 0.415 17919 85598 1 209 . 1 1 20 20 SER H H 20 7.040 7.040 8.311 -1.271 17919 85599 1 209 . 1 1 21 21 ASP N N 21 123.480 123.480 122.195 1.285 17919 85600 1 209 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.805 -0.110 17919 85601 1 209 . 1 1 21 21 ASP C C 21 176.360 176.360 175.182 1.178 17919 85602 1 209 . 1 1 21 21 ASP CA C 21 55.700 55.700 53.359 2.341 17919 85603 1 209 . 1 1 21 21 ASP CB C 21 40.800 40.800 42.125 -1.325 17919 85604 1 209 . 1 1 21 21 ASP H H 21 8.030 8.030 7.579 0.451 17919 85605 1 209 . 1 1 22 22 THR N N 22 108.800 108.800 111.439 -2.639 17919 85606 1 209 . 1 1 22 22 THR HA H 22 4.920 4.920 4.916 0.004 17919 85607 1 209 . 1 1 22 22 THR C C 22 176.750 176.750 176.246 0.504 17919 85608 1 209 . 1 1 22 22 THR CA C 22 59.690 59.690 61.759 -2.069 17919 85609 1 209 . 1 1 22 22 THR CB C 22 71.200 71.200 71.103 0.097 17919 85610 1 209 . 1 1 22 22 THR H H 22 7.900 7.900 8.171 -0.271 17919 85611 1 209 . 1 1 23 23 ILE N N 23 121.190 121.190 122.067 -0.877 17919 85612 1 209 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.942 -0.285 17919 85613 1 209 . 1 1 23 23 ILE C C 23 179.040 179.040 177.775 1.265 17919 85614 1 209 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.106 0.153 17919 85615 1 209 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.353 -2.003 17919 85616 1 209 . 1 1 23 23 ILE H H 23 8.560 8.560 9.063 -0.503 17919 85617 1 209 . 1 1 24 24 GLU N N 24 120.830 120.830 122.518 -1.688 17919 85618 1 209 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.925 -0.008 17919 85619 1 209 . 1 1 24 24 GLU C C 24 178.640 178.640 178.504 0.136 17919 85620 1 209 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.012 0.208 17919 85621 1 209 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.444 -1.163 17919 85622 1 209 . 1 1 24 24 GLU H H 24 9.760 9.760 8.439 1.321 17919 85623 1 209 . 1 1 25 25 ASN N N 25 120.570 120.570 117.812 2.758 17919 85624 1 209 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.481 0.044 17919 85625 1 209 . 1 1 25 25 ASN C C 25 178.380 178.380 178.150 0.230 17919 85626 1 209 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.883 0.177 17919 85627 1 209 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.078 0.372 17919 85628 1 209 . 1 1 25 25 ASN H H 25 7.920 7.920 7.762 0.158 17919 85629 1 209 . 1 1 26 26 VAL N N 26 121.710 121.710 121.283 0.427 17919 85630 1 209 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.548 -0.151 17919 85631 1 209 . 1 1 26 26 VAL C C 26 177.950 177.950 177.403 0.547 17919 85632 1 209 . 1 1 26 26 VAL CA C 26 67.660 67.660 67.385 0.275 17919 85633 1 209 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.685 -0.845 17919 85634 1 209 . 1 1 26 26 VAL H H 26 8.070 8.070 7.972 0.098 17919 85635 1 209 . 1 1 27 27 LYS N N 27 118.860 118.860 119.708 -0.848 17919 85636 1 209 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.150 0.430 17919 85637 1 209 . 1 1 27 27 LYS C C 27 180.550 180.550 179.022 1.528 17919 85638 1 209 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.567 -0.317 17919 85639 1 209 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.230 1.500 17919 85640 1 209 . 1 1 27 27 LYS H H 27 8.560 8.560 8.146 0.414 17919 85641 1 209 . 1 1 28 28 ALA N N 28 123.440 123.440 121.899 1.541 17919 85642 1 209 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.031 0.129 17919 85643 1 209 . 1 1 28 28 ALA C C 28 180.300 180.300 178.994 1.306 17919 85644 1 209 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.907 0.463 17919 85645 1 209 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.297 -0.587 17919 85646 1 209 . 1 1 28 28 ALA H H 28 8.060 8.060 8.512 -0.452 17919 85647 1 209 . 1 1 29 29 LYS N N 29 119.940 119.940 120.044 -0.104 17919 85648 1 209 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.040 0.167 17919 85649 1 209 . 1 1 29 29 LYS C C 29 180.320 180.320 178.910 1.410 17919 85650 1 209 . 1 1 29 29 LYS CA C 29 59.650 59.650 58.739 0.911 17919 85651 1 209 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.057 1.233 17919 85652 1 209 . 1 1 29 29 LYS H H 29 7.850 7.850 7.778 0.072 17919 85653 1 209 . 1 1 30 30 ILE N N 30 121.080 121.080 119.702 1.378 17919 85654 1 209 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.625 -0.118 17919 85655 1 209 . 1 1 30 30 ILE C C 30 178.310 178.310 177.601 0.709 17919 85656 1 209 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.124 1.026 17919 85657 1 209 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.692 -0.892 17919 85658 1 209 . 1 1 30 30 ILE H H 30 8.280 8.280 8.191 0.089 17919 85659 1 209 . 1 1 31 31 GLN N N 31 123.490 123.490 121.164 2.326 17919 85660 1 209 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.081 -0.252 17919 85661 1 209 . 1 1 31 31 GLN C C 31 178.890 178.890 178.040 0.850 17919 85662 1 209 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.099 0.901 17919 85663 1 209 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.599 -0.879 17919 85664 1 209 . 1 1 31 31 GLN H H 31 8.580 8.580 7.929 0.651 17919 85665 1 209 . 1 1 32 32 ASP N N 32 119.360 119.360 118.578 0.782 17919 85666 1 209 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.425 -0.071 17919 85667 1 209 . 1 1 32 32 ASP C C 32 177.250 177.250 178.222 -0.972 17919 85668 1 209 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.628 0.562 17919 85669 1 209 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.919 -0.339 17919 85670 1 209 . 1 1 32 32 ASP H H 32 8.010 8.010 7.894 0.116 17919 85671 1 209 . 1 1 33 33 LYS N N 33 115.130 115.130 118.351 -3.221 17919 85672 1 209 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.288 0.049 17919 85673 1 209 . 1 1 33 33 LYS C C 33 177.870 177.870 178.133 -0.263 17919 85674 1 209 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.289 -0.239 17919 85675 1 209 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.573 0.597 17919 85676 1 209 . 1 1 33 33 LYS H H 33 7.430 7.430 7.558 -0.128 17919 85677 1 209 . 1 1 34 34 GLU N N 34 113.870 113.870 114.628 -0.758 17919 85678 1 209 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.487 0.138 17919 85679 1 209 . 1 1 34 34 GLU C C 34 177.840 177.840 176.731 1.109 17919 85680 1 209 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.645 -0.475 17919 85681 1 209 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.407 1.253 17919 85682 1 209 . 1 1 34 34 GLU H H 34 8.740 8.740 8.168 0.572 17919 85683 1 209 . 1 1 35 35 GLY N N 35 108.650 108.650 108.846 -0.196 17919 85684 1 209 . 1 1 35 35 GLY C C 35 173.960 173.960 174.530 -0.570 17919 85685 1 209 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.921 0.159 17919 85686 1 209 . 1 1 35 35 GLY H H 35 8.530 8.530 7.814 0.716 17919 85687 1 209 . 1 1 36 36 ILE N N 36 119.880 119.880 121.535 -1.655 17919 85688 1 209 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.420 0.025 17919 85689 1 209 . 1 1 36 36 ILE C C 36 173.590 173.590 174.020 -0.430 17919 85690 1 209 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.909 -0.159 17919 85691 1 209 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.883 1.697 17919 85692 1 209 . 1 1 36 36 ILE H H 36 6.150 6.150 7.465 -1.315 17919 85693 1 209 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.849 -0.215 17919 85694 1 209 . 1 1 37 37 PRO C C 37 176.940 176.940 175.931 1.009 17919 85695 1 209 . 1 1 37 37 PRO CA C 37 61.660 61.660 60.948 0.712 17919 85696 1 209 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.213 0.637 17919 85697 1 209 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.195 -0.078 17919 85698 1 209 . 1 1 38 38 PRO C C 38 178.320 178.320 177.673 0.647 17919 85699 1 209 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.243 1.017 17919 85700 1 209 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.654 1.236 17919 85701 1 209 . 1 1 39 39 ASP N N 39 113.380 113.380 117.206 -3.826 17919 85702 1 209 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.330 0.100 17919 85703 1 209 . 1 1 39 39 ASP C C 39 177.090 177.090 177.424 -0.334 17919 85704 1 209 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.926 -1.286 17919 85705 1 209 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.456 -0.916 17919 85706 1 209 . 1 1 39 39 ASP H H 39 8.550 8.550 8.544 0.006 17919 85707 1 209 . 1 1 40 40 GLN N N 40 116.780 116.780 118.551 -1.771 17919 85708 1 209 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.211 0.253 17919 85709 1 209 . 1 1 40 40 GLN C C 40 175.380 175.380 175.899 -0.519 17919 85710 1 209 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.894 -1.254 17919 85711 1 209 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.640 0.500 17919 85712 1 209 . 1 1 40 40 GLN H H 40 7.820 7.820 8.158 -0.338 17919 85713 1 209 . 1 1 41 41 GLN N N 41 117.720 117.720 118.778 -1.058 17919 85714 1 209 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.609 -0.365 17919 85715 1 209 . 1 1 41 41 GLN C C 41 176.300 176.300 175.862 0.438 17919 85716 1 209 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.377 0.093 17919 85717 1 209 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.361 2.289 17919 85718 1 209 . 1 1 41 41 GLN H H 41 7.480 7.480 7.458 0.022 17919 85719 1 209 . 1 1 42 42 ARG N N 42 122.680 122.680 124.952 -2.272 17919 85720 1 209 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.622 -0.122 17919 85721 1 209 . 1 1 42 42 ARG C C 42 174.050 174.050 174.357 -0.307 17919 85722 1 209 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.436 0.614 17919 85723 1 209 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.297 -0.547 17919 85724 1 209 . 1 1 42 42 ARG H H 42 8.530 8.530 9.027 -0.497 17919 85725 1 209 . 1 1 43 43 LEU N N 43 124.040 124.040 126.706 -2.666 17919 85726 1 209 . 1 1 43 43 LEU C C 43 175.290 175.290 176.279 -0.989 17919 85727 1 209 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.683 -1.703 17919 85728 1 209 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.082 2.708 17919 85729 1 209 . 1 1 43 43 LEU H H 43 8.820 8.820 8.671 0.149 17919 85730 1 209 . 1 1 44 44 ILE N N 44 121.920 121.920 122.405 -0.485 17919 85731 1 209 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.676 0.316 17919 85732 1 209 . 1 1 44 44 ILE C C 44 176.060 176.060 173.968 2.092 17919 85733 1 209 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.382 -1.402 17919 85734 1 209 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.725 -0.305 17919 85735 1 209 . 1 1 44 44 ILE H H 44 9.030 9.030 8.960 0.070 17919 85736 1 209 . 1 1 45 45 PHE N N 45 125.390 125.390 127.231 -1.841 17919 85737 1 209 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.066 -0.021 17919 85738 1 209 . 1 1 45 45 PHE C C 45 174.470 174.470 174.725 -0.255 17919 85739 1 209 . 1 1 45 45 PHE CA C 45 57.020 57.020 55.874 1.146 17919 85740 1 209 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.514 1.246 17919 85741 1 209 . 1 1 45 45 PHE H H 45 8.830 8.830 9.227 -0.397 17919 85742 1 209 . 1 1 46 46 ALA N N 46 132.200 132.200 130.474 1.726 17919 85743 1 209 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.783 -0.093 17919 85744 1 209 . 1 1 46 46 ALA C C 46 177.290 177.290 177.554 -0.264 17919 85745 1 209 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.828 -0.288 17919 85746 1 209 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.669 -0.099 17919 85747 1 209 . 1 1 46 46 ALA H H 46 8.810 8.810 9.029 -0.219 17919 85748 1 209 . 1 1 47 47 GLY N N 47 102.340 102.340 104.326 -1.986 17919 85749 1 209 . 1 1 47 47 GLY C C 47 173.810 173.810 174.352 -0.542 17919 85750 1 209 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.275 0.075 17919 85751 1 209 . 1 1 47 47 GLY H H 47 8.130 8.130 8.603 -0.473 17919 85752 1 209 . 1 1 48 48 LYS N N 48 121.570 121.570 121.131 0.439 17919 85753 1 209 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.567 0.055 17919 85754 1 209 . 1 1 48 48 LYS C C 48 174.700 174.700 175.401 -0.701 17919 85755 1 209 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.970 -0.420 17919 85756 1 209 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.075 0.455 17919 85757 1 209 . 1 1 48 48 LYS H H 48 7.980 7.980 8.273 -0.293 17919 85758 1 209 . 1 1 49 49 GLN N N 49 122.410 122.410 124.824 -2.414 17919 85759 1 209 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.490 0.070 17919 85760 1 209 . 1 1 49 49 GLN C C 49 175.670 175.670 175.508 0.162 17919 85761 1 209 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.692 0.048 17919 85762 1 209 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.372 -0.372 17919 85763 1 209 . 1 1 49 49 GLN H H 49 8.600 8.600 8.573 0.027 17919 85764 1 209 . 1 1 50 50 LEU N N 50 125.520 125.520 128.197 -2.677 17919 85765 1 209 . 1 1 50 50 LEU HA H 50 4.090 4.090 3.916 0.174 17919 85766 1 209 . 1 1 50 50 LEU C C 50 176.660 176.660 175.715 0.945 17919 85767 1 209 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.315 -0.075 17919 85768 1 209 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.249 -0.679 17919 85769 1 209 . 1 1 50 50 LEU H H 50 8.530 8.530 8.045 0.485 17919 85770 1 209 . 1 1 51 51 GLU N N 51 122.940 122.940 121.822 1.118 17919 85771 1 209 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.557 -0.069 17919 85772 1 209 . 1 1 51 51 GLU C C 51 175.870 175.870 176.914 -1.044 17919 85773 1 209 . 1 1 51 51 GLU CA C 51 55.960 55.960 54.673 1.287 17919 85774 1 209 . 1 1 51 51 GLU CB C 51 31.570 31.570 33.068 -1.498 17919 85775 1 209 . 1 1 51 51 GLU H H 51 8.400 8.400 8.181 0.219 17919 85776 1 209 . 1 1 52 52 ASP N N 52 120.030 120.030 128.180 -8.150 17919 85777 1 209 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.295 0.064 17919 85778 1 209 . 1 1 52 52 ASP C C 52 177.330 177.330 177.792 -0.462 17919 85779 1 209 . 1 1 52 52 ASP CA C 52 56.960 56.960 58.403 -1.443 17919 85780 1 209 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.915 -0.065 17919 85781 1 209 . 1 1 52 52 ASP H H 52 8.160 8.160 8.969 -0.809 17919 85782 1 209 . 1 1 53 53 GLY N N 53 106.660 106.660 105.010 1.650 17919 85783 1 209 . 1 1 53 53 GLY C C 53 174.870 174.870 174.220 0.650 17919 85784 1 209 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.813 0.357 17919 85785 1 209 . 1 1 53 53 GLY H H 53 9.390 9.390 8.020 1.370 17919 85786 1 209 . 1 1 54 54 ARG N N 54 119.050 119.050 120.392 -1.342 17919 85787 1 209 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.646 0.049 17919 85788 1 209 . 1 1 54 54 ARG C C 54 175.350 175.350 175.323 0.027 17919 85789 1 209 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.548 -0.158 17919 85790 1 209 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.121 -0.471 17919 85791 1 209 . 1 1 54 54 ARG H H 54 7.460 7.460 7.591 -0.131 17919 85792 1 209 . 1 1 55 55 THR N N 55 108.400 108.400 111.194 -2.794 17919 85793 1 209 . 1 1 55 55 THR HA H 55 5.240 5.240 4.910 0.330 17919 85794 1 209 . 1 1 55 55 THR C C 55 176.560 176.560 176.118 0.442 17919 85795 1 209 . 1 1 55 55 THR CA C 55 59.690 59.690 60.072 -0.382 17919 85796 1 209 . 1 1 55 55 THR CB C 55 72.260 72.260 70.998 1.262 17919 85797 1 209 . 1 1 55 55 THR H H 55 8.730 8.730 8.692 0.038 17919 85798 1 209 . 1 1 56 56 LEU N N 56 117.920 117.920 121.657 -3.737 17919 85799 1 209 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.919 0.141 17919 85800 1 209 . 1 1 56 56 LEU C C 56 180.810 180.810 179.006 1.804 17919 85801 1 209 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.590 0.120 17919 85802 1 209 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.436 -1.066 17919 85803 1 209 . 1 1 56 56 LEU H H 56 8.140 8.140 8.805 -0.665 17919 85804 1 209 . 1 1 57 57 SER N N 57 113.330 113.330 113.521 -0.191 17919 85805 1 209 . 1 1 57 57 SER HA H 57 4.370 4.370 4.234 0.136 17919 85806 1 209 . 1 1 57 57 SER C C 57 178.310 178.310 175.794 2.516 17919 85807 1 209 . 1 1 57 57 SER CA C 57 61.080 61.080 61.604 -0.524 17919 85808 1 209 . 1 1 57 57 SER CB C 57 62.530 62.530 62.743 -0.214 17919 85809 1 209 . 1 1 57 57 SER H H 57 8.470 8.470 8.241 0.229 17919 85810 1 209 . 1 1 58 58 ASP N N 58 124.190 124.190 121.444 2.746 17919 85811 1 209 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.386 -0.089 17919 85812 1 209 . 1 1 58 58 ASP C C 58 177.400 177.400 177.392 0.008 17919 85813 1 209 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.530 0.650 17919 85814 1 209 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.626 -0.526 17919 85815 1 209 . 1 1 58 58 ASP H H 58 7.930 7.930 7.627 0.303 17919 85816 1 209 . 1 1 59 59 TYR N N 59 115.510 115.510 116.301 -0.791 17919 85817 1 209 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.589 0.081 17919 85818 1 209 . 1 1 59 59 TYR C C 59 174.700 174.700 174.878 -0.178 17919 85819 1 209 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.340 0.910 17919 85820 1 209 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.891 1.179 17919 85821 1 209 . 1 1 59 59 TYR H H 59 7.250 7.250 7.372 -0.122 17919 85822 1 209 . 1 1 60 60 ASN N N 60 115.900 115.900 117.377 -1.477 17919 85823 1 209 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.395 -0.040 17919 85824 1 209 . 1 1 60 60 ASN C C 60 174.340 174.340 174.898 -0.558 17919 85825 1 209 . 1 1 60 60 ASN CA C 60 54.120 54.120 53.897 0.223 17919 85826 1 209 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.243 0.167 17919 85827 1 209 . 1 1 60 60 ASN H H 60 8.150 8.150 7.442 0.708 17919 85828 1 209 . 1 1 61 61 ILE N N 61 118.600 118.600 120.810 -2.210 17919 85829 1 209 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.941 -0.548 17919 85830 1 209 . 1 1 61 61 ILE C C 61 174.610 174.610 175.356 -0.746 17919 85831 1 209 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.185 0.234 17919 85832 1 209 . 1 1 61 61 ILE CB C 61 36.740 36.740 38.075 -1.335 17919 85833 1 209 . 1 1 61 61 ILE H H 61 7.250 7.250 7.950 -0.700 17919 85834 1 209 . 1 1 62 62 GLN N N 62 124.740 124.740 124.441 0.299 17919 85835 1 209 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.545 -0.039 17919 85836 1 209 . 1 1 62 62 GLN C C 62 175.970 175.970 174.495 1.475 17919 85837 1 209 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.139 0.521 17919 85838 1 209 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.946 -0.296 17919 85839 1 209 . 1 1 62 62 GLN H H 62 7.610 7.610 8.253 -0.643 17919 85840 1 209 . 1 1 63 63 LYS N N 63 120.300 120.300 122.281 -1.981 17919 85841 1 209 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.926 0.075 17919 85842 1 209 . 1 1 63 63 LYS C C 63 175.810 175.810 177.079 -1.269 17919 85843 1 209 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.431 -0.641 17919 85844 1 209 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.293 0.357 17919 85845 1 209 . 1 1 63 63 LYS H H 63 8.490 8.490 8.556 -0.066 17919 85846 1 209 . 1 1 64 64 GLU N N 64 113.950 113.950 120.883 -6.933 17919 85847 1 209 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.744 -0.280 17919 85848 1 209 . 1 1 64 64 GLU C C 64 175.250 175.250 175.562 -0.312 17919 85849 1 209 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.913 -0.023 17919 85850 1 209 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.987 -3.087 17919 85851 1 209 . 1 1 64 64 GLU H H 64 9.280 9.280 8.762 0.518 17919 85852 1 209 . 1 1 65 65 SER N N 65 114.730 114.730 114.153 0.577 17919 85853 1 209 . 1 1 65 65 SER HA H 65 4.640 4.640 4.678 -0.038 17919 85854 1 209 . 1 1 65 65 SER C C 65 172.160 172.160 174.261 -2.101 17919 85855 1 209 . 1 1 65 65 SER CA C 65 60.890 60.890 59.123 1.767 17919 85856 1 209 . 1 1 65 65 SER CB C 65 64.910 64.910 64.736 0.174 17919 85857 1 209 . 1 1 65 65 SER H H 65 7.670 7.670 7.701 -0.031 17919 85858 1 209 . 1 1 66 66 THR N N 66 117.110 117.110 119.692 -2.582 17919 85859 1 209 . 1 1 66 66 THR HA H 66 5.270 5.270 5.290 -0.020 17919 85860 1 209 . 1 1 66 66 THR C C 66 173.950 173.950 174.390 -0.440 17919 85861 1 209 . 1 1 66 66 THR CA C 66 62.340 62.340 62.509 -0.169 17919 85862 1 209 . 1 1 66 66 THR CB C 66 70.080 70.080 70.531 -0.451 17919 85863 1 209 . 1 1 66 66 THR H H 66 8.730 8.730 8.574 0.156 17919 85864 1 209 . 1 1 67 67 LEU N N 67 127.110 127.110 127.102 0.008 17919 85865 1 209 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.754 0.306 17919 85866 1 209 . 1 1 67 67 LEU C C 67 175.770 175.770 175.113 0.657 17919 85867 1 209 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.574 0.326 17919 85868 1 209 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.489 -0.230 17919 85869 1 209 . 1 1 67 67 LEU H H 67 9.410 9.410 9.253 0.157 17919 85870 1 209 . 1 1 68 68 HIS N N 68 118.380 118.380 122.450 -4.070 17919 85871 1 209 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.419 -0.179 17919 85872 1 209 . 1 1 68 68 HIS C C 68 173.150 173.150 173.736 -0.586 17919 85873 1 209 . 1 1 68 68 HIS CA C 68 55.000 55.000 53.990 1.010 17919 85874 1 209 . 1 1 68 68 HIS CB C 68 30.530 30.530 31.705 -1.175 17919 85875 1 209 . 1 1 68 68 HIS H H 68 9.230 9.230 8.913 0.317 17919 85876 1 209 . 1 1 69 69 LEU N N 69 124.460 124.460 130.256 -5.796 17919 85877 1 209 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.567 0.623 17919 85878 1 209 . 1 1 69 69 LEU C C 69 175.270 175.270 173.942 1.328 17919 85879 1 209 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.447 0.443 17919 85880 1 209 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.637 -0.257 17919 85881 1 209 . 1 1 69 69 LEU H H 69 8.340 8.340 8.891 -0.551 17919 85882 1 209 . 1 1 70 70 VAL N N 70 126.940 126.940 126.828 0.112 17919 85883 1 209 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.239 0.111 17919 85884 1 209 . 1 1 70 70 VAL C C 70 174.000 174.000 174.880 -0.880 17919 85885 1 209 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.895 -0.095 17919 85886 1 209 . 1 1 70 70 VAL CB C 70 34.910 34.910 32.973 1.937 17919 85887 1 209 . 1 1 70 70 VAL H H 70 9.200 9.200 8.631 0.569 17919 85888 1 209 . 1 1 71 71 LEU N N 71 123.130 123.130 125.996 -2.866 17919 85889 1 209 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.770 0.290 17919 85890 1 209 . 1 1 71 71 LEU C C 71 177.830 177.830 176.846 0.984 17919 85891 1 209 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.971 -0.031 17919 85892 1 209 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.944 -0.094 17919 85893 1 209 . 1 1 71 71 LEU H H 71 8.120 8.120 8.438 -0.318 17919 85894 1 209 . 1 1 72 72 ARG N N 72 123.490 123.490 123.903 -0.413 17919 85895 1 209 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.297 0.004 17919 85896 1 209 . 1 1 72 72 ARG C C 72 175.350 175.350 175.360 -0.010 17919 85897 1 209 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.869 -0.259 17919 85898 1 209 . 1 1 72 72 ARG CB C 72 31.350 31.350 31.075 0.275 17919 85899 1 209 . 1 1 72 72 ARG H H 72 8.580 8.580 8.633 -0.053 17919 85900 1 210 . 1 1 2 2 GLN N N 2 123.220 123.220 120.755 2.465 17919 85901 1 210 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.348 -0.099 17919 85902 1 210 . 1 1 2 2 GLN C C 2 175.920 175.920 175.616 0.304 17919 85903 1 210 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.755 0.325 17919 85904 1 210 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.308 0.452 17919 85905 1 210 . 1 1 2 2 GLN H H 2 8.900 8.900 8.386 0.514 17919 85906 1 210 . 1 1 3 3 ILE N N 3 115.340 115.340 117.070 -1.730 17919 85907 1 210 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.618 -0.405 17919 85908 1 210 . 1 1 3 3 ILE C C 3 172.450 172.450 173.978 -1.528 17919 85909 1 210 . 1 1 3 3 ILE CA C 3 59.570 59.570 58.782 0.788 17919 85910 1 210 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.688 0.522 17919 85911 1 210 . 1 1 3 3 ILE H H 3 8.320 8.320 8.323 -0.003 17919 85912 1 210 . 1 1 4 4 PHE N N 4 118.110 118.110 119.174 -1.064 17919 85913 1 210 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.571 0.059 17919 85914 1 210 . 1 1 4 4 PHE C C 4 175.320 175.320 175.404 -0.084 17919 85915 1 210 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.279 -0.069 17919 85916 1 210 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.366 -0.886 17919 85917 1 210 . 1 1 4 4 PHE H H 4 8.610 8.610 8.505 0.105 17919 85918 1 210 . 1 1 5 5 VAL N N 5 121.000 121.000 121.546 -0.546 17919 85919 1 210 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.525 0.200 17919 85920 1 210 . 1 1 5 5 VAL C C 5 174.870 174.870 174.375 0.495 17919 85921 1 210 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.268 -0.648 17919 85922 1 210 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.451 -0.221 17919 85923 1 210 . 1 1 5 5 VAL H H 5 9.300 9.300 9.314 -0.014 17919 85924 1 210 . 1 1 6 6 LYS N N 6 127.520 127.520 129.215 -1.695 17919 85925 1 210 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.247 0.120 17919 85926 1 210 . 1 1 6 6 LYS C C 6 177.140 177.140 175.877 1.263 17919 85927 1 210 . 1 1 6 6 LYS CA C 6 54.520 54.520 53.580 0.940 17919 85928 1 210 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.026 1.024 17919 85929 1 210 . 1 1 6 6 LYS H H 6 8.820 8.820 8.878 -0.058 17919 85930 1 210 . 1 1 7 7 THR N N 7 115.400 115.400 117.316 -1.916 17919 85931 1 210 . 1 1 7 7 THR HA H 7 4.970 4.970 4.686 0.284 17919 85932 1 210 . 1 1 7 7 THR C C 7 176.910 176.910 176.452 0.458 17919 85933 1 210 . 1 1 7 7 THR CA C 7 60.470 60.470 60.619 -0.149 17919 85934 1 210 . 1 1 7 7 THR CB C 7 70.630 70.630 70.516 0.114 17919 85935 1 210 . 1 1 7 7 THR H H 7 8.730 8.730 8.697 0.033 17919 85936 1 210 . 1 1 8 8 LEU N N 8 121.330 121.330 123.221 -1.891 17919 85937 1 210 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.173 0.137 17919 85938 1 210 . 1 1 8 8 LEU C C 8 178.800 178.800 177.859 0.941 17919 85939 1 210 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.417 0.163 17919 85940 1 210 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.960 0.010 17919 85941 1 210 . 1 1 8 8 LEU H H 8 9.100 9.100 9.034 0.066 17919 85942 1 210 . 1 1 9 9 THR N N 9 105.590 105.590 108.992 -3.402 17919 85943 1 210 . 1 1 9 9 THR HA H 9 4.428 4.428 4.384 0.044 17919 85944 1 210 . 1 1 9 9 THR C C 9 175.520 175.520 175.449 0.071 17919 85945 1 210 . 1 1 9 9 THR CA C 9 61.400 61.400 61.629 -0.229 17919 85946 1 210 . 1 1 9 9 THR CB C 9 69.140 69.140 69.294 -0.154 17919 85947 1 210 . 1 1 9 9 THR H H 9 7.630 7.630 7.614 0.016 17919 85948 1 210 . 1 1 10 10 GLY N N 10 108.890 108.890 110.341 -1.451 17919 85949 1 210 . 1 1 10 10 GLY C C 10 174.070 174.070 173.484 0.586 17919 85950 1 210 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.843 0.617 17919 85951 1 210 . 1 1 10 10 GLY H H 10 7.810 7.810 7.998 -0.188 17919 85952 1 210 . 1 1 11 11 LYS N N 11 121.600 121.600 121.170 0.430 17919 85953 1 210 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.454 -0.093 17919 85954 1 210 . 1 1 11 11 LYS C C 11 175.940 175.940 175.188 0.752 17919 85955 1 210 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.096 0.184 17919 85956 1 210 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.805 -0.605 17919 85957 1 210 . 1 1 11 11 LYS H H 11 7.280 7.280 7.821 -0.541 17919 85958 1 210 . 1 1 12 12 THR N N 12 120.440 120.440 120.533 -0.093 17919 85959 1 210 . 1 1 12 12 THR HA H 12 5.046 5.046 5.297 -0.251 17919 85960 1 210 . 1 1 12 12 THR C C 12 174.320 174.320 174.302 0.018 17919 85961 1 210 . 1 1 12 12 THR CA C 12 62.390 62.390 61.117 1.273 17919 85962 1 210 . 1 1 12 12 THR CB C 12 69.910 69.910 69.948 -0.038 17919 85963 1 210 . 1 1 12 12 THR H H 12 8.650 8.650 8.352 0.298 17919 85964 1 210 . 1 1 13 13 ILE N N 13 127.110 127.110 123.099 4.011 17919 85965 1 210 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.851 -0.307 17919 85966 1 210 . 1 1 13 13 ILE C C 13 175.220 175.220 175.226 -0.006 17919 85967 1 210 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.146 0.834 17919 85968 1 210 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.680 0.270 17919 85969 1 210 . 1 1 13 13 ILE H H 13 9.450 9.450 9.024 0.426 17919 85970 1 210 . 1 1 14 14 THR N N 14 121.520 121.520 118.017 3.503 17919 85971 1 210 . 1 1 14 14 THR HA H 14 4.964 4.964 5.166 -0.202 17919 85972 1 210 . 1 1 14 14 THR C C 14 173.790 173.790 174.751 -0.961 17919 85973 1 210 . 1 1 14 14 THR CA C 14 61.940 61.940 60.615 1.325 17919 85974 1 210 . 1 1 14 14 THR CB C 14 69.650 69.650 69.671 -0.021 17919 85975 1 210 . 1 1 14 14 THR H H 14 8.710 8.710 8.408 0.302 17919 85976 1 210 . 1 1 15 15 LEU N N 15 124.800 124.800 125.694 -0.894 17919 85977 1 210 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.704 0.076 17919 85978 1 210 . 1 1 15 15 LEU C C 15 174.670 174.670 176.081 -1.411 17919 85979 1 210 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.593 -0.763 17919 85980 1 210 . 1 1 15 15 LEU CB C 15 47.070 47.070 44.188 2.882 17919 85981 1 210 . 1 1 15 15 LEU H H 15 8.710 8.710 8.146 0.564 17919 85982 1 210 . 1 1 16 16 GLU N N 16 122.160 122.160 122.776 -0.616 17919 85983 1 210 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.263 -0.346 17919 85984 1 210 . 1 1 16 16 GLU C C 16 175.860 175.860 176.138 -0.278 17919 85985 1 210 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.442 -0.622 17919 85986 1 210 . 1 1 16 16 GLU CB C 16 29.450 29.450 31.029 -1.579 17919 85987 1 210 . 1 1 16 16 GLU H H 16 8.140 8.140 8.648 -0.508 17919 85988 1 210 . 1 1 17 17 VAL N N 17 117.210 117.210 120.172 -2.962 17919 85989 1 210 . 1 1 17 17 VAL HA H 17 4.714 4.714 5.042 -0.328 17919 85990 1 210 . 1 1 17 17 VAL C C 17 174.160 174.160 174.515 -0.355 17919 85991 1 210 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.754 -0.324 17919 85992 1 210 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.887 0.513 17919 85993 1 210 . 1 1 17 17 VAL H H 17 8.900 8.900 8.783 0.117 17919 85994 1 210 . 1 1 18 18 GLU N N 18 118.990 118.990 119.534 -0.544 17919 85995 1 210 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.881 0.198 17919 85996 1 210 . 1 1 18 18 GLU C C 18 176.160 176.160 175.008 1.152 17919 85997 1 210 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.053 -0.333 17919 85998 1 210 . 1 1 18 18 GLU CB C 18 30.310 30.310 29.933 0.377 17919 85999 1 210 . 1 1 18 18 GLU H H 18 8.640 8.640 8.698 -0.058 17919 86000 1 210 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.420 -0.279 17919 86001 1 210 . 1 1 19 19 PRO C C 19 175.310 175.310 177.384 -2.074 17919 86002 1 210 . 1 1 19 19 PRO CA C 19 65.470 65.470 64.995 0.475 17919 86003 1 210 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.779 0.171 17919 86004 1 210 . 1 1 20 20 SER N N 20 103.400 103.400 112.713 -9.313 17919 86005 1 210 . 1 1 20 20 SER HA H 20 4.370 4.370 4.425 -0.055 17919 86006 1 210 . 1 1 20 20 SER C C 20 174.660 174.660 174.097 0.563 17919 86007 1 210 . 1 1 20 20 SER CA C 20 57.400 57.400 59.067 -1.667 17919 86008 1 210 . 1 1 20 20 SER CB C 20 63.370 63.370 63.298 0.072 17919 86009 1 210 . 1 1 20 20 SER H H 20 7.040 7.040 8.251 -1.211 17919 86010 1 210 . 1 1 21 21 ASP N N 21 123.480 123.480 122.954 0.526 17919 86011 1 210 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.789 -0.094 17919 86012 1 210 . 1 1 21 21 ASP C C 21 176.360 176.360 175.968 0.392 17919 86013 1 210 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.051 0.649 17919 86014 1 210 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.649 -0.849 17919 86015 1 210 . 1 1 21 21 ASP H H 21 8.030 8.030 7.642 0.388 17919 86016 1 210 . 1 1 22 22 THR N N 22 108.800 108.800 113.509 -4.709 17919 86017 1 210 . 1 1 22 22 THR HA H 22 4.920 4.920 4.758 0.162 17919 86018 1 210 . 1 1 22 22 THR C C 22 176.750 176.750 176.068 0.682 17919 86019 1 210 . 1 1 22 22 THR CA C 22 59.690 59.690 61.224 -1.534 17919 86020 1 210 . 1 1 22 22 THR CB C 22 71.200 71.200 70.611 0.589 17919 86021 1 210 . 1 1 22 22 THR H H 22 7.900 7.900 8.190 -0.290 17919 86022 1 210 . 1 1 23 23 ILE N N 23 121.190 121.190 122.259 -1.069 17919 86023 1 210 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.789 -0.132 17919 86024 1 210 . 1 1 23 23 ILE C C 23 179.040 179.040 177.661 1.379 17919 86025 1 210 . 1 1 23 23 ILE CA C 23 62.260 62.260 61.753 0.507 17919 86026 1 210 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.219 -1.869 17919 86027 1 210 . 1 1 23 23 ILE H H 23 8.560 8.560 8.425 0.135 17919 86028 1 210 . 1 1 24 24 GLU N N 24 120.830 120.830 121.392 -0.562 17919 86029 1 210 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.795 0.122 17919 86030 1 210 . 1 1 24 24 GLU C C 24 178.640 178.640 178.718 -0.078 17919 86031 1 210 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.067 0.153 17919 86032 1 210 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.433 -1.153 17919 86033 1 210 . 1 1 24 24 GLU H H 24 9.760 9.760 8.140 1.620 17919 86034 1 210 . 1 1 25 25 ASN N N 25 120.570 120.570 117.801 2.769 17919 86035 1 210 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.451 0.074 17919 86036 1 210 . 1 1 25 25 ASN C C 25 178.380 178.380 177.915 0.465 17919 86037 1 210 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.135 -0.075 17919 86038 1 210 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.624 -0.174 17919 86039 1 210 . 1 1 25 25 ASN H H 25 7.920 7.920 7.675 0.245 17919 86040 1 210 . 1 1 26 26 VAL N N 26 121.710 121.710 120.561 1.149 17919 86041 1 210 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.497 -0.100 17919 86042 1 210 . 1 1 26 26 VAL C C 26 177.950 177.950 178.097 -0.147 17919 86043 1 210 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.831 0.829 17919 86044 1 210 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.506 -0.666 17919 86045 1 210 . 1 1 26 26 VAL H H 26 8.070 8.070 8.334 -0.264 17919 86046 1 210 . 1 1 27 27 LYS N N 27 118.860 118.860 119.299 -0.439 17919 86047 1 210 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.223 0.357 17919 86048 1 210 . 1 1 27 27 LYS C C 27 180.550 180.550 179.116 1.434 17919 86049 1 210 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.327 -0.077 17919 86050 1 210 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.324 1.406 17919 86051 1 210 . 1 1 27 27 LYS H H 27 8.560 8.560 8.083 0.477 17919 86052 1 210 . 1 1 28 28 ALA N N 28 123.440 123.440 122.496 0.944 17919 86053 1 210 . 1 1 28 28 ALA HA H 28 4.160 4.160 3.941 0.219 17919 86054 1 210 . 1 1 28 28 ALA C C 28 180.300 180.300 179.253 1.047 17919 86055 1 210 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.471 -0.101 17919 86056 1 210 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.308 -0.599 17919 86057 1 210 . 1 1 28 28 ALA H H 28 8.060 8.060 8.405 -0.345 17919 86058 1 210 . 1 1 29 29 LYS N N 29 119.940 119.940 118.942 0.998 17919 86059 1 210 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.047 0.160 17919 86060 1 210 . 1 1 29 29 LYS C C 29 180.320 180.320 179.158 1.162 17919 86061 1 210 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.239 0.411 17919 86062 1 210 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.405 0.885 17919 86063 1 210 . 1 1 29 29 LYS H H 29 7.850 7.850 7.677 0.173 17919 86064 1 210 . 1 1 30 30 ILE N N 30 121.080 121.080 120.529 0.551 17919 86065 1 210 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.566 -0.059 17919 86066 1 210 . 1 1 30 30 ILE C C 30 178.310 178.310 177.750 0.560 17919 86067 1 210 . 1 1 30 30 ILE CA C 30 66.150 66.150 64.907 1.243 17919 86068 1 210 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.565 -0.765 17919 86069 1 210 . 1 1 30 30 ILE H H 30 8.280 8.280 7.936 0.344 17919 86070 1 210 . 1 1 31 31 GLN N N 31 123.490 123.490 120.224 3.266 17919 86071 1 210 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.960 -0.131 17919 86072 1 210 . 1 1 31 31 GLN C C 31 178.890 178.890 178.269 0.621 17919 86073 1 210 . 1 1 31 31 GLN CA C 31 60.000 60.000 58.523 1.477 17919 86074 1 210 . 1 1 31 31 GLN CB C 31 27.720 27.720 27.904 -0.183 17919 86075 1 210 . 1 1 31 31 GLN H H 31 8.580 8.580 8.246 0.334 17919 86076 1 210 . 1 1 32 32 ASP N N 32 119.360 119.360 118.957 0.403 17919 86077 1 210 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.394 -0.040 17919 86078 1 210 . 1 1 32 32 ASP C C 32 177.250 177.250 178.330 -1.080 17919 86079 1 210 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.742 0.448 17919 86080 1 210 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.897 -0.317 17919 86081 1 210 . 1 1 32 32 ASP H H 32 8.010 8.010 7.975 0.035 17919 86082 1 210 . 1 1 33 33 LYS N N 33 115.130 115.130 116.959 -1.829 17919 86083 1 210 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.349 -0.012 17919 86084 1 210 . 1 1 33 33 LYS C C 33 177.870 177.870 177.982 -0.112 17919 86085 1 210 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.297 -0.247 17919 86086 1 210 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.800 0.369 17919 86087 1 210 . 1 1 33 33 LYS H H 33 7.430 7.430 7.415 0.015 17919 86088 1 210 . 1 1 34 34 GLU N N 34 113.870 113.870 114.625 -0.755 17919 86089 1 210 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.484 0.141 17919 86090 1 210 . 1 1 34 34 GLU C C 34 177.840 177.840 177.172 0.668 17919 86091 1 210 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.480 -0.310 17919 86092 1 210 . 1 1 34 34 GLU CB C 34 32.660 32.660 30.981 1.679 17919 86093 1 210 . 1 1 34 34 GLU H H 34 8.740 8.740 8.143 0.597 17919 86094 1 210 . 1 1 35 35 GLY N N 35 108.650 108.650 109.090 -0.440 17919 86095 1 210 . 1 1 35 35 GLY C C 35 173.960 173.960 174.626 -0.666 17919 86096 1 210 . 1 1 35 35 GLY CA C 35 46.080 46.080 46.042 0.038 17919 86097 1 210 . 1 1 35 35 GLY H H 35 8.530 8.530 8.092 0.438 17919 86098 1 210 . 1 1 36 36 ILE N N 36 119.880 119.880 122.086 -2.206 17919 86099 1 210 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.286 0.159 17919 86100 1 210 . 1 1 36 36 ILE C C 36 173.590 173.590 174.457 -0.867 17919 86101 1 210 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.385 -0.635 17919 86102 1 210 . 1 1 36 36 ILE CB C 36 40.580 40.580 37.841 2.739 17919 86103 1 210 . 1 1 36 36 ILE H H 36 6.150 6.150 7.710 -1.560 17919 86104 1 210 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.741 -0.107 17919 86105 1 210 . 1 1 37 37 PRO C C 37 176.940 176.940 176.241 0.699 17919 86106 1 210 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.917 -0.257 17919 86107 1 210 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.098 0.752 17919 86108 1 210 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.217 -0.100 17919 86109 1 210 . 1 1 38 38 PRO C C 38 178.320 178.320 178.796 -0.476 17919 86110 1 210 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.719 0.541 17919 86111 1 210 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.901 0.990 17919 86112 1 210 . 1 1 39 39 ASP N N 39 113.380 113.380 115.773 -2.393 17919 86113 1 210 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.379 0.051 17919 86114 1 210 . 1 1 39 39 ASP C C 39 177.090 177.090 177.351 -0.261 17919 86115 1 210 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.402 -0.762 17919 86116 1 210 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.395 -0.855 17919 86117 1 210 . 1 1 39 39 ASP H H 39 8.550 8.550 8.688 -0.138 17919 86118 1 210 . 1 1 40 40 GLN N N 40 116.780 116.780 116.633 0.147 17919 86119 1 210 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.201 0.263 17919 86120 1 210 . 1 1 40 40 GLN C C 40 175.380 175.380 176.038 -0.658 17919 86121 1 210 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.193 -0.553 17919 86122 1 210 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.409 0.731 17919 86123 1 210 . 1 1 40 40 GLN H H 40 7.820 7.820 7.855 -0.035 17919 86124 1 210 . 1 1 41 41 GLN N N 41 117.720 117.720 118.902 -1.182 17919 86125 1 210 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.731 -0.487 17919 86126 1 210 . 1 1 41 41 GLN C C 41 176.300 176.300 174.703 1.597 17919 86127 1 210 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.136 1.334 17919 86128 1 210 . 1 1 41 41 GLN CB C 41 31.650 31.650 30.296 1.354 17919 86129 1 210 . 1 1 41 41 GLN H H 41 7.480 7.480 7.575 -0.095 17919 86130 1 210 . 1 1 42 42 ARG N N 42 122.680 122.680 123.056 -0.376 17919 86131 1 210 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.719 -0.219 17919 86132 1 210 . 1 1 42 42 ARG C C 42 174.050 174.050 174.075 -0.025 17919 86133 1 210 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.669 0.381 17919 86134 1 210 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.203 -1.453 17919 86135 1 210 . 1 1 42 42 ARG H H 42 8.530 8.530 8.329 0.201 17919 86136 1 210 . 1 1 43 43 LEU N N 43 124.040 124.040 123.096 0.944 17919 86137 1 210 . 1 1 43 43 LEU C C 43 175.290 175.290 175.392 -0.102 17919 86138 1 210 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.337 -0.358 17919 86139 1 210 . 1 1 43 43 LEU CB C 43 45.790 45.790 45.121 0.669 17919 86140 1 210 . 1 1 43 43 LEU H H 43 8.820 8.820 8.727 0.093 17919 86141 1 210 . 1 1 44 44 ILE N N 44 121.920 121.920 122.538 -0.618 17919 86142 1 210 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.358 -0.366 17919 86143 1 210 . 1 1 44 44 ILE C C 44 176.060 176.060 173.527 2.533 17919 86144 1 210 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.369 -0.389 17919 86145 1 210 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.712 -0.292 17919 86146 1 210 . 1 1 44 44 ILE H H 44 9.030 9.030 8.982 0.048 17919 86147 1 210 . 1 1 45 45 PHE N N 45 125.390 125.390 129.188 -3.798 17919 86148 1 210 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.998 0.047 17919 86149 1 210 . 1 1 45 45 PHE C C 45 174.470 174.470 174.576 -0.106 17919 86150 1 210 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.963 0.057 17919 86151 1 210 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.164 0.596 17919 86152 1 210 . 1 1 45 45 PHE H H 45 8.830 8.830 8.787 0.043 17919 86153 1 210 . 1 1 46 46 ALA N N 46 132.200 132.200 129.033 3.167 17919 86154 1 210 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.626 0.064 17919 86155 1 210 . 1 1 46 46 ALA C C 46 177.290 177.290 177.817 -0.527 17919 86156 1 210 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.432 0.108 17919 86157 1 210 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.426 0.144 17919 86158 1 210 . 1 1 46 46 ALA H H 46 8.810 8.810 8.737 0.073 17919 86159 1 210 . 1 1 47 47 GLY N N 47 102.340 102.340 103.565 -1.225 17919 86160 1 210 . 1 1 47 47 GLY C C 47 173.810 173.810 174.254 -0.444 17919 86161 1 210 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.918 0.432 17919 86162 1 210 . 1 1 47 47 GLY H H 47 8.130 8.130 8.485 -0.355 17919 86163 1 210 . 1 1 48 48 LYS N N 48 121.570 121.570 120.993 0.577 17919 86164 1 210 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.550 0.072 17919 86165 1 210 . 1 1 48 48 LYS C C 48 174.700 174.700 175.485 -0.785 17919 86166 1 210 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.056 -0.506 17919 86167 1 210 . 1 1 48 48 LYS CB C 48 34.530 34.530 33.964 0.566 17919 86168 1 210 . 1 1 48 48 LYS H H 48 7.980 7.980 7.930 0.050 17919 86169 1 210 . 1 1 49 49 GLN N N 49 122.410 122.410 123.983 -1.573 17919 86170 1 210 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.527 0.033 17919 86171 1 210 . 1 1 49 49 GLN C C 49 175.670 175.670 175.645 0.025 17919 86172 1 210 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.047 -0.307 17919 86173 1 210 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.324 -0.324 17919 86174 1 210 . 1 1 49 49 GLN H H 49 8.600 8.600 8.566 0.034 17919 86175 1 210 . 1 1 50 50 LEU N N 50 125.520 125.520 129.391 -3.871 17919 86176 1 210 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.277 -0.187 17919 86177 1 210 . 1 1 50 50 LEU C C 50 176.660 176.660 175.983 0.677 17919 86178 1 210 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.978 0.262 17919 86179 1 210 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.444 -0.874 17919 86180 1 210 . 1 1 50 50 LEU H H 50 8.530 8.530 8.844 -0.314 17919 86181 1 210 . 1 1 51 51 GLU N N 51 122.940 122.940 122.151 0.789 17919 86182 1 210 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.627 -0.139 17919 86183 1 210 . 1 1 51 51 GLU C C 51 175.870 175.870 176.866 -0.996 17919 86184 1 210 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.112 0.848 17919 86185 1 210 . 1 1 51 51 GLU CB C 51 31.570 31.570 33.314 -1.744 17919 86186 1 210 . 1 1 51 51 GLU H H 51 8.400 8.400 8.375 0.025 17919 86187 1 210 . 1 1 52 52 ASP N N 52 120.030 120.030 124.115 -4.085 17919 86188 1 210 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.444 -0.085 17919 86189 1 210 . 1 1 52 52 ASP C C 52 177.330 177.330 177.689 -0.359 17919 86190 1 210 . 1 1 52 52 ASP CA C 52 56.960 56.960 58.048 -1.088 17919 86191 1 210 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.989 -0.139 17919 86192 1 210 . 1 1 52 52 ASP H H 52 8.160 8.160 8.902 -0.742 17919 86193 1 210 . 1 1 53 53 GLY N N 53 106.660 106.660 105.528 1.132 17919 86194 1 210 . 1 1 53 53 GLY C C 53 174.870 174.870 174.547 0.323 17919 86195 1 210 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.679 0.491 17919 86196 1 210 . 1 1 53 53 GLY H H 53 9.390 9.390 8.246 1.144 17919 86197 1 210 . 1 1 54 54 ARG N N 54 119.050 119.050 120.163 -1.113 17919 86198 1 210 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.641 0.054 17919 86199 1 210 . 1 1 54 54 ARG C C 54 175.350 175.350 175.674 -0.324 17919 86200 1 210 . 1 1 54 54 ARG CA C 54 54.390 54.390 53.478 0.912 17919 86201 1 210 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.358 0.292 17919 86202 1 210 . 1 1 54 54 ARG H H 54 7.460 7.460 7.406 0.054 17919 86203 1 210 . 1 1 55 55 THR N N 55 108.400 108.400 111.620 -3.220 17919 86204 1 210 . 1 1 55 55 THR HA H 55 5.240 5.240 4.828 0.412 17919 86205 1 210 . 1 1 55 55 THR C C 55 176.560 176.560 176.536 0.024 17919 86206 1 210 . 1 1 55 55 THR CA C 55 59.690 59.690 61.038 -1.348 17919 86207 1 210 . 1 1 55 55 THR CB C 55 72.260 72.260 70.492 1.768 17919 86208 1 210 . 1 1 55 55 THR H H 55 8.730 8.730 8.858 -0.128 17919 86209 1 210 . 1 1 56 56 LEU N N 56 117.920 117.920 121.718 -3.798 17919 86210 1 210 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.963 0.097 17919 86211 1 210 . 1 1 56 56 LEU C C 56 180.810 180.810 179.105 1.705 17919 86212 1 210 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.411 0.299 17919 86213 1 210 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.504 -1.134 17919 86214 1 210 . 1 1 56 56 LEU H H 56 8.140 8.140 8.704 -0.564 17919 86215 1 210 . 1 1 57 57 SER N N 57 113.330 113.330 115.050 -1.720 17919 86216 1 210 . 1 1 57 57 SER HA H 57 4.370 4.370 4.144 0.226 17919 86217 1 210 . 1 1 57 57 SER C C 57 178.310 178.310 176.891 1.419 17919 86218 1 210 . 1 1 57 57 SER CA C 57 61.080 61.080 62.338 -1.258 17919 86219 1 210 . 1 1 57 57 SER CB C 57 62.530 62.530 62.827 -0.297 17919 86220 1 210 . 1 1 57 57 SER H H 57 8.470 8.470 8.299 0.171 17919 86221 1 210 . 1 1 58 58 ASP N N 58 124.190 124.190 123.226 0.964 17919 86222 1 210 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.301 -0.005 17919 86223 1 210 . 1 1 58 58 ASP C C 58 177.400 177.400 177.585 -0.185 17919 86224 1 210 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.896 0.284 17919 86225 1 210 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.534 -0.434 17919 86226 1 210 . 1 1 58 58 ASP H H 58 7.930 7.930 7.822 0.108 17919 86227 1 210 . 1 1 59 59 TYR N N 59 115.510 115.510 114.739 0.771 17919 86228 1 210 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.540 0.130 17919 86229 1 210 . 1 1 59 59 TYR C C 59 174.700 174.700 174.929 -0.229 17919 86230 1 210 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.697 0.553 17919 86231 1 210 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.293 1.777 17919 86232 1 210 . 1 1 59 59 TYR H H 59 7.250 7.250 7.642 -0.392 17919 86233 1 210 . 1 1 60 60 ASN N N 60 115.900 115.900 116.950 -1.050 17919 86234 1 210 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.364 -0.009 17919 86235 1 210 . 1 1 60 60 ASN C C 60 174.340 174.340 174.456 -0.116 17919 86236 1 210 . 1 1 60 60 ASN CA C 60 54.120 54.120 53.996 0.124 17919 86237 1 210 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.509 -0.099 17919 86238 1 210 . 1 1 60 60 ASN H H 60 8.150 8.150 7.774 0.376 17919 86239 1 210 . 1 1 61 61 ILE N N 61 118.600 118.600 119.418 -0.818 17919 86240 1 210 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.935 -0.542 17919 86241 1 210 . 1 1 61 61 ILE C C 61 174.610 174.610 175.085 -0.475 17919 86242 1 210 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.455 0.965 17919 86243 1 210 . 1 1 61 61 ILE CB C 61 36.740 36.740 38.164 -1.424 17919 86244 1 210 . 1 1 61 61 ILE H H 61 7.250 7.250 7.887 -0.637 17919 86245 1 210 . 1 1 62 62 GLN N N 62 124.740 124.740 126.270 -1.530 17919 86246 1 210 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.695 -0.189 17919 86247 1 210 . 1 1 62 62 GLN C C 62 175.970 175.970 174.869 1.101 17919 86248 1 210 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.559 0.101 17919 86249 1 210 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.978 -0.328 17919 86250 1 210 . 1 1 62 62 GLN H H 62 7.610 7.610 8.156 -0.546 17919 86251 1 210 . 1 1 63 63 LYS N N 63 120.300 120.300 120.866 -0.566 17919 86252 1 210 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.169 -0.168 17919 86253 1 210 . 1 1 63 63 LYS C C 63 175.810 175.810 177.305 -1.495 17919 86254 1 210 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.462 0.328 17919 86255 1 210 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.155 0.495 17919 86256 1 210 . 1 1 63 63 LYS H H 63 8.490 8.490 8.666 -0.176 17919 86257 1 210 . 1 1 64 64 GLU N N 64 113.950 113.950 119.120 -5.170 17919 86258 1 210 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.707 -0.242 17919 86259 1 210 . 1 1 64 64 GLU C C 64 175.250 175.250 176.108 -0.858 17919 86260 1 210 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.609 0.281 17919 86261 1 210 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.962 -3.062 17919 86262 1 210 . 1 1 64 64 GLU H H 64 9.280 9.280 9.020 0.260 17919 86263 1 210 . 1 1 65 65 SER N N 65 114.730 114.730 116.356 -1.626 17919 86264 1 210 . 1 1 65 65 SER HA H 65 4.640 4.640 4.640 0.000 17919 86265 1 210 . 1 1 65 65 SER C C 65 172.160 172.160 173.685 -1.525 17919 86266 1 210 . 1 1 65 65 SER CA C 65 60.890 60.890 60.694 0.196 17919 86267 1 210 . 1 1 65 65 SER CB C 65 64.910 64.910 64.038 0.872 17919 86268 1 210 . 1 1 65 65 SER H H 65 7.670 7.670 7.575 0.095 17919 86269 1 210 . 1 1 66 66 THR N N 66 117.110 117.110 118.741 -1.631 17919 86270 1 210 . 1 1 66 66 THR HA H 66 5.270 5.270 4.926 0.344 17919 86271 1 210 . 1 1 66 66 THR C C 66 173.950 173.950 174.250 -0.300 17919 86272 1 210 . 1 1 66 66 THR CA C 66 62.340 62.340 61.965 0.375 17919 86273 1 210 . 1 1 66 66 THR CB C 66 70.080 70.080 69.976 0.104 17919 86274 1 210 . 1 1 66 66 THR H H 66 8.730 8.730 8.495 0.235 17919 86275 1 210 . 1 1 67 67 LEU N N 67 127.110 127.110 127.497 -0.387 17919 86276 1 210 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.760 0.300 17919 86277 1 210 . 1 1 67 67 LEU C C 67 175.770 175.770 175.760 0.010 17919 86278 1 210 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.774 0.126 17919 86279 1 210 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.717 0.543 17919 86280 1 210 . 1 1 67 67 LEU H H 67 9.410 9.410 9.006 0.404 17919 86281 1 210 . 1 1 68 68 HIS N N 68 118.380 118.380 119.149 -0.769 17919 86282 1 210 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.290 -0.050 17919 86283 1 210 . 1 1 68 68 HIS C C 68 173.150 173.150 174.147 -0.997 17919 86284 1 210 . 1 1 68 68 HIS CA C 68 55.000 55.000 55.161 -0.161 17919 86285 1 210 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.710 -2.180 17919 86286 1 210 . 1 1 68 68 HIS H H 68 9.230 9.230 8.589 0.641 17919 86287 1 210 . 1 1 69 69 LEU N N 69 124.460 124.460 126.677 -2.217 17919 86288 1 210 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.211 -0.021 17919 86289 1 210 . 1 1 69 69 LEU C C 69 175.270 175.270 174.438 0.832 17919 86290 1 210 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.586 0.304 17919 86291 1 210 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.389 -0.009 17919 86292 1 210 . 1 1 69 69 LEU H H 69 8.340 8.340 8.418 -0.078 17919 86293 1 210 . 1 1 70 70 VAL N N 70 126.940 126.940 125.609 1.331 17919 86294 1 210 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.337 0.013 17919 86295 1 210 . 1 1 70 70 VAL C C 70 174.000 174.000 174.775 -0.775 17919 86296 1 210 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.748 0.052 17919 86297 1 210 . 1 1 70 70 VAL CB C 70 34.910 34.910 34.587 0.323 17919 86298 1 210 . 1 1 70 70 VAL H H 70 9.200 9.200 8.540 0.660 17919 86299 1 210 . 1 1 71 71 LEU N N 71 123.130 123.130 127.209 -4.079 17919 86300 1 210 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.026 0.034 17919 86301 1 210 . 1 1 71 71 LEU C C 71 177.830 177.830 177.097 0.733 17919 86302 1 210 . 1 1 71 71 LEU CA C 71 53.940 53.940 54.217 -0.277 17919 86303 1 210 . 1 1 71 71 LEU CB C 71 42.850 42.850 41.817 1.033 17919 86304 1 210 . 1 1 71 71 LEU H H 71 8.120 8.120 8.466 -0.346 17919 86305 1 210 . 1 1 72 72 ARG N N 72 123.490 123.490 125.462 -1.972 17919 86306 1 210 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.722 -0.421 17919 86307 1 210 . 1 1 72 72 ARG C C 72 175.350 175.350 175.867 -0.517 17919 86308 1 210 . 1 1 72 72 ARG CA C 72 55.610 55.610 54.270 1.340 17919 86309 1 210 . 1 1 72 72 ARG CB C 72 31.350 31.350 32.328 -0.978 17919 86310 1 210 . 1 1 72 72 ARG H H 72 8.580 8.580 8.590 -0.010 17919 86311 1 211 . 1 1 2 2 GLN N N 2 123.220 123.220 120.885 2.335 17919 86312 1 211 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.323 -0.074 17919 86313 1 211 . 1 1 2 2 GLN C C 2 175.920 175.920 175.955 -0.035 17919 86314 1 211 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.412 0.668 17919 86315 1 211 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.291 0.469 17919 86316 1 211 . 1 1 2 2 GLN H H 2 8.900 8.900 8.385 0.515 17919 86317 1 211 . 1 1 3 3 ILE N N 3 115.340 115.340 113.756 1.584 17919 86318 1 211 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.331 -0.118 17919 86319 1 211 . 1 1 3 3 ILE C C 3 172.450 172.450 173.557 -1.107 17919 86320 1 211 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.514 0.056 17919 86321 1 211 . 1 1 3 3 ILE CB C 3 42.210 42.210 42.140 0.070 17919 86322 1 211 . 1 1 3 3 ILE H H 3 8.320 8.320 8.293 0.027 17919 86323 1 211 . 1 1 4 4 PHE N N 4 118.110 118.110 118.092 0.018 17919 86324 1 211 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.548 0.082 17919 86325 1 211 . 1 1 4 4 PHE C C 4 175.320 175.320 175.105 0.215 17919 86326 1 211 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.865 -0.655 17919 86327 1 211 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.587 -1.107 17919 86328 1 211 . 1 1 4 4 PHE H H 4 8.610 8.610 8.577 0.033 17919 86329 1 211 . 1 1 5 5 VAL N N 5 121.000 121.000 121.078 -0.078 17919 86330 1 211 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.626 0.099 17919 86331 1 211 . 1 1 5 5 VAL C C 5 174.870 174.870 174.562 0.308 17919 86332 1 211 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.413 -0.792 17919 86333 1 211 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.223 0.007 17919 86334 1 211 . 1 1 5 5 VAL H H 5 9.300 9.300 9.237 0.063 17919 86335 1 211 . 1 1 6 6 LYS N N 6 127.520 127.520 129.343 -1.823 17919 86336 1 211 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.470 -0.103 17919 86337 1 211 . 1 1 6 6 LYS C C 6 177.140 177.140 176.383 0.757 17919 86338 1 211 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.369 0.151 17919 86339 1 211 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.678 -0.628 17919 86340 1 211 . 1 1 6 6 LYS H H 6 8.820 8.820 9.118 -0.298 17919 86341 1 211 . 1 1 7 7 THR N N 7 115.400 115.400 117.711 -2.311 17919 86342 1 211 . 1 1 7 7 THR HA H 7 4.970 4.970 4.742 0.228 17919 86343 1 211 . 1 1 7 7 THR C C 7 176.910 176.910 175.175 1.735 17919 86344 1 211 . 1 1 7 7 THR CA C 7 60.470 60.470 61.328 -0.857 17919 86345 1 211 . 1 1 7 7 THR CB C 7 70.630 70.630 70.982 -0.352 17919 86346 1 211 . 1 1 7 7 THR H H 7 8.730 8.730 9.036 -0.306 17919 86347 1 211 . 1 1 8 8 LEU N N 8 121.330 121.330 120.645 0.685 17919 86348 1 211 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.478 -0.168 17919 86349 1 211 . 1 1 8 8 LEU C C 8 178.800 178.800 178.091 0.709 17919 86350 1 211 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.088 0.492 17919 86351 1 211 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.048 -0.078 17919 86352 1 211 . 1 1 8 8 LEU H H 8 9.100 9.100 8.592 0.508 17919 86353 1 211 . 1 1 9 9 THR N N 9 105.590 105.590 111.186 -5.596 17919 86354 1 211 . 1 1 9 9 THR HA H 9 4.428 4.428 4.346 0.082 17919 86355 1 211 . 1 1 9 9 THR C C 9 175.520 175.520 175.847 -0.327 17919 86356 1 211 . 1 1 9 9 THR CA C 9 61.400 61.400 62.212 -0.812 17919 86357 1 211 . 1 1 9 9 THR CB C 9 69.140 69.140 69.140 -0.000 17919 86358 1 211 . 1 1 9 9 THR H H 9 7.630 7.630 7.652 -0.022 17919 86359 1 211 . 1 1 10 10 GLY N N 10 108.890 108.890 110.992 -2.102 17919 86360 1 211 . 1 1 10 10 GLY C C 10 174.070 174.070 174.407 -0.337 17919 86361 1 211 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.693 -0.233 17919 86362 1 211 . 1 1 10 10 GLY H H 10 7.810 7.810 7.895 -0.085 17919 86363 1 211 . 1 1 11 11 LYS N N 11 121.600 121.600 121.340 0.260 17919 86364 1 211 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.210 0.151 17919 86365 1 211 . 1 1 11 11 LYS C C 11 175.940 175.940 175.592 0.348 17919 86366 1 211 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.926 -0.646 17919 86367 1 211 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.071 0.129 17919 86368 1 211 . 1 1 11 11 LYS H H 11 7.280 7.280 7.525 -0.245 17919 86369 1 211 . 1 1 12 12 THR N N 12 120.440 120.440 118.274 2.166 17919 86370 1 211 . 1 1 12 12 THR HA H 12 5.046 5.046 5.014 0.032 17919 86371 1 211 . 1 1 12 12 THR C C 12 174.320 174.320 174.553 -0.233 17919 86372 1 211 . 1 1 12 12 THR CA C 12 62.390 62.390 61.857 0.533 17919 86373 1 211 . 1 1 12 12 THR CB C 12 69.910 69.910 69.584 0.326 17919 86374 1 211 . 1 1 12 12 THR H H 12 8.650 8.650 8.272 0.378 17919 86375 1 211 . 1 1 13 13 ILE N N 13 127.110 127.110 122.564 4.546 17919 86376 1 211 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.704 -0.160 17919 86377 1 211 . 1 1 13 13 ILE C C 13 175.220 175.220 174.574 0.646 17919 86378 1 211 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.459 0.521 17919 86379 1 211 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.486 -0.536 17919 86380 1 211 . 1 1 13 13 ILE H H 13 9.450 9.450 9.107 0.343 17919 86381 1 211 . 1 1 14 14 THR N N 14 121.520 121.520 122.430 -0.910 17919 86382 1 211 . 1 1 14 14 THR HA H 14 4.964 4.964 4.883 0.081 17919 86383 1 211 . 1 1 14 14 THR C C 14 173.790 173.790 173.546 0.244 17919 86384 1 211 . 1 1 14 14 THR CA C 14 61.940 61.940 62.043 -0.103 17919 86385 1 211 . 1 1 14 14 THR CB C 14 69.650 69.650 69.453 0.197 17919 86386 1 211 . 1 1 14 14 THR H H 14 8.710 8.710 8.680 0.030 17919 86387 1 211 . 1 1 15 15 LEU N N 15 124.800 124.800 127.053 -2.253 17919 86388 1 211 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.738 0.042 17919 86389 1 211 . 1 1 15 15 LEU C C 15 174.670 174.670 175.406 -0.736 17919 86390 1 211 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.797 -0.967 17919 86391 1 211 . 1 1 15 15 LEU CB C 15 47.070 47.070 43.992 3.078 17919 86392 1 211 . 1 1 15 15 LEU H H 15 8.710 8.710 8.152 0.558 17919 86393 1 211 . 1 1 16 16 GLU N N 16 122.160 122.160 122.973 -0.813 17919 86394 1 211 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.792 0.126 17919 86395 1 211 . 1 1 16 16 GLU C C 16 175.860 175.860 175.839 0.021 17919 86396 1 211 . 1 1 16 16 GLU CA C 16 54.820 54.820 56.515 -1.695 17919 86397 1 211 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.073 -0.623 17919 86398 1 211 . 1 1 16 16 GLU H H 16 8.140 8.140 8.728 -0.588 17919 86399 1 211 . 1 1 17 17 VAL N N 17 117.210 117.210 119.480 -2.270 17919 86400 1 211 . 1 1 17 17 VAL HA H 17 4.714 4.714 5.036 -0.322 17919 86401 1 211 . 1 1 17 17 VAL C C 17 174.160 174.160 174.865 -0.705 17919 86402 1 211 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.157 -0.727 17919 86403 1 211 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.341 1.059 17919 86404 1 211 . 1 1 17 17 VAL H H 17 8.900 8.900 8.861 0.039 17919 86405 1 211 . 1 1 18 18 GLU N N 18 118.990 118.990 121.834 -2.844 17919 86406 1 211 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.870 0.209 17919 86407 1 211 . 1 1 18 18 GLU C C 18 176.160 176.160 175.169 0.991 17919 86408 1 211 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.588 0.132 17919 86409 1 211 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.462 -0.152 17919 86410 1 211 . 1 1 18 18 GLU H H 18 8.640 8.640 8.510 0.130 17919 86411 1 211 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.229 -0.088 17919 86412 1 211 . 1 1 19 19 PRO C C 19 175.310 175.310 177.890 -2.580 17919 86413 1 211 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.656 -0.186 17919 86414 1 211 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.986 -0.036 17919 86415 1 211 . 1 1 20 20 SER N N 20 103.400 103.400 109.708 -6.308 17919 86416 1 211 . 1 1 20 20 SER HA H 20 4.370 4.370 4.282 0.088 17919 86417 1 211 . 1 1 20 20 SER C C 20 174.660 174.660 173.867 0.793 17919 86418 1 211 . 1 1 20 20 SER CA C 20 57.400 57.400 58.514 -1.114 17919 86419 1 211 . 1 1 20 20 SER CB C 20 63.370 63.370 63.071 0.299 17919 86420 1 211 . 1 1 20 20 SER H H 20 7.040 7.040 7.907 -0.867 17919 86421 1 211 . 1 1 21 21 ASP N N 21 123.480 123.480 123.438 0.042 17919 86422 1 211 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.761 -0.066 17919 86423 1 211 . 1 1 21 21 ASP C C 21 176.360 176.360 176.226 0.134 17919 86424 1 211 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.581 1.119 17919 86425 1 211 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.172 -0.372 17919 86426 1 211 . 1 1 21 21 ASP H H 21 8.030 8.030 7.587 0.443 17919 86427 1 211 . 1 1 22 22 THR N N 22 108.800 108.800 113.905 -5.105 17919 86428 1 211 . 1 1 22 22 THR HA H 22 4.920 4.920 4.859 0.061 17919 86429 1 211 . 1 1 22 22 THR C C 22 176.750 176.750 176.128 0.622 17919 86430 1 211 . 1 1 22 22 THR CA C 22 59.690 59.690 60.948 -1.258 17919 86431 1 211 . 1 1 22 22 THR CB C 22 71.200 71.200 70.689 0.511 17919 86432 1 211 . 1 1 22 22 THR H H 22 7.900 7.900 8.422 -0.522 17919 86433 1 211 . 1 1 23 23 ILE N N 23 121.190 121.190 121.283 -0.093 17919 86434 1 211 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.800 -0.143 17919 86435 1 211 . 1 1 23 23 ILE C C 23 179.040 179.040 177.809 1.231 17919 86436 1 211 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.462 -0.202 17919 86437 1 211 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.703 -2.353 17919 86438 1 211 . 1 1 23 23 ILE H H 23 8.560 8.560 8.726 -0.166 17919 86439 1 211 . 1 1 24 24 GLU N N 24 120.830 120.830 120.958 -0.128 17919 86440 1 211 . 1 1 24 24 GLU HA H 24 3.917 3.917 4.041 -0.124 17919 86441 1 211 . 1 1 24 24 GLU C C 24 178.640 178.640 178.670 -0.030 17919 86442 1 211 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.154 0.066 17919 86443 1 211 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.430 -1.150 17919 86444 1 211 . 1 1 24 24 GLU H H 24 9.760 9.760 8.312 1.448 17919 86445 1 211 . 1 1 25 25 ASN N N 25 120.570 120.570 118.185 2.385 17919 86446 1 211 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.476 0.049 17919 86447 1 211 . 1 1 25 25 ASN C C 25 178.380 178.380 178.117 0.263 17919 86448 1 211 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.883 0.178 17919 86449 1 211 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.498 -0.049 17919 86450 1 211 . 1 1 25 25 ASN H H 25 7.920 7.920 7.877 0.043 17919 86451 1 211 . 1 1 26 26 VAL N N 26 121.710 121.710 121.430 0.280 17919 86452 1 211 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.657 -0.260 17919 86453 1 211 . 1 1 26 26 VAL C C 26 177.950 177.950 177.384 0.566 17919 86454 1 211 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.950 0.710 17919 86455 1 211 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.526 -0.686 17919 86456 1 211 . 1 1 26 26 VAL H H 26 8.070 8.070 7.876 0.194 17919 86457 1 211 . 1 1 27 27 LYS N N 27 118.860 118.860 120.447 -1.587 17919 86458 1 211 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.286 0.294 17919 86459 1 211 . 1 1 27 27 LYS C C 27 180.550 180.550 179.049 1.501 17919 86460 1 211 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.468 -0.217 17919 86461 1 211 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.330 1.400 17919 86462 1 211 . 1 1 27 27 LYS H H 27 8.560 8.560 8.103 0.457 17919 86463 1 211 . 1 1 28 28 ALA N N 28 123.440 123.440 121.890 1.550 17919 86464 1 211 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.101 0.059 17919 86465 1 211 . 1 1 28 28 ALA C C 28 180.300 180.300 179.030 1.270 17919 86466 1 211 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.994 0.376 17919 86467 1 211 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.557 -0.847 17919 86468 1 211 . 1 1 28 28 ALA H H 28 8.060 8.060 8.323 -0.263 17919 86469 1 211 . 1 1 29 29 LYS N N 29 119.940 119.940 118.397 1.543 17919 86470 1 211 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.127 0.080 17919 86471 1 211 . 1 1 29 29 LYS C C 29 180.320 180.320 178.984 1.336 17919 86472 1 211 . 1 1 29 29 LYS CA C 29 59.650 59.650 58.724 0.926 17919 86473 1 211 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.507 0.783 17919 86474 1 211 . 1 1 29 29 LYS H H 29 7.850 7.850 7.638 0.212 17919 86475 1 211 . 1 1 30 30 ILE N N 30 121.080 121.080 120.979 0.101 17919 86476 1 211 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.653 -0.146 17919 86477 1 211 . 1 1 30 30 ILE C C 30 178.310 178.310 177.043 1.267 17919 86478 1 211 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.093 1.057 17919 86479 1 211 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.822 -1.022 17919 86480 1 211 . 1 1 30 30 ILE H H 30 8.280 8.280 8.274 0.006 17919 86481 1 211 . 1 1 31 31 GLN N N 31 123.490 123.490 119.962 3.528 17919 86482 1 211 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.921 -0.092 17919 86483 1 211 . 1 1 31 31 GLN C C 31 178.890 178.890 177.386 1.504 17919 86484 1 211 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.182 0.818 17919 86485 1 211 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.511 -0.791 17919 86486 1 211 . 1 1 31 31 GLN H H 31 8.580 8.580 7.755 0.825 17919 86487 1 211 . 1 1 32 32 ASP N N 32 119.360 119.360 117.343 2.017 17919 86488 1 211 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.473 -0.119 17919 86489 1 211 . 1 1 32 32 ASP C C 32 177.250 177.250 177.476 -0.226 17919 86490 1 211 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.091 1.099 17919 86491 1 211 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.581 -0.001 17919 86492 1 211 . 1 1 32 32 ASP H H 32 8.010 8.010 8.224 -0.214 17919 86493 1 211 . 1 1 33 33 LYS N N 33 115.130 115.130 118.864 -3.734 17919 86494 1 211 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.291 0.046 17919 86495 1 211 . 1 1 33 33 LYS C C 33 177.870 177.870 178.270 -0.400 17919 86496 1 211 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.687 -0.637 17919 86497 1 211 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.172 0.998 17919 86498 1 211 . 1 1 33 33 LYS H H 33 7.430 7.430 7.548 -0.118 17919 86499 1 211 . 1 1 34 34 GLU N N 34 113.870 113.870 116.627 -2.757 17919 86500 1 211 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.373 0.252 17919 86501 1 211 . 1 1 34 34 GLU C C 34 177.840 177.840 177.424 0.416 17919 86502 1 211 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.989 -1.819 17919 86503 1 211 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.214 1.446 17919 86504 1 211 . 1 1 34 34 GLU H H 34 8.740 8.740 8.304 0.436 17919 86505 1 211 . 1 1 35 35 GLY N N 35 108.650 108.650 107.661 0.989 17919 86506 1 211 . 1 1 35 35 GLY C C 35 173.960 173.960 174.318 -0.358 17919 86507 1 211 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.312 0.768 17919 86508 1 211 . 1 1 35 35 GLY H H 35 8.530 8.530 7.842 0.688 17919 86509 1 211 . 1 1 36 36 ILE N N 36 119.880 119.880 121.959 -2.079 17919 86510 1 211 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.231 0.214 17919 86511 1 211 . 1 1 36 36 ILE C C 36 173.590 173.590 174.188 -0.598 17919 86512 1 211 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.305 -0.555 17919 86513 1 211 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.056 2.524 17919 86514 1 211 . 1 1 36 36 ILE H H 36 6.150 6.150 7.607 -1.457 17919 86515 1 211 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.461 0.173 17919 86516 1 211 . 1 1 37 37 PRO C C 37 176.940 176.940 175.975 0.965 17919 86517 1 211 . 1 1 37 37 PRO CA C 37 61.660 61.660 62.351 -0.691 17919 86518 1 211 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.239 0.611 17919 86519 1 211 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.223 -0.106 17919 86520 1 211 . 1 1 38 38 PRO C C 38 178.320 178.320 178.576 -0.256 17919 86521 1 211 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.258 1.002 17919 86522 1 211 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.868 1.022 17919 86523 1 211 . 1 1 39 39 ASP N N 39 113.380 113.380 116.907 -3.527 17919 86524 1 211 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.424 0.006 17919 86525 1 211 . 1 1 39 39 ASP C C 39 177.090 177.090 177.089 0.001 17919 86526 1 211 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.491 -0.851 17919 86527 1 211 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.577 -1.037 17919 86528 1 211 . 1 1 39 39 ASP H H 39 8.550 8.550 8.652 -0.102 17919 86529 1 211 . 1 1 40 40 GLN N N 40 116.780 116.780 115.397 1.383 17919 86530 1 211 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.331 0.133 17919 86531 1 211 . 1 1 40 40 GLN C C 40 175.380 175.380 175.733 -0.353 17919 86532 1 211 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.162 -0.522 17919 86533 1 211 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.945 0.195 17919 86534 1 211 . 1 1 40 40 GLN H H 40 7.820 7.820 7.585 0.235 17919 86535 1 211 . 1 1 41 41 GLN N N 41 117.720 117.720 118.803 -1.083 17919 86536 1 211 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.426 -0.182 17919 86537 1 211 . 1 1 41 41 GLN C C 41 176.300 176.300 175.474 0.826 17919 86538 1 211 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.773 0.697 17919 86539 1 211 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.657 1.993 17919 86540 1 211 . 1 1 41 41 GLN H H 41 7.480 7.480 7.199 0.281 17919 86541 1 211 . 1 1 42 42 ARG N N 42 122.680 122.680 124.087 -1.407 17919 86542 1 211 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.614 -0.114 17919 86543 1 211 . 1 1 42 42 ARG C C 42 174.050 174.050 174.400 -0.350 17919 86544 1 211 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.586 0.464 17919 86545 1 211 . 1 1 42 42 ARG CB C 42 31.750 31.750 34.219 -2.469 17919 86546 1 211 . 1 1 42 42 ARG H H 42 8.530 8.530 8.672 -0.142 17919 86547 1 211 . 1 1 43 43 LEU N N 43 124.040 124.040 122.115 1.925 17919 86548 1 211 . 1 1 43 43 LEU C C 43 175.290 175.290 175.614 -0.324 17919 86549 1 211 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.635 -0.655 17919 86550 1 211 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.975 0.815 17919 86551 1 211 . 1 1 43 43 LEU H H 43 8.820 8.820 8.644 0.176 17919 86552 1 211 . 1 1 44 44 ILE N N 44 121.920 121.920 120.019 1.901 17919 86553 1 211 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.214 -0.222 17919 86554 1 211 . 1 1 44 44 ILE C C 44 176.060 176.060 174.393 1.667 17919 86555 1 211 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.801 -0.821 17919 86556 1 211 . 1 1 44 44 ILE CB C 44 41.420 41.420 42.207 -0.787 17919 86557 1 211 . 1 1 44 44 ILE H H 44 9.030 9.030 8.923 0.107 17919 86558 1 211 . 1 1 45 45 PHE N N 45 125.390 125.390 126.066 -0.676 17919 86559 1 211 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.011 0.034 17919 86560 1 211 . 1 1 45 45 PHE C C 45 174.470 174.470 174.580 -0.110 17919 86561 1 211 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.950 0.070 17919 86562 1 211 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.668 1.092 17919 86563 1 211 . 1 1 45 45 PHE H H 45 8.830 8.830 8.966 -0.136 17919 86564 1 211 . 1 1 46 46 ALA N N 46 132.200 132.200 130.970 1.230 17919 86565 1 211 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.760 -0.070 17919 86566 1 211 . 1 1 46 46 ALA C C 46 177.290 177.290 177.553 -0.263 17919 86567 1 211 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.235 0.305 17919 86568 1 211 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.513 0.057 17919 86569 1 211 . 1 1 46 46 ALA H H 46 8.810 8.810 8.697 0.113 17919 86570 1 211 . 1 1 47 47 GLY N N 47 102.340 102.340 103.559 -1.219 17919 86571 1 211 . 1 1 47 47 GLY C C 47 173.810 173.810 174.290 -0.480 17919 86572 1 211 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.222 0.128 17919 86573 1 211 . 1 1 47 47 GLY H H 47 8.130 8.130 8.592 -0.462 17919 86574 1 211 . 1 1 48 48 LYS N N 48 121.570 121.570 121.082 0.488 17919 86575 1 211 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.548 0.074 17919 86576 1 211 . 1 1 48 48 LYS C C 48 174.700 174.700 175.461 -0.761 17919 86577 1 211 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.075 -0.525 17919 86578 1 211 . 1 1 48 48 LYS CB C 48 34.530 34.530 33.932 0.598 17919 86579 1 211 . 1 1 48 48 LYS H H 48 7.980 7.980 7.543 0.437 17919 86580 1 211 . 1 1 49 49 GLN N N 49 122.410 122.410 124.056 -1.646 17919 86581 1 211 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.529 0.031 17919 86582 1 211 . 1 1 49 49 GLN C C 49 175.670 175.670 175.437 0.233 17919 86583 1 211 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.822 -0.082 17919 86584 1 211 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.580 -0.580 17919 86585 1 211 . 1 1 49 49 GLN H H 49 8.600 8.600 8.580 0.020 17919 86586 1 211 . 1 1 50 50 LEU N N 50 125.520 125.520 128.989 -3.469 17919 86587 1 211 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.252 -0.162 17919 86588 1 211 . 1 1 50 50 LEU C C 50 176.660 176.660 175.322 1.338 17919 86589 1 211 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.746 0.494 17919 86590 1 211 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.411 -0.841 17919 86591 1 211 . 1 1 50 50 LEU H H 50 8.530 8.530 8.402 0.128 17919 86592 1 211 . 1 1 51 51 GLU N N 51 122.940 122.940 123.616 -0.676 17919 86593 1 211 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.472 0.016 17919 86594 1 211 . 1 1 51 51 GLU C C 51 175.870 175.870 177.160 -1.290 17919 86595 1 211 . 1 1 51 51 GLU CA C 51 55.960 55.960 54.911 1.049 17919 86596 1 211 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.066 -0.496 17919 86597 1 211 . 1 1 51 51 GLU H H 51 8.400 8.400 8.214 0.186 17919 86598 1 211 . 1 1 52 52 ASP N N 52 120.030 120.030 124.389 -4.359 17919 86599 1 211 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.430 -0.071 17919 86600 1 211 . 1 1 52 52 ASP C C 52 177.330 177.330 177.900 -0.570 17919 86601 1 211 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.820 -0.860 17919 86602 1 211 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.578 0.272 17919 86603 1 211 . 1 1 52 52 ASP H H 52 8.160 8.160 8.774 -0.614 17919 86604 1 211 . 1 1 53 53 GLY N N 53 106.660 106.660 104.665 1.995 17919 86605 1 211 . 1 1 53 53 GLY C C 53 174.870 174.870 174.874 -0.004 17919 86606 1 211 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.133 0.036 17919 86607 1 211 . 1 1 53 53 GLY H H 53 9.390 9.390 8.336 1.054 17919 86608 1 211 . 1 1 54 54 ARG N N 54 119.050 119.050 119.746 -0.696 17919 86609 1 211 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.639 0.056 17919 86610 1 211 . 1 1 54 54 ARG C C 54 175.350 175.350 175.646 -0.296 17919 86611 1 211 . 1 1 54 54 ARG CA C 54 54.390 54.390 53.969 0.421 17919 86612 1 211 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.475 0.175 17919 86613 1 211 . 1 1 54 54 ARG H H 54 7.460 7.460 7.321 0.139 17919 86614 1 211 . 1 1 55 55 THR N N 55 108.400 108.400 110.540 -2.140 17919 86615 1 211 . 1 1 55 55 THR HA H 55 5.240 5.240 4.981 0.259 17919 86616 1 211 . 1 1 55 55 THR C C 55 176.560 176.560 176.199 0.361 17919 86617 1 211 . 1 1 55 55 THR CA C 55 59.690 59.690 59.763 -0.073 17919 86618 1 211 . 1 1 55 55 THR CB C 55 72.260 72.260 71.456 0.804 17919 86619 1 211 . 1 1 55 55 THR H H 55 8.730 8.730 8.336 0.393 17919 86620 1 211 . 1 1 56 56 LEU N N 56 117.920 117.920 121.405 -3.485 17919 86621 1 211 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.872 0.188 17919 86622 1 211 . 1 1 56 56 LEU C C 56 180.810 180.810 178.925 1.885 17919 86623 1 211 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.698 0.012 17919 86624 1 211 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.383 -1.013 17919 86625 1 211 . 1 1 56 56 LEU H H 56 8.140 8.140 8.734 -0.594 17919 86626 1 211 . 1 1 57 57 SER N N 57 113.330 113.330 113.548 -0.218 17919 86627 1 211 . 1 1 57 57 SER HA H 57 4.370 4.370 4.285 0.085 17919 86628 1 211 . 1 1 57 57 SER C C 57 178.310 178.310 177.264 1.046 17919 86629 1 211 . 1 1 57 57 SER CA C 57 61.080 61.080 61.177 -0.097 17919 86630 1 211 . 1 1 57 57 SER CB C 57 62.530 62.530 62.557 -0.027 17919 86631 1 211 . 1 1 57 57 SER H H 57 8.470 8.470 7.811 0.659 17919 86632 1 211 . 1 1 58 58 ASP N N 58 124.190 124.190 124.432 -0.242 17919 86633 1 211 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.336 -0.040 17919 86634 1 211 . 1 1 58 58 ASP C C 58 177.400 177.400 177.659 -0.259 17919 86635 1 211 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.788 0.392 17919 86636 1 211 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.395 -0.295 17919 86637 1 211 . 1 1 58 58 ASP H H 58 7.930 7.930 7.925 0.005 17919 86638 1 211 . 1 1 59 59 TYR N N 59 115.510 115.510 115.718 -0.208 17919 86639 1 211 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.552 0.118 17919 86640 1 211 . 1 1 59 59 TYR C C 59 174.700 174.700 174.997 -0.297 17919 86641 1 211 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.683 0.567 17919 86642 1 211 . 1 1 59 59 TYR CB C 59 40.070 40.070 37.759 2.311 17919 86643 1 211 . 1 1 59 59 TYR H H 59 7.250 7.250 7.692 -0.442 17919 86644 1 211 . 1 1 60 60 ASN N N 60 115.900 115.900 117.929 -2.029 17919 86645 1 211 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.408 -0.053 17919 86646 1 211 . 1 1 60 60 ASN C C 60 174.340 174.340 174.472 -0.132 17919 86647 1 211 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.067 0.053 17919 86648 1 211 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.488 -0.078 17919 86649 1 211 . 1 1 60 60 ASN H H 60 8.150 8.150 7.658 0.492 17919 86650 1 211 . 1 1 61 61 ILE N N 61 118.600 118.600 120.320 -1.720 17919 86651 1 211 . 1 1 61 61 ILE HA H 61 3.393 3.393 4.095 -0.702 17919 86652 1 211 . 1 1 61 61 ILE C C 61 174.610 174.610 175.162 -0.552 17919 86653 1 211 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.224 1.196 17919 86654 1 211 . 1 1 61 61 ILE CB C 61 36.740 36.740 38.486 -1.746 17919 86655 1 211 . 1 1 61 61 ILE H H 61 7.250 7.250 8.554 -1.304 17919 86656 1 211 . 1 1 62 62 GLN N N 62 124.740 124.740 125.652 -0.912 17919 86657 1 211 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.773 -0.267 17919 86658 1 211 . 1 1 62 62 GLN C C 62 175.970 175.970 176.120 -0.150 17919 86659 1 211 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.441 0.219 17919 86660 1 211 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.263 0.387 17919 86661 1 211 . 1 1 62 62 GLN H H 62 7.610 7.610 8.358 -0.748 17919 86662 1 211 . 1 1 63 63 LYS N N 63 120.300 120.300 120.124 0.176 17919 86663 1 211 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.217 -0.216 17919 86664 1 211 . 1 1 63 63 LYS C C 63 175.810 175.810 177.410 -1.600 17919 86665 1 211 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.325 0.465 17919 86666 1 211 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.577 0.074 17919 86667 1 211 . 1 1 63 63 LYS H H 63 8.490 8.490 8.605 -0.115 17919 86668 1 211 . 1 1 64 64 GLU N N 64 113.950 113.950 115.801 -1.851 17919 86669 1 211 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.934 -0.469 17919 86670 1 211 . 1 1 64 64 GLU C C 64 175.250 175.250 175.971 -0.721 17919 86671 1 211 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.719 0.171 17919 86672 1 211 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.243 -2.343 17919 86673 1 211 . 1 1 64 64 GLU H H 64 9.280 9.280 8.506 0.774 17919 86674 1 211 . 1 1 65 65 SER N N 65 114.730 114.730 116.983 -2.253 17919 86675 1 211 . 1 1 65 65 SER HA H 65 4.640 4.640 4.482 0.158 17919 86676 1 211 . 1 1 65 65 SER C C 65 172.160 172.160 174.315 -2.155 17919 86677 1 211 . 1 1 65 65 SER CA C 65 60.890 60.890 60.680 0.210 17919 86678 1 211 . 1 1 65 65 SER CB C 65 64.910 64.910 64.345 0.565 17919 86679 1 211 . 1 1 65 65 SER H H 65 7.670 7.670 7.374 0.296 17919 86680 1 211 . 1 1 66 66 THR N N 66 117.110 117.110 120.063 -2.953 17919 86681 1 211 . 1 1 66 66 THR HA H 66 5.270 5.270 5.455 -0.185 17919 86682 1 211 . 1 1 66 66 THR C C 66 173.950 173.950 174.223 -0.273 17919 86683 1 211 . 1 1 66 66 THR CA C 66 62.340 62.340 61.500 0.840 17919 86684 1 211 . 1 1 66 66 THR CB C 66 70.080 70.080 71.050 -0.970 17919 86685 1 211 . 1 1 66 66 THR H H 66 8.730 8.730 8.531 0.199 17919 86686 1 211 . 1 1 67 67 LEU N N 67 127.110 127.110 126.658 0.452 17919 86687 1 211 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.971 0.089 17919 86688 1 211 . 1 1 67 67 LEU C C 67 175.770 175.770 175.388 0.382 17919 86689 1 211 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.796 0.104 17919 86690 1 211 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.977 -0.717 17919 86691 1 211 . 1 1 67 67 LEU H H 67 9.410 9.410 9.250 0.160 17919 86692 1 211 . 1 1 68 68 HIS N N 68 118.380 118.380 120.963 -2.583 17919 86693 1 211 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.428 -0.188 17919 86694 1 211 . 1 1 68 68 HIS C C 68 173.150 173.150 173.898 -0.748 17919 86695 1 211 . 1 1 68 68 HIS CA C 68 55.000 55.000 53.997 1.003 17919 86696 1 211 . 1 1 68 68 HIS CB C 68 30.530 30.530 31.857 -1.327 17919 86697 1 211 . 1 1 68 68 HIS H H 68 9.230 9.230 8.711 0.519 17919 86698 1 211 . 1 1 69 69 LEU N N 69 124.460 124.460 130.172 -5.712 17919 86699 1 211 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.218 -0.028 17919 86700 1 211 . 1 1 69 69 LEU C C 69 175.270 175.270 174.032 1.238 17919 86701 1 211 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.080 0.810 17919 86702 1 211 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.622 -0.242 17919 86703 1 211 . 1 1 69 69 LEU H H 69 8.340 8.340 8.667 -0.327 17919 86704 1 211 . 1 1 70 70 VAL N N 70 126.940 126.940 122.144 4.796 17919 86705 1 211 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.442 -0.093 17919 86706 1 211 . 1 1 70 70 VAL C C 70 174.000 174.000 173.790 0.210 17919 86707 1 211 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.708 1.092 17919 86708 1 211 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.392 -0.482 17919 86709 1 211 . 1 1 70 70 VAL H H 70 9.200 9.200 8.573 0.627 17919 86710 1 211 . 1 1 71 71 LEU N N 71 123.130 123.130 123.213 -0.083 17919 86711 1 211 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.199 -0.139 17919 86712 1 211 . 1 1 71 71 LEU C C 71 177.830 177.830 176.958 0.872 17919 86713 1 211 . 1 1 71 71 LEU CA C 71 53.940 53.940 52.981 0.959 17919 86714 1 211 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.790 0.060 17919 86715 1 211 . 1 1 71 71 LEU H H 71 8.120 8.120 8.262 -0.142 17919 86716 1 211 . 1 1 72 72 ARG N N 72 123.490 123.490 124.942 -1.452 17919 86717 1 211 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.227 0.074 17919 86718 1 211 . 1 1 72 72 ARG C C 72 175.350 175.350 175.662 -0.312 17919 86719 1 211 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.719 -1.109 17919 86720 1 211 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.174 1.176 17919 86721 1 211 . 1 1 72 72 ARG H H 72 8.580 8.580 8.304 0.276 17919 86722 1 212 . 1 1 2 2 GLN N N 2 123.220 123.220 121.743 1.477 17919 86723 1 212 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.448 -0.199 17919 86724 1 212 . 1 1 2 2 GLN C C 2 175.920 175.920 174.756 1.164 17919 86725 1 212 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.428 0.652 17919 86726 1 212 . 1 1 2 2 GLN CB C 2 30.760 30.760 31.461 -0.701 17919 86727 1 212 . 1 1 2 2 GLN H H 2 8.900 8.900 8.411 0.489 17919 86728 1 212 . 1 1 3 3 ILE N N 3 115.340 115.340 117.154 -1.814 17919 86729 1 212 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.424 -0.211 17919 86730 1 212 . 1 1 3 3 ILE C C 3 172.450 172.450 173.146 -0.696 17919 86731 1 212 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.175 0.395 17919 86732 1 212 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.998 0.212 17919 86733 1 212 . 1 1 3 3 ILE H H 3 8.320 8.320 8.439 -0.119 17919 86734 1 212 . 1 1 4 4 PHE N N 4 118.110 118.110 119.451 -1.341 17919 86735 1 212 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.328 0.302 17919 86736 1 212 . 1 1 4 4 PHE C C 4 175.320 175.320 174.928 0.392 17919 86737 1 212 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.860 -0.650 17919 86738 1 212 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.047 -0.567 17919 86739 1 212 . 1 1 4 4 PHE H H 4 8.610 8.610 8.597 0.013 17919 86740 1 212 . 1 1 5 5 VAL N N 5 121.000 121.000 115.086 5.914 17919 86741 1 212 . 1 1 5 5 VAL HA H 5 4.725 4.725 5.241 -0.516 17919 86742 1 212 . 1 1 5 5 VAL C C 5 174.870 174.870 174.218 0.652 17919 86743 1 212 . 1 1 5 5 VAL CA C 5 60.620 60.620 59.791 0.829 17919 86744 1 212 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.937 -0.707 17919 86745 1 212 . 1 1 5 5 VAL H H 5 9.300 9.300 9.153 0.147 17919 86746 1 212 . 1 1 6 6 LYS N N 6 127.520 127.520 127.649 -0.129 17919 86747 1 212 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.462 -0.095 17919 86748 1 212 . 1 1 6 6 LYS C C 6 177.140 177.140 175.844 1.296 17919 86749 1 212 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.481 0.039 17919 86750 1 212 . 1 1 6 6 LYS CB C 6 35.050 35.050 36.591 -1.541 17919 86751 1 212 . 1 1 6 6 LYS H H 6 8.820 8.820 9.120 -0.300 17919 86752 1 212 . 1 1 7 7 THR N N 7 115.400 115.400 117.579 -2.179 17919 86753 1 212 . 1 1 7 7 THR HA H 7 4.970 4.970 4.859 0.111 17919 86754 1 212 . 1 1 7 7 THR C C 7 176.910 176.910 175.521 1.389 17919 86755 1 212 . 1 1 7 7 THR CA C 7 60.470 60.470 60.401 0.069 17919 86756 1 212 . 1 1 7 7 THR CB C 7 70.630 70.630 71.493 -0.863 17919 86757 1 212 . 1 1 7 7 THR H H 7 8.730 8.730 9.026 -0.296 17919 86758 1 212 . 1 1 8 8 LEU N N 8 121.330 121.330 124.286 -2.956 17919 86759 1 212 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.403 -0.093 17919 86760 1 212 . 1 1 8 8 LEU C C 8 178.800 178.800 176.876 1.924 17919 86761 1 212 . 1 1 8 8 LEU CA C 8 57.580 57.580 56.149 1.431 17919 86762 1 212 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.801 0.169 17919 86763 1 212 . 1 1 8 8 LEU H H 8 9.100 9.100 9.047 0.053 17919 86764 1 212 . 1 1 9 9 THR N N 9 105.590 105.590 109.279 -3.689 17919 86765 1 212 . 1 1 9 9 THR HA H 9 4.428 4.428 4.442 -0.014 17919 86766 1 212 . 1 1 9 9 THR C C 9 175.520 175.520 175.356 0.164 17919 86767 1 212 . 1 1 9 9 THR CA C 9 61.400 61.400 61.439 -0.039 17919 86768 1 212 . 1 1 9 9 THR CB C 9 69.140 69.140 69.543 -0.403 17919 86769 1 212 . 1 1 9 9 THR H H 9 7.630 7.630 7.528 0.102 17919 86770 1 212 . 1 1 10 10 GLY N N 10 108.890 108.890 110.242 -1.352 17919 86771 1 212 . 1 1 10 10 GLY C C 10 174.070 174.070 173.729 0.341 17919 86772 1 212 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.734 0.726 17919 86773 1 212 . 1 1 10 10 GLY H H 10 7.810 7.810 7.825 -0.015 17919 86774 1 212 . 1 1 11 11 LYS N N 11 121.600 121.600 122.086 -0.486 17919 86775 1 212 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.602 -0.241 17919 86776 1 212 . 1 1 11 11 LYS C C 11 175.940 175.940 175.361 0.579 17919 86777 1 212 . 1 1 11 11 LYS CA C 11 56.280 56.280 55.365 0.915 17919 86778 1 212 . 1 1 11 11 LYS CB C 11 33.200 33.200 34.383 -1.183 17919 86779 1 212 . 1 1 11 11 LYS H H 11 7.280 7.280 8.100 -0.820 17919 86780 1 212 . 1 1 12 12 THR N N 12 120.440 120.440 119.858 0.582 17919 86781 1 212 . 1 1 12 12 THR HA H 12 5.046 5.046 5.095 -0.049 17919 86782 1 212 . 1 1 12 12 THR C C 12 174.320 174.320 174.025 0.295 17919 86783 1 212 . 1 1 12 12 THR CA C 12 62.390 62.390 61.528 0.862 17919 86784 1 212 . 1 1 12 12 THR CB C 12 69.910 69.910 70.186 -0.276 17919 86785 1 212 . 1 1 12 12 THR H H 12 8.650 8.650 8.383 0.267 17919 86786 1 212 . 1 1 13 13 ILE N N 13 127.110 127.110 128.545 -1.435 17919 86787 1 212 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.512 0.032 17919 86788 1 212 . 1 1 13 13 ILE C C 13 175.220 175.220 174.950 0.270 17919 86789 1 212 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.527 -0.547 17919 86790 1 212 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.431 -0.481 17919 86791 1 212 . 1 1 13 13 ILE H H 13 9.450 9.450 9.278 0.172 17919 86792 1 212 . 1 1 14 14 THR N N 14 121.520 121.520 122.573 -1.053 17919 86793 1 212 . 1 1 14 14 THR HA H 14 4.964 4.964 4.872 0.092 17919 86794 1 212 . 1 1 14 14 THR C C 14 173.790 173.790 173.842 -0.052 17919 86795 1 212 . 1 1 14 14 THR CA C 14 61.940 61.940 62.197 -0.257 17919 86796 1 212 . 1 1 14 14 THR CB C 14 69.650 69.650 69.803 -0.153 17919 86797 1 212 . 1 1 14 14 THR H H 14 8.710 8.710 8.466 0.244 17919 86798 1 212 . 1 1 15 15 LEU N N 15 124.800 124.800 125.907 -1.107 17919 86799 1 212 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.844 -0.064 17919 86800 1 212 . 1 1 15 15 LEU C C 15 174.670 174.670 175.052 -0.382 17919 86801 1 212 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.650 -0.820 17919 86802 1 212 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.223 1.847 17919 86803 1 212 . 1 1 15 15 LEU H H 15 8.710 8.710 8.815 -0.105 17919 86804 1 212 . 1 1 16 16 GLU N N 16 122.160 122.160 121.952 0.208 17919 86805 1 212 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.291 -0.374 17919 86806 1 212 . 1 1 16 16 GLU C C 16 175.860 175.860 176.031 -0.171 17919 86807 1 212 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.040 -0.220 17919 86808 1 212 . 1 1 16 16 GLU CB C 16 29.450 29.450 31.783 -2.333 17919 86809 1 212 . 1 1 16 16 GLU H H 16 8.140 8.140 8.597 -0.457 17919 86810 1 212 . 1 1 17 17 VAL N N 17 117.210 117.210 120.643 -3.433 17919 86811 1 212 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.913 -0.199 17919 86812 1 212 . 1 1 17 17 VAL C C 17 174.160 174.160 174.824 -0.664 17919 86813 1 212 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.011 -0.581 17919 86814 1 212 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.964 0.437 17919 86815 1 212 . 1 1 17 17 VAL H H 17 8.900 8.900 9.013 -0.113 17919 86816 1 212 . 1 1 18 18 GLU N N 18 118.990 118.990 121.401 -2.411 17919 86817 1 212 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.798 0.281 17919 86818 1 212 . 1 1 18 18 GLU C C 18 176.160 176.160 175.494 0.666 17919 86819 1 212 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.403 0.317 17919 86820 1 212 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.152 0.158 17919 86821 1 212 . 1 1 18 18 GLU H H 18 8.640 8.640 8.851 -0.211 17919 86822 1 212 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.415 -0.274 17919 86823 1 212 . 1 1 19 19 PRO C C 19 175.310 175.310 177.694 -2.384 17919 86824 1 212 . 1 1 19 19 PRO CA C 19 65.470 65.470 64.911 0.559 17919 86825 1 212 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.855 0.095 17919 86826 1 212 . 1 1 20 20 SER N N 20 103.400 103.400 112.911 -9.511 17919 86827 1 212 . 1 1 20 20 SER HA H 20 4.370 4.370 4.294 0.076 17919 86828 1 212 . 1 1 20 20 SER C C 20 174.660 174.660 174.508 0.152 17919 86829 1 212 . 1 1 20 20 SER CA C 20 57.400 57.400 58.956 -1.556 17919 86830 1 212 . 1 1 20 20 SER CB C 20 63.370 63.370 62.848 0.522 17919 86831 1 212 . 1 1 20 20 SER H H 20 7.040 7.040 8.071 -1.031 17919 86832 1 212 . 1 1 21 21 ASP N N 21 123.480 123.480 124.444 -0.964 17919 86833 1 212 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.692 0.003 17919 86834 1 212 . 1 1 21 21 ASP C C 21 176.360 176.360 176.323 0.037 17919 86835 1 212 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.455 0.245 17919 86836 1 212 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.300 -0.500 17919 86837 1 212 . 1 1 21 21 ASP H H 21 8.030 8.030 7.991 0.039 17919 86838 1 212 . 1 1 22 22 THR N N 22 108.800 108.800 112.358 -3.558 17919 86839 1 212 . 1 1 22 22 THR HA H 22 4.920 4.920 4.705 0.215 17919 86840 1 212 . 1 1 22 22 THR C C 22 176.750 176.750 176.280 0.470 17919 86841 1 212 . 1 1 22 22 THR CA C 22 59.690 59.690 61.771 -2.081 17919 86842 1 212 . 1 1 22 22 THR CB C 22 71.200 71.200 70.081 1.119 17919 86843 1 212 . 1 1 22 22 THR H H 22 7.900 7.900 8.210 -0.310 17919 86844 1 212 . 1 1 23 23 ILE N N 23 121.190 121.190 123.076 -1.886 17919 86845 1 212 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.730 -0.073 17919 86846 1 212 . 1 1 23 23 ILE C C 23 179.040 179.040 177.749 1.291 17919 86847 1 212 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.209 -0.950 17919 86848 1 212 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.251 -1.901 17919 86849 1 212 . 1 1 23 23 ILE H H 23 8.560 8.560 9.020 -0.460 17919 86850 1 212 . 1 1 24 24 GLU N N 24 120.830 120.830 120.934 -0.104 17919 86851 1 212 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.795 0.122 17919 86852 1 212 . 1 1 24 24 GLU C C 24 178.640 178.640 178.599 0.041 17919 86853 1 212 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.264 -0.044 17919 86854 1 212 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.366 -1.085 17919 86855 1 212 . 1 1 24 24 GLU H H 24 9.760 9.760 8.541 1.219 17919 86856 1 212 . 1 1 25 25 ASN N N 25 120.570 120.570 116.929 3.641 17919 86857 1 212 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.580 -0.055 17919 86858 1 212 . 1 1 25 25 ASN C C 25 178.380 178.380 177.917 0.463 17919 86859 1 212 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.720 0.340 17919 86860 1 212 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.716 -0.266 17919 86861 1 212 . 1 1 25 25 ASN H H 25 7.920 7.920 7.543 0.377 17919 86862 1 212 . 1 1 26 26 VAL N N 26 121.710 121.710 121.784 -0.074 17919 86863 1 212 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.585 -0.188 17919 86864 1 212 . 1 1 26 26 VAL C C 26 177.950 177.950 177.691 0.259 17919 86865 1 212 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.917 0.743 17919 86866 1 212 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.477 -0.637 17919 86867 1 212 . 1 1 26 26 VAL H H 26 8.070 8.070 8.523 -0.453 17919 86868 1 212 . 1 1 27 27 LYS N N 27 118.860 118.860 120.443 -1.583 17919 86869 1 212 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.158 0.422 17919 86870 1 212 . 1 1 27 27 LYS C C 27 180.550 180.550 179.175 1.375 17919 86871 1 212 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.767 -0.517 17919 86872 1 212 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.321 1.409 17919 86873 1 212 . 1 1 27 27 LYS H H 27 8.560 8.560 8.538 0.022 17919 86874 1 212 . 1 1 28 28 ALA N N 28 123.440 123.440 122.298 1.142 17919 86875 1 212 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.148 0.012 17919 86876 1 212 . 1 1 28 28 ALA C C 28 180.300 180.300 179.372 0.928 17919 86877 1 212 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.944 0.426 17919 86878 1 212 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.392 -0.682 17919 86879 1 212 . 1 1 28 28 ALA H H 28 8.060 8.060 8.517 -0.457 17919 86880 1 212 . 1 1 29 29 LYS N N 29 119.940 119.940 119.017 0.923 17919 86881 1 212 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.002 0.205 17919 86882 1 212 . 1 1 29 29 LYS C C 29 180.320 180.320 178.666 1.654 17919 86883 1 212 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.383 0.267 17919 86884 1 212 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.398 0.892 17919 86885 1 212 . 1 1 29 29 LYS H H 29 7.850 7.850 7.878 -0.028 17919 86886 1 212 . 1 1 30 30 ILE N N 30 121.080 121.080 118.838 2.242 17919 86887 1 212 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.740 -0.233 17919 86888 1 212 . 1 1 30 30 ILE C C 30 178.310 178.310 177.223 1.087 17919 86889 1 212 . 1 1 30 30 ILE CA C 30 66.150 66.150 64.513 1.637 17919 86890 1 212 . 1 1 30 30 ILE CB C 30 36.800 36.800 38.270 -1.470 17919 86891 1 212 . 1 1 30 30 ILE H H 30 8.280 8.280 8.063 0.217 17919 86892 1 212 . 1 1 31 31 GLN N N 31 123.490 123.490 120.901 2.589 17919 86893 1 212 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.950 -0.121 17919 86894 1 212 . 1 1 31 31 GLN C C 31 178.890 178.890 178.268 0.622 17919 86895 1 212 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.455 0.545 17919 86896 1 212 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.564 -0.844 17919 86897 1 212 . 1 1 31 31 GLN H H 31 8.580 8.580 8.399 0.181 17919 86898 1 212 . 1 1 32 32 ASP N N 32 119.360 119.360 119.278 0.082 17919 86899 1 212 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.404 -0.050 17919 86900 1 212 . 1 1 32 32 ASP C C 32 177.250 177.250 177.465 -0.215 17919 86901 1 212 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.721 0.469 17919 86902 1 212 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.719 -0.139 17919 86903 1 212 . 1 1 32 32 ASP H H 32 8.010 8.010 8.078 -0.068 17919 86904 1 212 . 1 1 33 33 LYS N N 33 115.130 115.130 117.252 -2.122 17919 86905 1 212 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.480 -0.143 17919 86906 1 212 . 1 1 33 33 LYS C C 33 177.870 177.870 177.920 -0.050 17919 86907 1 212 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.429 0.621 17919 86908 1 212 . 1 1 33 33 LYS CB C 33 34.170 34.170 34.245 -0.076 17919 86909 1 212 . 1 1 33 33 LYS H H 33 7.430 7.430 7.477 -0.047 17919 86910 1 212 . 1 1 34 34 GLU N N 34 113.870 113.870 115.266 -1.396 17919 86911 1 212 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.465 0.160 17919 86912 1 212 . 1 1 34 34 GLU C C 34 177.840 177.840 177.495 0.345 17919 86913 1 212 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.757 -0.587 17919 86914 1 212 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.905 0.755 17919 86915 1 212 . 1 1 34 34 GLU H H 34 8.740 8.740 8.287 0.453 17919 86916 1 212 . 1 1 35 35 GLY N N 35 108.650 108.650 108.780 -0.130 17919 86917 1 212 . 1 1 35 35 GLY C C 35 173.960 173.960 174.036 -0.076 17919 86918 1 212 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.583 0.497 17919 86919 1 212 . 1 1 35 35 GLY H H 35 8.530 8.530 8.393 0.137 17919 86920 1 212 . 1 1 36 36 ILE N N 36 119.880 119.880 120.546 -0.666 17919 86921 1 212 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.381 0.064 17919 86922 1 212 . 1 1 36 36 ILE C C 36 173.590 173.590 174.463 -0.873 17919 86923 1 212 . 1 1 36 36 ILE CA C 36 57.750 57.750 56.309 1.441 17919 86924 1 212 . 1 1 36 36 ILE CB C 36 40.580 40.580 36.854 3.726 17919 86925 1 212 . 1 1 36 36 ILE H H 36 6.150 6.150 7.829 -1.679 17919 86926 1 212 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.702 -0.068 17919 86927 1 212 . 1 1 37 37 PRO C C 37 176.940 176.940 175.969 0.971 17919 86928 1 212 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.946 -0.286 17919 86929 1 212 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.613 0.237 17919 86930 1 212 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.221 -0.104 17919 86931 1 212 . 1 1 38 38 PRO C C 38 178.320 178.320 178.750 -0.430 17919 86932 1 212 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.548 0.712 17919 86933 1 212 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.866 1.024 17919 86934 1 212 . 1 1 39 39 ASP N N 39 113.380 113.380 117.057 -3.677 17919 86935 1 212 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.331 0.099 17919 86936 1 212 . 1 1 39 39 ASP C C 39 177.090 177.090 177.829 -0.739 17919 86937 1 212 . 1 1 39 39 ASP CA C 39 55.640 55.640 57.284 -1.644 17919 86938 1 212 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.377 -0.837 17919 86939 1 212 . 1 1 39 39 ASP H H 39 8.550 8.550 8.841 -0.291 17919 86940 1 212 . 1 1 40 40 GLN N N 40 116.780 116.780 117.169 -0.389 17919 86941 1 212 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.191 0.273 17919 86942 1 212 . 1 1 40 40 GLN C C 40 175.380 175.380 175.733 -0.353 17919 86943 1 212 . 1 1 40 40 GLN CA C 40 55.640 55.640 57.026 -1.386 17919 86944 1 212 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.463 0.676 17919 86945 1 212 . 1 1 40 40 GLN H H 40 7.820 7.820 7.873 -0.053 17919 86946 1 212 . 1 1 41 41 GLN N N 41 117.720 117.720 119.225 -1.505 17919 86947 1 212 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.676 -0.432 17919 86948 1 212 . 1 1 41 41 GLN C C 41 176.300 176.300 175.175 1.125 17919 86949 1 212 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.448 1.022 17919 86950 1 212 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.510 2.140 17919 86951 1 212 . 1 1 41 41 GLN H H 41 7.480 7.480 7.352 0.128 17919 86952 1 212 . 1 1 42 42 ARG N N 42 122.680 122.680 126.822 -4.142 17919 86953 1 212 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.525 -0.025 17919 86954 1 212 . 1 1 42 42 ARG C C 42 174.050 174.050 174.191 -0.141 17919 86955 1 212 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.079 -0.029 17919 86956 1 212 . 1 1 42 42 ARG CB C 42 31.750 31.750 31.775 -0.025 17919 86957 1 212 . 1 1 42 42 ARG H H 42 8.530 8.530 8.766 -0.236 17919 86958 1 212 . 1 1 43 43 LEU N N 43 124.040 124.040 128.401 -4.361 17919 86959 1 212 . 1 1 43 43 LEU C C 43 175.290 175.290 175.767 -0.477 17919 86960 1 212 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.327 -1.347 17919 86961 1 212 . 1 1 43 43 LEU CB C 43 45.790 45.790 42.898 2.892 17919 86962 1 212 . 1 1 43 43 LEU H H 43 8.820 8.820 8.644 0.176 17919 86963 1 212 . 1 1 44 44 ILE N N 44 121.920 121.920 122.786 -0.866 17919 86964 1 212 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.579 0.413 17919 86965 1 212 . 1 1 44 44 ILE C C 44 176.060 176.060 174.276 1.784 17919 86966 1 212 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.468 -1.488 17919 86967 1 212 . 1 1 44 44 ILE CB C 44 41.420 41.420 40.161 1.259 17919 86968 1 212 . 1 1 44 44 ILE H H 44 9.030 9.030 8.957 0.073 17919 86969 1 212 . 1 1 45 45 PHE N N 45 125.390 125.390 127.680 -2.290 17919 86970 1 212 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.044 0.001 17919 86971 1 212 . 1 1 45 45 PHE C C 45 174.470 174.470 174.458 0.012 17919 86972 1 212 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.260 0.760 17919 86973 1 212 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.483 0.277 17919 86974 1 212 . 1 1 45 45 PHE H H 45 8.830 8.830 8.622 0.208 17919 86975 1 212 . 1 1 46 46 ALA N N 46 132.200 132.200 127.927 4.273 17919 86976 1 212 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.538 0.152 17919 86977 1 212 . 1 1 46 46 ALA C C 46 177.290 177.290 177.683 -0.393 17919 86978 1 212 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.426 0.114 17919 86979 1 212 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.233 0.338 17919 86980 1 212 . 1 1 46 46 ALA H H 46 8.810 8.810 8.462 0.348 17919 86981 1 212 . 1 1 47 47 GLY N N 47 102.340 102.340 103.879 -1.539 17919 86982 1 212 . 1 1 47 47 GLY C C 47 173.810 173.810 174.155 -0.345 17919 86983 1 212 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.932 0.418 17919 86984 1 212 . 1 1 47 47 GLY H H 47 8.130 8.130 8.509 -0.379 17919 86985 1 212 . 1 1 48 48 LYS N N 48 121.570 121.570 121.123 0.447 17919 86986 1 212 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.676 -0.054 17919 86987 1 212 . 1 1 48 48 LYS C C 48 174.700 174.700 175.241 -0.541 17919 86988 1 212 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.509 0.041 17919 86989 1 212 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.294 0.235 17919 86990 1 212 . 1 1 48 48 LYS H H 48 7.980 7.980 8.002 -0.022 17919 86991 1 212 . 1 1 49 49 GLN N N 49 122.410 122.410 125.668 -3.258 17919 86992 1 212 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.555 0.005 17919 86993 1 212 . 1 1 49 49 GLN C C 49 175.670 175.670 175.478 0.192 17919 86994 1 212 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.177 -0.437 17919 86995 1 212 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.358 -0.358 17919 86996 1 212 . 1 1 49 49 GLN H H 49 8.600 8.600 8.560 0.040 17919 86997 1 212 . 1 1 50 50 LEU N N 50 125.520 125.520 128.321 -2.801 17919 86998 1 212 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.132 -0.042 17919 86999 1 212 . 1 1 50 50 LEU C C 50 176.660 176.660 175.178 1.482 17919 87000 1 212 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.538 0.702 17919 87001 1 212 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.416 -0.846 17919 87002 1 212 . 1 1 50 50 LEU H H 50 8.530 8.530 8.434 0.096 17919 87003 1 212 . 1 1 51 51 GLU N N 51 122.940 122.940 122.517 0.423 17919 87004 1 212 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.544 -0.056 17919 87005 1 212 . 1 1 51 51 GLU C C 51 175.870 175.870 177.419 -1.549 17919 87006 1 212 . 1 1 51 51 GLU CA C 51 55.960 55.960 54.479 1.481 17919 87007 1 212 . 1 1 51 51 GLU CB C 51 31.570 31.570 33.125 -1.555 17919 87008 1 212 . 1 1 51 51 GLU H H 51 8.400 8.400 7.708 0.692 17919 87009 1 212 . 1 1 52 52 ASP N N 52 120.030 120.030 124.300 -4.270 17919 87010 1 212 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.376 -0.017 17919 87011 1 212 . 1 1 52 52 ASP C C 52 177.330 177.330 177.110 0.220 17919 87012 1 212 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.941 -0.981 17919 87013 1 212 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.777 0.073 17919 87014 1 212 . 1 1 52 52 ASP H H 52 8.160 8.160 8.844 -0.684 17919 87015 1 212 . 1 1 53 53 GLY N N 53 106.660 106.660 105.166 1.494 17919 87016 1 212 . 1 1 53 53 GLY C C 53 174.870 174.870 174.303 0.567 17919 87017 1 212 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.796 0.374 17919 87018 1 212 . 1 1 53 53 GLY H H 53 9.390 9.390 8.467 0.923 17919 87019 1 212 . 1 1 54 54 ARG N N 54 119.050 119.050 121.629 -2.579 17919 87020 1 212 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.543 0.152 17919 87021 1 212 . 1 1 54 54 ARG C C 54 175.350 175.350 175.840 -0.490 17919 87022 1 212 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.747 -0.357 17919 87023 1 212 . 1 1 54 54 ARG CB C 54 32.650 32.650 31.645 1.005 17919 87024 1 212 . 1 1 54 54 ARG H H 54 7.460 7.460 7.514 -0.054 17919 87025 1 212 . 1 1 55 55 THR N N 55 108.400 108.400 111.548 -3.148 17919 87026 1 212 . 1 1 55 55 THR HA H 55 5.240 5.240 4.998 0.242 17919 87027 1 212 . 1 1 55 55 THR C C 55 176.560 176.560 176.303 0.257 17919 87028 1 212 . 1 1 55 55 THR CA C 55 59.690 59.690 60.304 -0.614 17919 87029 1 212 . 1 1 55 55 THR CB C 55 72.260 72.260 70.744 1.516 17919 87030 1 212 . 1 1 55 55 THR H H 55 8.730 8.730 9.000 -0.270 17919 87031 1 212 . 1 1 56 56 LEU N N 56 117.920 117.920 120.843 -2.923 17919 87032 1 212 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.031 0.029 17919 87033 1 212 . 1 1 56 56 LEU C C 56 180.810 180.810 178.900 1.910 17919 87034 1 212 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.227 0.483 17919 87035 1 212 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.420 -1.050 17919 87036 1 212 . 1 1 56 56 LEU H H 56 8.140 8.140 8.716 -0.576 17919 87037 1 212 . 1 1 57 57 SER N N 57 113.330 113.330 115.353 -2.023 17919 87038 1 212 . 1 1 57 57 SER HA H 57 4.370 4.370 4.219 0.151 17919 87039 1 212 . 1 1 57 57 SER C C 57 178.310 178.310 176.873 1.437 17919 87040 1 212 . 1 1 57 57 SER CA C 57 61.080 61.080 62.208 -1.128 17919 87041 1 212 . 1 1 57 57 SER CB C 57 62.530 62.530 62.782 -0.252 17919 87042 1 212 . 1 1 57 57 SER H H 57 8.470 8.470 8.262 0.208 17919 87043 1 212 . 1 1 58 58 ASP N N 58 124.190 124.190 122.296 1.894 17919 87044 1 212 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.346 -0.050 17919 87045 1 212 . 1 1 58 58 ASP C C 58 177.400 177.400 177.363 0.037 17919 87046 1 212 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.855 0.325 17919 87047 1 212 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.453 -0.353 17919 87048 1 212 . 1 1 58 58 ASP H H 58 7.930 7.930 7.617 0.313 17919 87049 1 212 . 1 1 59 59 TYR N N 59 115.510 115.510 115.958 -0.448 17919 87050 1 212 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.578 0.092 17919 87051 1 212 . 1 1 59 59 TYR C C 59 174.700 174.700 174.378 0.322 17919 87052 1 212 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.753 0.497 17919 87053 1 212 . 1 1 59 59 TYR CB C 59 40.070 40.070 37.770 2.300 17919 87054 1 212 . 1 1 59 59 TYR H H 59 7.250 7.250 7.450 -0.200 17919 87055 1 212 . 1 1 60 60 ASN N N 60 115.900 115.900 115.155 0.745 17919 87056 1 212 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.357 -0.002 17919 87057 1 212 . 1 1 60 60 ASN C C 60 174.340 174.340 174.594 -0.254 17919 87058 1 212 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.114 0.006 17919 87059 1 212 . 1 1 60 60 ASN CB C 60 37.410 37.410 36.325 1.085 17919 87060 1 212 . 1 1 60 60 ASN H H 60 8.150 8.150 7.693 0.457 17919 87061 1 212 . 1 1 61 61 ILE N N 61 118.600 118.600 119.663 -1.063 17919 87062 1 212 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.894 -0.501 17919 87063 1 212 . 1 1 61 61 ILE C C 61 174.610 174.610 175.389 -0.779 17919 87064 1 212 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.785 0.635 17919 87065 1 212 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.910 -1.170 17919 87066 1 212 . 1 1 61 61 ILE H H 61 7.250 7.250 8.167 -0.917 17919 87067 1 212 . 1 1 62 62 GLN N N 62 124.740 124.740 126.581 -1.841 17919 87068 1 212 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.718 -0.212 17919 87069 1 212 . 1 1 62 62 GLN C C 62 175.970 175.970 174.906 1.064 17919 87070 1 212 . 1 1 62 62 GLN CA C 62 53.660 53.660 52.949 0.711 17919 87071 1 212 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.344 0.306 17919 87072 1 212 . 1 1 62 62 GLN H H 62 7.610 7.610 7.950 -0.340 17919 87073 1 212 . 1 1 63 63 LYS N N 63 120.300 120.300 120.652 -0.352 17919 87074 1 212 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.142 -0.141 17919 87075 1 212 . 1 1 63 63 LYS C C 63 175.810 175.810 177.360 -1.550 17919 87076 1 212 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.892 -0.102 17919 87077 1 212 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.159 0.491 17919 87078 1 212 . 1 1 63 63 LYS H H 63 8.490 8.490 8.398 0.092 17919 87079 1 212 . 1 1 64 64 GLU N N 64 113.950 113.950 119.353 -5.403 17919 87080 1 212 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.753 -0.288 17919 87081 1 212 . 1 1 64 64 GLU C C 64 175.250 175.250 176.011 -0.761 17919 87082 1 212 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.921 -0.031 17919 87083 1 212 . 1 1 64 64 GLU CB C 64 25.900 25.900 29.314 -3.414 17919 87084 1 212 . 1 1 64 64 GLU H H 64 9.280 9.280 9.078 0.202 17919 87085 1 212 . 1 1 65 65 SER N N 65 114.730 114.730 116.297 -1.567 17919 87086 1 212 . 1 1 65 65 SER HA H 65 4.640 4.640 4.295 0.345 17919 87087 1 212 . 1 1 65 65 SER C C 65 172.160 172.160 173.709 -1.549 17919 87088 1 212 . 1 1 65 65 SER CA C 65 60.890 60.890 60.827 0.063 17919 87089 1 212 . 1 1 65 65 SER CB C 65 64.910 64.910 63.904 1.006 17919 87090 1 212 . 1 1 65 65 SER H H 65 7.670 7.670 7.258 0.412 17919 87091 1 212 . 1 1 66 66 THR N N 66 117.110 117.110 119.572 -2.462 17919 87092 1 212 . 1 1 66 66 THR HA H 66 5.270 5.270 5.272 -0.002 17919 87093 1 212 . 1 1 66 66 THR C C 66 173.950 173.950 174.279 -0.329 17919 87094 1 212 . 1 1 66 66 THR CA C 66 62.340 62.340 61.671 0.669 17919 87095 1 212 . 1 1 66 66 THR CB C 66 70.080 70.080 69.691 0.389 17919 87096 1 212 . 1 1 66 66 THR H H 66 8.730 8.730 8.410 0.320 17919 87097 1 212 . 1 1 67 67 LEU N N 67 127.110 127.110 127.549 -0.439 17919 87098 1 212 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.746 0.314 17919 87099 1 212 . 1 1 67 67 LEU C C 67 175.770 175.770 175.561 0.209 17919 87100 1 212 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.618 0.282 17919 87101 1 212 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.832 0.428 17919 87102 1 212 . 1 1 67 67 LEU H H 67 9.410 9.410 9.233 0.177 17919 87103 1 212 . 1 1 68 68 HIS N N 68 118.380 118.380 121.019 -2.639 17919 87104 1 212 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.416 -0.176 17919 87105 1 212 . 1 1 68 68 HIS C C 68 173.150 173.150 173.737 -0.587 17919 87106 1 212 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.077 0.923 17919 87107 1 212 . 1 1 68 68 HIS CB C 68 30.530 30.530 31.928 -1.398 17919 87108 1 212 . 1 1 68 68 HIS H H 68 9.230 9.230 8.643 0.587 17919 87109 1 212 . 1 1 69 69 LEU N N 69 124.460 124.460 130.180 -5.720 17919 87110 1 212 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.544 0.646 17919 87111 1 212 . 1 1 69 69 LEU C C 69 175.270 175.270 174.049 1.221 17919 87112 1 212 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.969 -0.079 17919 87113 1 212 . 1 1 69 69 LEU CB C 69 44.380 44.380 43.799 0.581 17919 87114 1 212 . 1 1 69 69 LEU H H 69 8.340 8.340 8.299 0.041 17919 87115 1 212 . 1 1 70 70 VAL N N 70 126.940 126.940 126.490 0.450 17919 87116 1 212 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.320 0.030 17919 87117 1 212 . 1 1 70 70 VAL C C 70 174.000 174.000 174.433 -0.433 17919 87118 1 212 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.741 0.059 17919 87119 1 212 . 1 1 70 70 VAL CB C 70 34.910 34.910 34.913 -0.002 17919 87120 1 212 . 1 1 70 70 VAL H H 70 9.200 9.200 8.440 0.760 17919 87121 1 212 . 1 1 71 71 LEU N N 71 123.130 123.130 124.169 -1.039 17919 87122 1 212 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.024 0.036 17919 87123 1 212 . 1 1 71 71 LEU C C 71 177.830 177.830 177.362 0.468 17919 87124 1 212 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.880 0.060 17919 87125 1 212 . 1 1 71 71 LEU CB C 71 42.850 42.850 44.102 -1.252 17919 87126 1 212 . 1 1 71 71 LEU H H 71 8.120 8.120 8.539 -0.419 17919 87127 1 212 . 1 1 72 72 ARG N N 72 123.490 123.490 124.767 -1.277 17919 87128 1 212 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.377 -0.076 17919 87129 1 212 . 1 1 72 72 ARG C C 72 175.350 175.350 175.886 -0.536 17919 87130 1 212 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.173 -0.563 17919 87131 1 212 . 1 1 72 72 ARG CB C 72 31.350 31.350 28.428 2.922 17919 87132 1 212 . 1 1 72 72 ARG H H 72 8.580 8.580 8.681 -0.101 17919 87133 1 213 . 1 1 2 2 GLN N N 2 123.220 123.220 124.164 -0.944 17919 87134 1 213 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.428 -0.179 17919 87135 1 213 . 1 1 2 2 GLN C C 2 175.920 175.920 175.611 0.309 17919 87136 1 213 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.509 0.571 17919 87137 1 213 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.759 0.001 17919 87138 1 213 . 1 1 2 2 GLN H H 2 8.900 8.900 8.420 0.480 17919 87139 1 213 . 1 1 3 3 ILE N N 3 115.340 115.340 115.478 -0.138 17919 87140 1 213 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.417 -0.204 17919 87141 1 213 . 1 1 3 3 ILE C C 3 172.450 172.450 173.610 -1.160 17919 87142 1 213 . 1 1 3 3 ILE CA C 3 59.570 59.570 58.984 0.586 17919 87143 1 213 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.886 0.324 17919 87144 1 213 . 1 1 3 3 ILE H H 3 8.320 8.320 8.313 0.007 17919 87145 1 213 . 1 1 4 4 PHE N N 4 118.110 118.110 119.189 -1.079 17919 87146 1 213 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.389 0.241 17919 87147 1 213 . 1 1 4 4 PHE C C 4 175.320 175.320 174.930 0.390 17919 87148 1 213 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.493 -0.284 17919 87149 1 213 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.467 0.013 17919 87150 1 213 . 1 1 4 4 PHE H H 4 8.610 8.610 8.495 0.115 17919 87151 1 213 . 1 1 5 5 VAL N N 5 121.000 121.000 123.696 -2.696 17919 87152 1 213 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.513 0.212 17919 87153 1 213 . 1 1 5 5 VAL C C 5 174.870 174.870 175.168 -0.298 17919 87154 1 213 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.521 -0.901 17919 87155 1 213 . 1 1 5 5 VAL CB C 5 34.230 34.230 32.742 1.488 17919 87156 1 213 . 1 1 5 5 VAL H H 5 9.300 9.300 9.345 -0.045 17919 87157 1 213 . 1 1 6 6 LYS N N 6 127.520 127.520 128.361 -0.841 17919 87158 1 213 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.012 0.355 17919 87159 1 213 . 1 1 6 6 LYS C C 6 177.140 177.140 176.583 0.557 17919 87160 1 213 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.914 -0.394 17919 87161 1 213 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.533 0.517 17919 87162 1 213 . 1 1 6 6 LYS H H 6 8.820 8.820 8.699 0.121 17919 87163 1 213 . 1 1 7 7 THR N N 7 115.400 115.400 115.015 0.385 17919 87164 1 213 . 1 1 7 7 THR HA H 7 4.970 4.970 5.381 -0.411 17919 87165 1 213 . 1 1 7 7 THR C C 7 176.910 176.910 176.424 0.486 17919 87166 1 213 . 1 1 7 7 THR CA C 7 60.470 60.470 59.789 0.681 17919 87167 1 213 . 1 1 7 7 THR CB C 7 70.630 70.630 71.306 -0.676 17919 87168 1 213 . 1 1 7 7 THR H H 7 8.730 8.730 8.724 0.006 17919 87169 1 213 . 1 1 8 8 LEU N N 8 121.330 121.330 121.117 0.213 17919 87170 1 213 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.339 -0.029 17919 87171 1 213 . 1 1 8 8 LEU C C 8 178.800 178.800 177.352 1.448 17919 87172 1 213 . 1 1 8 8 LEU CA C 8 57.580 57.580 56.472 1.108 17919 87173 1 213 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.286 -0.316 17919 87174 1 213 . 1 1 8 8 LEU H H 8 9.100 9.100 8.967 0.133 17919 87175 1 213 . 1 1 9 9 THR N N 9 105.590 105.590 109.481 -3.891 17919 87176 1 213 . 1 1 9 9 THR HA H 9 4.428 4.428 4.405 0.023 17919 87177 1 213 . 1 1 9 9 THR C C 9 175.520 175.520 175.362 0.158 17919 87178 1 213 . 1 1 9 9 THR CA C 9 61.400 61.400 61.536 -0.136 17919 87179 1 213 . 1 1 9 9 THR CB C 9 69.140 69.140 69.229 -0.089 17919 87180 1 213 . 1 1 9 9 THR H H 9 7.630 7.630 7.394 0.236 17919 87181 1 213 . 1 1 10 10 GLY N N 10 108.890 108.890 110.405 -1.515 17919 87182 1 213 . 1 1 10 10 GLY C C 10 174.070 174.070 173.914 0.156 17919 87183 1 213 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.894 0.566 17919 87184 1 213 . 1 1 10 10 GLY H H 10 7.810 7.810 7.593 0.217 17919 87185 1 213 . 1 1 11 11 LYS N N 11 121.600 121.600 122.392 -0.792 17919 87186 1 213 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.504 -0.143 17919 87187 1 213 . 1 1 11 11 LYS C C 11 175.940 175.940 175.327 0.613 17919 87188 1 213 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.127 0.153 17919 87189 1 213 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.748 -0.548 17919 87190 1 213 . 1 1 11 11 LYS H H 11 7.280 7.280 7.697 -0.417 17919 87191 1 213 . 1 1 12 12 THR N N 12 120.440 120.440 120.737 -0.297 17919 87192 1 213 . 1 1 12 12 THR HA H 12 5.046 5.046 5.189 -0.143 17919 87193 1 213 . 1 1 12 12 THR C C 12 174.320 174.320 174.191 0.129 17919 87194 1 213 . 1 1 12 12 THR CA C 12 62.390 62.390 61.761 0.629 17919 87195 1 213 . 1 1 12 12 THR CB C 12 69.910 69.910 70.736 -0.826 17919 87196 1 213 . 1 1 12 12 THR H H 12 8.650 8.650 8.305 0.345 17919 87197 1 213 . 1 1 13 13 ILE N N 13 127.110 127.110 126.778 0.332 17919 87198 1 213 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.427 0.117 17919 87199 1 213 . 1 1 13 13 ILE C C 13 175.220 175.220 174.742 0.478 17919 87200 1 213 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.246 -0.266 17919 87201 1 213 . 1 1 13 13 ILE CB C 13 40.950 40.950 42.240 -1.290 17919 87202 1 213 . 1 1 13 13 ILE H H 13 9.450 9.450 9.265 0.185 17919 87203 1 213 . 1 1 14 14 THR N N 14 121.520 121.520 121.392 0.128 17919 87204 1 213 . 1 1 14 14 THR HA H 14 4.964 4.964 5.135 -0.171 17919 87205 1 213 . 1 1 14 14 THR C C 14 173.790 173.790 173.795 -0.005 17919 87206 1 213 . 1 1 14 14 THR CA C 14 61.940 61.940 61.815 0.125 17919 87207 1 213 . 1 1 14 14 THR CB C 14 69.650 69.650 70.016 -0.366 17919 87208 1 213 . 1 1 14 14 THR H H 14 8.710 8.710 8.467 0.243 17919 87209 1 213 . 1 1 15 15 LEU N N 15 124.800 124.800 125.286 -0.486 17919 87210 1 213 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.727 0.053 17919 87211 1 213 . 1 1 15 15 LEU C C 15 174.670 174.670 175.033 -0.363 17919 87212 1 213 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.848 -1.018 17919 87213 1 213 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.606 1.464 17919 87214 1 213 . 1 1 15 15 LEU H H 15 8.710 8.710 8.716 -0.006 17919 87215 1 213 . 1 1 16 16 GLU N N 16 122.160 122.160 124.864 -2.704 17919 87216 1 213 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.710 0.207 17919 87217 1 213 . 1 1 16 16 GLU C C 16 175.860 175.860 175.835 0.025 17919 87218 1 213 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.870 -1.050 17919 87219 1 213 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.353 -0.903 17919 87220 1 213 . 1 1 16 16 GLU H H 16 8.140 8.140 8.737 -0.597 17919 87221 1 213 . 1 1 17 17 VAL N N 17 117.210 117.210 120.552 -3.342 17919 87222 1 213 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.787 -0.073 17919 87223 1 213 . 1 1 17 17 VAL C C 17 174.160 174.160 174.447 -0.287 17919 87224 1 213 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.469 -0.039 17919 87225 1 213 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.056 1.343 17919 87226 1 213 . 1 1 17 17 VAL H H 17 8.900 8.900 8.917 -0.017 17919 87227 1 213 . 1 1 18 18 GLU N N 18 118.990 118.990 120.130 -1.140 17919 87228 1 213 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.740 0.339 17919 87229 1 213 . 1 1 18 18 GLU C C 18 176.160 176.160 175.456 0.704 17919 87230 1 213 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.880 -0.160 17919 87231 1 213 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.342 -0.032 17919 87232 1 213 . 1 1 18 18 GLU H H 18 8.640 8.640 8.577 0.063 17919 87233 1 213 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.219 -0.078 17919 87234 1 213 . 1 1 19 19 PRO C C 19 175.310 175.310 177.388 -2.078 17919 87235 1 213 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.647 -0.177 17919 87236 1 213 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.975 -0.025 17919 87237 1 213 . 1 1 20 20 SER N N 20 103.400 103.400 108.676 -5.276 17919 87238 1 213 . 1 1 20 20 SER HA H 20 4.370 4.370 4.331 0.039 17919 87239 1 213 . 1 1 20 20 SER C C 20 174.660 174.660 174.313 0.347 17919 87240 1 213 . 1 1 20 20 SER CA C 20 57.400 57.400 58.166 -0.766 17919 87241 1 213 . 1 1 20 20 SER CB C 20 63.370 63.370 63.361 0.009 17919 87242 1 213 . 1 1 20 20 SER H H 20 7.040 7.040 7.865 -0.825 17919 87243 1 213 . 1 1 21 21 ASP N N 21 123.480 123.480 125.304 -1.824 17919 87244 1 213 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.606 0.089 17919 87245 1 213 . 1 1 21 21 ASP C C 21 176.360 176.360 176.114 0.246 17919 87246 1 213 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.623 0.076 17919 87247 1 213 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.241 -0.441 17919 87248 1 213 . 1 1 21 21 ASP H H 21 8.030 8.030 7.614 0.416 17919 87249 1 213 . 1 1 22 22 THR N N 22 108.800 108.800 112.387 -3.587 17919 87250 1 213 . 1 1 22 22 THR HA H 22 4.920 4.920 4.847 0.073 17919 87251 1 213 . 1 1 22 22 THR C C 22 176.750 176.750 176.174 0.576 17919 87252 1 213 . 1 1 22 22 THR CA C 22 59.690 59.690 60.931 -1.240 17919 87253 1 213 . 1 1 22 22 THR CB C 22 71.200 71.200 70.985 0.215 17919 87254 1 213 . 1 1 22 22 THR H H 22 7.900 7.900 7.981 -0.081 17919 87255 1 213 . 1 1 23 23 ILE N N 23 121.190 121.190 122.603 -1.413 17919 87256 1 213 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.763 -0.106 17919 87257 1 213 . 1 1 23 23 ILE C C 23 179.040 179.040 177.787 1.253 17919 87258 1 213 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.185 -0.925 17919 87259 1 213 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.383 -2.033 17919 87260 1 213 . 1 1 23 23 ILE H H 23 8.560 8.560 8.803 -0.243 17919 87261 1 213 . 1 1 24 24 GLU N N 24 120.830 120.830 118.898 1.932 17919 87262 1 213 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.988 -0.071 17919 87263 1 213 . 1 1 24 24 GLU C C 24 178.640 178.640 178.454 0.186 17919 87264 1 213 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.240 0.980 17919 87265 1 213 . 1 1 24 24 GLU CB C 24 28.280 28.280 28.777 -0.497 17919 87266 1 213 . 1 1 24 24 GLU H H 24 9.760 9.760 8.495 1.265 17919 87267 1 213 . 1 1 25 25 ASN N N 25 120.570 120.570 118.689 1.881 17919 87268 1 213 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.561 -0.036 17919 87269 1 213 . 1 1 25 25 ASN C C 25 178.380 178.380 177.420 0.960 17919 87270 1 213 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.927 0.133 17919 87271 1 213 . 1 1 25 25 ASN CB C 25 38.450 38.450 39.115 -0.665 17919 87272 1 213 . 1 1 25 25 ASN H H 25 7.920 7.920 7.538 0.382 17919 87273 1 213 . 1 1 26 26 VAL N N 26 121.710 121.710 120.695 1.015 17919 87274 1 213 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.712 -0.315 17919 87275 1 213 . 1 1 26 26 VAL C C 26 177.950 177.950 178.109 -0.159 17919 87276 1 213 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.410 1.250 17919 87277 1 213 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.228 -0.388 17919 87278 1 213 . 1 1 26 26 VAL H H 26 8.070 8.070 8.277 -0.207 17919 87279 1 213 . 1 1 27 27 LYS N N 27 118.860 118.860 120.264 -1.404 17919 87280 1 213 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.179 0.401 17919 87281 1 213 . 1 1 27 27 LYS C C 27 180.550 180.550 179.135 1.415 17919 87282 1 213 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.874 -0.624 17919 87283 1 213 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.145 1.585 17919 87284 1 213 . 1 1 27 27 LYS H H 27 8.560 8.560 8.479 0.081 17919 87285 1 213 . 1 1 28 28 ALA N N 28 123.440 123.440 121.231 2.209 17919 87286 1 213 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.220 -0.060 17919 87287 1 213 . 1 1 28 28 ALA C C 28 180.300 180.300 179.240 1.060 17919 87288 1 213 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.583 0.787 17919 87289 1 213 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.544 -0.834 17919 87290 1 213 . 1 1 28 28 ALA H H 28 8.060 8.060 7.822 0.238 17919 87291 1 213 . 1 1 29 29 LYS N N 29 119.940 119.940 119.297 0.643 17919 87292 1 213 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.047 0.160 17919 87293 1 213 . 1 1 29 29 LYS C C 29 180.320 180.320 179.028 1.292 17919 87294 1 213 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.426 0.224 17919 87295 1 213 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.346 0.944 17919 87296 1 213 . 1 1 29 29 LYS H H 29 7.850 7.850 8.083 -0.233 17919 87297 1 213 . 1 1 30 30 ILE N N 30 121.080 121.080 120.267 0.813 17919 87298 1 213 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.656 -0.149 17919 87299 1 213 . 1 1 30 30 ILE C C 30 178.310 178.310 177.218 1.092 17919 87300 1 213 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.363 0.787 17919 87301 1 213 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.806 -1.006 17919 87302 1 213 . 1 1 30 30 ILE H H 30 8.280 8.280 7.663 0.617 17919 87303 1 213 . 1 1 31 31 GLN N N 31 123.490 123.490 120.397 3.093 17919 87304 1 213 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.913 -0.084 17919 87305 1 213 . 1 1 31 31 GLN C C 31 178.890 178.890 178.151 0.739 17919 87306 1 213 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.486 0.513 17919 87307 1 213 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.487 -0.767 17919 87308 1 213 . 1 1 31 31 GLN H H 31 8.580 8.580 7.870 0.710 17919 87309 1 213 . 1 1 32 32 ASP N N 32 119.360 119.360 120.351 -0.991 17919 87310 1 213 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.375 -0.021 17919 87311 1 213 . 1 1 32 32 ASP C C 32 177.250 177.250 178.012 -0.762 17919 87312 1 213 . 1 1 32 32 ASP CA C 32 57.190 57.190 57.052 0.138 17919 87313 1 213 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.776 -0.196 17919 87314 1 213 . 1 1 32 32 ASP H H 32 8.010 8.010 8.082 -0.072 17919 87315 1 213 . 1 1 33 33 LYS N N 33 115.130 115.130 116.954 -1.824 17919 87316 1 213 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.255 0.082 17919 87317 1 213 . 1 1 33 33 LYS C C 33 177.870 177.870 177.888 -0.018 17919 87318 1 213 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.631 -0.581 17919 87319 1 213 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.292 0.877 17919 87320 1 213 . 1 1 33 33 LYS H H 33 7.430 7.430 7.481 -0.051 17919 87321 1 213 . 1 1 34 34 GLU N N 34 113.870 113.870 113.994 -0.124 17919 87322 1 213 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.485 0.140 17919 87323 1 213 . 1 1 34 34 GLU C C 34 177.840 177.840 176.996 0.844 17919 87324 1 213 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.658 -0.488 17919 87325 1 213 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.713 0.947 17919 87326 1 213 . 1 1 34 34 GLU H H 34 8.740 8.740 8.069 0.671 17919 87327 1 213 . 1 1 35 35 GLY N N 35 108.650 108.650 109.555 -0.905 17919 87328 1 213 . 1 1 35 35 GLY C C 35 173.960 173.960 174.354 -0.394 17919 87329 1 213 . 1 1 35 35 GLY CA C 35 46.080 46.080 46.021 0.059 17919 87330 1 213 . 1 1 35 35 GLY H H 35 8.530 8.530 8.167 0.363 17919 87331 1 213 . 1 1 36 36 ILE N N 36 119.880 119.880 120.855 -0.975 17919 87332 1 213 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.346 0.099 17919 87333 1 213 . 1 1 36 36 ILE C C 36 173.590 173.590 174.179 -0.589 17919 87334 1 213 . 1 1 36 36 ILE CA C 36 57.750 57.750 56.295 1.455 17919 87335 1 213 . 1 1 36 36 ILE CB C 36 40.580 40.580 37.401 3.179 17919 87336 1 213 . 1 1 36 36 ILE H H 36 6.150 6.150 7.564 -1.414 17919 87337 1 213 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.616 0.018 17919 87338 1 213 . 1 1 37 37 PRO C C 37 176.940 176.940 176.564 0.376 17919 87339 1 213 . 1 1 37 37 PRO CA C 37 61.660 61.660 62.042 -0.382 17919 87340 1 213 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.600 0.250 17919 87341 1 213 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.279 -0.162 17919 87342 1 213 . 1 1 38 38 PRO C C 38 178.320 178.320 178.434 -0.114 17919 87343 1 213 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.452 0.808 17919 87344 1 213 . 1 1 38 38 PRO CB C 38 32.890 32.890 32.067 0.823 17919 87345 1 213 . 1 1 39 39 ASP N N 39 113.380 113.380 118.065 -4.685 17919 87346 1 213 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.383 0.047 17919 87347 1 213 . 1 1 39 39 ASP C C 39 177.090 177.090 177.750 -0.660 17919 87348 1 213 . 1 1 39 39 ASP CA C 39 55.640 55.640 57.009 -1.369 17919 87349 1 213 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.661 -1.121 17919 87350 1 213 . 1 1 39 39 ASP H H 39 8.550 8.550 8.682 -0.132 17919 87351 1 213 . 1 1 40 40 GLN N N 40 116.780 116.780 116.524 0.256 17919 87352 1 213 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.445 0.019 17919 87353 1 213 . 1 1 40 40 GLN C C 40 175.380 175.380 175.971 -0.591 17919 87354 1 213 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.029 -0.389 17919 87355 1 213 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.669 0.470 17919 87356 1 213 . 1 1 40 40 GLN H H 40 7.820 7.820 8.090 -0.270 17919 87357 1 213 . 1 1 41 41 GLN N N 41 117.720 117.720 119.367 -1.647 17919 87358 1 213 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.401 -0.157 17919 87359 1 213 . 1 1 41 41 GLN C C 41 176.300 176.300 175.690 0.610 17919 87360 1 213 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.900 0.570 17919 87361 1 213 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.428 2.222 17919 87362 1 213 . 1 1 41 41 GLN H H 41 7.480 7.480 7.296 0.184 17919 87363 1 213 . 1 1 42 42 ARG N N 42 122.680 122.680 125.372 -2.692 17919 87364 1 213 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.576 -0.076 17919 87365 1 213 . 1 1 42 42 ARG C C 42 174.050 174.050 174.801 -0.751 17919 87366 1 213 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.983 0.067 17919 87367 1 213 . 1 1 42 42 ARG CB C 42 31.750 31.750 31.446 0.304 17919 87368 1 213 . 1 1 42 42 ARG H H 42 8.530 8.530 9.109 -0.579 17919 87369 1 213 . 1 1 43 43 LEU N N 43 124.040 124.040 126.554 -2.514 17919 87370 1 213 . 1 1 43 43 LEU C C 43 175.290 175.290 175.952 -0.662 17919 87371 1 213 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.945 -0.965 17919 87372 1 213 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.252 2.538 17919 87373 1 213 . 1 1 43 43 LEU H H 43 8.820 8.820 8.830 -0.010 17919 87374 1 213 . 1 1 44 44 ILE N N 44 121.920 121.920 123.014 -1.094 17919 87375 1 213 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.198 -0.206 17919 87376 1 213 . 1 1 44 44 ILE C C 44 176.060 176.060 174.773 1.287 17919 87377 1 213 . 1 1 44 44 ILE CA C 44 58.980 58.980 58.419 0.562 17919 87378 1 213 . 1 1 44 44 ILE CB C 44 41.420 41.420 38.703 2.717 17919 87379 1 213 . 1 1 44 44 ILE H H 44 9.030 9.030 8.869 0.161 17919 87380 1 213 . 1 1 45 45 PHE N N 45 125.390 125.390 128.174 -2.784 17919 87381 1 213 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.964 0.081 17919 87382 1 213 . 1 1 45 45 PHE C C 45 174.470 174.470 174.578 -0.108 17919 87383 1 213 . 1 1 45 45 PHE CA C 45 57.020 57.020 55.555 1.465 17919 87384 1 213 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.444 1.316 17919 87385 1 213 . 1 1 45 45 PHE H H 45 8.830 8.830 8.691 0.139 17919 87386 1 213 . 1 1 46 46 ALA N N 46 132.200 132.200 130.706 1.494 17919 87387 1 213 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.714 -0.024 17919 87388 1 213 . 1 1 46 46 ALA C C 46 177.290 177.290 177.334 -0.044 17919 87389 1 213 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.663 -0.123 17919 87390 1 213 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.131 0.438 17919 87391 1 213 . 1 1 46 46 ALA H H 46 8.810 8.810 9.381 -0.571 17919 87392 1 213 . 1 1 47 47 GLY N N 47 102.340 102.340 104.182 -1.842 17919 87393 1 213 . 1 1 47 47 GLY C C 47 173.810 173.810 174.292 -0.482 17919 87394 1 213 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.420 -0.070 17919 87395 1 213 . 1 1 47 47 GLY H H 47 8.130 8.130 8.535 -0.405 17919 87396 1 213 . 1 1 48 48 LYS N N 48 121.570 121.570 120.616 0.954 17919 87397 1 213 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.563 0.059 17919 87398 1 213 . 1 1 48 48 LYS C C 48 174.700 174.700 175.147 -0.447 17919 87399 1 213 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.890 -0.340 17919 87400 1 213 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.938 -0.408 17919 87401 1 213 . 1 1 48 48 LYS H H 48 7.980 7.980 7.951 0.029 17919 87402 1 213 . 1 1 49 49 GLN N N 49 122.410 122.410 122.865 -0.455 17919 87403 1 213 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.574 -0.014 17919 87404 1 213 . 1 1 49 49 GLN C C 49 175.670 175.670 175.998 -0.328 17919 87405 1 213 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.872 -0.132 17919 87406 1 213 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.311 -0.310 17919 87407 1 213 . 1 1 49 49 GLN H H 49 8.600 8.600 8.555 0.045 17919 87408 1 213 . 1 1 50 50 LEU N N 50 125.520 125.520 128.315 -2.795 17919 87409 1 213 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.255 -0.165 17919 87410 1 213 . 1 1 50 50 LEU C C 50 176.660 176.660 175.681 0.979 17919 87411 1 213 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.506 -0.266 17919 87412 1 213 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.658 -1.088 17919 87413 1 213 . 1 1 50 50 LEU H H 50 8.530 8.530 8.279 0.251 17919 87414 1 213 . 1 1 51 51 GLU N N 51 122.940 122.940 121.838 1.102 17919 87415 1 213 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.590 -0.102 17919 87416 1 213 . 1 1 51 51 GLU C C 51 175.870 175.870 176.790 -0.920 17919 87417 1 213 . 1 1 51 51 GLU CA C 51 55.960 55.960 54.955 1.005 17919 87418 1 213 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.276 -0.706 17919 87419 1 213 . 1 1 51 51 GLU H H 51 8.400 8.400 8.725 -0.325 17919 87420 1 213 . 1 1 52 52 ASP N N 52 120.030 120.030 127.129 -7.099 17919 87421 1 213 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.496 -0.137 17919 87422 1 213 . 1 1 52 52 ASP C C 52 177.330 177.330 177.392 -0.062 17919 87423 1 213 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.595 -0.635 17919 87424 1 213 . 1 1 52 52 ASP CB C 52 40.850 40.850 41.039 -0.189 17919 87425 1 213 . 1 1 52 52 ASP H H 52 8.160 8.160 8.854 -0.694 17919 87426 1 213 . 1 1 53 53 GLY N N 53 106.660 106.660 106.780 -0.120 17919 87427 1 213 . 1 1 53 53 GLY C C 53 174.870 174.870 173.944 0.926 17919 87428 1 213 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.829 0.341 17919 87429 1 213 . 1 1 53 53 GLY H H 53 9.390 9.390 8.489 0.901 17919 87430 1 213 . 1 1 54 54 ARG N N 54 119.050 119.050 119.176 -0.126 17919 87431 1 213 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.678 0.017 17919 87432 1 213 . 1 1 54 54 ARG C C 54 175.350 175.350 175.058 0.292 17919 87433 1 213 . 1 1 54 54 ARG CA C 54 54.390 54.390 53.834 0.556 17919 87434 1 213 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.472 0.178 17919 87435 1 213 . 1 1 54 54 ARG H H 54 7.460 7.460 7.571 -0.111 17919 87436 1 213 . 1 1 55 55 THR N N 55 108.400 108.400 110.634 -2.234 17919 87437 1 213 . 1 1 55 55 THR HA H 55 5.240 5.240 5.258 -0.018 17919 87438 1 213 . 1 1 55 55 THR C C 55 176.560 176.560 176.193 0.367 17919 87439 1 213 . 1 1 55 55 THR CA C 55 59.690 59.690 59.558 0.132 17919 87440 1 213 . 1 1 55 55 THR CB C 55 72.260 72.260 71.382 0.879 17919 87441 1 213 . 1 1 55 55 THR H H 55 8.730 8.730 7.904 0.826 17919 87442 1 213 . 1 1 56 56 LEU N N 56 117.920 117.920 121.299 -3.379 17919 87443 1 213 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.947 0.113 17919 87444 1 213 . 1 1 56 56 LEU C C 56 180.810 180.810 178.849 1.961 17919 87445 1 213 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.198 0.512 17919 87446 1 213 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.553 -1.183 17919 87447 1 213 . 1 1 56 56 LEU H H 56 8.140 8.140 8.630 -0.490 17919 87448 1 213 . 1 1 57 57 SER N N 57 113.330 113.330 114.014 -0.684 17919 87449 1 213 . 1 1 57 57 SER HA H 57 4.370 4.370 4.205 0.165 17919 87450 1 213 . 1 1 57 57 SER C C 57 178.310 178.310 176.827 1.483 17919 87451 1 213 . 1 1 57 57 SER CA C 57 61.080 61.080 61.158 -0.078 17919 87452 1 213 . 1 1 57 57 SER CB C 57 62.530 62.530 62.715 -0.186 17919 87453 1 213 . 1 1 57 57 SER H H 57 8.470 8.470 8.571 -0.101 17919 87454 1 213 . 1 1 58 58 ASP N N 58 124.190 124.190 122.710 1.480 17919 87455 1 213 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.373 -0.077 17919 87456 1 213 . 1 1 58 58 ASP C C 58 177.400 177.400 177.450 -0.050 17919 87457 1 213 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.451 0.729 17919 87458 1 213 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.746 -0.646 17919 87459 1 213 . 1 1 58 58 ASP H H 58 7.930 7.930 7.575 0.355 17919 87460 1 213 . 1 1 59 59 TYR N N 59 115.510 115.510 115.864 -0.354 17919 87461 1 213 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.625 0.045 17919 87462 1 213 . 1 1 59 59 TYR C C 59 174.700 174.700 174.867 -0.167 17919 87463 1 213 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.747 0.503 17919 87464 1 213 . 1 1 59 59 TYR CB C 59 40.070 40.070 37.636 2.434 17919 87465 1 213 . 1 1 59 59 TYR H H 59 7.250 7.250 7.288 -0.038 17919 87466 1 213 . 1 1 60 60 ASN N N 60 115.900 115.900 116.704 -0.804 17919 87467 1 213 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.346 0.009 17919 87468 1 213 . 1 1 60 60 ASN C C 60 174.340 174.340 174.437 -0.097 17919 87469 1 213 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.149 -0.029 17919 87470 1 213 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.522 -0.112 17919 87471 1 213 . 1 1 60 60 ASN H H 60 8.150 8.150 7.600 0.550 17919 87472 1 213 . 1 1 61 61 ILE N N 61 118.600 118.600 119.418 -0.818 17919 87473 1 213 . 1 1 61 61 ILE HA H 61 3.393 3.393 4.055 -0.662 17919 87474 1 213 . 1 1 61 61 ILE C C 61 174.610 174.610 175.011 -0.401 17919 87475 1 213 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.456 0.963 17919 87476 1 213 . 1 1 61 61 ILE CB C 61 36.740 36.740 38.093 -1.353 17919 87477 1 213 . 1 1 61 61 ILE H H 61 7.250 7.250 8.255 -1.005 17919 87478 1 213 . 1 1 62 62 GLN N N 62 124.740 124.740 125.654 -0.914 17919 87479 1 213 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.878 -0.372 17919 87480 1 213 . 1 1 62 62 GLN C C 62 175.970 175.970 175.606 0.364 17919 87481 1 213 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.250 0.410 17919 87482 1 213 . 1 1 62 62 GLN CB C 62 31.650 31.650 32.284 -0.634 17919 87483 1 213 . 1 1 62 62 GLN H H 62 7.610 7.610 8.110 -0.500 17919 87484 1 213 . 1 1 63 63 LYS N N 63 120.300 120.300 120.926 -0.626 17919 87485 1 213 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.972 0.029 17919 87486 1 213 . 1 1 63 63 LYS C C 63 175.810 175.810 176.787 -0.977 17919 87487 1 213 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.792 -0.002 17919 87488 1 213 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.910 0.740 17919 87489 1 213 . 1 1 63 63 LYS H H 63 8.490 8.490 8.592 -0.102 17919 87490 1 213 . 1 1 64 64 GLU N N 64 113.950 113.950 119.537 -5.587 17919 87491 1 213 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.481 -0.016 17919 87492 1 213 . 1 1 64 64 GLU C C 64 175.250 175.250 176.189 -0.939 17919 87493 1 213 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.707 0.183 17919 87494 1 213 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.390 -2.490 17919 87495 1 213 . 1 1 64 64 GLU H H 64 9.280 9.280 8.706 0.574 17919 87496 1 213 . 1 1 65 65 SER N N 65 114.730 114.730 115.167 -0.437 17919 87497 1 213 . 1 1 65 65 SER HA H 65 4.640 4.640 4.544 0.096 17919 87498 1 213 . 1 1 65 65 SER C C 65 172.160 172.160 173.788 -1.628 17919 87499 1 213 . 1 1 65 65 SER CA C 65 60.890 60.890 60.114 0.776 17919 87500 1 213 . 1 1 65 65 SER CB C 65 64.910 64.910 64.596 0.314 17919 87501 1 213 . 1 1 65 65 SER H H 65 7.670 7.670 7.198 0.472 17919 87502 1 213 . 1 1 66 66 THR N N 66 117.110 117.110 120.105 -2.995 17919 87503 1 213 . 1 1 66 66 THR HA H 66 5.270 5.270 5.274 -0.004 17919 87504 1 213 . 1 1 66 66 THR C C 66 173.950 173.950 174.186 -0.236 17919 87505 1 213 . 1 1 66 66 THR CA C 66 62.340 62.340 61.852 0.488 17919 87506 1 213 . 1 1 66 66 THR CB C 66 70.080 70.080 70.112 -0.032 17919 87507 1 213 . 1 1 66 66 THR H H 66 8.730 8.730 8.483 0.247 17919 87508 1 213 . 1 1 67 67 LEU N N 67 127.110 127.110 126.937 0.173 17919 87509 1 213 . 1 1 67 67 LEU HA H 67 5.060 5.060 5.175 -0.115 17919 87510 1 213 . 1 1 67 67 LEU C C 67 175.770 175.770 176.061 -0.291 17919 87511 1 213 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.796 0.104 17919 87512 1 213 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.887 -0.627 17919 87513 1 213 . 1 1 67 67 LEU H H 67 9.410 9.410 9.199 0.211 17919 87514 1 213 . 1 1 68 68 HIS N N 68 118.380 118.380 114.629 3.751 17919 87515 1 213 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.223 0.017 17919 87516 1 213 . 1 1 68 68 HIS C C 68 173.150 173.150 173.667 -0.517 17919 87517 1 213 . 1 1 68 68 HIS CA C 68 55.000 55.000 55.765 -0.765 17919 87518 1 213 . 1 1 68 68 HIS CB C 68 30.530 30.530 33.225 -2.696 17919 87519 1 213 . 1 1 68 68 HIS H H 68 9.230 9.230 8.406 0.824 17919 87520 1 213 . 1 1 69 69 LEU N N 69 124.460 124.460 126.064 -1.604 17919 87521 1 213 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.197 -0.007 17919 87522 1 213 . 1 1 69 69 LEU C C 69 175.270 175.270 174.700 0.570 17919 87523 1 213 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.947 -0.056 17919 87524 1 213 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.078 0.302 17919 87525 1 213 . 1 1 69 69 LEU H H 69 8.340 8.340 8.484 -0.144 17919 87526 1 213 . 1 1 70 70 VAL N N 70 126.940 126.940 127.073 -0.133 17919 87527 1 213 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.393 -0.043 17919 87528 1 213 . 1 1 70 70 VAL C C 70 174.000 174.000 174.490 -0.490 17919 87529 1 213 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.769 0.031 17919 87530 1 213 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.424 -0.514 17919 87531 1 213 . 1 1 70 70 VAL H H 70 9.200 9.200 8.655 0.545 17919 87532 1 213 . 1 1 71 71 LEU N N 71 123.130 123.130 124.832 -1.702 17919 87533 1 213 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.248 -0.188 17919 87534 1 213 . 1 1 71 71 LEU C C 71 177.830 177.830 177.037 0.793 17919 87535 1 213 . 1 1 71 71 LEU CA C 71 53.940 53.940 54.062 -0.122 17919 87536 1 213 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.850 -0.000 17919 87537 1 213 . 1 1 71 71 LEU H H 71 8.120 8.120 8.427 -0.307 17919 87538 1 213 . 1 1 72 72 ARG N N 72 123.490 123.490 124.300 -0.810 17919 87539 1 213 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.553 -0.252 17919 87540 1 213 . 1 1 72 72 ARG C C 72 175.350 175.350 175.646 -0.296 17919 87541 1 213 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.613 -0.003 17919 87542 1 213 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.975 0.375 17919 87543 1 213 . 1 1 72 72 ARG H H 72 8.580 8.580 8.630 -0.050 17919 87544 1 214 . 1 1 2 2 GLN N N 2 123.220 123.220 120.961 2.259 17919 87545 1 214 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.337 -0.088 17919 87546 1 214 . 1 1 2 2 GLN C C 2 175.920 175.920 175.296 0.624 17919 87547 1 214 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.849 0.231 17919 87548 1 214 . 1 1 2 2 GLN CB C 2 30.760 30.760 29.421 1.339 17919 87549 1 214 . 1 1 2 2 GLN H H 2 8.900 8.900 8.443 0.457 17919 87550 1 214 . 1 1 3 3 ILE N N 3 115.340 115.340 116.975 -1.635 17919 87551 1 214 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.330 -0.117 17919 87552 1 214 . 1 1 3 3 ILE C C 3 172.450 172.450 173.414 -0.964 17919 87553 1 214 . 1 1 3 3 ILE CA C 3 59.570 59.570 58.721 0.849 17919 87554 1 214 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.843 0.367 17919 87555 1 214 . 1 1 3 3 ILE H H 3 8.320 8.320 8.433 -0.113 17919 87556 1 214 . 1 1 4 4 PHE N N 4 118.110 118.110 118.834 -0.724 17919 87557 1 214 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.641 -0.011 17919 87558 1 214 . 1 1 4 4 PHE C C 4 175.320 175.320 175.141 0.179 17919 87559 1 214 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.211 -0.001 17919 87560 1 214 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.493 -0.013 17919 87561 1 214 . 1 1 4 4 PHE H H 4 8.610 8.610 8.138 0.472 17919 87562 1 214 . 1 1 5 5 VAL N N 5 121.000 121.000 121.742 -0.742 17919 87563 1 214 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.529 0.196 17919 87564 1 214 . 1 1 5 5 VAL C C 5 174.870 174.870 174.309 0.561 17919 87565 1 214 . 1 1 5 5 VAL CA C 5 60.620 60.620 60.998 -0.378 17919 87566 1 214 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.985 0.245 17919 87567 1 214 . 1 1 5 5 VAL H H 5 9.300 9.300 9.141 0.159 17919 87568 1 214 . 1 1 6 6 LYS N N 6 127.520 127.520 130.232 -2.712 17919 87569 1 214 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.246 0.121 17919 87570 1 214 . 1 1 6 6 LYS C C 6 177.140 177.140 175.994 1.146 17919 87571 1 214 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.544 -0.024 17919 87572 1 214 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.630 -0.580 17919 87573 1 214 . 1 1 6 6 LYS H H 6 8.820 8.820 9.355 -0.535 17919 87574 1 214 . 1 1 7 7 THR N N 7 115.400 115.400 118.705 -3.305 17919 87575 1 214 . 1 1 7 7 THR HA H 7 4.970 4.970 5.078 -0.108 17919 87576 1 214 . 1 1 7 7 THR C C 7 176.910 176.910 176.219 0.691 17919 87577 1 214 . 1 1 7 7 THR CA C 7 60.470 60.470 60.280 0.190 17919 87578 1 214 . 1 1 7 7 THR CB C 7 70.630 70.630 70.942 -0.312 17919 87579 1 214 . 1 1 7 7 THR H H 7 8.730 8.730 8.825 -0.095 17919 87580 1 214 . 1 1 8 8 LEU N N 8 121.330 121.330 122.675 -1.345 17919 87581 1 214 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.412 -0.102 17919 87582 1 214 . 1 1 8 8 LEU C C 8 178.800 178.800 177.390 1.410 17919 87583 1 214 . 1 1 8 8 LEU CA C 8 57.580 57.580 56.996 0.584 17919 87584 1 214 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.334 -0.364 17919 87585 1 214 . 1 1 8 8 LEU H H 8 9.100 9.100 8.515 0.585 17919 87586 1 214 . 1 1 9 9 THR N N 9 105.590 105.590 109.240 -3.650 17919 87587 1 214 . 1 1 9 9 THR HA H 9 4.428 4.428 4.366 0.062 17919 87588 1 214 . 1 1 9 9 THR C C 9 175.520 175.520 175.505 0.015 17919 87589 1 214 . 1 1 9 9 THR CA C 9 61.400 61.400 61.788 -0.388 17919 87590 1 214 . 1 1 9 9 THR CB C 9 69.140 69.140 69.643 -0.503 17919 87591 1 214 . 1 1 9 9 THR H H 9 7.630 7.630 7.619 0.011 17919 87592 1 214 . 1 1 10 10 GLY N N 10 108.890 108.890 110.698 -1.808 17919 87593 1 214 . 1 1 10 10 GLY C C 10 174.070 174.070 173.614 0.456 17919 87594 1 214 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.750 0.710 17919 87595 1 214 . 1 1 10 10 GLY H H 10 7.810 7.810 7.876 -0.066 17919 87596 1 214 . 1 1 11 11 LYS N N 11 121.600 121.600 122.333 -0.733 17919 87597 1 214 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.489 -0.128 17919 87598 1 214 . 1 1 11 11 LYS C C 11 175.940 175.940 175.349 0.591 17919 87599 1 214 . 1 1 11 11 LYS CA C 11 56.280 56.280 55.840 0.440 17919 87600 1 214 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.659 -0.459 17919 87601 1 214 . 1 1 11 11 LYS H H 11 7.280 7.280 7.681 -0.401 17919 87602 1 214 . 1 1 12 12 THR N N 12 120.440 120.440 119.794 0.646 17919 87603 1 214 . 1 1 12 12 THR HA H 12 5.046 5.046 5.001 0.045 17919 87604 1 214 . 1 1 12 12 THR C C 12 174.320 174.320 174.399 -0.079 17919 87605 1 214 . 1 1 12 12 THR CA C 12 62.390 62.390 62.084 0.306 17919 87606 1 214 . 1 1 12 12 THR CB C 12 69.910 69.910 70.056 -0.146 17919 87607 1 214 . 1 1 12 12 THR H H 12 8.650 8.650 8.239 0.411 17919 87608 1 214 . 1 1 13 13 ILE N N 13 127.110 127.110 125.812 1.298 17919 87609 1 214 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.460 0.085 17919 87610 1 214 . 1 1 13 13 ILE C C 13 175.220 175.220 175.036 0.184 17919 87611 1 214 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.059 -0.078 17919 87612 1 214 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.601 -0.651 17919 87613 1 214 . 1 1 13 13 ILE H H 13 9.450 9.450 8.672 0.778 17919 87614 1 214 . 1 1 14 14 THR N N 14 121.520 121.520 120.959 0.561 17919 87615 1 214 . 1 1 14 14 THR HA H 14 4.964 4.964 5.240 -0.276 17919 87616 1 214 . 1 1 14 14 THR C C 14 173.790 173.790 173.978 -0.188 17919 87617 1 214 . 1 1 14 14 THR CA C 14 61.940 61.940 62.082 -0.142 17919 87618 1 214 . 1 1 14 14 THR CB C 14 69.650 69.650 69.885 -0.235 17919 87619 1 214 . 1 1 14 14 THR H H 14 8.710 8.710 8.500 0.210 17919 87620 1 214 . 1 1 15 15 LEU N N 15 124.800 124.800 126.732 -1.932 17919 87621 1 214 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.760 0.020 17919 87622 1 214 . 1 1 15 15 LEU C C 15 174.670 174.670 175.187 -0.517 17919 87623 1 214 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.610 -0.780 17919 87624 1 214 . 1 1 15 15 LEU CB C 15 47.070 47.070 46.259 0.811 17919 87625 1 214 . 1 1 15 15 LEU H H 15 8.710 8.710 8.731 -0.021 17919 87626 1 214 . 1 1 16 16 GLU N N 16 122.160 122.160 123.007 -0.847 17919 87627 1 214 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.020 -0.103 17919 87628 1 214 . 1 1 16 16 GLU C C 16 175.860 175.860 175.832 0.028 17919 87629 1 214 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.437 -0.617 17919 87630 1 214 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.828 -1.377 17919 87631 1 214 . 1 1 16 16 GLU H H 16 8.140 8.140 8.629 -0.489 17919 87632 1 214 . 1 1 17 17 VAL N N 17 117.210 117.210 120.920 -3.710 17919 87633 1 214 . 1 1 17 17 VAL HA H 17 4.714 4.714 5.018 -0.304 17919 87634 1 214 . 1 1 17 17 VAL C C 17 174.160 174.160 175.171 -1.011 17919 87635 1 214 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.809 -0.379 17919 87636 1 214 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.849 0.551 17919 87637 1 214 . 1 1 17 17 VAL H H 17 8.900 8.900 9.057 -0.157 17919 87638 1 214 . 1 1 18 18 GLU N N 18 118.990 118.990 121.507 -2.517 17919 87639 1 214 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.887 0.192 17919 87640 1 214 . 1 1 18 18 GLU C C 18 176.160 176.160 175.658 0.502 17919 87641 1 214 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.880 -0.160 17919 87642 1 214 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.973 -0.663 17919 87643 1 214 . 1 1 18 18 GLU H H 18 8.640 8.640 8.572 0.068 17919 87644 1 214 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.384 -0.243 17919 87645 1 214 . 1 1 19 19 PRO C C 19 175.310 175.310 177.675 -2.365 17919 87646 1 214 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.136 0.334 17919 87647 1 214 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.007 -0.057 17919 87648 1 214 . 1 1 20 20 SER N N 20 103.400 103.400 110.256 -6.856 17919 87649 1 214 . 1 1 20 20 SER HA H 20 4.370 4.370 4.327 0.043 17919 87650 1 214 . 1 1 20 20 SER C C 20 174.660 174.660 174.471 0.189 17919 87651 1 214 . 1 1 20 20 SER CA C 20 57.400 57.400 58.546 -1.146 17919 87652 1 214 . 1 1 20 20 SER CB C 20 63.370 63.370 62.842 0.528 17919 87653 1 214 . 1 1 20 20 SER H H 20 7.040 7.040 7.988 -0.948 17919 87654 1 214 . 1 1 21 21 ASP N N 21 123.480 123.480 124.620 -1.140 17919 87655 1 214 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.604 0.091 17919 87656 1 214 . 1 1 21 21 ASP C C 21 176.360 176.360 176.405 -0.045 17919 87657 1 214 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.283 0.417 17919 87658 1 214 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.377 -0.577 17919 87659 1 214 . 1 1 21 21 ASP H H 21 8.030 8.030 7.709 0.321 17919 87660 1 214 . 1 1 22 22 THR N N 22 108.800 108.800 113.668 -4.868 17919 87661 1 214 . 1 1 22 22 THR HA H 22 4.920 4.920 4.881 0.039 17919 87662 1 214 . 1 1 22 22 THR C C 22 176.750 176.750 176.361 0.389 17919 87663 1 214 . 1 1 22 22 THR CA C 22 59.690 59.690 60.846 -1.155 17919 87664 1 214 . 1 1 22 22 THR CB C 22 71.200 71.200 70.996 0.204 17919 87665 1 214 . 1 1 22 22 THR H H 22 7.900 7.900 8.391 -0.491 17919 87666 1 214 . 1 1 23 23 ILE N N 23 121.190 121.190 122.547 -1.357 17919 87667 1 214 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.775 -0.118 17919 87668 1 214 . 1 1 23 23 ILE C C 23 179.040 179.040 178.012 1.028 17919 87669 1 214 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.383 -1.123 17919 87670 1 214 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.276 -1.925 17919 87671 1 214 . 1 1 23 23 ILE H H 23 8.560 8.560 8.556 0.004 17919 87672 1 214 . 1 1 24 24 GLU N N 24 120.830 120.830 120.853 -0.023 17919 87673 1 214 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.975 -0.058 17919 87674 1 214 . 1 1 24 24 GLU C C 24 178.640 178.640 178.598 0.042 17919 87675 1 214 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.915 0.305 17919 87676 1 214 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.164 -0.884 17919 87677 1 214 . 1 1 24 24 GLU H H 24 9.760 9.760 8.301 1.459 17919 87678 1 214 . 1 1 25 25 ASN N N 25 120.570 120.570 118.357 2.213 17919 87679 1 214 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.492 0.033 17919 87680 1 214 . 1 1 25 25 ASN C C 25 178.380 178.380 177.959 0.421 17919 87681 1 214 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.286 -0.226 17919 87682 1 214 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.438 0.012 17919 87683 1 214 . 1 1 25 25 ASN H H 25 7.920 7.920 7.769 0.151 17919 87684 1 214 . 1 1 26 26 VAL N N 26 121.710 121.710 121.351 0.359 17919 87685 1 214 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.621 -0.224 17919 87686 1 214 . 1 1 26 26 VAL C C 26 177.950 177.950 177.627 0.323 17919 87687 1 214 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.546 1.114 17919 87688 1 214 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.199 -0.359 17919 87689 1 214 . 1 1 26 26 VAL H H 26 8.070 8.070 8.162 -0.092 17919 87690 1 214 . 1 1 27 27 LYS N N 27 118.860 118.860 120.368 -1.508 17919 87691 1 214 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.147 0.433 17919 87692 1 214 . 1 1 27 27 LYS C C 27 180.550 180.550 179.319 1.231 17919 87693 1 214 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.866 -0.616 17919 87694 1 214 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.129 1.601 17919 87695 1 214 . 1 1 27 27 LYS H H 27 8.560 8.560 8.376 0.184 17919 87696 1 214 . 1 1 28 28 ALA N N 28 123.440 123.440 121.711 1.729 17919 87697 1 214 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.004 0.156 17919 87698 1 214 . 1 1 28 28 ALA C C 28 180.300 180.300 179.106 1.194 17919 87699 1 214 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.211 0.159 17919 87700 1 214 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.425 -0.715 17919 87701 1 214 . 1 1 28 28 ALA H H 28 8.060 8.060 8.461 -0.401 17919 87702 1 214 . 1 1 29 29 LYS N N 29 119.940 119.940 119.668 0.272 17919 87703 1 214 . 1 1 29 29 LYS HA H 29 4.207 4.207 3.973 0.234 17919 87704 1 214 . 1 1 29 29 LYS C C 29 180.320 180.320 179.157 1.163 17919 87705 1 214 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.490 0.160 17919 87706 1 214 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.329 0.961 17919 87707 1 214 . 1 1 29 29 LYS H H 29 7.850 7.850 7.776 0.074 17919 87708 1 214 . 1 1 30 30 ILE N N 30 121.080 121.080 120.355 0.725 17919 87709 1 214 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.590 -0.083 17919 87710 1 214 . 1 1 30 30 ILE C C 30 178.310 178.310 177.572 0.738 17919 87711 1 214 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.174 0.976 17919 87712 1 214 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.589 -0.789 17919 87713 1 214 . 1 1 30 30 ILE H H 30 8.280 8.280 8.479 -0.199 17919 87714 1 214 . 1 1 31 31 GLN N N 31 123.490 123.490 120.648 2.842 17919 87715 1 214 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.997 -0.168 17919 87716 1 214 . 1 1 31 31 GLN C C 31 178.890 178.890 178.541 0.349 17919 87717 1 214 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.191 0.809 17919 87718 1 214 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.543 -0.823 17919 87719 1 214 . 1 1 31 31 GLN H H 31 8.580 8.580 8.372 0.208 17919 87720 1 214 . 1 1 32 32 ASP N N 32 119.360 119.360 117.955 1.405 17919 87721 1 214 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.490 -0.136 17919 87722 1 214 . 1 1 32 32 ASP C C 32 177.250 177.250 177.783 -0.533 17919 87723 1 214 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.225 0.965 17919 87724 1 214 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.885 -0.305 17919 87725 1 214 . 1 1 32 32 ASP H H 32 8.010 8.010 7.985 0.025 17919 87726 1 214 . 1 1 33 33 LYS N N 33 115.130 115.130 118.637 -3.507 17919 87727 1 214 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.323 0.014 17919 87728 1 214 . 1 1 33 33 LYS C C 33 177.870 177.870 177.730 0.140 17919 87729 1 214 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.637 0.413 17919 87730 1 214 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.472 0.697 17919 87731 1 214 . 1 1 33 33 LYS H H 33 7.430 7.430 7.517 -0.087 17919 87732 1 214 . 1 1 34 34 GLU N N 34 113.870 113.870 115.855 -1.985 17919 87733 1 214 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.549 0.076 17919 87734 1 214 . 1 1 34 34 GLU C C 34 177.840 177.840 176.637 1.203 17919 87735 1 214 . 1 1 34 34 GLU CA C 34 55.170 55.170 54.905 0.265 17919 87736 1 214 . 1 1 34 34 GLU CB C 34 32.660 32.660 30.962 1.698 17919 87737 1 214 . 1 1 34 34 GLU H H 34 8.740 8.740 8.017 0.723 17919 87738 1 214 . 1 1 35 35 GLY N N 35 108.650 108.650 109.162 -0.512 17919 87739 1 214 . 1 1 35 35 GLY C C 35 173.960 173.960 174.887 -0.927 17919 87740 1 214 . 1 1 35 35 GLY CA C 35 46.080 46.080 46.075 0.005 17919 87741 1 214 . 1 1 35 35 GLY H H 35 8.530 8.530 7.948 0.582 17919 87742 1 214 . 1 1 36 36 ILE N N 36 119.880 119.880 121.170 -1.290 17919 87743 1 214 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.366 0.079 17919 87744 1 214 . 1 1 36 36 ILE C C 36 173.590 173.590 174.183 -0.593 17919 87745 1 214 . 1 1 36 36 ILE CA C 36 57.750 57.750 56.890 0.860 17919 87746 1 214 . 1 1 36 36 ILE CB C 36 40.580 40.580 36.898 3.682 17919 87747 1 214 . 1 1 36 36 ILE H H 36 6.150 6.150 7.599 -1.449 17919 87748 1 214 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.733 -0.099 17919 87749 1 214 . 1 1 37 37 PRO C C 37 176.940 176.940 176.592 0.348 17919 87750 1 214 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.719 -0.059 17919 87751 1 214 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.590 0.260 17919 87752 1 214 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.214 -0.097 17919 87753 1 214 . 1 1 38 38 PRO C C 38 178.320 178.320 177.708 0.612 17919 87754 1 214 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.136 1.124 17919 87755 1 214 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.866 1.024 17919 87756 1 214 . 1 1 39 39 ASP N N 39 113.380 113.380 116.309 -2.929 17919 87757 1 214 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.315 0.115 17919 87758 1 214 . 1 1 39 39 ASP C C 39 177.090 177.090 177.189 -0.099 17919 87759 1 214 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.354 -0.714 17919 87760 1 214 . 1 1 39 39 ASP CB C 39 39.540 39.540 39.696 -0.156 17919 87761 1 214 . 1 1 39 39 ASP H H 39 8.550 8.550 8.655 -0.105 17919 87762 1 214 . 1 1 40 40 GLN N N 40 116.780 116.780 116.638 0.142 17919 87763 1 214 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.298 0.166 17919 87764 1 214 . 1 1 40 40 GLN C C 40 175.380 175.380 176.963 -1.583 17919 87765 1 214 . 1 1 40 40 GLN CA C 40 55.640 55.640 57.073 -1.433 17919 87766 1 214 . 1 1 40 40 GLN CB C 40 30.140 30.140 30.134 0.006 17919 87767 1 214 . 1 1 40 40 GLN H H 40 7.820 7.820 7.695 0.125 17919 87768 1 214 . 1 1 41 41 GLN N N 41 117.720 117.720 120.112 -2.392 17919 87769 1 214 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.058 0.186 17919 87770 1 214 . 1 1 41 41 GLN C C 41 176.300 176.300 174.988 1.312 17919 87771 1 214 . 1 1 41 41 GLN CA C 41 56.470 56.470 57.468 -0.998 17919 87772 1 214 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.073 2.577 17919 87773 1 214 . 1 1 41 41 GLN H H 41 7.480 7.480 7.661 -0.181 17919 87774 1 214 . 1 1 42 42 ARG N N 42 122.680 122.680 125.129 -2.449 17919 87775 1 214 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.700 -0.200 17919 87776 1 214 . 1 1 42 42 ARG C C 42 174.050 174.050 173.761 0.289 17919 87777 1 214 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.947 0.103 17919 87778 1 214 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.182 -1.432 17919 87779 1 214 . 1 1 42 42 ARG H H 42 8.530 8.530 8.728 -0.198 17919 87780 1 214 . 1 1 43 43 LEU N N 43 124.040 124.040 127.318 -3.278 17919 87781 1 214 . 1 1 43 43 LEU C C 43 175.290 175.290 175.823 -0.533 17919 87782 1 214 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.754 -0.774 17919 87783 1 214 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.062 1.728 17919 87784 1 214 . 1 1 43 43 LEU H H 43 8.820 8.820 8.739 0.081 17919 87785 1 214 . 1 1 44 44 ILE N N 44 121.920 121.920 122.050 -0.130 17919 87786 1 214 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.920 0.072 17919 87787 1 214 . 1 1 44 44 ILE C C 44 176.060 176.060 174.080 1.980 17919 87788 1 214 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.701 -1.721 17919 87789 1 214 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.913 -0.493 17919 87790 1 214 . 1 1 44 44 ILE H H 44 9.030 9.030 8.298 0.732 17919 87791 1 214 . 1 1 45 45 PHE N N 45 125.390 125.390 126.720 -1.330 17919 87792 1 214 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.996 0.049 17919 87793 1 214 . 1 1 45 45 PHE C C 45 174.470 174.470 174.620 -0.150 17919 87794 1 214 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.927 0.093 17919 87795 1 214 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.506 0.254 17919 87796 1 214 . 1 1 45 45 PHE H H 45 8.830 8.830 9.210 -0.380 17919 87797 1 214 . 1 1 46 46 ALA N N 46 132.200 132.200 128.802 3.398 17919 87798 1 214 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.591 0.099 17919 87799 1 214 . 1 1 46 46 ALA C C 46 177.290 177.290 177.749 -0.459 17919 87800 1 214 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.506 0.034 17919 87801 1 214 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.547 0.022 17919 87802 1 214 . 1 1 46 46 ALA H H 46 8.810 8.810 8.561 0.249 17919 87803 1 214 . 1 1 47 47 GLY N N 47 102.340 102.340 103.467 -1.127 17919 87804 1 214 . 1 1 47 47 GLY C C 47 173.810 173.810 174.115 -0.305 17919 87805 1 214 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.752 0.598 17919 87806 1 214 . 1 1 47 47 GLY H H 47 8.130 8.130 8.440 -0.310 17919 87807 1 214 . 1 1 48 48 LYS N N 48 121.570 121.570 121.704 -0.134 17919 87808 1 214 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.601 0.021 17919 87809 1 214 . 1 1 48 48 LYS C C 48 174.700 174.700 175.246 -0.546 17919 87810 1 214 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.130 -0.580 17919 87811 1 214 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.570 -0.040 17919 87812 1 214 . 1 1 48 48 LYS H H 48 7.980 7.980 7.826 0.154 17919 87813 1 214 . 1 1 49 49 GLN N N 49 122.410 122.410 125.118 -2.708 17919 87814 1 214 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.243 0.317 17919 87815 1 214 . 1 1 49 49 GLN C C 49 175.670 175.670 175.320 0.350 17919 87816 1 214 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.260 -0.520 17919 87817 1 214 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.512 -0.512 17919 87818 1 214 . 1 1 49 49 GLN H H 49 8.600 8.600 8.590 0.010 17919 87819 1 214 . 1 1 50 50 LEU N N 50 125.520 125.520 127.683 -2.163 17919 87820 1 214 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.320 -0.230 17919 87821 1 214 . 1 1 50 50 LEU C C 50 176.660 176.660 176.721 -0.061 17919 87822 1 214 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.351 -0.111 17919 87823 1 214 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.169 -0.599 17919 87824 1 214 . 1 1 50 50 LEU H H 50 8.530 8.530 8.117 0.413 17919 87825 1 214 . 1 1 51 51 GLU N N 51 122.940 122.940 122.792 0.148 17919 87826 1 214 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.619 -0.131 17919 87827 1 214 . 1 1 51 51 GLU C C 51 175.870 175.870 177.067 -1.197 17919 87828 1 214 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.348 0.612 17919 87829 1 214 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.850 -0.280 17919 87830 1 214 . 1 1 51 51 GLU H H 51 8.400 8.400 8.641 -0.241 17919 87831 1 214 . 1 1 52 52 ASP N N 52 120.030 120.030 123.871 -3.841 17919 87832 1 214 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.439 -0.080 17919 87833 1 214 . 1 1 52 52 ASP C C 52 177.330 177.330 177.424 -0.094 17919 87834 1 214 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.320 -0.360 17919 87835 1 214 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.895 -0.045 17919 87836 1 214 . 1 1 52 52 ASP H H 52 8.160 8.160 8.832 -0.672 17919 87837 1 214 . 1 1 53 53 GLY N N 53 106.660 106.660 105.609 1.051 17919 87838 1 214 . 1 1 53 53 GLY C C 53 174.870 174.870 173.987 0.883 17919 87839 1 214 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.608 0.562 17919 87840 1 214 . 1 1 53 53 GLY H H 53 9.390 9.390 8.459 0.931 17919 87841 1 214 . 1 1 54 54 ARG N N 54 119.050 119.050 119.238 -0.188 17919 87842 1 214 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.662 0.033 17919 87843 1 214 . 1 1 54 54 ARG C C 54 175.350 175.350 176.043 -0.693 17919 87844 1 214 . 1 1 54 54 ARG CA C 54 54.390 54.390 53.894 0.496 17919 87845 1 214 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.059 0.591 17919 87846 1 214 . 1 1 54 54 ARG H H 54 7.460 7.460 7.559 -0.099 17919 87847 1 214 . 1 1 55 55 THR N N 55 108.400 108.400 111.568 -3.168 17919 87848 1 214 . 1 1 55 55 THR HA H 55 5.240 5.240 5.090 0.150 17919 87849 1 214 . 1 1 55 55 THR C C 55 176.560 176.560 176.200 0.360 17919 87850 1 214 . 1 1 55 55 THR CA C 55 59.690 59.690 60.149 -0.459 17919 87851 1 214 . 1 1 55 55 THR CB C 55 72.260 72.260 71.227 1.033 17919 87852 1 214 . 1 1 55 55 THR H H 55 8.730 8.730 8.873 -0.143 17919 87853 1 214 . 1 1 56 56 LEU N N 56 117.920 117.920 121.363 -3.443 17919 87854 1 214 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.036 0.024 17919 87855 1 214 . 1 1 56 56 LEU C C 56 180.810 180.810 178.947 1.863 17919 87856 1 214 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.447 0.263 17919 87857 1 214 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.459 -1.089 17919 87858 1 214 . 1 1 56 56 LEU H H 56 8.140 8.140 8.564 -0.424 17919 87859 1 214 . 1 1 57 57 SER N N 57 113.330 113.330 115.409 -2.079 17919 87860 1 214 . 1 1 57 57 SER HA H 57 4.370 4.370 4.137 0.233 17919 87861 1 214 . 1 1 57 57 SER C C 57 178.310 178.310 176.937 1.373 17919 87862 1 214 . 1 1 57 57 SER CA C 57 61.080 61.080 61.949 -0.869 17919 87863 1 214 . 1 1 57 57 SER CB C 57 62.530 62.530 62.472 0.058 17919 87864 1 214 . 1 1 57 57 SER H H 57 8.470 8.470 8.490 -0.020 17919 87865 1 214 . 1 1 58 58 ASP N N 58 124.190 124.190 122.257 1.933 17919 87866 1 214 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.323 -0.027 17919 87867 1 214 . 1 1 58 58 ASP C C 58 177.400 177.400 177.553 -0.153 17919 87868 1 214 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.758 0.422 17919 87869 1 214 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.301 -0.201 17919 87870 1 214 . 1 1 58 58 ASP H H 58 7.930 7.930 7.863 0.067 17919 87871 1 214 . 1 1 59 59 TYR N N 59 115.510 115.510 115.321 0.189 17919 87872 1 214 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.586 0.084 17919 87873 1 214 . 1 1 59 59 TYR C C 59 174.700 174.700 175.039 -0.339 17919 87874 1 214 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.508 0.742 17919 87875 1 214 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.418 1.652 17919 87876 1 214 . 1 1 59 59 TYR H H 59 7.250 7.250 7.478 -0.228 17919 87877 1 214 . 1 1 60 60 ASN N N 60 115.900 115.900 116.988 -1.088 17919 87878 1 214 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.389 -0.034 17919 87879 1 214 . 1 1 60 60 ASN C C 60 174.340 174.340 174.913 -0.573 17919 87880 1 214 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.032 0.088 17919 87881 1 214 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.446 -0.036 17919 87882 1 214 . 1 1 60 60 ASN H H 60 8.150 8.150 7.576 0.574 17919 87883 1 214 . 1 1 61 61 ILE N N 61 118.600 118.600 118.891 -0.291 17919 87884 1 214 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.797 -0.404 17919 87885 1 214 . 1 1 61 61 ILE C C 61 174.610 174.610 176.090 -1.480 17919 87886 1 214 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.099 0.321 17919 87887 1 214 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.686 -0.946 17919 87888 1 214 . 1 1 61 61 ILE H H 61 7.250 7.250 8.090 -0.840 17919 87889 1 214 . 1 1 62 62 GLN N N 62 124.740 124.740 126.487 -1.747 17919 87890 1 214 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.568 -0.062 17919 87891 1 214 . 1 1 62 62 GLN C C 62 175.970 175.970 175.702 0.268 17919 87892 1 214 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.913 -0.253 17919 87893 1 214 . 1 1 62 62 GLN CB C 62 31.650 31.650 32.266 -0.616 17919 87894 1 214 . 1 1 62 62 GLN H H 62 7.610 7.610 8.021 -0.411 17919 87895 1 214 . 1 1 63 63 LYS N N 63 120.300 120.300 120.362 -0.062 17919 87896 1 214 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.160 -0.159 17919 87897 1 214 . 1 1 63 63 LYS C C 63 175.810 175.810 177.318 -1.508 17919 87898 1 214 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.304 0.485 17919 87899 1 214 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.974 0.677 17919 87900 1 214 . 1 1 63 63 LYS H H 63 8.490 8.490 8.626 -0.136 17919 87901 1 214 . 1 1 64 64 GLU N N 64 113.950 113.950 118.766 -4.816 17919 87902 1 214 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.637 -0.172 17919 87903 1 214 . 1 1 64 64 GLU C C 64 175.250 175.250 175.805 -0.555 17919 87904 1 214 . 1 1 64 64 GLU CA C 64 57.890 57.890 58.117 -0.227 17919 87905 1 214 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.857 -2.957 17919 87906 1 214 . 1 1 64 64 GLU H H 64 9.280 9.280 8.931 0.349 17919 87907 1 214 . 1 1 65 65 SER N N 65 114.730 114.730 115.866 -1.136 17919 87908 1 214 . 1 1 65 65 SER HA H 65 4.640 4.640 4.435 0.205 17919 87909 1 214 . 1 1 65 65 SER C C 65 172.160 172.160 173.870 -1.710 17919 87910 1 214 . 1 1 65 65 SER CA C 65 60.890 60.890 60.532 0.357 17919 87911 1 214 . 1 1 65 65 SER CB C 65 64.910 64.910 63.902 1.008 17919 87912 1 214 . 1 1 65 65 SER H H 65 7.670 7.670 7.655 0.015 17919 87913 1 214 . 1 1 66 66 THR N N 66 117.110 117.110 118.821 -1.711 17919 87914 1 214 . 1 1 66 66 THR HA H 66 5.270 5.270 5.111 0.159 17919 87915 1 214 . 1 1 66 66 THR C C 66 173.950 173.950 174.276 -0.326 17919 87916 1 214 . 1 1 66 66 THR CA C 66 62.340 62.340 61.782 0.558 17919 87917 1 214 . 1 1 66 66 THR CB C 66 70.080 70.080 70.340 -0.260 17919 87918 1 214 . 1 1 66 66 THR H H 66 8.730 8.730 8.548 0.182 17919 87919 1 214 . 1 1 67 67 LEU N N 67 127.110 127.110 126.232 0.878 17919 87920 1 214 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.710 0.350 17919 87921 1 214 . 1 1 67 67 LEU C C 67 175.770 175.770 175.476 0.294 17919 87922 1 214 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.945 -0.045 17919 87923 1 214 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.229 0.031 17919 87924 1 214 . 1 1 67 67 LEU H H 67 9.410 9.410 8.688 0.722 17919 87925 1 214 . 1 1 68 68 HIS N N 68 118.380 118.380 122.883 -4.503 17919 87926 1 214 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.432 -0.192 17919 87927 1 214 . 1 1 68 68 HIS C C 68 173.150 173.150 173.740 -0.590 17919 87928 1 214 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.269 0.731 17919 87929 1 214 . 1 1 68 68 HIS CB C 68 30.530 30.530 31.411 -0.881 17919 87930 1 214 . 1 1 68 68 HIS H H 68 9.230 9.230 8.658 0.572 17919 87931 1 214 . 1 1 69 69 LEU N N 69 124.460 124.460 130.184 -5.724 17919 87932 1 214 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.100 0.090 17919 87933 1 214 . 1 1 69 69 LEU C C 69 175.270 175.270 174.163 1.107 17919 87934 1 214 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.139 0.751 17919 87935 1 214 . 1 1 69 69 LEU CB C 69 44.380 44.380 45.361 -0.981 17919 87936 1 214 . 1 1 69 69 LEU H H 69 8.340 8.340 8.977 -0.637 17919 87937 1 214 . 1 1 70 70 VAL N N 70 126.940 126.940 122.686 4.254 17919 87938 1 214 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.545 -0.195 17919 87939 1 214 . 1 1 70 70 VAL C C 70 174.000 174.000 173.527 0.473 17919 87940 1 214 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.418 1.382 17919 87941 1 214 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.438 -0.527 17919 87942 1 214 . 1 1 70 70 VAL H H 70 9.200 9.200 8.782 0.418 17919 87943 1 214 . 1 1 71 71 LEU N N 71 123.130 123.130 122.917 0.213 17919 87944 1 214 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.833 0.227 17919 87945 1 214 . 1 1 71 71 LEU C C 71 177.830 177.830 177.790 0.040 17919 87946 1 214 . 1 1 71 71 LEU CA C 71 53.940 53.940 54.341 -0.401 17919 87947 1 214 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.449 -0.599 17919 87948 1 214 . 1 1 71 71 LEU H H 71 8.120 8.120 8.472 -0.352 17919 87949 1 214 . 1 1 72 72 ARG N N 72 123.490 123.490 123.034 0.456 17919 87950 1 214 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.446 -0.145 17919 87951 1 214 . 1 1 72 72 ARG C C 72 175.350 175.350 175.758 -0.408 17919 87952 1 214 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.294 0.316 17919 87953 1 214 . 1 1 72 72 ARG CB C 72 31.350 31.350 28.443 2.907 17919 87954 1 214 . 1 1 72 72 ARG H H 72 8.580 8.580 8.172 0.408 17919 87955 1 215 . 1 1 2 2 GLN N N 2 123.220 123.220 120.519 2.701 17919 87956 1 215 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.357 -0.108 17919 87957 1 215 . 1 1 2 2 GLN C C 2 175.920 175.920 174.659 1.261 17919 87958 1 215 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.603 0.477 17919 87959 1 215 . 1 1 2 2 GLN CB C 2 30.760 30.760 31.583 -0.823 17919 87960 1 215 . 1 1 2 2 GLN H H 2 8.900 8.900 8.360 0.540 17919 87961 1 215 . 1 1 3 3 ILE N N 3 115.340 115.340 117.569 -2.229 17919 87962 1 215 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.555 -0.342 17919 87963 1 215 . 1 1 3 3 ILE C C 3 172.450 172.450 173.294 -0.844 17919 87964 1 215 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.297 0.273 17919 87965 1 215 . 1 1 3 3 ILE CB C 3 42.210 42.210 42.176 0.034 17919 87966 1 215 . 1 1 3 3 ILE H H 3 8.320 8.320 8.709 -0.389 17919 87967 1 215 . 1 1 4 4 PHE N N 4 118.110 118.110 118.957 -0.847 17919 87968 1 215 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.645 -0.015 17919 87969 1 215 . 1 1 4 4 PHE C C 4 175.320 175.320 175.101 0.219 17919 87970 1 215 . 1 1 4 4 PHE CA C 4 55.210 55.210 56.024 -0.814 17919 87971 1 215 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.384 -0.904 17919 87972 1 215 . 1 1 4 4 PHE H H 4 8.610 8.610 8.410 0.200 17919 87973 1 215 . 1 1 5 5 VAL N N 5 121.000 121.000 116.913 4.087 17919 87974 1 215 . 1 1 5 5 VAL HA H 5 4.725 4.725 5.261 -0.536 17919 87975 1 215 . 1 1 5 5 VAL C C 5 174.870 174.870 174.188 0.682 17919 87976 1 215 . 1 1 5 5 VAL CA C 5 60.620 60.620 59.974 0.645 17919 87977 1 215 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.589 -0.359 17919 87978 1 215 . 1 1 5 5 VAL H H 5 9.300 9.300 9.340 -0.040 17919 87979 1 215 . 1 1 6 6 LYS N N 6 127.520 127.520 128.395 -0.875 17919 87980 1 215 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.526 -0.159 17919 87981 1 215 . 1 1 6 6 LYS C C 6 177.140 177.140 176.368 0.772 17919 87982 1 215 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.070 0.450 17919 87983 1 215 . 1 1 6 6 LYS CB C 6 35.050 35.050 36.555 -1.505 17919 87984 1 215 . 1 1 6 6 LYS H H 6 8.820 8.820 9.351 -0.531 17919 87985 1 215 . 1 1 7 7 THR N N 7 115.400 115.400 117.802 -2.402 17919 87986 1 215 . 1 1 7 7 THR HA H 7 4.970 4.970 5.128 -0.158 17919 87987 1 215 . 1 1 7 7 THR C C 7 176.910 176.910 176.508 0.402 17919 87988 1 215 . 1 1 7 7 THR CA C 7 60.470 60.470 60.847 -0.377 17919 87989 1 215 . 1 1 7 7 THR CB C 7 70.630 70.630 70.609 0.021 17919 87990 1 215 . 1 1 7 7 THR H H 7 8.730 8.730 8.945 -0.215 17919 87991 1 215 . 1 1 8 8 LEU N N 8 121.330 121.330 124.123 -2.793 17919 87992 1 215 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.327 -0.017 17919 87993 1 215 . 1 1 8 8 LEU C C 8 178.800 178.800 177.473 1.327 17919 87994 1 215 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.701 -0.121 17919 87995 1 215 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.042 -0.072 17919 87996 1 215 . 1 1 8 8 LEU H H 8 9.100 9.100 8.826 0.274 17919 87997 1 215 . 1 1 9 9 THR N N 9 105.590 105.590 108.818 -3.228 17919 87998 1 215 . 1 1 9 9 THR HA H 9 4.428 4.428 4.406 0.022 17919 87999 1 215 . 1 1 9 9 THR C C 9 175.520 175.520 175.517 0.003 17919 88000 1 215 . 1 1 9 9 THR CA C 9 61.400 61.400 61.304 0.096 17919 88001 1 215 . 1 1 9 9 THR CB C 9 69.140 69.140 69.619 -0.479 17919 88002 1 215 . 1 1 9 9 THR H H 9 7.630 7.630 7.628 0.002 17919 88003 1 215 . 1 1 10 10 GLY N N 10 108.890 108.890 111.467 -2.577 17919 88004 1 215 . 1 1 10 10 GLY C C 10 174.070 174.070 173.400 0.670 17919 88005 1 215 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.014 0.445 17919 88006 1 215 . 1 1 10 10 GLY H H 10 7.810 7.810 8.378 -0.568 17919 88007 1 215 . 1 1 11 11 LYS N N 11 121.600 121.600 122.087 -0.487 17919 88008 1 215 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.414 -0.053 17919 88009 1 215 . 1 1 11 11 LYS C C 11 175.940 175.940 175.428 0.512 17919 88010 1 215 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.386 -0.106 17919 88011 1 215 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.333 -0.133 17919 88012 1 215 . 1 1 11 11 LYS H H 11 7.280 7.280 7.828 -0.548 17919 88013 1 215 . 1 1 12 12 THR N N 12 120.440 120.440 122.017 -1.577 17919 88014 1 215 . 1 1 12 12 THR HA H 12 5.046 5.046 5.185 -0.139 17919 88015 1 215 . 1 1 12 12 THR C C 12 174.320 174.320 174.610 -0.290 17919 88016 1 215 . 1 1 12 12 THR CA C 12 62.390 62.390 61.822 0.568 17919 88017 1 215 . 1 1 12 12 THR CB C 12 69.910 69.910 69.744 0.166 17919 88018 1 215 . 1 1 12 12 THR H H 12 8.650 8.650 8.380 0.270 17919 88019 1 215 . 1 1 13 13 ILE N N 13 127.110 127.110 126.397 0.713 17919 88020 1 215 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.643 -0.099 17919 88021 1 215 . 1 1 13 13 ILE C C 13 175.220 175.220 175.013 0.207 17919 88022 1 215 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.741 0.239 17919 88023 1 215 . 1 1 13 13 ILE CB C 13 40.950 40.950 42.159 -1.209 17919 88024 1 215 . 1 1 13 13 ILE H H 13 9.450 9.450 9.096 0.354 17919 88025 1 215 . 1 1 14 14 THR N N 14 121.520 121.520 118.446 3.074 17919 88026 1 215 . 1 1 14 14 THR HA H 14 4.964 4.964 5.014 -0.050 17919 88027 1 215 . 1 1 14 14 THR C C 14 173.790 173.790 174.255 -0.465 17919 88028 1 215 . 1 1 14 14 THR CA C 14 61.940 61.940 60.795 1.145 17919 88029 1 215 . 1 1 14 14 THR CB C 14 69.650 69.650 69.606 0.044 17919 88030 1 215 . 1 1 14 14 THR H H 14 8.710 8.710 8.322 0.388 17919 88031 1 215 . 1 1 15 15 LEU N N 15 124.800 124.800 123.571 1.229 17919 88032 1 215 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.736 0.044 17919 88033 1 215 . 1 1 15 15 LEU C C 15 174.670 174.670 175.127 -0.457 17919 88034 1 215 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.816 -0.986 17919 88035 1 215 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.101 1.969 17919 88036 1 215 . 1 1 15 15 LEU H H 15 8.710 8.710 8.813 -0.103 17919 88037 1 215 . 1 1 16 16 GLU N N 16 122.160 122.160 124.165 -2.005 17919 88038 1 215 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.162 -0.245 17919 88039 1 215 . 1 1 16 16 GLU C C 16 175.860 175.860 176.078 -0.218 17919 88040 1 215 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.551 -0.731 17919 88041 1 215 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.399 -0.949 17919 88042 1 215 . 1 1 16 16 GLU H H 16 8.140 8.140 8.705 -0.565 17919 88043 1 215 . 1 1 17 17 VAL N N 17 117.210 117.210 119.184 -1.974 17919 88044 1 215 . 1 1 17 17 VAL HA H 17 4.714 4.714 5.035 -0.321 17919 88045 1 215 . 1 1 17 17 VAL C C 17 174.160 174.160 174.653 -0.493 17919 88046 1 215 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.733 -0.303 17919 88047 1 215 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.715 0.685 17919 88048 1 215 . 1 1 17 17 VAL H H 17 8.900 8.900 8.762 0.138 17919 88049 1 215 . 1 1 18 18 GLU N N 18 118.990 118.990 122.395 -3.405 17919 88050 1 215 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.814 0.266 17919 88051 1 215 . 1 1 18 18 GLU C C 18 176.160 176.160 175.560 0.600 17919 88052 1 215 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.520 0.200 17919 88053 1 215 . 1 1 18 18 GLU CB C 18 30.310 30.310 29.349 0.961 17919 88054 1 215 . 1 1 18 18 GLU H H 18 8.640 8.640 8.668 -0.028 17919 88055 1 215 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.279 -0.138 17919 88056 1 215 . 1 1 19 19 PRO C C 19 175.310 175.310 177.652 -2.342 17919 88057 1 215 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.674 -0.204 17919 88058 1 215 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.000 -0.050 17919 88059 1 215 . 1 1 20 20 SER N N 20 103.400 103.400 108.254 -4.854 17919 88060 1 215 . 1 1 20 20 SER HA H 20 4.370 4.370 4.311 0.059 17919 88061 1 215 . 1 1 20 20 SER C C 20 174.660 174.660 174.703 -0.043 17919 88062 1 215 . 1 1 20 20 SER CA C 20 57.400 57.400 58.937 -1.537 17919 88063 1 215 . 1 1 20 20 SER CB C 20 63.370 63.370 62.625 0.745 17919 88064 1 215 . 1 1 20 20 SER H H 20 7.040 7.040 8.079 -1.039 17919 88065 1 215 . 1 1 21 21 ASP N N 21 123.480 123.480 125.572 -2.092 17919 88066 1 215 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.702 -0.007 17919 88067 1 215 . 1 1 21 21 ASP C C 21 176.360 176.360 175.959 0.401 17919 88068 1 215 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.419 0.281 17919 88069 1 215 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.496 -0.696 17919 88070 1 215 . 1 1 21 21 ASP H H 21 8.030 8.030 7.571 0.459 17919 88071 1 215 . 1 1 22 22 THR N N 22 108.800 108.800 113.562 -4.762 17919 88072 1 215 . 1 1 22 22 THR HA H 22 4.920 4.920 4.876 0.044 17919 88073 1 215 . 1 1 22 22 THR C C 22 176.750 176.750 176.508 0.242 17919 88074 1 215 . 1 1 22 22 THR CA C 22 59.690 59.690 60.447 -0.757 17919 88075 1 215 . 1 1 22 22 THR CB C 22 71.200 71.200 71.098 0.102 17919 88076 1 215 . 1 1 22 22 THR H H 22 7.900 7.900 8.146 -0.246 17919 88077 1 215 . 1 1 23 23 ILE N N 23 121.190 121.190 122.984 -1.794 17919 88078 1 215 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.677 -0.020 17919 88079 1 215 . 1 1 23 23 ILE C C 23 179.040 179.040 177.789 1.251 17919 88080 1 215 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.757 -1.496 17919 88081 1 215 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.154 -1.804 17919 88082 1 215 . 1 1 23 23 ILE H H 23 8.560 8.560 8.814 -0.254 17919 88083 1 215 . 1 1 24 24 GLU N N 24 120.830 120.830 120.665 0.165 17919 88084 1 215 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.908 0.009 17919 88085 1 215 . 1 1 24 24 GLU C C 24 178.640 178.640 178.614 0.026 17919 88086 1 215 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.926 0.294 17919 88087 1 215 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.476 -1.196 17919 88088 1 215 . 1 1 24 24 GLU H H 24 9.760 9.760 8.447 1.313 17919 88089 1 215 . 1 1 25 25 ASN N N 25 120.570 120.570 118.224 2.346 17919 88090 1 215 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.513 0.012 17919 88091 1 215 . 1 1 25 25 ASN C C 25 178.380 178.380 177.788 0.592 17919 88092 1 215 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.111 -0.051 17919 88093 1 215 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.801 -0.351 17919 88094 1 215 . 1 1 25 25 ASN H H 25 7.920 7.920 7.489 0.431 17919 88095 1 215 . 1 1 26 26 VAL N N 26 121.710 121.710 120.482 1.228 17919 88096 1 215 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.672 -0.275 17919 88097 1 215 . 1 1 26 26 VAL C C 26 177.950 177.950 178.044 -0.094 17919 88098 1 215 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.356 1.304 17919 88099 1 215 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.026 -0.185 17919 88100 1 215 . 1 1 26 26 VAL H H 26 8.070 8.070 8.647 -0.577 17919 88101 1 215 . 1 1 27 27 LYS N N 27 118.860 118.860 119.973 -1.113 17919 88102 1 215 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.156 0.424 17919 88103 1 215 . 1 1 27 27 LYS C C 27 180.550 180.550 179.094 1.456 17919 88104 1 215 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.880 -0.630 17919 88105 1 215 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.166 1.563 17919 88106 1 215 . 1 1 27 27 LYS H H 27 8.560 8.560 8.353 0.207 17919 88107 1 215 . 1 1 28 28 ALA N N 28 123.440 123.440 121.779 1.661 17919 88108 1 215 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.203 -0.043 17919 88109 1 215 . 1 1 28 28 ALA C C 28 180.300 180.300 179.390 0.910 17919 88110 1 215 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.673 0.697 17919 88111 1 215 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.451 -0.741 17919 88112 1 215 . 1 1 28 28 ALA H H 28 8.060 8.060 7.744 0.316 17919 88113 1 215 . 1 1 29 29 LYS N N 29 119.940 119.940 119.728 0.212 17919 88114 1 215 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.022 0.185 17919 88115 1 215 . 1 1 29 29 LYS C C 29 180.320 180.320 179.132 1.188 17919 88116 1 215 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.446 0.204 17919 88117 1 215 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.384 0.906 17919 88118 1 215 . 1 1 29 29 LYS H H 29 7.850 7.850 8.039 -0.189 17919 88119 1 215 . 1 1 30 30 ILE N N 30 121.080 121.080 120.598 0.482 17919 88120 1 215 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.546 -0.039 17919 88121 1 215 . 1 1 30 30 ILE C C 30 178.310 178.310 177.515 0.795 17919 88122 1 215 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.131 1.019 17919 88123 1 215 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.507 -0.707 17919 88124 1 215 . 1 1 30 30 ILE H H 30 8.280 8.280 8.198 0.082 17919 88125 1 215 . 1 1 31 31 GLN N N 31 123.490 123.490 120.018 3.472 17919 88126 1 215 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.994 -0.165 17919 88127 1 215 . 1 1 31 31 GLN C C 31 178.890 178.890 178.563 0.327 17919 88128 1 215 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.110 0.890 17919 88129 1 215 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.453 -0.733 17919 88130 1 215 . 1 1 31 31 GLN H H 31 8.580 8.580 8.354 0.226 17919 88131 1 215 . 1 1 32 32 ASP N N 32 119.360 119.360 119.526 -0.166 17919 88132 1 215 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.404 -0.050 17919 88133 1 215 . 1 1 32 32 ASP C C 32 177.250 177.250 177.990 -0.740 17919 88134 1 215 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.810 0.380 17919 88135 1 215 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.873 -0.293 17919 88136 1 215 . 1 1 32 32 ASP H H 32 8.010 8.010 8.034 -0.024 17919 88137 1 215 . 1 1 33 33 LYS N N 33 115.130 115.130 117.488 -2.358 17919 88138 1 215 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.292 0.045 17919 88139 1 215 . 1 1 33 33 LYS C C 33 177.870 177.870 177.994 -0.124 17919 88140 1 215 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.579 -0.529 17919 88141 1 215 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.189 0.981 17919 88142 1 215 . 1 1 33 33 LYS H H 33 7.430 7.430 7.497 -0.067 17919 88143 1 215 . 1 1 34 34 GLU N N 34 113.870 113.870 114.551 -0.681 17919 88144 1 215 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.459 0.166 17919 88145 1 215 . 1 1 34 34 GLU C C 34 177.840 177.840 177.133 0.707 17919 88146 1 215 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.005 -0.835 17919 88147 1 215 . 1 1 34 34 GLU CB C 34 32.660 32.660 32.022 0.638 17919 88148 1 215 . 1 1 34 34 GLU H H 34 8.740 8.740 8.043 0.697 17919 88149 1 215 . 1 1 35 35 GLY N N 35 108.650 108.650 108.297 0.353 17919 88150 1 215 . 1 1 35 35 GLY C C 35 173.960 173.960 174.320 -0.360 17919 88151 1 215 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.436 0.644 17919 88152 1 215 . 1 1 35 35 GLY H H 35 8.530 8.530 8.273 0.257 17919 88153 1 215 . 1 1 36 36 ILE N N 36 119.880 119.880 121.393 -1.513 17919 88154 1 215 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.346 0.099 17919 88155 1 215 . 1 1 36 36 ILE C C 36 173.590 173.590 174.161 -0.571 17919 88156 1 215 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.246 0.504 17919 88157 1 215 . 1 1 36 36 ILE CB C 36 40.580 40.580 36.646 3.934 17919 88158 1 215 . 1 1 36 36 ILE H H 36 6.150 6.150 7.780 -1.630 17919 88159 1 215 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.511 0.123 17919 88160 1 215 . 1 1 37 37 PRO C C 37 176.940 176.940 176.101 0.839 17919 88161 1 215 . 1 1 37 37 PRO CA C 37 61.660 61.660 62.624 -0.964 17919 88162 1 215 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.298 0.552 17919 88163 1 215 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.192 -0.075 17919 88164 1 215 . 1 1 38 38 PRO C C 38 178.320 178.320 178.478 -0.158 17919 88165 1 215 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.706 0.554 17919 88166 1 215 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.847 1.043 17919 88167 1 215 . 1 1 39 39 ASP N N 39 113.380 113.380 116.866 -3.486 17919 88168 1 215 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.389 0.041 17919 88169 1 215 . 1 1 39 39 ASP C C 39 177.090 177.090 177.979 -0.889 17919 88170 1 215 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.876 -1.236 17919 88171 1 215 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.448 -0.908 17919 88172 1 215 . 1 1 39 39 ASP H H 39 8.550 8.550 8.746 -0.196 17919 88173 1 215 . 1 1 40 40 GLN N N 40 116.780 116.780 117.429 -0.649 17919 88174 1 215 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.190 0.274 17919 88175 1 215 . 1 1 40 40 GLN C C 40 175.380 175.380 175.740 -0.360 17919 88176 1 215 . 1 1 40 40 GLN CA C 40 55.640 55.640 57.051 -1.411 17919 88177 1 215 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.441 0.699 17919 88178 1 215 . 1 1 40 40 GLN H H 40 7.820 7.820 8.224 -0.404 17919 88179 1 215 . 1 1 41 41 GLN N N 41 117.720 117.720 118.072 -0.352 17919 88180 1 215 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.752 -0.508 17919 88181 1 215 . 1 1 41 41 GLN C C 41 176.300 176.300 175.553 0.747 17919 88182 1 215 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.534 0.936 17919 88183 1 215 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.891 1.759 17919 88184 1 215 . 1 1 41 41 GLN H H 41 7.480 7.480 7.198 0.282 17919 88185 1 215 . 1 1 42 42 ARG N N 42 122.680 122.680 125.941 -3.261 17919 88186 1 215 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.609 -0.109 17919 88187 1 215 . 1 1 42 42 ARG C C 42 174.050 174.050 173.768 0.282 17919 88188 1 215 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.953 0.097 17919 88189 1 215 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.141 -0.391 17919 88190 1 215 . 1 1 42 42 ARG H H 42 8.530 8.530 8.389 0.141 17919 88191 1 215 . 1 1 43 43 LEU N N 43 124.040 124.040 127.351 -3.311 17919 88192 1 215 . 1 1 43 43 LEU C C 43 175.290 175.290 175.783 -0.493 17919 88193 1 215 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.496 -1.516 17919 88194 1 215 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.870 1.920 17919 88195 1 215 . 1 1 43 43 LEU H H 43 8.820 8.820 8.687 0.133 17919 88196 1 215 . 1 1 44 44 ILE N N 44 121.920 121.920 121.309 0.611 17919 88197 1 215 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.847 0.145 17919 88198 1 215 . 1 1 44 44 ILE C C 44 176.060 176.060 174.207 1.853 17919 88199 1 215 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.345 -1.365 17919 88200 1 215 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.274 0.146 17919 88201 1 215 . 1 1 44 44 ILE H H 44 9.030 9.030 9.016 0.014 17919 88202 1 215 . 1 1 45 45 PHE N N 45 125.390 125.390 126.549 -1.159 17919 88203 1 215 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.996 0.049 17919 88204 1 215 . 1 1 45 45 PHE C C 45 174.470 174.470 174.222 0.248 17919 88205 1 215 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.756 0.264 17919 88206 1 215 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.381 0.379 17919 88207 1 215 . 1 1 45 45 PHE H H 45 8.830 8.830 8.990 -0.160 17919 88208 1 215 . 1 1 46 46 ALA N N 46 132.200 132.200 128.030 4.170 17919 88209 1 215 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.601 0.089 17919 88210 1 215 . 1 1 46 46 ALA C C 46 177.290 177.290 177.954 -0.664 17919 88211 1 215 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.650 -0.110 17919 88212 1 215 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.643 -0.073 17919 88213 1 215 . 1 1 46 46 ALA H H 46 8.810 8.810 8.548 0.262 17919 88214 1 215 . 1 1 47 47 GLY N N 47 102.340 102.340 104.702 -2.362 17919 88215 1 215 . 1 1 47 47 GLY C C 47 173.810 173.810 174.238 -0.428 17919 88216 1 215 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.997 0.353 17919 88217 1 215 . 1 1 47 47 GLY H H 47 8.130 8.130 8.664 -0.534 17919 88218 1 215 . 1 1 48 48 LYS N N 48 121.570 121.570 120.409 1.161 17919 88219 1 215 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.719 -0.097 17919 88220 1 215 . 1 1 48 48 LYS C C 48 174.700 174.700 175.061 -0.361 17919 88221 1 215 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.830 -0.280 17919 88222 1 215 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.283 0.247 17919 88223 1 215 . 1 1 48 48 LYS H H 48 7.980 7.980 7.809 0.171 17919 88224 1 215 . 1 1 49 49 GLN N N 49 122.410 122.410 121.626 0.784 17919 88225 1 215 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.930 -0.370 17919 88226 1 215 . 1 1 49 49 GLN C C 49 175.670 175.670 175.413 0.257 17919 88227 1 215 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.158 0.582 17919 88228 1 215 . 1 1 49 49 GLN CB C 49 29.000 29.000 30.024 -1.024 17919 88229 1 215 . 1 1 49 49 GLN H H 49 8.600 8.600 8.340 0.260 17919 88230 1 215 . 1 1 50 50 LEU N N 50 125.520 125.520 124.800 0.720 17919 88231 1 215 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.330 -0.240 17919 88232 1 215 . 1 1 50 50 LEU C C 50 176.660 176.660 176.581 0.079 17919 88233 1 215 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.877 0.364 17919 88234 1 215 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.490 -0.920 17919 88235 1 215 . 1 1 50 50 LEU H H 50 8.530 8.530 7.946 0.584 17919 88236 1 215 . 1 1 51 51 GLU N N 51 122.940 122.940 123.630 -0.690 17919 88237 1 215 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.392 0.096 17919 88238 1 215 . 1 1 51 51 GLU C C 51 175.870 175.870 176.605 -0.735 17919 88239 1 215 . 1 1 51 51 GLU CA C 51 55.960 55.960 56.217 -0.257 17919 88240 1 215 . 1 1 51 51 GLU CB C 51 31.570 31.570 30.834 0.736 17919 88241 1 215 . 1 1 51 51 GLU H H 51 8.400 8.400 8.299 0.101 17919 88242 1 215 . 1 1 52 52 ASP N N 52 120.030 120.030 123.810 -3.780 17919 88243 1 215 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.368 -0.009 17919 88244 1 215 . 1 1 52 52 ASP C C 52 177.330 177.330 177.809 -0.479 17919 88245 1 215 . 1 1 52 52 ASP CA C 52 56.960 56.960 58.096 -1.136 17919 88246 1 215 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.744 0.106 17919 88247 1 215 . 1 1 52 52 ASP H H 52 8.160 8.160 8.841 -0.681 17919 88248 1 215 . 1 1 53 53 GLY N N 53 106.660 106.660 104.558 2.102 17919 88249 1 215 . 1 1 53 53 GLY C C 53 174.870 174.870 173.856 1.014 17919 88250 1 215 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.628 0.542 17919 88251 1 215 . 1 1 53 53 GLY H H 53 9.390 9.390 8.412 0.978 17919 88252 1 215 . 1 1 54 54 ARG N N 54 119.050 119.050 119.906 -0.856 17919 88253 1 215 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.685 0.010 17919 88254 1 215 . 1 1 54 54 ARG C C 54 175.350 175.350 174.935 0.415 17919 88255 1 215 . 1 1 54 54 ARG CA C 54 54.390 54.390 53.933 0.457 17919 88256 1 215 . 1 1 54 54 ARG CB C 54 32.650 32.650 34.346 -1.696 17919 88257 1 215 . 1 1 54 54 ARG H H 54 7.460 7.460 7.439 0.021 17919 88258 1 215 . 1 1 55 55 THR N N 55 108.400 108.400 112.262 -3.862 17919 88259 1 215 . 1 1 55 55 THR HA H 55 5.240 5.240 4.964 0.276 17919 88260 1 215 . 1 1 55 55 THR C C 55 176.560 176.560 176.032 0.528 17919 88261 1 215 . 1 1 55 55 THR CA C 55 59.690 59.690 60.276 -0.587 17919 88262 1 215 . 1 1 55 55 THR CB C 55 72.260 72.260 70.615 1.645 17919 88263 1 215 . 1 1 55 55 THR H H 55 8.730 8.730 8.692 0.038 17919 88264 1 215 . 1 1 56 56 LEU N N 56 117.920 117.920 121.840 -3.920 17919 88265 1 215 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.154 -0.094 17919 88266 1 215 . 1 1 56 56 LEU C C 56 180.810 180.810 178.647 2.163 17919 88267 1 215 . 1 1 56 56 LEU CA C 56 58.710 58.710 57.936 0.774 17919 88268 1 215 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.398 -1.028 17919 88269 1 215 . 1 1 56 56 LEU H H 56 8.140 8.140 8.550 -0.410 17919 88270 1 215 . 1 1 57 57 SER N N 57 113.330 113.330 115.341 -2.011 17919 88271 1 215 . 1 1 57 57 SER HA H 57 4.370 4.370 4.063 0.307 17919 88272 1 215 . 1 1 57 57 SER C C 57 178.310 178.310 176.681 1.629 17919 88273 1 215 . 1 1 57 57 SER CA C 57 61.080 61.080 61.993 -0.913 17919 88274 1 215 . 1 1 57 57 SER CB C 57 62.530 62.530 62.799 -0.269 17919 88275 1 215 . 1 1 57 57 SER H H 57 8.470 8.470 8.388 0.082 17919 88276 1 215 . 1 1 58 58 ASP N N 58 124.190 124.190 120.279 3.911 17919 88277 1 215 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.291 0.005 17919 88278 1 215 . 1 1 58 58 ASP C C 58 177.400 177.400 177.384 0.016 17919 88279 1 215 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.705 0.475 17919 88280 1 215 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.475 -0.375 17919 88281 1 215 . 1 1 58 58 ASP H H 58 7.930 7.930 7.693 0.237 17919 88282 1 215 . 1 1 59 59 TYR N N 59 115.510 115.510 115.621 -0.111 17919 88283 1 215 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.662 0.008 17919 88284 1 215 . 1 1 59 59 TYR C C 59 174.700 174.700 174.853 -0.153 17919 88285 1 215 . 1 1 59 59 TYR CA C 59 58.250 58.250 56.226 2.024 17919 88286 1 215 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.487 1.583 17919 88287 1 215 . 1 1 59 59 TYR H H 59 7.250 7.250 7.212 0.038 17919 88288 1 215 . 1 1 60 60 ASN N N 60 115.900 115.900 115.844 0.056 17919 88289 1 215 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.381 -0.026 17919 88290 1 215 . 1 1 60 60 ASN C C 60 174.340 174.340 174.678 -0.338 17919 88291 1 215 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.357 -0.237 17919 88292 1 215 . 1 1 60 60 ASN CB C 60 37.410 37.410 36.395 1.016 17919 88293 1 215 . 1 1 60 60 ASN H H 60 8.150 8.150 8.179 -0.029 17919 88294 1 215 . 1 1 61 61 ILE N N 61 118.600 118.600 119.468 -0.868 17919 88295 1 215 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.819 -0.426 17919 88296 1 215 . 1 1 61 61 ILE C C 61 174.610 174.610 175.397 -0.787 17919 88297 1 215 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.689 -0.269 17919 88298 1 215 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.734 -0.994 17919 88299 1 215 . 1 1 61 61 ILE H H 61 7.250 7.250 7.824 -0.574 17919 88300 1 215 . 1 1 62 62 GLN N N 62 124.740 124.740 125.223 -0.483 17919 88301 1 215 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.823 -0.317 17919 88302 1 215 . 1 1 62 62 GLN C C 62 175.970 175.970 175.356 0.614 17919 88303 1 215 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.156 0.504 17919 88304 1 215 . 1 1 62 62 GLN CB C 62 31.650 31.650 32.363 -0.713 17919 88305 1 215 . 1 1 62 62 GLN H H 62 7.610 7.610 7.990 -0.380 17919 88306 1 215 . 1 1 63 63 LYS N N 63 120.300 120.300 121.117 -0.817 17919 88307 1 215 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.127 -0.126 17919 88308 1 215 . 1 1 63 63 LYS C C 63 175.810 175.810 177.073 -1.263 17919 88309 1 215 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.866 -0.076 17919 88310 1 215 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.875 0.775 17919 88311 1 215 . 1 1 63 63 LYS H H 63 8.490 8.490 8.638 -0.148 17919 88312 1 215 . 1 1 64 64 GLU N N 64 113.950 113.950 118.835 -4.885 17919 88313 1 215 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.912 -0.447 17919 88314 1 215 . 1 1 64 64 GLU C C 64 175.250 175.250 176.231 -0.981 17919 88315 1 215 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.868 0.022 17919 88316 1 215 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.717 -2.817 17919 88317 1 215 . 1 1 64 64 GLU H H 64 9.280 9.280 9.037 0.243 17919 88318 1 215 . 1 1 65 65 SER N N 65 114.730 114.730 115.211 -0.481 17919 88319 1 215 . 1 1 65 65 SER HA H 65 4.640 4.640 4.386 0.254 17919 88320 1 215 . 1 1 65 65 SER C C 65 172.160 172.160 173.845 -1.685 17919 88321 1 215 . 1 1 65 65 SER CA C 65 60.890 60.890 61.009 -0.119 17919 88322 1 215 . 1 1 65 65 SER CB C 65 64.910 64.910 63.726 1.184 17919 88323 1 215 . 1 1 65 65 SER H H 65 7.670 7.670 7.660 0.010 17919 88324 1 215 . 1 1 66 66 THR N N 66 117.110 117.110 119.629 -2.519 17919 88325 1 215 . 1 1 66 66 THR HA H 66 5.270 5.270 5.209 0.061 17919 88326 1 215 . 1 1 66 66 THR C C 66 173.950 173.950 174.052 -0.102 17919 88327 1 215 . 1 1 66 66 THR CA C 66 62.340 62.340 61.569 0.771 17919 88328 1 215 . 1 1 66 66 THR CB C 66 70.080 70.080 70.001 0.078 17919 88329 1 215 . 1 1 66 66 THR H H 66 8.730 8.730 8.297 0.433 17919 88330 1 215 . 1 1 67 67 LEU N N 67 127.110 127.110 127.241 -0.131 17919 88331 1 215 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.822 0.238 17919 88332 1 215 . 1 1 67 67 LEU C C 67 175.770 175.770 175.462 0.308 17919 88333 1 215 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.704 0.196 17919 88334 1 215 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.801 0.459 17919 88335 1 215 . 1 1 67 67 LEU H H 67 9.410 9.410 9.118 0.292 17919 88336 1 215 . 1 1 68 68 HIS N N 68 118.380 118.380 123.187 -4.807 17919 88337 1 215 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.237 0.003 17919 88338 1 215 . 1 1 68 68 HIS C C 68 173.150 173.150 173.340 -0.190 17919 88339 1 215 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.044 0.956 17919 88340 1 215 . 1 1 68 68 HIS CB C 68 30.530 30.530 31.158 -0.628 17919 88341 1 215 . 1 1 68 68 HIS H H 68 9.230 9.230 8.787 0.443 17919 88342 1 215 . 1 1 69 69 LEU N N 69 124.460 124.460 130.324 -5.864 17919 88343 1 215 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.910 0.280 17919 88344 1 215 . 1 1 69 69 LEU C C 69 175.270 175.270 173.967 1.303 17919 88345 1 215 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.473 0.417 17919 88346 1 215 . 1 1 69 69 LEU CB C 69 44.380 44.380 45.299 -0.919 17919 88347 1 215 . 1 1 69 69 LEU H H 69 8.340 8.340 9.321 -0.981 17919 88348 1 215 . 1 1 70 70 VAL N N 70 126.940 126.940 126.962 -0.022 17919 88349 1 215 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.365 -0.015 17919 88350 1 215 . 1 1 70 70 VAL C C 70 174.000 174.000 174.537 -0.537 17919 88351 1 215 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.587 0.213 17919 88352 1 215 . 1 1 70 70 VAL CB C 70 34.910 34.910 34.069 0.841 17919 88353 1 215 . 1 1 70 70 VAL H H 70 9.200 9.200 8.593 0.607 17919 88354 1 215 . 1 1 71 71 LEU N N 71 123.130 123.130 127.218 -4.088 17919 88355 1 215 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.440 0.620 17919 88356 1 215 . 1 1 71 71 LEU C C 71 177.830 177.830 176.219 1.611 17919 88357 1 215 . 1 1 71 71 LEU CA C 71 53.940 53.940 54.561 -0.621 17919 88358 1 215 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.781 0.069 17919 88359 1 215 . 1 1 71 71 LEU H H 71 8.120 8.120 8.582 -0.462 17919 88360 1 215 . 1 1 72 72 ARG N N 72 123.490 123.490 125.624 -2.134 17919 88361 1 215 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.358 -0.057 17919 88362 1 215 . 1 1 72 72 ARG C C 72 175.350 175.350 175.199 0.151 17919 88363 1 215 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.121 -0.511 17919 88364 1 215 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.843 0.507 17919 88365 1 215 . 1 1 72 72 ARG H H 72 8.580 8.580 8.625 -0.045 17919 88366 1 216 . 1 1 2 2 GLN N N 2 123.220 123.220 121.361 1.859 17919 88367 1 216 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.454 -0.205 17919 88368 1 216 . 1 1 2 2 GLN C C 2 175.920 175.920 174.955 0.965 17919 88369 1 216 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.660 0.420 17919 88370 1 216 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.819 -0.059 17919 88371 1 216 . 1 1 2 2 GLN H H 2 8.900 8.900 8.435 0.465 17919 88372 1 216 . 1 1 3 3 ILE N N 3 115.340 115.340 118.153 -2.813 17919 88373 1 216 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.467 -0.254 17919 88374 1 216 . 1 1 3 3 ILE C C 3 172.450 172.450 173.236 -0.786 17919 88375 1 216 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.261 0.309 17919 88376 1 216 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.952 0.258 17919 88377 1 216 . 1 1 3 3 ILE H H 3 8.320 8.320 8.670 -0.350 17919 88378 1 216 . 1 1 4 4 PHE N N 4 118.110 118.110 119.923 -1.813 17919 88379 1 216 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.428 0.202 17919 88380 1 216 . 1 1 4 4 PHE C C 4 175.320 175.320 175.459 -0.139 17919 88381 1 216 . 1 1 4 4 PHE CA C 4 55.210 55.210 56.211 -1.001 17919 88382 1 216 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.725 -0.245 17919 88383 1 216 . 1 1 4 4 PHE H H 4 8.610 8.610 8.601 0.009 17919 88384 1 216 . 1 1 5 5 VAL N N 5 121.000 121.000 121.312 -0.312 17919 88385 1 216 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.807 -0.082 17919 88386 1 216 . 1 1 5 5 VAL C C 5 174.870 174.870 175.027 -0.157 17919 88387 1 216 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.597 -0.977 17919 88388 1 216 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.561 -0.331 17919 88389 1 216 . 1 1 5 5 VAL H H 5 9.300 9.300 9.327 -0.027 17919 88390 1 216 . 1 1 6 6 LYS N N 6 127.520 127.520 126.687 0.833 17919 88391 1 216 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.606 -0.239 17919 88392 1 216 . 1 1 6 6 LYS C C 6 177.140 177.140 176.820 0.320 17919 88393 1 216 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.319 0.201 17919 88394 1 216 . 1 1 6 6 LYS CB C 6 35.050 35.050 36.303 -1.253 17919 88395 1 216 . 1 1 6 6 LYS H H 6 8.820 8.820 9.412 -0.592 17919 88396 1 216 . 1 1 7 7 THR N N 7 115.400 115.400 116.460 -1.060 17919 88397 1 216 . 1 1 7 7 THR HA H 7 4.970 4.970 4.971 -0.001 17919 88398 1 216 . 1 1 7 7 THR C C 7 176.910 176.910 176.581 0.329 17919 88399 1 216 . 1 1 7 7 THR CA C 7 60.470 60.470 61.165 -0.695 17919 88400 1 216 . 1 1 7 7 THR CB C 7 70.630 70.630 70.491 0.139 17919 88401 1 216 . 1 1 7 7 THR H H 7 8.730 8.730 8.676 0.054 17919 88402 1 216 . 1 1 8 8 LEU N N 8 121.330 121.330 122.755 -1.425 17919 88403 1 216 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.101 0.209 17919 88404 1 216 . 1 1 8 8 LEU C C 8 178.800 178.800 178.081 0.719 17919 88405 1 216 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.858 -0.278 17919 88406 1 216 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.708 0.262 17919 88407 1 216 . 1 1 8 8 LEU H H 8 9.100 9.100 8.708 0.392 17919 88408 1 216 . 1 1 9 9 THR N N 9 105.590 105.590 109.760 -4.170 17919 88409 1 216 . 1 1 9 9 THR HA H 9 4.428 4.428 4.225 0.203 17919 88410 1 216 . 1 1 9 9 THR C C 9 175.520 175.520 175.613 -0.093 17919 88411 1 216 . 1 1 9 9 THR CA C 9 61.400 61.400 62.249 -0.849 17919 88412 1 216 . 1 1 9 9 THR CB C 9 69.140 69.140 69.150 -0.010 17919 88413 1 216 . 1 1 9 9 THR H H 9 7.630 7.630 7.853 -0.223 17919 88414 1 216 . 1 1 10 10 GLY N N 10 108.890 108.890 111.721 -2.831 17919 88415 1 216 . 1 1 10 10 GLY C C 10 174.070 174.070 173.328 0.742 17919 88416 1 216 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.888 0.572 17919 88417 1 216 . 1 1 10 10 GLY H H 10 7.810 7.810 8.089 -0.279 17919 88418 1 216 . 1 1 11 11 LYS N N 11 121.600 121.600 120.903 0.697 17919 88419 1 216 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.378 -0.017 17919 88420 1 216 . 1 1 11 11 LYS C C 11 175.940 175.940 175.403 0.537 17919 88421 1 216 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.590 -0.310 17919 88422 1 216 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.337 -0.137 17919 88423 1 216 . 1 1 11 11 LYS H H 11 7.280 7.280 7.583 -0.303 17919 88424 1 216 . 1 1 12 12 THR N N 12 120.440 120.440 121.249 -0.809 17919 88425 1 216 . 1 1 12 12 THR HA H 12 5.046 5.046 5.047 -0.001 17919 88426 1 216 . 1 1 12 12 THR C C 12 174.320 174.320 174.583 -0.263 17919 88427 1 216 . 1 1 12 12 THR CA C 12 62.390 62.390 61.853 0.537 17919 88428 1 216 . 1 1 12 12 THR CB C 12 69.910 69.910 69.963 -0.053 17919 88429 1 216 . 1 1 12 12 THR H H 12 8.650 8.650 8.169 0.481 17919 88430 1 216 . 1 1 13 13 ILE N N 13 127.110 127.110 127.268 -0.158 17919 88431 1 216 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.419 0.125 17919 88432 1 216 . 1 1 13 13 ILE C C 13 175.220 175.220 174.964 0.256 17919 88433 1 216 . 1 1 13 13 ILE CA C 13 59.980 59.980 61.055 -1.075 17919 88434 1 216 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.032 0.918 17919 88435 1 216 . 1 1 13 13 ILE H H 13 9.450 9.450 9.165 0.285 17919 88436 1 216 . 1 1 14 14 THR N N 14 121.520 121.520 123.250 -1.730 17919 88437 1 216 . 1 1 14 14 THR HA H 14 4.964 4.964 4.924 0.040 17919 88438 1 216 . 1 1 14 14 THR C C 14 173.790 173.790 173.605 0.185 17919 88439 1 216 . 1 1 14 14 THR CA C 14 61.940 61.940 61.633 0.307 17919 88440 1 216 . 1 1 14 14 THR CB C 14 69.650 69.650 70.322 -0.672 17919 88441 1 216 . 1 1 14 14 THR H H 14 8.710 8.710 8.441 0.269 17919 88442 1 216 . 1 1 15 15 LEU N N 15 124.800 124.800 127.679 -2.879 17919 88443 1 216 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.723 0.057 17919 88444 1 216 . 1 1 15 15 LEU C C 15 174.670 174.670 175.055 -0.385 17919 88445 1 216 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.405 -0.575 17919 88446 1 216 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.303 1.767 17919 88447 1 216 . 1 1 15 15 LEU H H 15 8.710 8.710 9.041 -0.331 17919 88448 1 216 . 1 1 16 16 GLU N N 16 122.160 122.160 121.904 0.256 17919 88449 1 216 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.324 -0.407 17919 88450 1 216 . 1 1 16 16 GLU C C 16 175.860 175.860 175.692 0.168 17919 88451 1 216 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.250 -0.430 17919 88452 1 216 . 1 1 16 16 GLU CB C 16 29.450 29.450 31.206 -1.756 17919 88453 1 216 . 1 1 16 16 GLU H H 16 8.140 8.140 8.548 -0.408 17919 88454 1 216 . 1 1 17 17 VAL N N 17 117.210 117.210 120.212 -3.002 17919 88455 1 216 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.920 -0.206 17919 88456 1 216 . 1 1 17 17 VAL C C 17 174.160 174.160 174.171 -0.011 17919 88457 1 216 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.707 -1.277 17919 88458 1 216 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.966 0.434 17919 88459 1 216 . 1 1 17 17 VAL H H 17 8.900 8.900 8.629 0.271 17919 88460 1 216 . 1 1 18 18 GLU N N 18 118.990 118.990 121.937 -2.947 17919 88461 1 216 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.877 0.202 17919 88462 1 216 . 1 1 18 18 GLU C C 18 176.160 176.160 175.180 0.980 17919 88463 1 216 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.707 0.013 17919 88464 1 216 . 1 1 18 18 GLU CB C 18 30.310 30.310 29.971 0.339 17919 88465 1 216 . 1 1 18 18 GLU H H 18 8.640 8.640 8.254 0.386 17919 88466 1 216 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.338 -0.197 17919 88467 1 216 . 1 1 19 19 PRO C C 19 175.310 175.310 177.526 -2.216 17919 88468 1 216 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.230 0.240 17919 88469 1 216 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.760 0.190 17919 88470 1 216 . 1 1 20 20 SER N N 20 103.400 103.400 110.316 -6.916 17919 88471 1 216 . 1 1 20 20 SER HA H 20 4.370 4.370 4.342 0.028 17919 88472 1 216 . 1 1 20 20 SER C C 20 174.660 174.660 174.716 -0.056 17919 88473 1 216 . 1 1 20 20 SER CA C 20 57.400 57.400 58.506 -1.106 17919 88474 1 216 . 1 1 20 20 SER CB C 20 63.370 63.370 62.743 0.627 17919 88475 1 216 . 1 1 20 20 SER H H 20 7.040 7.040 8.417 -1.377 17919 88476 1 216 . 1 1 21 21 ASP N N 21 123.480 123.480 124.978 -1.498 17919 88477 1 216 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.844 -0.149 17919 88478 1 216 . 1 1 21 21 ASP C C 21 176.360 176.360 175.884 0.476 17919 88479 1 216 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.674 1.026 17919 88480 1 216 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.944 -1.144 17919 88481 1 216 . 1 1 21 21 ASP H H 21 8.030 8.030 7.558 0.472 17919 88482 1 216 . 1 1 22 22 THR N N 22 108.800 108.800 114.784 -5.984 17919 88483 1 216 . 1 1 22 22 THR HA H 22 4.920 4.920 4.814 0.106 17919 88484 1 216 . 1 1 22 22 THR C C 22 176.750 176.750 176.215 0.535 17919 88485 1 216 . 1 1 22 22 THR CA C 22 59.690 59.690 61.466 -1.776 17919 88486 1 216 . 1 1 22 22 THR CB C 22 71.200 71.200 70.261 0.939 17919 88487 1 216 . 1 1 22 22 THR H H 22 7.900 7.900 8.288 -0.388 17919 88488 1 216 . 1 1 23 23 ILE N N 23 121.190 121.190 122.851 -1.661 17919 88489 1 216 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.789 -0.132 17919 88490 1 216 . 1 1 23 23 ILE C C 23 179.040 179.040 177.709 1.331 17919 88491 1 216 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.548 -1.288 17919 88492 1 216 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.692 -2.342 17919 88493 1 216 . 1 1 23 23 ILE H H 23 8.560 8.560 8.503 0.057 17919 88494 1 216 . 1 1 24 24 GLU N N 24 120.830 120.830 119.700 1.130 17919 88495 1 216 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.978 -0.061 17919 88496 1 216 . 1 1 24 24 GLU C C 24 178.640 178.640 178.573 0.067 17919 88497 1 216 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.388 0.832 17919 88498 1 216 . 1 1 24 24 GLU CB C 24 28.280 28.280 28.834 -0.554 17919 88499 1 216 . 1 1 24 24 GLU H H 24 9.760 9.760 8.730 1.030 17919 88500 1 216 . 1 1 25 25 ASN N N 25 120.570 120.570 118.887 1.683 17919 88501 1 216 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.532 -0.007 17919 88502 1 216 . 1 1 25 25 ASN C C 25 178.380 178.380 177.663 0.717 17919 88503 1 216 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.989 0.071 17919 88504 1 216 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.913 -0.462 17919 88505 1 216 . 1 1 25 25 ASN H H 25 7.920 7.920 7.655 0.265 17919 88506 1 216 . 1 1 26 26 VAL N N 26 121.710 121.710 121.445 0.265 17919 88507 1 216 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.657 -0.260 17919 88508 1 216 . 1 1 26 26 VAL C C 26 177.950 177.950 177.635 0.315 17919 88509 1 216 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.183 1.477 17919 88510 1 216 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.545 -0.705 17919 88511 1 216 . 1 1 26 26 VAL H H 26 8.070 8.070 8.490 -0.420 17919 88512 1 216 . 1 1 27 27 LYS N N 27 118.860 118.860 120.417 -1.557 17919 88513 1 216 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.073 0.507 17919 88514 1 216 . 1 1 27 27 LYS C C 27 180.550 180.550 179.011 1.539 17919 88515 1 216 . 1 1 27 27 LYS CA C 27 59.250 59.250 60.015 -0.765 17919 88516 1 216 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.233 1.497 17919 88517 1 216 . 1 1 27 27 LYS H H 27 8.560 8.560 8.482 0.078 17919 88518 1 216 . 1 1 28 28 ALA N N 28 123.440 123.440 121.302 2.138 17919 88519 1 216 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.179 -0.019 17919 88520 1 216 . 1 1 28 28 ALA C C 28 180.300 180.300 179.407 0.893 17919 88521 1 216 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.812 0.558 17919 88522 1 216 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.490 -0.780 17919 88523 1 216 . 1 1 28 28 ALA H H 28 8.060 8.060 8.057 0.003 17919 88524 1 216 . 1 1 29 29 LYS N N 29 119.940 119.940 119.156 0.784 17919 88525 1 216 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.077 0.130 17919 88526 1 216 . 1 1 29 29 LYS C C 29 180.320 180.320 179.008 1.312 17919 88527 1 216 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.209 0.441 17919 88528 1 216 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.475 0.815 17919 88529 1 216 . 1 1 29 29 LYS H H 29 7.850 7.850 7.729 0.121 17919 88530 1 216 . 1 1 30 30 ILE N N 30 121.080 121.080 120.291 0.789 17919 88531 1 216 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.690 -0.183 17919 88532 1 216 . 1 1 30 30 ILE C C 30 178.310 178.310 177.142 1.168 17919 88533 1 216 . 1 1 30 30 ILE CA C 30 66.150 66.150 64.942 1.208 17919 88534 1 216 . 1 1 30 30 ILE CB C 30 36.800 36.800 38.089 -1.289 17919 88535 1 216 . 1 1 30 30 ILE H H 30 8.280 8.280 8.212 0.068 17919 88536 1 216 . 1 1 31 31 GLN N N 31 123.490 123.490 120.300 3.190 17919 88537 1 216 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.922 -0.093 17919 88538 1 216 . 1 1 31 31 GLN C C 31 178.890 178.890 178.354 0.536 17919 88539 1 216 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.214 0.786 17919 88540 1 216 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.535 -0.815 17919 88541 1 216 . 1 1 31 31 GLN H H 31 8.580 8.580 8.417 0.163 17919 88542 1 216 . 1 1 32 32 ASP N N 32 119.360 119.360 119.166 0.194 17919 88543 1 216 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.405 -0.051 17919 88544 1 216 . 1 1 32 32 ASP C C 32 177.250 177.250 177.750 -0.500 17919 88545 1 216 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.773 0.417 17919 88546 1 216 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.810 -0.230 17919 88547 1 216 . 1 1 32 32 ASP H H 32 8.010 8.010 7.950 0.060 17919 88548 1 216 . 1 1 33 33 LYS N N 33 115.130 115.130 117.111 -1.981 17919 88549 1 216 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.460 -0.123 17919 88550 1 216 . 1 1 33 33 LYS C C 33 177.870 177.870 177.502 0.368 17919 88551 1 216 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.208 0.842 17919 88552 1 216 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.568 0.602 17919 88553 1 216 . 1 1 33 33 LYS H H 33 7.430 7.430 7.594 -0.164 17919 88554 1 216 . 1 1 34 34 GLU N N 34 113.870 113.870 114.640 -0.770 17919 88555 1 216 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.505 0.120 17919 88556 1 216 . 1 1 34 34 GLU C C 34 177.840 177.840 177.012 0.828 17919 88557 1 216 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.749 -0.579 17919 88558 1 216 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.836 0.824 17919 88559 1 216 . 1 1 34 34 GLU H H 34 8.740 8.740 7.963 0.777 17919 88560 1 216 . 1 1 35 35 GLY N N 35 108.650 108.650 109.274 -0.624 17919 88561 1 216 . 1 1 35 35 GLY C C 35 173.960 173.960 174.667 -0.707 17919 88562 1 216 . 1 1 35 35 GLY CA C 35 46.080 46.080 46.000 0.080 17919 88563 1 216 . 1 1 35 35 GLY H H 35 8.530 8.530 7.994 0.536 17919 88564 1 216 . 1 1 36 36 ILE N N 36 119.880 119.880 121.855 -1.975 17919 88565 1 216 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.399 0.046 17919 88566 1 216 . 1 1 36 36 ILE C C 36 173.590 173.590 174.508 -0.918 17919 88567 1 216 . 1 1 36 36 ILE CA C 36 57.750 57.750 56.408 1.342 17919 88568 1 216 . 1 1 36 36 ILE CB C 36 40.580 40.580 36.932 3.648 17919 88569 1 216 . 1 1 36 36 ILE H H 36 6.150 6.150 7.761 -1.611 17919 88570 1 216 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.628 0.006 17919 88571 1 216 . 1 1 37 37 PRO C C 37 176.940 176.940 176.488 0.452 17919 88572 1 216 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.650 0.010 17919 88573 1 216 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.396 0.454 17919 88574 1 216 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.151 -0.034 17919 88575 1 216 . 1 1 38 38 PRO C C 38 178.320 178.320 178.565 -0.245 17919 88576 1 216 . 1 1 38 38 PRO CA C 38 66.260 66.260 66.012 0.248 17919 88577 1 216 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.834 1.056 17919 88578 1 216 . 1 1 39 39 ASP N N 39 113.380 113.380 114.603 -1.223 17919 88579 1 216 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.416 0.014 17919 88580 1 216 . 1 1 39 39 ASP C C 39 177.090 177.090 176.838 0.252 17919 88581 1 216 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.153 -0.513 17919 88582 1 216 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.538 -0.999 17919 88583 1 216 . 1 1 39 39 ASP H H 39 8.550 8.550 8.586 -0.036 17919 88584 1 216 . 1 1 40 40 GLN N N 40 116.780 116.780 115.896 0.884 17919 88585 1 216 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.290 0.174 17919 88586 1 216 . 1 1 40 40 GLN C C 40 175.380 175.380 175.487 -0.107 17919 88587 1 216 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.449 0.191 17919 88588 1 216 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.395 0.745 17919 88589 1 216 . 1 1 40 40 GLN H H 40 7.820 7.820 7.829 -0.009 17919 88590 1 216 . 1 1 41 41 GLN N N 41 117.720 117.720 120.015 -2.295 17919 88591 1 216 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.443 -0.199 17919 88592 1 216 . 1 1 41 41 GLN C C 41 176.300 176.300 174.913 1.387 17919 88593 1 216 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.635 0.835 17919 88594 1 216 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.464 2.186 17919 88595 1 216 . 1 1 41 41 GLN H H 41 7.480 7.480 7.489 -0.009 17919 88596 1 216 . 1 1 42 42 ARG N N 42 122.680 122.680 125.025 -2.345 17919 88597 1 216 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.551 -0.051 17919 88598 1 216 . 1 1 42 42 ARG C C 42 174.050 174.050 174.698 -0.648 17919 88599 1 216 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.095 -0.045 17919 88600 1 216 . 1 1 42 42 ARG CB C 42 31.750 31.750 31.610 0.140 17919 88601 1 216 . 1 1 42 42 ARG H H 42 8.530 8.530 8.455 0.075 17919 88602 1 216 . 1 1 43 43 LEU N N 43 124.040 124.040 127.280 -3.240 17919 88603 1 216 . 1 1 43 43 LEU C C 43 175.290 175.290 175.585 -0.295 17919 88604 1 216 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.075 -1.095 17919 88605 1 216 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.532 2.258 17919 88606 1 216 . 1 1 43 43 LEU H H 43 8.820 8.820 8.827 -0.007 17919 88607 1 216 . 1 1 44 44 ILE N N 44 121.920 121.920 123.134 -1.214 17919 88608 1 216 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.972 0.020 17919 88609 1 216 . 1 1 44 44 ILE C C 44 176.060 176.060 174.387 1.673 17919 88610 1 216 . 1 1 44 44 ILE CA C 44 58.980 58.980 58.237 0.743 17919 88611 1 216 . 1 1 44 44 ILE CB C 44 41.420 41.420 40.520 0.900 17919 88612 1 216 . 1 1 44 44 ILE H H 44 9.030 9.030 8.970 0.060 17919 88613 1 216 . 1 1 45 45 PHE N N 45 125.390 125.390 126.042 -0.652 17919 88614 1 216 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.823 0.222 17919 88615 1 216 . 1 1 45 45 PHE C C 45 174.470 174.470 174.517 -0.047 17919 88616 1 216 . 1 1 45 45 PHE CA C 45 57.020 57.020 55.321 1.700 17919 88617 1 216 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.848 0.912 17919 88618 1 216 . 1 1 45 45 PHE H H 45 8.830 8.830 8.906 -0.076 17919 88619 1 216 . 1 1 46 46 ALA N N 46 132.200 132.200 130.432 1.768 17919 88620 1 216 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.607 0.083 17919 88621 1 216 . 1 1 46 46 ALA C C 46 177.290 177.290 177.615 -0.325 17919 88622 1 216 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.714 -0.174 17919 88623 1 216 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.193 0.377 17919 88624 1 216 . 1 1 46 46 ALA H H 46 8.810 8.810 9.017 -0.207 17919 88625 1 216 . 1 1 47 47 GLY N N 47 102.340 102.340 103.623 -1.283 17919 88626 1 216 . 1 1 47 47 GLY C C 47 173.810 173.810 174.435 -0.625 17919 88627 1 216 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.287 0.063 17919 88628 1 216 . 1 1 47 47 GLY H H 47 8.130 8.130 8.632 -0.502 17919 88629 1 216 . 1 1 48 48 LYS N N 48 121.570 121.570 121.166 0.404 17919 88630 1 216 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.521 0.101 17919 88631 1 216 . 1 1 48 48 LYS C C 48 174.700 174.700 175.441 -0.741 17919 88632 1 216 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.182 -0.632 17919 88633 1 216 . 1 1 48 48 LYS CB C 48 34.530 34.530 33.930 0.600 17919 88634 1 216 . 1 1 48 48 LYS H H 48 7.980 7.980 8.057 -0.077 17919 88635 1 216 . 1 1 49 49 GLN N N 49 122.410 122.410 124.148 -1.738 17919 88636 1 216 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.517 0.043 17919 88637 1 216 . 1 1 49 49 GLN C C 49 175.670 175.670 175.508 0.162 17919 88638 1 216 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.505 0.235 17919 88639 1 216 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.375 -0.376 17919 88640 1 216 . 1 1 49 49 GLN H H 49 8.600 8.600 8.530 0.070 17919 88641 1 216 . 1 1 50 50 LEU N N 50 125.520 125.520 128.884 -3.364 17919 88642 1 216 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.261 -0.171 17919 88643 1 216 . 1 1 50 50 LEU C C 50 176.660 176.660 176.095 0.565 17919 88644 1 216 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.041 0.199 17919 88645 1 216 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.516 -0.945 17919 88646 1 216 . 1 1 50 50 LEU H H 50 8.530 8.530 8.453 0.077 17919 88647 1 216 . 1 1 51 51 GLU N N 51 122.940 122.940 120.448 2.492 17919 88648 1 216 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.598 -0.110 17919 88649 1 216 . 1 1 51 51 GLU C C 51 175.870 175.870 176.882 -1.012 17919 88650 1 216 . 1 1 51 51 GLU CA C 51 55.960 55.960 54.984 0.976 17919 88651 1 216 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.276 -0.706 17919 88652 1 216 . 1 1 51 51 GLU H H 51 8.400 8.400 8.600 -0.200 17919 88653 1 216 . 1 1 52 52 ASP N N 52 120.030 120.030 122.813 -2.783 17919 88654 1 216 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.462 -0.103 17919 88655 1 216 . 1 1 52 52 ASP C C 52 177.330 177.330 177.835 -0.505 17919 88656 1 216 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.606 -0.646 17919 88657 1 216 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.861 -0.011 17919 88658 1 216 . 1 1 52 52 ASP H H 52 8.160 8.160 8.833 -0.673 17919 88659 1 216 . 1 1 53 53 GLY N N 53 106.660 106.660 104.875 1.785 17919 88660 1 216 . 1 1 53 53 GLY C C 53 174.870 174.870 173.866 1.004 17919 88661 1 216 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.850 0.320 17919 88662 1 216 . 1 1 53 53 GLY H H 53 9.390 9.390 8.407 0.983 17919 88663 1 216 . 1 1 54 54 ARG N N 54 119.050 119.050 119.960 -0.910 17919 88664 1 216 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.578 0.117 17919 88665 1 216 . 1 1 54 54 ARG C C 54 175.350 175.350 175.665 -0.315 17919 88666 1 216 . 1 1 54 54 ARG CA C 54 54.390 54.390 53.272 1.118 17919 88667 1 216 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.761 -0.111 17919 88668 1 216 . 1 1 54 54 ARG H H 54 7.460 7.460 7.222 0.238 17919 88669 1 216 . 1 1 55 55 THR N N 55 108.400 108.400 111.609 -3.209 17919 88670 1 216 . 1 1 55 55 THR HA H 55 5.240 5.240 4.951 0.289 17919 88671 1 216 . 1 1 55 55 THR C C 55 176.560 176.560 176.363 0.197 17919 88672 1 216 . 1 1 55 55 THR CA C 55 59.690 59.690 60.556 -0.866 17919 88673 1 216 . 1 1 55 55 THR CB C 55 72.260 72.260 70.771 1.489 17919 88674 1 216 . 1 1 55 55 THR H H 55 8.730 8.730 8.496 0.234 17919 88675 1 216 . 1 1 56 56 LEU N N 56 117.920 117.920 121.729 -3.809 17919 88676 1 216 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.998 0.062 17919 88677 1 216 . 1 1 56 56 LEU C C 56 180.810 180.810 178.922 1.888 17919 88678 1 216 . 1 1 56 56 LEU CA C 56 58.710 58.710 57.951 0.759 17919 88679 1 216 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.492 -1.122 17919 88680 1 216 . 1 1 56 56 LEU H H 56 8.140 8.140 8.969 -0.829 17919 88681 1 216 . 1 1 57 57 SER N N 57 113.330 113.330 115.685 -2.355 17919 88682 1 216 . 1 1 57 57 SER HA H 57 4.370 4.370 4.166 0.204 17919 88683 1 216 . 1 1 57 57 SER C C 57 178.310 178.310 176.817 1.493 17919 88684 1 216 . 1 1 57 57 SER CA C 57 61.080 61.080 62.094 -1.014 17919 88685 1 216 . 1 1 57 57 SER CB C 57 62.530 62.530 62.657 -0.127 17919 88686 1 216 . 1 1 57 57 SER H H 57 8.470 8.470 8.321 0.149 17919 88687 1 216 . 1 1 58 58 ASP N N 58 124.190 124.190 121.829 2.361 17919 88688 1 216 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.329 -0.033 17919 88689 1 216 . 1 1 58 58 ASP C C 58 177.400 177.400 177.625 -0.225 17919 88690 1 216 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.796 0.384 17919 88691 1 216 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.371 -0.271 17919 88692 1 216 . 1 1 58 58 ASP H H 58 7.930 7.930 7.639 0.291 17919 88693 1 216 . 1 1 59 59 TYR N N 59 115.510 115.510 115.684 -0.174 17919 88694 1 216 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.603 0.067 17919 88695 1 216 . 1 1 59 59 TYR C C 59 174.700 174.700 175.021 -0.321 17919 88696 1 216 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.193 1.057 17919 88697 1 216 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.266 1.804 17919 88698 1 216 . 1 1 59 59 TYR H H 59 7.250 7.250 7.312 -0.062 17919 88699 1 216 . 1 1 60 60 ASN N N 60 115.900 115.900 117.598 -1.698 17919 88700 1 216 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.409 -0.054 17919 88701 1 216 . 1 1 60 60 ASN C C 60 174.340 174.340 174.796 -0.456 17919 88702 1 216 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.177 -0.057 17919 88703 1 216 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.087 0.323 17919 88704 1 216 . 1 1 60 60 ASN H H 60 8.150 8.150 7.876 0.274 17919 88705 1 216 . 1 1 61 61 ILE N N 61 118.600 118.600 119.539 -0.939 17919 88706 1 216 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.981 -0.588 17919 88707 1 216 . 1 1 61 61 ILE C C 61 174.610 174.610 175.099 -0.489 17919 88708 1 216 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.421 0.999 17919 88709 1 216 . 1 1 61 61 ILE CB C 61 36.740 36.740 38.496 -1.756 17919 88710 1 216 . 1 1 61 61 ILE H H 61 7.250 7.250 7.509 -0.259 17919 88711 1 216 . 1 1 62 62 GLN N N 62 124.740 124.740 124.666 0.074 17919 88712 1 216 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.800 -0.294 17919 88713 1 216 . 1 1 62 62 GLN C C 62 175.970 175.970 175.631 0.339 17919 88714 1 216 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.503 0.157 17919 88715 1 216 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.882 -0.232 17919 88716 1 216 . 1 1 62 62 GLN H H 62 7.610 7.610 8.061 -0.451 17919 88717 1 216 . 1 1 63 63 LYS N N 63 120.300 120.300 122.475 -2.175 17919 88718 1 216 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.014 -0.013 17919 88719 1 216 . 1 1 63 63 LYS C C 63 175.810 175.810 176.641 -0.831 17919 88720 1 216 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.730 0.061 17919 88721 1 216 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.057 0.593 17919 88722 1 216 . 1 1 63 63 LYS H H 63 8.490 8.490 8.676 -0.186 17919 88723 1 216 . 1 1 64 64 GLU N N 64 113.950 113.950 116.347 -2.397 17919 88724 1 216 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.850 -0.385 17919 88725 1 216 . 1 1 64 64 GLU C C 64 175.250 175.250 175.570 -0.320 17919 88726 1 216 . 1 1 64 64 GLU CA C 64 57.890 57.890 58.076 -0.186 17919 88727 1 216 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.787 -2.887 17919 88728 1 216 . 1 1 64 64 GLU H H 64 9.280 9.280 9.143 0.137 17919 88729 1 216 . 1 1 65 65 SER N N 65 114.730 114.730 116.195 -1.465 17919 88730 1 216 . 1 1 65 65 SER HA H 65 4.640 4.640 4.507 0.133 17919 88731 1 216 . 1 1 65 65 SER C C 65 172.160 172.160 173.839 -1.679 17919 88732 1 216 . 1 1 65 65 SER CA C 65 60.890 60.890 60.636 0.254 17919 88733 1 216 . 1 1 65 65 SER CB C 65 64.910 64.910 63.788 1.122 17919 88734 1 216 . 1 1 65 65 SER H H 65 7.670 7.670 7.699 -0.029 17919 88735 1 216 . 1 1 66 66 THR N N 66 117.110 117.110 120.570 -3.460 17919 88736 1 216 . 1 1 66 66 THR HA H 66 5.270 5.270 5.042 0.228 17919 88737 1 216 . 1 1 66 66 THR C C 66 173.950 173.950 174.074 -0.124 17919 88738 1 216 . 1 1 66 66 THR CA C 66 62.340 62.340 62.441 -0.101 17919 88739 1 216 . 1 1 66 66 THR CB C 66 70.080 70.080 69.909 0.171 17919 88740 1 216 . 1 1 66 66 THR H H 66 8.730 8.730 8.305 0.425 17919 88741 1 216 . 1 1 67 67 LEU N N 67 127.110 127.110 126.179 0.931 17919 88742 1 216 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.645 0.415 17919 88743 1 216 . 1 1 67 67 LEU C C 67 175.770 175.770 175.683 0.087 17919 88744 1 216 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.058 -0.158 17919 88745 1 216 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.737 0.523 17919 88746 1 216 . 1 1 67 67 LEU H H 67 9.410 9.410 9.086 0.324 17919 88747 1 216 . 1 1 68 68 HIS N N 68 118.380 118.380 119.077 -0.697 17919 88748 1 216 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.499 -0.259 17919 88749 1 216 . 1 1 68 68 HIS C C 68 173.150 173.150 174.375 -1.225 17919 88750 1 216 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.187 0.813 17919 88751 1 216 . 1 1 68 68 HIS CB C 68 30.530 30.530 31.613 -1.083 17919 88752 1 216 . 1 1 68 68 HIS H H 68 9.230 9.230 9.111 0.119 17919 88753 1 216 . 1 1 69 69 LEU N N 69 124.460 124.460 128.123 -3.663 17919 88754 1 216 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.116 0.074 17919 88755 1 216 . 1 1 69 69 LEU C C 69 175.270 175.270 174.321 0.949 17919 88756 1 216 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.468 0.422 17919 88757 1 216 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.530 -0.150 17919 88758 1 216 . 1 1 69 69 LEU H H 69 8.340 8.340 9.063 -0.723 17919 88759 1 216 . 1 1 70 70 VAL N N 70 126.940 126.940 124.733 2.207 17919 88760 1 216 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.654 -0.304 17919 88761 1 216 . 1 1 70 70 VAL C C 70 174.000 174.000 173.487 0.513 17919 88762 1 216 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.678 1.122 17919 88763 1 216 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.520 -0.610 17919 88764 1 216 . 1 1 70 70 VAL H H 70 9.200 9.200 9.007 0.193 17919 88765 1 216 . 1 1 71 71 LEU N N 71 123.130 123.130 125.302 -2.172 17919 88766 1 216 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.146 -0.086 17919 88767 1 216 . 1 1 71 71 LEU C C 71 177.830 177.830 176.423 1.407 17919 88768 1 216 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.529 0.411 17919 88769 1 216 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.449 -0.599 17919 88770 1 216 . 1 1 71 71 LEU H H 71 8.120 8.120 8.304 -0.184 17919 88771 1 216 . 1 1 72 72 ARG N N 72 123.490 123.490 125.756 -2.266 17919 88772 1 216 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.434 -0.133 17919 88773 1 216 . 1 1 72 72 ARG C C 72 175.350 175.350 175.061 0.289 17919 88774 1 216 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.055 -0.445 17919 88775 1 216 . 1 1 72 72 ARG CB C 72 31.350 31.350 31.225 0.125 17919 88776 1 216 . 1 1 72 72 ARG H H 72 8.580 8.580 8.348 0.232 17919 88777 1 217 . 1 1 2 2 GLN N N 2 123.220 123.220 124.941 -1.721 17919 88778 1 217 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.052 0.197 17919 88779 1 217 . 1 1 2 2 GLN C C 2 175.920 175.920 173.664 2.256 17919 88780 1 217 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.465 0.615 17919 88781 1 217 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.091 0.669 17919 88782 1 217 . 1 1 2 2 GLN H H 2 8.900 8.900 8.287 0.613 17919 88783 1 217 . 1 1 3 3 ILE N N 3 115.340 115.340 116.333 -0.993 17919 88784 1 217 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.254 -0.041 17919 88785 1 217 . 1 1 3 3 ILE C C 3 172.450 172.450 173.012 -0.562 17919 88786 1 217 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.850 -0.280 17919 88787 1 217 . 1 1 3 3 ILE CB C 3 42.210 42.210 42.088 0.122 17919 88788 1 217 . 1 1 3 3 ILE H H 3 8.320 8.320 8.688 -0.368 17919 88789 1 217 . 1 1 4 4 PHE N N 4 118.110 118.110 119.174 -1.064 17919 88790 1 217 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.712 -0.082 17919 88791 1 217 . 1 1 4 4 PHE C C 4 175.320 175.320 175.592 -0.272 17919 88792 1 217 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.209 0.001 17919 88793 1 217 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.260 -0.779 17919 88794 1 217 . 1 1 4 4 PHE H H 4 8.610 8.610 8.530 0.080 17919 88795 1 217 . 1 1 5 5 VAL N N 5 121.000 121.000 119.844 1.156 17919 88796 1 217 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.907 -0.182 17919 88797 1 217 . 1 1 5 5 VAL C C 5 174.870 174.870 174.925 -0.055 17919 88798 1 217 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.113 -0.493 17919 88799 1 217 . 1 1 5 5 VAL CB C 5 34.230 34.230 35.211 -0.980 17919 88800 1 217 . 1 1 5 5 VAL H H 5 9.300 9.300 8.993 0.307 17919 88801 1 217 . 1 1 6 6 LYS N N 6 127.520 127.520 127.578 -0.058 17919 88802 1 217 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.404 -0.037 17919 88803 1 217 . 1 1 6 6 LYS C C 6 177.140 177.140 176.732 0.408 17919 88804 1 217 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.570 -0.050 17919 88805 1 217 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.781 0.269 17919 88806 1 217 . 1 1 6 6 LYS H H 6 8.820 8.820 8.633 0.187 17919 88807 1 217 . 1 1 7 7 THR N N 7 115.400 115.400 115.958 -0.558 17919 88808 1 217 . 1 1 7 7 THR HA H 7 4.970 4.970 4.368 0.602 17919 88809 1 217 . 1 1 7 7 THR C C 7 176.910 176.910 176.385 0.525 17919 88810 1 217 . 1 1 7 7 THR CA C 7 60.470 60.470 60.825 -0.355 17919 88811 1 217 . 1 1 7 7 THR CB C 7 70.630 70.630 69.972 0.658 17919 88812 1 217 . 1 1 7 7 THR H H 7 8.730 8.730 8.549 0.181 17919 88813 1 217 . 1 1 8 8 LEU N N 8 121.330 121.330 119.857 1.473 17919 88814 1 217 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.353 -0.043 17919 88815 1 217 . 1 1 8 8 LEU C C 8 178.800 178.800 178.698 0.102 17919 88816 1 217 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.276 0.304 17919 88817 1 217 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.566 0.404 17919 88818 1 217 . 1 1 8 8 LEU H H 8 9.100 9.100 8.569 0.531 17919 88819 1 217 . 1 1 9 9 THR N N 9 105.590 105.590 109.495 -3.905 17919 88820 1 217 . 1 1 9 9 THR HA H 9 4.428 4.428 4.241 0.187 17919 88821 1 217 . 1 1 9 9 THR C C 9 175.520 175.520 176.167 -0.647 17919 88822 1 217 . 1 1 9 9 THR CA C 9 61.400 61.400 62.366 -0.966 17919 88823 1 217 . 1 1 9 9 THR CB C 9 69.140 69.140 68.762 0.378 17919 88824 1 217 . 1 1 9 9 THR H H 9 7.630 7.630 7.878 -0.248 17919 88825 1 217 . 1 1 10 10 GLY N N 10 108.890 108.890 110.908 -2.018 17919 88826 1 217 . 1 1 10 10 GLY C C 10 174.070 174.070 173.602 0.468 17919 88827 1 217 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.418 0.042 17919 88828 1 217 . 1 1 10 10 GLY H H 10 7.810 7.810 7.729 0.081 17919 88829 1 217 . 1 1 11 11 LYS N N 11 121.600 121.600 120.390 1.210 17919 88830 1 217 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.362 -0.001 17919 88831 1 217 . 1 1 11 11 LYS C C 11 175.940 175.940 175.237 0.703 17919 88832 1 217 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.577 -0.297 17919 88833 1 217 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.653 -0.453 17919 88834 1 217 . 1 1 11 11 LYS H H 11 7.280 7.280 8.065 -0.785 17919 88835 1 217 . 1 1 12 12 THR N N 12 120.440 120.440 119.854 0.586 17919 88836 1 217 . 1 1 12 12 THR HA H 12 5.046 5.046 5.050 -0.004 17919 88837 1 217 . 1 1 12 12 THR C C 12 174.320 174.320 174.090 0.230 17919 88838 1 217 . 1 1 12 12 THR CA C 12 62.390 62.390 61.491 0.899 17919 88839 1 217 . 1 1 12 12 THR CB C 12 69.910 69.910 69.770 0.140 17919 88840 1 217 . 1 1 12 12 THR H H 12 8.650 8.650 8.249 0.401 17919 88841 1 217 . 1 1 13 13 ILE N N 13 127.110 127.110 127.929 -0.819 17919 88842 1 217 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.446 0.098 17919 88843 1 217 . 1 1 13 13 ILE C C 13 175.220 175.220 175.390 -0.170 17919 88844 1 217 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.517 -0.537 17919 88845 1 217 . 1 1 13 13 ILE CB C 13 40.950 40.950 39.572 1.377 17919 88846 1 217 . 1 1 13 13 ILE H H 13 9.450 9.450 9.128 0.322 17919 88847 1 217 . 1 1 14 14 THR N N 14 121.520 121.520 123.091 -1.571 17919 88848 1 217 . 1 1 14 14 THR HA H 14 4.964 4.964 4.848 0.116 17919 88849 1 217 . 1 1 14 14 THR C C 14 173.790 173.790 173.720 0.070 17919 88850 1 217 . 1 1 14 14 THR CA C 14 61.940 61.940 62.282 -0.342 17919 88851 1 217 . 1 1 14 14 THR CB C 14 69.650 69.650 69.957 -0.307 17919 88852 1 217 . 1 1 14 14 THR H H 14 8.710 8.710 8.475 0.235 17919 88853 1 217 . 1 1 15 15 LEU N N 15 124.800 124.800 127.511 -2.711 17919 88854 1 217 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.638 0.142 17919 88855 1 217 . 1 1 15 15 LEU C C 15 174.670 174.670 174.922 -0.252 17919 88856 1 217 . 1 1 15 15 LEU CA C 15 52.830 52.830 54.008 -1.178 17919 88857 1 217 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.517 1.553 17919 88858 1 217 . 1 1 15 15 LEU H H 15 8.710 8.710 9.082 -0.372 17919 88859 1 217 . 1 1 16 16 GLU N N 16 122.160 122.160 126.122 -3.962 17919 88860 1 217 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.678 0.239 17919 88861 1 217 . 1 1 16 16 GLU C C 16 175.860 175.860 175.641 0.219 17919 88862 1 217 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.435 -0.615 17919 88863 1 217 . 1 1 16 16 GLU CB C 16 29.450 29.450 29.425 0.025 17919 88864 1 217 . 1 1 16 16 GLU H H 16 8.140 8.140 8.733 -0.593 17919 88865 1 217 . 1 1 17 17 VAL N N 17 117.210 117.210 120.656 -3.446 17919 88866 1 217 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.963 -0.249 17919 88867 1 217 . 1 1 17 17 VAL C C 17 174.160 174.160 174.972 -0.812 17919 88868 1 217 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.553 -0.123 17919 88869 1 217 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.785 0.615 17919 88870 1 217 . 1 1 17 17 VAL H H 17 8.900 8.900 9.057 -0.157 17919 88871 1 217 . 1 1 18 18 GLU N N 18 118.990 118.990 122.480 -3.490 17919 88872 1 217 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.885 0.194 17919 88873 1 217 . 1 1 18 18 GLU C C 18 176.160 176.160 175.743 0.417 17919 88874 1 217 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.862 -0.142 17919 88875 1 217 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.430 -0.120 17919 88876 1 217 . 1 1 18 18 GLU H H 18 8.640 8.640 8.225 0.415 17919 88877 1 217 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.277 -0.136 17919 88878 1 217 . 1 1 19 19 PRO C C 19 175.310 175.310 177.486 -2.176 17919 88879 1 217 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.207 0.263 17919 88880 1 217 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.774 0.176 17919 88881 1 217 . 1 1 20 20 SER N N 20 103.400 103.400 111.469 -8.069 17919 88882 1 217 . 1 1 20 20 SER HA H 20 4.370 4.370 4.302 0.068 17919 88883 1 217 . 1 1 20 20 SER C C 20 174.660 174.660 174.483 0.177 17919 88884 1 217 . 1 1 20 20 SER CA C 20 57.400 57.400 58.744 -1.344 17919 88885 1 217 . 1 1 20 20 SER CB C 20 63.370 63.370 62.672 0.698 17919 88886 1 217 . 1 1 20 20 SER H H 20 7.040 7.040 8.258 -1.218 17919 88887 1 217 . 1 1 21 21 ASP N N 21 123.480 123.480 124.073 -0.593 17919 88888 1 217 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.737 -0.041 17919 88889 1 217 . 1 1 21 21 ASP C C 21 176.360 176.360 175.643 0.717 17919 88890 1 217 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.889 0.811 17919 88891 1 217 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.864 -1.065 17919 88892 1 217 . 1 1 21 21 ASP H H 21 8.030 8.030 7.672 0.358 17919 88893 1 217 . 1 1 22 22 THR N N 22 108.800 108.800 112.199 -3.399 17919 88894 1 217 . 1 1 22 22 THR HA H 22 4.920 4.920 5.031 -0.111 17919 88895 1 217 . 1 1 22 22 THR C C 22 176.750 176.750 176.379 0.371 17919 88896 1 217 . 1 1 22 22 THR CA C 22 59.690 59.690 60.324 -0.634 17919 88897 1 217 . 1 1 22 22 THR CB C 22 71.200 71.200 71.177 0.023 17919 88898 1 217 . 1 1 22 22 THR H H 22 7.900 7.900 8.823 -0.923 17919 88899 1 217 . 1 1 23 23 ILE N N 23 121.190 121.190 122.626 -1.436 17919 88900 1 217 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.769 -0.112 17919 88901 1 217 . 1 1 23 23 ILE C C 23 179.040 179.040 177.998 1.042 17919 88902 1 217 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.216 -0.956 17919 88903 1 217 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.259 -1.909 17919 88904 1 217 . 1 1 23 23 ILE H H 23 8.560 8.560 8.495 0.065 17919 88905 1 217 . 1 1 24 24 GLU N N 24 120.830 120.830 120.878 -0.048 17919 88906 1 217 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.967 -0.050 17919 88907 1 217 . 1 1 24 24 GLU C C 24 178.640 178.640 178.649 -0.009 17919 88908 1 217 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.662 0.558 17919 88909 1 217 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.103 -0.823 17919 88910 1 217 . 1 1 24 24 GLU H H 24 9.760 9.760 8.212 1.548 17919 88911 1 217 . 1 1 25 25 ASN N N 25 120.570 120.570 118.007 2.563 17919 88912 1 217 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.458 0.067 17919 88913 1 217 . 1 1 25 25 ASN C C 25 178.380 178.380 178.191 0.189 17919 88914 1 217 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.015 0.045 17919 88915 1 217 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.563 -0.113 17919 88916 1 217 . 1 1 25 25 ASN H H 25 7.920 7.920 7.724 0.196 17919 88917 1 217 . 1 1 26 26 VAL N N 26 121.710 121.710 120.631 1.079 17919 88918 1 217 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.609 -0.212 17919 88919 1 217 . 1 1 26 26 VAL C C 26 177.950 177.950 177.360 0.590 17919 88920 1 217 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.526 1.134 17919 88921 1 217 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.438 -0.598 17919 88922 1 217 . 1 1 26 26 VAL H H 26 8.070 8.070 7.867 0.203 17919 88923 1 217 . 1 1 27 27 LYS N N 27 118.860 118.860 120.866 -2.006 17919 88924 1 217 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.140 0.440 17919 88925 1 217 . 1 1 27 27 LYS C C 27 180.550 180.550 178.952 1.598 17919 88926 1 217 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.938 -0.688 17919 88927 1 217 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.215 1.515 17919 88928 1 217 . 1 1 27 27 LYS H H 27 8.560 8.560 8.318 0.242 17919 88929 1 217 . 1 1 28 28 ALA N N 28 123.440 123.440 120.280 3.160 17919 88930 1 217 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.067 0.093 17919 88931 1 217 . 1 1 28 28 ALA C C 28 180.300 180.300 179.034 1.266 17919 88932 1 217 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.176 0.194 17919 88933 1 217 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.561 -0.851 17919 88934 1 217 . 1 1 28 28 ALA H H 28 8.060 8.060 7.929 0.131 17919 88935 1 217 . 1 1 29 29 LYS N N 29 119.940 119.940 119.800 0.140 17919 88936 1 217 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.002 0.205 17919 88937 1 217 . 1 1 29 29 LYS C C 29 180.320 180.320 179.028 1.292 17919 88938 1 217 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.363 0.287 17919 88939 1 217 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.218 1.072 17919 88940 1 217 . 1 1 29 29 LYS H H 29 7.850 7.850 7.373 0.477 17919 88941 1 217 . 1 1 30 30 ILE N N 30 121.080 121.080 120.370 0.710 17919 88942 1 217 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.583 -0.076 17919 88943 1 217 . 1 1 30 30 ILE C C 30 178.310 178.310 177.518 0.792 17919 88944 1 217 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.370 0.780 17919 88945 1 217 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.642 -0.842 17919 88946 1 217 . 1 1 30 30 ILE H H 30 8.280 8.280 8.287 -0.007 17919 88947 1 217 . 1 1 31 31 GLN N N 31 123.490 123.490 120.816 2.674 17919 88948 1 217 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.040 -0.211 17919 88949 1 217 . 1 1 31 31 GLN C C 31 178.890 178.890 177.970 0.920 17919 88950 1 217 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.089 0.911 17919 88951 1 217 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.523 -0.803 17919 88952 1 217 . 1 1 31 31 GLN H H 31 8.580 8.580 8.042 0.538 17919 88953 1 217 . 1 1 32 32 ASP N N 32 119.360 119.360 118.247 1.113 17919 88954 1 217 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.444 -0.090 17919 88955 1 217 . 1 1 32 32 ASP C C 32 177.250 177.250 178.319 -1.069 17919 88956 1 217 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.488 0.702 17919 88957 1 217 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.857 -0.277 17919 88958 1 217 . 1 1 32 32 ASP H H 32 8.010 8.010 7.730 0.280 17919 88959 1 217 . 1 1 33 33 LYS N N 33 115.130 115.130 118.588 -3.458 17919 88960 1 217 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.280 0.057 17919 88961 1 217 . 1 1 33 33 LYS C C 33 177.870 177.870 178.109 -0.239 17919 88962 1 217 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.436 -0.386 17919 88963 1 217 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.438 0.732 17919 88964 1 217 . 1 1 33 33 LYS H H 33 7.430 7.430 7.590 -0.160 17919 88965 1 217 . 1 1 34 34 GLU N N 34 113.870 113.870 115.364 -1.494 17919 88966 1 217 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.404 0.221 17919 88967 1 217 . 1 1 34 34 GLU C C 34 177.840 177.840 176.650 1.190 17919 88968 1 217 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.068 0.102 17919 88969 1 217 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.119 1.541 17919 88970 1 217 . 1 1 34 34 GLU H H 34 8.740 8.740 8.183 0.557 17919 88971 1 217 . 1 1 35 35 GLY N N 35 108.650 108.650 108.391 0.259 17919 88972 1 217 . 1 1 35 35 GLY C C 35 173.960 173.960 174.879 -0.919 17919 88973 1 217 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.775 0.305 17919 88974 1 217 . 1 1 35 35 GLY H H 35 8.530 8.530 7.681 0.849 17919 88975 1 217 . 1 1 36 36 ILE N N 36 119.880 119.880 121.833 -1.953 17919 88976 1 217 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.388 0.057 17919 88977 1 217 . 1 1 36 36 ILE C C 36 173.590 173.590 174.192 -0.602 17919 88978 1 217 . 1 1 36 36 ILE CA C 36 57.750 57.750 56.654 1.096 17919 88979 1 217 . 1 1 36 36 ILE CB C 36 40.580 40.580 36.967 3.613 17919 88980 1 217 . 1 1 36 36 ILE H H 36 6.150 6.150 7.690 -1.540 17919 88981 1 217 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.775 -0.141 17919 88982 1 217 . 1 1 37 37 PRO C C 37 176.940 176.940 176.257 0.683 17919 88983 1 217 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.797 -0.137 17919 88984 1 217 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.456 0.394 17919 88985 1 217 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.170 -0.053 17919 88986 1 217 . 1 1 38 38 PRO C C 38 178.320 178.320 178.203 0.117 17919 88987 1 217 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.632 0.629 17919 88988 1 217 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.754 1.136 17919 88989 1 217 . 1 1 39 39 ASP N N 39 113.380 113.380 115.506 -2.126 17919 88990 1 217 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.435 -0.005 17919 88991 1 217 . 1 1 39 39 ASP C C 39 177.090 177.090 177.222 -0.132 17919 88992 1 217 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.558 -0.918 17919 88993 1 217 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.028 -0.488 17919 88994 1 217 . 1 1 39 39 ASP H H 39 8.550 8.550 8.706 -0.156 17919 88995 1 217 . 1 1 40 40 GLN N N 40 116.780 116.780 117.527 -0.747 17919 88996 1 217 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.242 0.222 17919 88997 1 217 . 1 1 40 40 GLN C C 40 175.380 175.380 175.351 0.029 17919 88998 1 217 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.974 -1.335 17919 88999 1 217 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.852 0.288 17919 89000 1 217 . 1 1 40 40 GLN H H 40 7.820 7.820 8.185 -0.365 17919 89001 1 217 . 1 1 41 41 GLN N N 41 117.720 117.720 118.646 -0.926 17919 89002 1 217 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.513 -0.269 17919 89003 1 217 . 1 1 41 41 GLN C C 41 176.300 176.300 175.347 0.953 17919 89004 1 217 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.544 0.927 17919 89005 1 217 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.722 1.928 17919 89006 1 217 . 1 1 41 41 GLN H H 41 7.480 7.480 7.526 -0.046 17919 89007 1 217 . 1 1 42 42 ARG N N 42 122.680 122.680 126.421 -3.741 17919 89008 1 217 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.664 -0.164 17919 89009 1 217 . 1 1 42 42 ARG C C 42 174.050 174.050 173.879 0.171 17919 89010 1 217 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.694 0.356 17919 89011 1 217 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.046 -1.296 17919 89012 1 217 . 1 1 42 42 ARG H H 42 8.530 8.530 8.519 0.011 17919 89013 1 217 . 1 1 43 43 LEU N N 43 124.040 124.040 126.590 -2.550 17919 89014 1 217 . 1 1 43 43 LEU C C 43 175.290 175.290 175.825 -0.535 17919 89015 1 217 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.290 -0.310 17919 89016 1 217 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.688 1.102 17919 89017 1 217 . 1 1 43 43 LEU H H 43 8.820 8.820 8.810 0.010 17919 89018 1 217 . 1 1 44 44 ILE N N 44 121.920 121.920 117.863 4.057 17919 89019 1 217 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.005 -0.013 17919 89020 1 217 . 1 1 44 44 ILE C C 44 176.060 176.060 173.716 2.344 17919 89021 1 217 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.956 -0.976 17919 89022 1 217 . 1 1 44 44 ILE CB C 44 41.420 41.420 40.899 0.521 17919 89023 1 217 . 1 1 44 44 ILE H H 44 9.030 9.030 9.128 -0.098 17919 89024 1 217 . 1 1 45 45 PHE N N 45 125.390 125.390 128.259 -2.869 17919 89025 1 217 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.034 0.011 17919 89026 1 217 . 1 1 45 45 PHE C C 45 174.470 174.470 174.560 -0.090 17919 89027 1 217 . 1 1 45 45 PHE CA C 45 57.020 57.020 57.203 -0.183 17919 89028 1 217 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.345 0.415 17919 89029 1 217 . 1 1 45 45 PHE H H 45 8.830 8.830 8.937 -0.107 17919 89030 1 217 . 1 1 46 46 ALA N N 46 132.200 132.200 129.175 3.025 17919 89031 1 217 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.586 0.104 17919 89032 1 217 . 1 1 46 46 ALA C C 46 177.290 177.290 177.891 -0.601 17919 89033 1 217 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.656 -0.116 17919 89034 1 217 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.427 0.143 17919 89035 1 217 . 1 1 46 46 ALA H H 46 8.810 8.810 8.593 0.217 17919 89036 1 217 . 1 1 47 47 GLY N N 47 102.340 102.340 103.651 -1.311 17919 89037 1 217 . 1 1 47 47 GLY C C 47 173.810 173.810 174.305 -0.495 17919 89038 1 217 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.775 0.575 17919 89039 1 217 . 1 1 47 47 GLY H H 47 8.130 8.130 8.354 -0.224 17919 89040 1 217 . 1 1 48 48 LYS N N 48 121.570 121.570 122.858 -1.288 17919 89041 1 217 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.523 0.099 17919 89042 1 217 . 1 1 48 48 LYS C C 48 174.700 174.700 175.070 -0.370 17919 89043 1 217 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.992 -0.442 17919 89044 1 217 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.082 0.448 17919 89045 1 217 . 1 1 48 48 LYS H H 48 7.980 7.980 7.887 0.093 17919 89046 1 217 . 1 1 49 49 GLN N N 49 122.410 122.410 126.096 -3.686 17919 89047 1 217 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.556 0.004 17919 89048 1 217 . 1 1 49 49 GLN C C 49 175.670 175.670 175.515 0.155 17919 89049 1 217 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.936 -0.196 17919 89050 1 217 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.461 -0.461 17919 89051 1 217 . 1 1 49 49 GLN H H 49 8.600 8.600 8.614 -0.014 17919 89052 1 217 . 1 1 50 50 LEU N N 50 125.520 125.520 128.304 -2.784 17919 89053 1 217 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.301 -0.211 17919 89054 1 217 . 1 1 50 50 LEU C C 50 176.660 176.660 176.686 -0.026 17919 89055 1 217 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.193 0.047 17919 89056 1 217 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.466 -0.896 17919 89057 1 217 . 1 1 50 50 LEU H H 50 8.530 8.530 8.123 0.407 17919 89058 1 217 . 1 1 51 51 GLU N N 51 122.940 122.940 122.714 0.226 17919 89059 1 217 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.582 -0.094 17919 89060 1 217 . 1 1 51 51 GLU C C 51 175.870 175.870 177.060 -1.190 17919 89061 1 217 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.381 0.579 17919 89062 1 217 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.557 0.013 17919 89063 1 217 . 1 1 51 51 GLU H H 51 8.400 8.400 8.559 -0.159 17919 89064 1 217 . 1 1 52 52 ASP N N 52 120.030 120.030 125.224 -5.194 17919 89065 1 217 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.411 -0.052 17919 89066 1 217 . 1 1 52 52 ASP C C 52 177.330 177.330 177.669 -0.339 17919 89067 1 217 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.768 -0.808 17919 89068 1 217 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.899 -0.049 17919 89069 1 217 . 1 1 52 52 ASP H H 52 8.160 8.160 8.942 -0.782 17919 89070 1 217 . 1 1 53 53 GLY N N 53 106.660 106.660 106.197 0.463 17919 89071 1 217 . 1 1 53 53 GLY C C 53 174.870 174.870 174.079 0.791 17919 89072 1 217 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.687 0.483 17919 89073 1 217 . 1 1 53 53 GLY H H 53 9.390 9.390 8.447 0.943 17919 89074 1 217 . 1 1 54 54 ARG N N 54 119.050 119.050 120.925 -1.875 17919 89075 1 217 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.622 0.073 17919 89076 1 217 . 1 1 54 54 ARG C C 54 175.350 175.350 175.491 -0.141 17919 89077 1 217 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.395 -0.005 17919 89078 1 217 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.032 0.618 17919 89079 1 217 . 1 1 54 54 ARG H H 54 7.460 7.460 7.647 -0.187 17919 89080 1 217 . 1 1 55 55 THR N N 55 108.400 108.400 112.385 -3.985 17919 89081 1 217 . 1 1 55 55 THR HA H 55 5.240 5.240 4.908 0.332 17919 89082 1 217 . 1 1 55 55 THR C C 55 176.560 176.560 175.799 0.761 17919 89083 1 217 . 1 1 55 55 THR CA C 55 59.690 59.690 60.459 -0.769 17919 89084 1 217 . 1 1 55 55 THR CB C 55 72.260 72.260 70.996 1.264 17919 89085 1 217 . 1 1 55 55 THR H H 55 8.730 8.730 8.928 -0.198 17919 89086 1 217 . 1 1 56 56 LEU N N 56 117.920 117.920 122.638 -4.718 17919 89087 1 217 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.103 -0.043 17919 89088 1 217 . 1 1 56 56 LEU C C 56 180.810 180.810 179.016 1.794 17919 89089 1 217 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.508 0.202 17919 89090 1 217 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.456 -1.086 17919 89091 1 217 . 1 1 56 56 LEU H H 56 8.140 8.140 8.571 -0.431 17919 89092 1 217 . 1 1 57 57 SER N N 57 113.330 113.330 115.276 -1.946 17919 89093 1 217 . 1 1 57 57 SER HA H 57 4.370 4.370 4.080 0.290 17919 89094 1 217 . 1 1 57 57 SER C C 57 178.310 178.310 176.607 1.703 17919 89095 1 217 . 1 1 57 57 SER CA C 57 61.080 61.080 62.404 -1.324 17919 89096 1 217 . 1 1 57 57 SER CB C 57 62.530 62.530 62.874 -0.344 17919 89097 1 217 . 1 1 57 57 SER H H 57 8.470 8.470 8.245 0.225 17919 89098 1 217 . 1 1 58 58 ASP N N 58 124.190 124.190 121.015 3.175 17919 89099 1 217 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.432 -0.136 17919 89100 1 217 . 1 1 58 58 ASP C C 58 177.400 177.400 176.905 0.495 17919 89101 1 217 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.139 1.041 17919 89102 1 217 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.563 -0.464 17919 89103 1 217 . 1 1 58 58 ASP H H 58 7.930 7.930 7.670 0.260 17919 89104 1 217 . 1 1 59 59 TYR N N 59 115.510 115.510 115.987 -0.477 17919 89105 1 217 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.632 0.038 17919 89106 1 217 . 1 1 59 59 TYR C C 59 174.700 174.700 175.111 -0.411 17919 89107 1 217 . 1 1 59 59 TYR CA C 59 58.250 58.250 56.430 1.820 17919 89108 1 217 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.463 1.607 17919 89109 1 217 . 1 1 59 59 TYR H H 59 7.250 7.250 7.342 -0.092 17919 89110 1 217 . 1 1 60 60 ASN N N 60 115.900 115.900 116.497 -0.597 17919 89111 1 217 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.353 0.002 17919 89112 1 217 . 1 1 60 60 ASN C C 60 174.340 174.340 174.517 -0.177 17919 89113 1 217 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.111 0.009 17919 89114 1 217 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.827 -0.417 17919 89115 1 217 . 1 1 60 60 ASN H H 60 8.150 8.150 7.602 0.548 17919 89116 1 217 . 1 1 61 61 ILE N N 61 118.600 118.600 119.317 -0.717 17919 89117 1 217 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.827 -0.434 17919 89118 1 217 . 1 1 61 61 ILE C C 61 174.610 174.610 176.258 -1.648 17919 89119 1 217 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.034 0.386 17919 89120 1 217 . 1 1 61 61 ILE CB C 61 36.740 36.740 36.667 0.073 17919 89121 1 217 . 1 1 61 61 ILE H H 61 7.250 7.250 7.957 -0.707 17919 89122 1 217 . 1 1 62 62 GLN N N 62 124.740 124.740 126.565 -1.825 17919 89123 1 217 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.644 -0.138 17919 89124 1 217 . 1 1 62 62 GLN C C 62 175.970 175.970 175.373 0.597 17919 89125 1 217 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.314 0.346 17919 89126 1 217 . 1 1 62 62 GLN CB C 62 31.650 31.650 30.827 0.823 17919 89127 1 217 . 1 1 62 62 GLN H H 62 7.610 7.610 8.088 -0.478 17919 89128 1 217 . 1 1 63 63 LYS N N 63 120.300 120.300 120.278 0.022 17919 89129 1 217 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.085 -0.084 17919 89130 1 217 . 1 1 63 63 LYS C C 63 175.810 175.810 177.155 -1.345 17919 89131 1 217 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.713 0.077 17919 89132 1 217 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.056 0.594 17919 89133 1 217 . 1 1 63 63 LYS H H 63 8.490 8.490 8.665 -0.175 17919 89134 1 217 . 1 1 64 64 GLU N N 64 113.950 113.950 118.146 -4.196 17919 89135 1 217 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.636 -0.171 17919 89136 1 217 . 1 1 64 64 GLU C C 64 175.250 175.250 175.987 -0.737 17919 89137 1 217 . 1 1 64 64 GLU CA C 64 57.890 57.890 58.055 -0.165 17919 89138 1 217 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.746 -2.846 17919 89139 1 217 . 1 1 64 64 GLU H H 64 9.280 9.280 8.818 0.462 17919 89140 1 217 . 1 1 65 65 SER N N 65 114.730 114.730 116.097 -1.367 17919 89141 1 217 . 1 1 65 65 SER HA H 65 4.640 4.640 4.435 0.205 17919 89142 1 217 . 1 1 65 65 SER C C 65 172.160 172.160 173.863 -1.703 17919 89143 1 217 . 1 1 65 65 SER CA C 65 60.890 60.890 60.415 0.475 17919 89144 1 217 . 1 1 65 65 SER CB C 65 64.910 64.910 63.928 0.982 17919 89145 1 217 . 1 1 65 65 SER H H 65 7.670 7.670 7.464 0.206 17919 89146 1 217 . 1 1 66 66 THR N N 66 117.110 117.110 120.197 -3.087 17919 89147 1 217 . 1 1 66 66 THR HA H 66 5.270 5.270 4.915 0.355 17919 89148 1 217 . 1 1 66 66 THR C C 66 173.950 173.950 174.021 -0.071 17919 89149 1 217 . 1 1 66 66 THR CA C 66 62.340 62.340 62.111 0.229 17919 89150 1 217 . 1 1 66 66 THR CB C 66 70.080 70.080 70.351 -0.271 17919 89151 1 217 . 1 1 66 66 THR H H 66 8.730 8.730 8.569 0.161 17919 89152 1 217 . 1 1 67 67 LEU N N 67 127.110 127.110 126.410 0.700 17919 89153 1 217 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.716 0.344 17919 89154 1 217 . 1 1 67 67 LEU C C 67 175.770 175.770 175.432 0.338 17919 89155 1 217 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.825 0.075 17919 89156 1 217 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.084 0.176 17919 89157 1 217 . 1 1 67 67 LEU H H 67 9.410 9.410 8.968 0.442 17919 89158 1 217 . 1 1 68 68 HIS N N 68 118.380 118.380 120.890 -2.510 17919 89159 1 217 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.251 -0.011 17919 89160 1 217 . 1 1 68 68 HIS C C 68 173.150 173.150 173.884 -0.734 17919 89161 1 217 . 1 1 68 68 HIS CA C 68 55.000 55.000 55.062 -0.062 17919 89162 1 217 . 1 1 68 68 HIS CB C 68 30.530 30.530 33.002 -2.472 17919 89163 1 217 . 1 1 68 68 HIS H H 68 9.230 9.230 8.542 0.688 17919 89164 1 217 . 1 1 69 69 LEU N N 69 124.460 124.460 129.132 -4.672 17919 89165 1 217 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.137 0.053 17919 89166 1 217 . 1 1 69 69 LEU C C 69 175.270 175.270 174.609 0.661 17919 89167 1 217 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.543 0.347 17919 89168 1 217 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.067 0.313 17919 89169 1 217 . 1 1 69 69 LEU H H 69 8.340 8.340 8.079 0.261 17919 89170 1 217 . 1 1 70 70 VAL N N 70 126.940 126.940 124.033 2.907 17919 89171 1 217 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.687 -0.337 17919 89172 1 217 . 1 1 70 70 VAL C C 70 174.000 174.000 174.128 -0.128 17919 89173 1 217 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.869 0.931 17919 89174 1 217 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.790 -0.880 17919 89175 1 217 . 1 1 70 70 VAL H H 70 9.200 9.200 8.953 0.247 17919 89176 1 217 . 1 1 71 71 LEU N N 71 123.130 123.130 124.245 -1.115 17919 89177 1 217 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.990 0.070 17919 89178 1 217 . 1 1 71 71 LEU C C 71 177.830 177.830 178.074 -0.244 17919 89179 1 217 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.682 0.258 17919 89180 1 217 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.331 -0.482 17919 89181 1 217 . 1 1 71 71 LEU H H 71 8.120 8.120 8.399 -0.279 17919 89182 1 217 . 1 1 72 72 ARG N N 72 123.490 123.490 121.459 2.031 17919 89183 1 217 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.300 0.001 17919 89184 1 217 . 1 1 72 72 ARG C C 72 175.350 175.350 175.684 -0.334 17919 89185 1 217 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.179 -0.569 17919 89186 1 217 . 1 1 72 72 ARG CB C 72 31.350 31.350 27.864 3.486 17919 89187 1 217 . 1 1 72 72 ARG H H 72 8.580 8.580 8.451 0.129 17919 89188 1 218 . 1 1 2 2 GLN N N 2 123.220 123.220 119.485 3.735 17919 89189 1 218 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.198 0.051 17919 89190 1 218 . 1 1 2 2 GLN C C 2 175.920 175.920 175.734 0.186 17919 89191 1 218 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.875 0.205 17919 89192 1 218 . 1 1 2 2 GLN CB C 2 30.760 30.760 29.972 0.788 17919 89193 1 218 . 1 1 2 2 GLN H H 2 8.900 8.900 8.341 0.559 17919 89194 1 218 . 1 1 3 3 ILE N N 3 115.340 115.340 116.588 -1.248 17919 89195 1 218 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.500 -0.287 17919 89196 1 218 . 1 1 3 3 ILE C C 3 172.450 172.450 173.455 -1.005 17919 89197 1 218 . 1 1 3 3 ILE CA C 3 59.570 59.570 58.924 0.646 17919 89198 1 218 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.730 0.480 17919 89199 1 218 . 1 1 3 3 ILE H H 3 8.320 8.320 8.752 -0.432 17919 89200 1 218 . 1 1 4 4 PHE N N 4 118.110 118.110 119.071 -0.961 17919 89201 1 218 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.528 0.102 17919 89202 1 218 . 1 1 4 4 PHE C C 4 175.320 175.320 175.230 0.090 17919 89203 1 218 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.982 -0.772 17919 89204 1 218 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.312 -0.832 17919 89205 1 218 . 1 1 4 4 PHE H H 4 8.610 8.610 8.195 0.415 17919 89206 1 218 . 1 1 5 5 VAL N N 5 121.000 121.000 121.489 -0.489 17919 89207 1 218 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.747 -0.022 17919 89208 1 218 . 1 1 5 5 VAL C C 5 174.870 174.870 174.423 0.447 17919 89209 1 218 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.260 -0.640 17919 89210 1 218 . 1 1 5 5 VAL CB C 5 34.230 34.230 35.110 -0.880 17919 89211 1 218 . 1 1 5 5 VAL H H 5 9.300 9.300 9.323 -0.023 17919 89212 1 218 . 1 1 6 6 LYS N N 6 127.520 127.520 129.098 -1.578 17919 89213 1 218 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.255 0.112 17919 89214 1 218 . 1 1 6 6 LYS C C 6 177.140 177.140 176.471 0.669 17919 89215 1 218 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.404 0.116 17919 89216 1 218 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.704 -0.654 17919 89217 1 218 . 1 1 6 6 LYS H H 6 8.820 8.820 9.178 -0.358 17919 89218 1 218 . 1 1 7 7 THR N N 7 115.400 115.400 118.294 -2.894 17919 89219 1 218 . 1 1 7 7 THR HA H 7 4.970 4.970 4.311 0.659 17919 89220 1 218 . 1 1 7 7 THR C C 7 176.910 176.910 175.985 0.925 17919 89221 1 218 . 1 1 7 7 THR CA C 7 60.470 60.470 62.128 -1.658 17919 89222 1 218 . 1 1 7 7 THR CB C 7 70.630 70.630 69.910 0.720 17919 89223 1 218 . 1 1 7 7 THR H H 7 8.730 8.730 8.981 -0.251 17919 89224 1 218 . 1 1 8 8 LEU N N 8 121.330 121.330 123.068 -1.738 17919 89225 1 218 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.288 0.022 17919 89226 1 218 . 1 1 8 8 LEU C C 8 178.800 178.800 178.115 0.685 17919 89227 1 218 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.834 -0.254 17919 89228 1 218 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.980 -0.010 17919 89229 1 218 . 1 1 8 8 LEU H H 8 9.100 9.100 8.837 0.263 17919 89230 1 218 . 1 1 9 9 THR N N 9 105.590 105.590 106.972 -1.382 17919 89231 1 218 . 1 1 9 9 THR HA H 9 4.428 4.428 4.323 0.105 17919 89232 1 218 . 1 1 9 9 THR C C 9 175.520 175.520 175.633 -0.113 17919 89233 1 218 . 1 1 9 9 THR CA C 9 61.400 61.400 61.781 -0.380 17919 89234 1 218 . 1 1 9 9 THR CB C 9 69.140 69.140 68.893 0.247 17919 89235 1 218 . 1 1 9 9 THR H H 9 7.630 7.630 7.688 -0.058 17919 89236 1 218 . 1 1 10 10 GLY N N 10 108.890 108.890 111.124 -2.234 17919 89237 1 218 . 1 1 10 10 GLY C C 10 174.070 174.070 173.991 0.079 17919 89238 1 218 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.928 0.532 17919 89239 1 218 . 1 1 10 10 GLY H H 10 7.810 7.810 8.107 -0.297 17919 89240 1 218 . 1 1 11 11 LYS N N 11 121.600 121.600 122.884 -1.284 17919 89241 1 218 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.266 0.095 17919 89242 1 218 . 1 1 11 11 LYS C C 11 175.940 175.940 175.873 0.067 17919 89243 1 218 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.562 -0.282 17919 89244 1 218 . 1 1 11 11 LYS CB C 11 33.200 33.200 32.956 0.243 17919 89245 1 218 . 1 1 11 11 LYS H H 11 7.280 7.280 7.721 -0.441 17919 89246 1 218 . 1 1 12 12 THR N N 12 120.440 120.440 122.030 -1.590 17919 89247 1 218 . 1 1 12 12 THR HA H 12 5.046 5.046 4.950 0.096 17919 89248 1 218 . 1 1 12 12 THR C C 12 174.320 174.320 174.824 -0.504 17919 89249 1 218 . 1 1 12 12 THR CA C 12 62.390 62.390 62.293 0.097 17919 89250 1 218 . 1 1 12 12 THR CB C 12 69.910 69.910 69.764 0.146 17919 89251 1 218 . 1 1 12 12 THR H H 12 8.650 8.650 8.477 0.173 17919 89252 1 218 . 1 1 13 13 ILE N N 13 127.110 127.110 121.648 5.462 17919 89253 1 218 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.759 -0.215 17919 89254 1 218 . 1 1 13 13 ILE C C 13 175.220 175.220 174.650 0.570 17919 89255 1 218 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.156 0.824 17919 89256 1 218 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.698 0.252 17919 89257 1 218 . 1 1 13 13 ILE H H 13 9.450 9.450 9.046 0.404 17919 89258 1 218 . 1 1 14 14 THR N N 14 121.520 121.520 119.515 2.005 17919 89259 1 218 . 1 1 14 14 THR HA H 14 4.964 4.964 5.040 -0.076 17919 89260 1 218 . 1 1 14 14 THR C C 14 173.790 173.790 174.029 -0.239 17919 89261 1 218 . 1 1 14 14 THR CA C 14 61.940 61.940 61.809 0.131 17919 89262 1 218 . 1 1 14 14 THR CB C 14 69.650 69.650 69.719 -0.069 17919 89263 1 218 . 1 1 14 14 THR H H 14 8.710 8.710 8.366 0.344 17919 89264 1 218 . 1 1 15 15 LEU N N 15 124.800 124.800 127.273 -2.473 17919 89265 1 218 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.687 0.093 17919 89266 1 218 . 1 1 15 15 LEU C C 15 174.670 174.670 175.043 -0.373 17919 89267 1 218 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.588 -0.758 17919 89268 1 218 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.804 1.266 17919 89269 1 218 . 1 1 15 15 LEU H H 15 8.710 8.710 8.826 -0.116 17919 89270 1 218 . 1 1 16 16 GLU N N 16 122.160 122.160 124.004 -1.844 17919 89271 1 218 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.345 -0.428 17919 89272 1 218 . 1 1 16 16 GLU C C 16 175.860 175.860 175.757 0.103 17919 89273 1 218 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.261 -0.441 17919 89274 1 218 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.696 -1.246 17919 89275 1 218 . 1 1 16 16 GLU H H 16 8.140 8.140 8.652 -0.512 17919 89276 1 218 . 1 1 17 17 VAL N N 17 117.210 117.210 122.713 -5.503 17919 89277 1 218 . 1 1 17 17 VAL HA H 17 4.714 4.714 5.117 -0.403 17919 89278 1 218 . 1 1 17 17 VAL C C 17 174.160 174.160 174.223 -0.063 17919 89279 1 218 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.311 -0.881 17919 89280 1 218 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.458 0.942 17919 89281 1 218 . 1 1 17 17 VAL H H 17 8.900 8.900 8.405 0.495 17919 89282 1 218 . 1 1 18 18 GLU N N 18 118.990 118.990 120.355 -1.365 17919 89283 1 218 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.878 0.201 17919 89284 1 218 . 1 1 18 18 GLU C C 18 176.160 176.160 175.726 0.434 17919 89285 1 218 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.044 -0.324 17919 89286 1 218 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.980 -0.670 17919 89287 1 218 . 1 1 18 18 GLU H H 18 8.640 8.640 8.945 -0.305 17919 89288 1 218 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.369 -0.228 17919 89289 1 218 . 1 1 19 19 PRO C C 19 175.310 175.310 177.885 -2.575 17919 89290 1 218 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.224 0.246 17919 89291 1 218 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.070 -0.120 17919 89292 1 218 . 1 1 20 20 SER N N 20 103.400 103.400 110.658 -7.258 17919 89293 1 218 . 1 1 20 20 SER HA H 20 4.370 4.370 4.354 0.016 17919 89294 1 218 . 1 1 20 20 SER C C 20 174.660 174.660 174.372 0.288 17919 89295 1 218 . 1 1 20 20 SER CA C 20 57.400 57.400 58.733 -1.333 17919 89296 1 218 . 1 1 20 20 SER CB C 20 63.370 63.370 63.314 0.056 17919 89297 1 218 . 1 1 20 20 SER H H 20 7.040 7.040 8.003 -0.963 17919 89298 1 218 . 1 1 21 21 ASP N N 21 123.480 123.480 122.934 0.546 17919 89299 1 218 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.721 -0.026 17919 89300 1 218 . 1 1 21 21 ASP C C 21 176.360 176.360 175.863 0.497 17919 89301 1 218 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.248 0.452 17919 89302 1 218 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.567 -0.767 17919 89303 1 218 . 1 1 21 21 ASP H H 21 8.030 8.030 7.647 0.383 17919 89304 1 218 . 1 1 22 22 THR N N 22 108.800 108.800 112.355 -3.555 17919 89305 1 218 . 1 1 22 22 THR HA H 22 4.920 4.920 4.654 0.266 17919 89306 1 218 . 1 1 22 22 THR C C 22 176.750 176.750 176.108 0.642 17919 89307 1 218 . 1 1 22 22 THR CA C 22 59.690 59.690 61.584 -1.894 17919 89308 1 218 . 1 1 22 22 THR CB C 22 71.200 71.200 70.690 0.510 17919 89309 1 218 . 1 1 22 22 THR H H 22 7.900 7.900 8.206 -0.306 17919 89310 1 218 . 1 1 23 23 ILE N N 23 121.190 121.190 122.660 -1.470 17919 89311 1 218 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.775 -0.118 17919 89312 1 218 . 1 1 23 23 ILE C C 23 179.040 179.040 177.657 1.383 17919 89313 1 218 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.822 -0.562 17919 89314 1 218 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.326 -1.976 17919 89315 1 218 . 1 1 23 23 ILE H H 23 8.560 8.560 8.553 0.007 17919 89316 1 218 . 1 1 24 24 GLU N N 24 120.830 120.830 121.360 -0.530 17919 89317 1 218 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.822 0.095 17919 89318 1 218 . 1 1 24 24 GLU C C 24 178.640 178.640 178.412 0.228 17919 89319 1 218 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.264 -0.044 17919 89320 1 218 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.350 -1.070 17919 89321 1 218 . 1 1 24 24 GLU H H 24 9.760 9.760 8.393 1.367 17919 89322 1 218 . 1 1 25 25 ASN N N 25 120.570 120.570 117.556 3.014 17919 89323 1 218 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.455 0.070 17919 89324 1 218 . 1 1 25 25 ASN C C 25 178.380 178.380 177.854 0.526 17919 89325 1 218 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.207 -0.147 17919 89326 1 218 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.631 -0.181 17919 89327 1 218 . 1 1 25 25 ASN H H 25 7.920 7.920 7.640 0.280 17919 89328 1 218 . 1 1 26 26 VAL N N 26 121.710 121.710 120.049 1.661 17919 89329 1 218 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.607 -0.210 17919 89330 1 218 . 1 1 26 26 VAL C C 26 177.950 177.950 178.003 -0.053 17919 89331 1 218 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.141 1.519 17919 89332 1 218 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.030 -0.190 17919 89333 1 218 . 1 1 26 26 VAL H H 26 8.070 8.070 7.488 0.582 17919 89334 1 218 . 1 1 27 27 LYS N N 27 118.860 118.860 120.266 -1.406 17919 89335 1 218 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.135 0.445 17919 89336 1 218 . 1 1 27 27 LYS C C 27 180.550 180.550 179.245 1.305 17919 89337 1 218 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.829 -0.579 17919 89338 1 218 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.209 1.521 17919 89339 1 218 . 1 1 27 27 LYS H H 27 8.560 8.560 8.478 0.082 17919 89340 1 218 . 1 1 28 28 ALA N N 28 123.440 123.440 121.286 2.154 17919 89341 1 218 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.063 0.097 17919 89342 1 218 . 1 1 28 28 ALA C C 28 180.300 180.300 179.226 1.074 17919 89343 1 218 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.967 0.403 17919 89344 1 218 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.413 -0.703 17919 89345 1 218 . 1 1 28 28 ALA H H 28 8.060 8.060 8.294 -0.234 17919 89346 1 218 . 1 1 29 29 LYS N N 29 119.940 119.940 119.510 0.430 17919 89347 1 218 . 1 1 29 29 LYS HA H 29 4.207 4.207 3.972 0.235 17919 89348 1 218 . 1 1 29 29 LYS C C 29 180.320 180.320 178.787 1.533 17919 89349 1 218 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.306 0.344 17919 89350 1 218 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.321 0.969 17919 89351 1 218 . 1 1 29 29 LYS H H 29 7.850 7.850 7.795 0.055 17919 89352 1 218 . 1 1 30 30 ILE N N 30 121.080 121.080 119.529 1.551 17919 89353 1 218 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.683 -0.176 17919 89354 1 218 . 1 1 30 30 ILE C C 30 178.310 178.310 177.340 0.970 17919 89355 1 218 . 1 1 30 30 ILE CA C 30 66.150 66.150 64.869 1.281 17919 89356 1 218 . 1 1 30 30 ILE CB C 30 36.800 36.800 38.049 -1.249 17919 89357 1 218 . 1 1 30 30 ILE H H 30 8.280 8.280 7.933 0.347 17919 89358 1 218 . 1 1 31 31 GLN N N 31 123.490 123.490 121.346 2.144 17919 89359 1 218 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.926 -0.097 17919 89360 1 218 . 1 1 31 31 GLN C C 31 178.890 178.890 178.204 0.686 17919 89361 1 218 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.286 0.714 17919 89362 1 218 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.513 -0.793 17919 89363 1 218 . 1 1 31 31 GLN H H 31 8.580 8.580 8.225 0.355 17919 89364 1 218 . 1 1 32 32 ASP N N 32 119.360 119.360 118.652 0.708 17919 89365 1 218 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.400 -0.046 17919 89366 1 218 . 1 1 32 32 ASP C C 32 177.250 177.250 177.678 -0.428 17919 89367 1 218 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.578 0.612 17919 89368 1 218 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.713 -0.133 17919 89369 1 218 . 1 1 32 32 ASP H H 32 8.010 8.010 8.086 -0.076 17919 89370 1 218 . 1 1 33 33 LYS N N 33 115.130 115.130 118.219 -3.089 17919 89371 1 218 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.412 -0.075 17919 89372 1 218 . 1 1 33 33 LYS C C 33 177.870 177.870 177.594 0.276 17919 89373 1 218 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.573 0.477 17919 89374 1 218 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.738 0.432 17919 89375 1 218 . 1 1 33 33 LYS H H 33 7.430 7.430 7.520 -0.090 17919 89376 1 218 . 1 1 34 34 GLU N N 34 113.870 113.870 115.255 -1.385 17919 89377 1 218 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.516 0.109 17919 89378 1 218 . 1 1 34 34 GLU C C 34 177.840 177.840 177.258 0.582 17919 89379 1 218 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.356 -1.186 17919 89380 1 218 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.636 1.024 17919 89381 1 218 . 1 1 34 34 GLU H H 34 8.740 8.740 8.205 0.535 17919 89382 1 218 . 1 1 35 35 GLY N N 35 108.650 108.650 109.534 -0.884 17919 89383 1 218 . 1 1 35 35 GLY C C 35 173.960 173.960 174.240 -0.280 17919 89384 1 218 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.737 0.343 17919 89385 1 218 . 1 1 35 35 GLY H H 35 8.530 8.530 8.314 0.216 17919 89386 1 218 . 1 1 36 36 ILE N N 36 119.880 119.880 122.130 -2.250 17919 89387 1 218 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.256 0.189 17919 89388 1 218 . 1 1 36 36 ILE C C 36 173.590 173.590 174.260 -0.670 17919 89389 1 218 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.040 -0.290 17919 89390 1 218 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.362 2.218 17919 89391 1 218 . 1 1 36 36 ILE H H 36 6.150 6.150 7.637 -1.487 17919 89392 1 218 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.930 -0.296 17919 89393 1 218 . 1 1 37 37 PRO C C 37 176.940 176.940 176.839 0.101 17919 89394 1 218 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.396 0.264 17919 89395 1 218 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.421 0.429 17919 89396 1 218 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.191 -0.074 17919 89397 1 218 . 1 1 38 38 PRO C C 38 178.320 178.320 178.037 0.283 17919 89398 1 218 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.614 0.646 17919 89399 1 218 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.637 1.253 17919 89400 1 218 . 1 1 39 39 ASP N N 39 113.380 113.380 115.992 -2.612 17919 89401 1 218 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.326 0.104 17919 89402 1 218 . 1 1 39 39 ASP C C 39 177.090 177.090 177.127 -0.037 17919 89403 1 218 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.705 -1.065 17919 89404 1 218 . 1 1 39 39 ASP CB C 39 39.540 39.540 39.099 0.441 17919 89405 1 218 . 1 1 39 39 ASP H H 39 8.550 8.550 8.893 -0.343 17919 89406 1 218 . 1 1 40 40 GLN N N 40 116.780 116.780 116.849 -0.069 17919 89407 1 218 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.457 0.007 17919 89408 1 218 . 1 1 40 40 GLN C C 40 175.380 175.380 175.984 -0.604 17919 89409 1 218 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.177 0.463 17919 89410 1 218 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.335 0.805 17919 89411 1 218 . 1 1 40 40 GLN H H 40 7.820 7.820 7.991 -0.171 17919 89412 1 218 . 1 1 41 41 GLN N N 41 117.720 117.720 119.757 -2.037 17919 89413 1 218 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.353 -0.109 17919 89414 1 218 . 1 1 41 41 GLN C C 41 176.300 176.300 175.640 0.660 17919 89415 1 218 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.114 0.356 17919 89416 1 218 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.431 2.219 17919 89417 1 218 . 1 1 41 41 GLN H H 41 7.480 7.480 7.492 -0.012 17919 89418 1 218 . 1 1 42 42 ARG N N 42 122.680 122.680 126.258 -3.578 17919 89419 1 218 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.591 -0.091 17919 89420 1 218 . 1 1 42 42 ARG C C 42 174.050 174.050 174.268 -0.218 17919 89421 1 218 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.735 0.315 17919 89422 1 218 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.309 -0.559 17919 89423 1 218 . 1 1 42 42 ARG H H 42 8.530 8.530 8.919 -0.389 17919 89424 1 218 . 1 1 43 43 LEU N N 43 124.040 124.040 127.632 -3.592 17919 89425 1 218 . 1 1 43 43 LEU C C 43 175.290 175.290 175.653 -0.363 17919 89426 1 218 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.919 -0.939 17919 89427 1 218 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.447 2.343 17919 89428 1 218 . 1 1 43 43 LEU H H 43 8.820 8.820 8.858 -0.038 17919 89429 1 218 . 1 1 44 44 ILE N N 44 121.920 121.920 122.865 -0.945 17919 89430 1 218 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.074 -0.082 17919 89431 1 218 . 1 1 44 44 ILE C C 44 176.060 176.060 174.377 1.683 17919 89432 1 218 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.144 -1.164 17919 89433 1 218 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.097 0.323 17919 89434 1 218 . 1 1 44 44 ILE H H 44 9.030 9.030 8.828 0.202 17919 89435 1 218 . 1 1 45 45 PHE N N 45 125.390 125.390 127.868 -2.478 17919 89436 1 218 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.027 0.018 17919 89437 1 218 . 1 1 45 45 PHE C C 45 174.470 174.470 174.461 0.009 17919 89438 1 218 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.778 0.242 17919 89439 1 218 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.923 0.837 17919 89440 1 218 . 1 1 45 45 PHE H H 45 8.830 8.830 8.826 0.004 17919 89441 1 218 . 1 1 46 46 ALA N N 46 132.200 132.200 130.039 2.161 17919 89442 1 218 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.730 -0.040 17919 89443 1 218 . 1 1 46 46 ALA C C 46 177.290 177.290 177.592 -0.302 17919 89444 1 218 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.638 -0.098 17919 89445 1 218 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.527 0.043 17919 89446 1 218 . 1 1 46 46 ALA H H 46 8.810 8.810 8.809 0.001 17919 89447 1 218 . 1 1 47 47 GLY N N 47 102.340 102.340 102.904 -0.564 17919 89448 1 218 . 1 1 47 47 GLY C C 47 173.810 173.810 174.307 -0.497 17919 89449 1 218 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.760 0.590 17919 89450 1 218 . 1 1 47 47 GLY H H 47 8.130 8.130 8.384 -0.254 17919 89451 1 218 . 1 1 48 48 LYS N N 48 121.570 121.570 121.818 -0.248 17919 89452 1 218 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.567 0.055 17919 89453 1 218 . 1 1 48 48 LYS C C 48 174.700 174.700 175.353 -0.653 17919 89454 1 218 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.004 -0.454 17919 89455 1 218 . 1 1 48 48 LYS CB C 48 34.530 34.530 33.910 0.620 17919 89456 1 218 . 1 1 48 48 LYS H H 48 7.980 7.980 7.963 0.017 17919 89457 1 218 . 1 1 49 49 GLN N N 49 122.410 122.410 124.528 -2.118 17919 89458 1 218 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.587 -0.027 17919 89459 1 218 . 1 1 49 49 GLN C C 49 175.670 175.670 175.654 0.016 17919 89460 1 218 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.869 -0.129 17919 89461 1 218 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.407 -0.407 17919 89462 1 218 . 1 1 49 49 GLN H H 49 8.600 8.600 8.551 0.049 17919 89463 1 218 . 1 1 50 50 LEU N N 50 125.520 125.520 127.652 -2.132 17919 89464 1 218 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.270 -0.180 17919 89465 1 218 . 1 1 50 50 LEU C C 50 176.660 176.660 176.121 0.539 17919 89466 1 218 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.051 0.189 17919 89467 1 218 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.454 -0.884 17919 89468 1 218 . 1 1 50 50 LEU H H 50 8.530 8.530 8.374 0.156 17919 89469 1 218 . 1 1 51 51 GLU N N 51 122.940 122.940 122.898 0.042 17919 89470 1 218 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.587 -0.099 17919 89471 1 218 . 1 1 51 51 GLU C C 51 175.870 175.870 176.869 -0.999 17919 89472 1 218 . 1 1 51 51 GLU CA C 51 55.960 55.960 54.983 0.976 17919 89473 1 218 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.206 -0.636 17919 89474 1 218 . 1 1 51 51 GLU H H 51 8.400 8.400 8.906 -0.506 17919 89475 1 218 . 1 1 52 52 ASP N N 52 120.030 120.030 128.014 -7.984 17919 89476 1 218 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.340 0.019 17919 89477 1 218 . 1 1 52 52 ASP C C 52 177.330 177.330 177.633 -0.303 17919 89478 1 218 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.716 -0.756 17919 89479 1 218 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.616 0.234 17919 89480 1 218 . 1 1 52 52 ASP H H 52 8.160 8.160 8.855 -0.695 17919 89481 1 218 . 1 1 53 53 GLY N N 53 106.660 106.660 105.556 1.104 17919 89482 1 218 . 1 1 53 53 GLY C C 53 174.870 174.870 174.320 0.550 17919 89483 1 218 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.973 0.197 17919 89484 1 218 . 1 1 53 53 GLY H H 53 9.390 9.390 8.534 0.856 17919 89485 1 218 . 1 1 54 54 ARG N N 54 119.050 119.050 120.805 -1.755 17919 89486 1 218 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.590 0.105 17919 89487 1 218 . 1 1 54 54 ARG C C 54 175.350 175.350 175.578 -0.228 17919 89488 1 218 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.467 -0.077 17919 89489 1 218 . 1 1 54 54 ARG CB C 54 32.650 32.650 31.670 0.980 17919 89490 1 218 . 1 1 54 54 ARG H H 54 7.460 7.460 7.662 -0.202 17919 89491 1 218 . 1 1 55 55 THR N N 55 108.400 108.400 113.752 -5.352 17919 89492 1 218 . 1 1 55 55 THR HA H 55 5.240 5.240 4.833 0.407 17919 89493 1 218 . 1 1 55 55 THR C C 55 176.560 176.560 176.294 0.266 17919 89494 1 218 . 1 1 55 55 THR CA C 55 59.690 59.690 60.748 -1.058 17919 89495 1 218 . 1 1 55 55 THR CB C 55 72.260 72.260 70.111 2.149 17919 89496 1 218 . 1 1 55 55 THR H H 55 8.730 8.730 8.903 -0.173 17919 89497 1 218 . 1 1 56 56 LEU N N 56 117.920 117.920 122.721 -4.801 17919 89498 1 218 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.941 0.119 17919 89499 1 218 . 1 1 56 56 LEU C C 56 180.810 180.810 178.978 1.832 17919 89500 1 218 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.983 -0.273 17919 89501 1 218 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.280 -0.910 17919 89502 1 218 . 1 1 56 56 LEU H H 56 8.140 8.140 8.782 -0.642 17919 89503 1 218 . 1 1 57 57 SER N N 57 113.330 113.330 115.016 -1.686 17919 89504 1 218 . 1 1 57 57 SER HA H 57 4.370 4.370 4.162 0.208 17919 89505 1 218 . 1 1 57 57 SER C C 57 178.310 178.310 176.825 1.485 17919 89506 1 218 . 1 1 57 57 SER CA C 57 61.080 61.080 62.332 -1.252 17919 89507 1 218 . 1 1 57 57 SER CB C 57 62.530 62.530 62.683 -0.153 17919 89508 1 218 . 1 1 57 57 SER H H 57 8.470 8.470 8.136 0.334 17919 89509 1 218 . 1 1 58 58 ASP N N 58 124.190 124.190 121.395 2.795 17919 89510 1 218 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.325 -0.029 17919 89511 1 218 . 1 1 58 58 ASP C C 58 177.400 177.400 177.076 0.324 17919 89512 1 218 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.644 0.536 17919 89513 1 218 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.382 -0.282 17919 89514 1 218 . 1 1 58 58 ASP H H 58 7.930 7.930 7.764 0.166 17919 89515 1 218 . 1 1 59 59 TYR N N 59 115.510 115.510 115.684 -0.174 17919 89516 1 218 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.556 0.114 17919 89517 1 218 . 1 1 59 59 TYR C C 59 174.700 174.700 174.845 -0.145 17919 89518 1 218 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.445 0.805 17919 89519 1 218 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.871 1.199 17919 89520 1 218 . 1 1 59 59 TYR H H 59 7.250 7.250 7.311 -0.061 17919 89521 1 218 . 1 1 60 60 ASN N N 60 115.900 115.900 116.058 -0.158 17919 89522 1 218 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.362 -0.007 17919 89523 1 218 . 1 1 60 60 ASN C C 60 174.340 174.340 174.303 0.037 17919 89524 1 218 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.184 -0.063 17919 89525 1 218 . 1 1 60 60 ASN CB C 60 37.410 37.410 36.273 1.137 17919 89526 1 218 . 1 1 60 60 ASN H H 60 8.150 8.150 8.342 -0.192 17919 89527 1 218 . 1 1 61 61 ILE N N 61 118.600 118.600 119.857 -1.257 17919 89528 1 218 . 1 1 61 61 ILE HA H 61 3.393 3.393 4.050 -0.657 17919 89529 1 218 . 1 1 61 61 ILE C C 61 174.610 174.610 174.993 -0.383 17919 89530 1 218 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.124 1.296 17919 89531 1 218 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.858 -1.118 17919 89532 1 218 . 1 1 61 61 ILE H H 61 7.250 7.250 7.728 -0.478 17919 89533 1 218 . 1 1 62 62 GLN N N 62 124.740 124.740 126.083 -1.343 17919 89534 1 218 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.864 -0.358 17919 89535 1 218 . 1 1 62 62 GLN C C 62 175.970 175.970 175.461 0.509 17919 89536 1 218 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.341 0.319 17919 89537 1 218 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.922 -0.272 17919 89538 1 218 . 1 1 62 62 GLN H H 62 7.610 7.610 7.987 -0.377 17919 89539 1 218 . 1 1 63 63 LYS N N 63 120.300 120.300 121.977 -1.677 17919 89540 1 218 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.067 -0.066 17919 89541 1 218 . 1 1 63 63 LYS C C 63 175.810 175.810 176.655 -0.845 17919 89542 1 218 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.895 -0.105 17919 89543 1 218 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.948 0.702 17919 89544 1 218 . 1 1 63 63 LYS H H 63 8.490 8.490 8.545 -0.055 17919 89545 1 218 . 1 1 64 64 GLU N N 64 113.950 113.950 117.877 -3.927 17919 89546 1 218 . 1 1 64 64 GLU HA H 64 3.465 3.465 4.119 -0.654 17919 89547 1 218 . 1 1 64 64 GLU C C 64 175.250 175.250 176.216 -0.966 17919 89548 1 218 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.531 0.359 17919 89549 1 218 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.936 -3.036 17919 89550 1 218 . 1 1 64 64 GLU H H 64 9.280 9.280 9.053 0.227 17919 89551 1 218 . 1 1 65 65 SER N N 65 114.730 114.730 117.093 -2.363 17919 89552 1 218 . 1 1 65 65 SER HA H 65 4.640 4.640 4.543 0.097 17919 89553 1 218 . 1 1 65 65 SER C C 65 172.160 172.160 173.697 -1.537 17919 89554 1 218 . 1 1 65 65 SER CA C 65 60.890 60.890 61.271 -0.381 17919 89555 1 218 . 1 1 65 65 SER CB C 65 64.910 64.910 63.894 1.016 17919 89556 1 218 . 1 1 65 65 SER H H 65 7.670 7.670 7.671 -0.001 17919 89557 1 218 . 1 1 66 66 THR N N 66 117.110 117.110 120.515 -3.405 17919 89558 1 218 . 1 1 66 66 THR HA H 66 5.270 5.270 5.114 0.156 17919 89559 1 218 . 1 1 66 66 THR C C 66 173.950 173.950 174.052 -0.102 17919 89560 1 218 . 1 1 66 66 THR CA C 66 62.340 62.340 61.692 0.648 17919 89561 1 218 . 1 1 66 66 THR CB C 66 70.080 70.080 70.136 -0.056 17919 89562 1 218 . 1 1 66 66 THR H H 66 8.730 8.730 8.288 0.442 17919 89563 1 218 . 1 1 67 67 LEU N N 67 127.110 127.110 126.852 0.258 17919 89564 1 218 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.881 0.179 17919 89565 1 218 . 1 1 67 67 LEU C C 67 175.770 175.770 174.998 0.772 17919 89566 1 218 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.767 0.133 17919 89567 1 218 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.783 -0.523 17919 89568 1 218 . 1 1 67 67 LEU H H 67 9.410 9.410 8.882 0.528 17919 89569 1 218 . 1 1 68 68 HIS N N 68 118.380 118.380 120.996 -2.616 17919 89570 1 218 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.274 -0.034 17919 89571 1 218 . 1 1 68 68 HIS C C 68 173.150 173.150 173.510 -0.360 17919 89572 1 218 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.356 0.644 17919 89573 1 218 . 1 1 68 68 HIS CB C 68 30.530 30.530 33.083 -2.553 17919 89574 1 218 . 1 1 68 68 HIS H H 68 9.230 9.230 8.868 0.362 17919 89575 1 218 . 1 1 69 69 LEU N N 69 124.460 124.460 129.041 -4.581 17919 89576 1 218 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.058 0.132 17919 89577 1 218 . 1 1 69 69 LEU C C 69 175.270 175.270 174.183 1.087 17919 89578 1 218 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.275 0.615 17919 89579 1 218 . 1 1 69 69 LEU CB C 69 44.380 44.380 43.982 0.398 17919 89580 1 218 . 1 1 69 69 LEU H H 69 8.340 8.340 8.432 -0.092 17919 89581 1 218 . 1 1 70 70 VAL N N 70 126.940 126.940 126.457 0.483 17919 89582 1 218 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.359 -0.009 17919 89583 1 218 . 1 1 70 70 VAL C C 70 174.000 174.000 174.549 -0.549 17919 89584 1 218 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.372 0.428 17919 89585 1 218 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.012 -0.102 17919 89586 1 218 . 1 1 70 70 VAL H H 70 9.200 9.200 9.000 0.200 17919 89587 1 218 . 1 1 71 71 LEU N N 71 123.130 123.130 124.257 -1.127 17919 89588 1 218 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.914 0.146 17919 89589 1 218 . 1 1 71 71 LEU C C 71 177.830 177.830 177.385 0.445 17919 89590 1 218 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.133 0.807 17919 89591 1 218 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.739 0.111 17919 89592 1 218 . 1 1 71 71 LEU H H 71 8.120 8.120 8.457 -0.337 17919 89593 1 218 . 1 1 72 72 ARG N N 72 123.490 123.490 122.108 1.382 17919 89594 1 218 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.437 -0.136 17919 89595 1 218 . 1 1 72 72 ARG C C 72 175.350 175.350 176.039 -0.689 17919 89596 1 218 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.947 -0.337 17919 89597 1 218 . 1 1 72 72 ARG CB C 72 31.350 31.350 31.184 0.166 17919 89598 1 218 . 1 1 72 72 ARG H H 72 8.580 8.580 8.058 0.522 17919 89599 1 219 . 1 1 2 2 GLN N N 2 123.220 123.220 120.311 2.909 17919 89600 1 219 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.084 0.165 17919 89601 1 219 . 1 1 2 2 GLN C C 2 175.920 175.920 176.162 -0.242 17919 89602 1 219 . 1 1 2 2 GLN CA C 2 55.080 55.080 55.836 -0.756 17919 89603 1 219 . 1 1 2 2 GLN CB C 2 30.760 30.760 28.776 1.984 17919 89604 1 219 . 1 1 2 2 GLN H H 2 8.900 8.900 8.213 0.687 17919 89605 1 219 . 1 1 3 3 ILE N N 3 115.340 115.340 116.236 -0.896 17919 89606 1 219 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.665 -0.452 17919 89607 1 219 . 1 1 3 3 ILE C C 3 172.450 172.450 173.967 -1.517 17919 89608 1 219 . 1 1 3 3 ILE CA C 3 59.570 59.570 58.930 0.640 17919 89609 1 219 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.756 0.454 17919 89610 1 219 . 1 1 3 3 ILE H H 3 8.320 8.320 8.171 0.149 17919 89611 1 219 . 1 1 4 4 PHE N N 4 118.110 118.110 118.942 -0.832 17919 89612 1 219 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.272 0.358 17919 89613 1 219 . 1 1 4 4 PHE C C 4 175.320 175.320 174.962 0.358 17919 89614 1 219 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.663 -0.453 17919 89615 1 219 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.724 -0.244 17919 89616 1 219 . 1 1 4 4 PHE H H 4 8.610 8.610 8.222 0.388 17919 89617 1 219 . 1 1 5 5 VAL N N 5 121.000 121.000 122.736 -1.736 17919 89618 1 219 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.977 -0.252 17919 89619 1 219 . 1 1 5 5 VAL C C 5 174.870 174.870 175.261 -0.391 17919 89620 1 219 . 1 1 5 5 VAL CA C 5 60.620 60.620 60.875 -0.255 17919 89621 1 219 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.911 -0.681 17919 89622 1 219 . 1 1 5 5 VAL H H 5 9.300 9.300 9.283 0.017 17919 89623 1 219 . 1 1 6 6 LYS N N 6 127.520 127.520 128.189 -0.669 17919 89624 1 219 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.301 0.066 17919 89625 1 219 . 1 1 6 6 LYS C C 6 177.140 177.140 177.027 0.113 17919 89626 1 219 . 1 1 6 6 LYS CA C 6 54.520 54.520 53.722 0.798 17919 89627 1 219 . 1 1 6 6 LYS CB C 6 35.050 35.050 33.487 1.563 17919 89628 1 219 . 1 1 6 6 LYS H H 6 8.820 8.820 9.085 -0.265 17919 89629 1 219 . 1 1 7 7 THR N N 7 115.400 115.400 116.817 -1.417 17919 89630 1 219 . 1 1 7 7 THR HA H 7 4.970 4.970 4.617 0.353 17919 89631 1 219 . 1 1 7 7 THR C C 7 176.910 176.910 176.711 0.199 17919 89632 1 219 . 1 1 7 7 THR CA C 7 60.470 60.470 60.220 0.250 17919 89633 1 219 . 1 1 7 7 THR CB C 7 70.630 70.630 70.210 0.420 17919 89634 1 219 . 1 1 7 7 THR H H 7 8.730 8.730 8.473 0.257 17919 89635 1 219 . 1 1 8 8 LEU N N 8 121.330 121.330 120.836 0.494 17919 89636 1 219 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.172 0.138 17919 89637 1 219 . 1 1 8 8 LEU C C 8 178.800 178.800 177.761 1.039 17919 89638 1 219 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.659 -0.079 17919 89639 1 219 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.474 0.496 17919 89640 1 219 . 1 1 8 8 LEU H H 8 9.100 9.100 8.888 0.212 17919 89641 1 219 . 1 1 9 9 THR N N 9 105.590 105.590 106.059 -0.469 17919 89642 1 219 . 1 1 9 9 THR HA H 9 4.428 4.428 4.289 0.139 17919 89643 1 219 . 1 1 9 9 THR C C 9 175.520 175.520 175.818 -0.298 17919 89644 1 219 . 1 1 9 9 THR CA C 9 61.400 61.400 61.962 -0.562 17919 89645 1 219 . 1 1 9 9 THR CB C 9 69.140 69.140 69.046 0.094 17919 89646 1 219 . 1 1 9 9 THR H H 9 7.630 7.630 7.627 0.003 17919 89647 1 219 . 1 1 10 10 GLY N N 10 108.890 108.890 111.587 -2.697 17919 89648 1 219 . 1 1 10 10 GLY C C 10 174.070 174.070 173.910 0.160 17919 89649 1 219 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.333 0.127 17919 89650 1 219 . 1 1 10 10 GLY H H 10 7.810 7.810 7.761 0.049 17919 89651 1 219 . 1 1 11 11 LYS N N 11 121.600 121.600 120.852 0.748 17919 89652 1 219 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.312 0.049 17919 89653 1 219 . 1 1 11 11 LYS C C 11 175.940 175.940 175.931 0.009 17919 89654 1 219 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.308 -0.028 17919 89655 1 219 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.420 -0.220 17919 89656 1 219 . 1 1 11 11 LYS H H 11 7.280 7.280 7.582 -0.302 17919 89657 1 219 . 1 1 12 12 THR N N 12 120.440 120.440 122.173 -1.733 17919 89658 1 219 . 1 1 12 12 THR HA H 12 5.046 5.046 4.686 0.360 17919 89659 1 219 . 1 1 12 12 THR C C 12 174.320 174.320 174.202 0.118 17919 89660 1 219 . 1 1 12 12 THR CA C 12 62.390 62.390 62.806 -0.416 17919 89661 1 219 . 1 1 12 12 THR CB C 12 69.910 69.910 69.197 0.713 17919 89662 1 219 . 1 1 12 12 THR H H 12 8.650 8.650 8.284 0.366 17919 89663 1 219 . 1 1 13 13 ILE N N 13 127.110 127.110 129.683 -2.573 17919 89664 1 219 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.352 0.192 17919 89665 1 219 . 1 1 13 13 ILE C C 13 175.220 175.220 175.121 0.099 17919 89666 1 219 . 1 1 13 13 ILE CA C 13 59.980 59.980 58.807 1.173 17919 89667 1 219 . 1 1 13 13 ILE CB C 13 40.950 40.950 38.394 2.556 17919 89668 1 219 . 1 1 13 13 ILE H H 13 9.450 9.450 9.182 0.268 17919 89669 1 219 . 1 1 14 14 THR N N 14 121.520 121.520 124.054 -2.534 17919 89670 1 219 . 1 1 14 14 THR HA H 14 4.964 4.964 4.766 0.198 17919 89671 1 219 . 1 1 14 14 THR C C 14 173.790 173.790 173.383 0.407 17919 89672 1 219 . 1 1 14 14 THR CA C 14 61.940 61.940 62.118 -0.178 17919 89673 1 219 . 1 1 14 14 THR CB C 14 69.650 69.650 69.566 0.084 17919 89674 1 219 . 1 1 14 14 THR H H 14 8.710 8.710 8.721 -0.011 17919 89675 1 219 . 1 1 15 15 LEU N N 15 124.800 124.800 127.175 -2.375 17919 89676 1 219 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.783 -0.003 17919 89677 1 219 . 1 1 15 15 LEU C C 15 174.670 174.670 175.336 -0.666 17919 89678 1 219 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.744 -0.914 17919 89679 1 219 . 1 1 15 15 LEU CB C 15 47.070 47.070 43.916 3.154 17919 89680 1 219 . 1 1 15 15 LEU H H 15 8.710 8.710 8.067 0.643 17919 89681 1 219 . 1 1 16 16 GLU N N 16 122.160 122.160 123.010 -0.850 17919 89682 1 219 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.491 -0.574 17919 89683 1 219 . 1 1 16 16 GLU C C 16 175.860 175.860 175.844 0.016 17919 89684 1 219 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.563 -0.744 17919 89685 1 219 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.904 -1.454 17919 89686 1 219 . 1 1 16 16 GLU H H 16 8.140 8.140 8.707 -0.567 17919 89687 1 219 . 1 1 17 17 VAL N N 17 117.210 117.210 119.634 -2.424 17919 89688 1 219 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.793 -0.079 17919 89689 1 219 . 1 1 17 17 VAL C C 17 174.160 174.160 173.828 0.332 17919 89690 1 219 . 1 1 17 17 VAL CA C 17 58.430 58.430 60.089 -1.659 17919 89691 1 219 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.214 1.186 17919 89692 1 219 . 1 1 17 17 VAL H H 17 8.900 8.900 8.434 0.466 17919 89693 1 219 . 1 1 18 18 GLU N N 18 118.990 118.990 121.926 -2.936 17919 89694 1 219 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.740 0.339 17919 89695 1 219 . 1 1 18 18 GLU C C 18 176.160 176.160 175.937 0.223 17919 89696 1 219 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.775 -1.055 17919 89697 1 219 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.387 -0.077 17919 89698 1 219 . 1 1 18 18 GLU H H 18 8.640 8.640 8.828 -0.188 17919 89699 1 219 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.386 -0.245 17919 89700 1 219 . 1 1 19 19 PRO C C 19 175.310 175.310 176.826 -1.516 17919 89701 1 219 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.018 0.452 17919 89702 1 219 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.875 0.075 17919 89703 1 219 . 1 1 20 20 SER N N 20 103.400 103.400 110.810 -7.410 17919 89704 1 219 . 1 1 20 20 SER HA H 20 4.370 4.370 4.416 -0.046 17919 89705 1 219 . 1 1 20 20 SER C C 20 174.660 174.660 174.362 0.298 17919 89706 1 219 . 1 1 20 20 SER CA C 20 57.400 57.400 58.904 -1.504 17919 89707 1 219 . 1 1 20 20 SER CB C 20 63.370 63.370 63.565 -0.195 17919 89708 1 219 . 1 1 20 20 SER H H 20 7.040 7.040 8.209 -1.169 17919 89709 1 219 . 1 1 21 21 ASP N N 21 123.480 123.480 124.755 -1.275 17919 89710 1 219 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.738 -0.043 17919 89711 1 219 . 1 1 21 21 ASP C C 21 176.360 176.360 175.918 0.442 17919 89712 1 219 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.262 0.438 17919 89713 1 219 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.462 -0.662 17919 89714 1 219 . 1 1 21 21 ASP H H 21 8.030 8.030 7.555 0.475 17919 89715 1 219 . 1 1 22 22 THR N N 22 108.800 108.800 114.420 -5.620 17919 89716 1 219 . 1 1 22 22 THR HA H 22 4.920 4.920 4.727 0.193 17919 89717 1 219 . 1 1 22 22 THR C C 22 176.750 176.750 176.270 0.480 17919 89718 1 219 . 1 1 22 22 THR CA C 22 59.690 59.690 61.932 -2.242 17919 89719 1 219 . 1 1 22 22 THR CB C 22 71.200 71.200 69.926 1.274 17919 89720 1 219 . 1 1 22 22 THR H H 22 7.900 7.900 8.257 -0.357 17919 89721 1 219 . 1 1 23 23 ILE N N 23 121.190 121.190 122.353 -1.163 17919 89722 1 219 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.773 -0.116 17919 89723 1 219 . 1 1 23 23 ILE C C 23 179.040 179.040 177.720 1.320 17919 89724 1 219 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.140 -0.880 17919 89725 1 219 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.591 -2.241 17919 89726 1 219 . 1 1 23 23 ILE H H 23 8.560 8.560 8.580 -0.020 17919 89727 1 219 . 1 1 24 24 GLU N N 24 120.830 120.830 120.730 0.100 17919 89728 1 219 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.913 0.004 17919 89729 1 219 . 1 1 24 24 GLU C C 24 178.640 178.640 178.742 -0.102 17919 89730 1 219 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.771 0.449 17919 89731 1 219 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.516 -1.236 17919 89732 1 219 . 1 1 24 24 GLU H H 24 9.760 9.760 7.962 1.798 17919 89733 1 219 . 1 1 25 25 ASN N N 25 120.570 120.570 118.263 2.307 17919 89734 1 219 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.478 0.047 17919 89735 1 219 . 1 1 25 25 ASN C C 25 178.380 178.380 177.902 0.478 17919 89736 1 219 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.163 -0.102 17919 89737 1 219 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.391 0.059 17919 89738 1 219 . 1 1 25 25 ASN H H 25 7.920 7.920 7.993 -0.073 17919 89739 1 219 . 1 1 26 26 VAL N N 26 121.710 121.710 119.861 1.849 17919 89740 1 219 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.667 -0.270 17919 89741 1 219 . 1 1 26 26 VAL C C 26 177.950 177.950 177.807 0.143 17919 89742 1 219 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.245 1.415 17919 89743 1 219 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.431 -0.591 17919 89744 1 219 . 1 1 26 26 VAL H H 26 8.070 8.070 7.674 0.396 17919 89745 1 219 . 1 1 27 27 LYS N N 27 118.860 118.860 119.565 -0.705 17919 89746 1 219 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.274 0.306 17919 89747 1 219 . 1 1 27 27 LYS C C 27 180.550 180.550 179.149 1.401 17919 89748 1 219 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.182 0.068 17919 89749 1 219 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.265 1.465 17919 89750 1 219 . 1 1 27 27 LYS H H 27 8.560 8.560 8.175 0.385 17919 89751 1 219 . 1 1 28 28 ALA N N 28 123.440 123.440 122.261 1.179 17919 89752 1 219 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.149 0.011 17919 89753 1 219 . 1 1 28 28 ALA C C 28 180.300 180.300 178.720 1.580 17919 89754 1 219 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.205 0.165 17919 89755 1 219 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.713 -1.003 17919 89756 1 219 . 1 1 28 28 ALA H H 28 8.060 8.060 8.359 -0.299 17919 89757 1 219 . 1 1 29 29 LYS N N 29 119.940 119.940 117.944 1.996 17919 89758 1 219 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.156 0.051 17919 89759 1 219 . 1 1 29 29 LYS C C 29 180.320 180.320 178.909 1.411 17919 89760 1 219 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.018 0.632 17919 89761 1 219 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.281 1.009 17919 89762 1 219 . 1 1 29 29 LYS H H 29 7.850 7.850 7.372 0.478 17919 89763 1 219 . 1 1 30 30 ILE N N 30 121.080 121.080 120.073 1.007 17919 89764 1 219 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.830 -0.323 17919 89765 1 219 . 1 1 30 30 ILE C C 30 178.310 178.310 177.465 0.845 17919 89766 1 219 . 1 1 30 30 ILE CA C 30 66.150 66.150 63.038 3.112 17919 89767 1 219 . 1 1 30 30 ILE CB C 30 36.800 36.800 36.966 -0.166 17919 89768 1 219 . 1 1 30 30 ILE H H 30 8.280 8.280 7.586 0.694 17919 89769 1 219 . 1 1 31 31 GLN N N 31 123.490 123.490 121.101 2.389 17919 89770 1 219 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.009 -0.180 17919 89771 1 219 . 1 1 31 31 GLN C C 31 178.890 178.890 178.386 0.504 17919 89772 1 219 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.414 0.586 17919 89773 1 219 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.460 -0.740 17919 89774 1 219 . 1 1 31 31 GLN H H 31 8.580 8.580 7.889 0.691 17919 89775 1 219 . 1 1 32 32 ASP N N 32 119.360 119.360 119.850 -0.490 17919 89776 1 219 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.392 -0.038 17919 89777 1 219 . 1 1 32 32 ASP C C 32 177.250 177.250 177.923 -0.673 17919 89778 1 219 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.914 0.276 17919 89779 1 219 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.821 -0.241 17919 89780 1 219 . 1 1 32 32 ASP H H 32 8.010 8.010 8.052 -0.042 17919 89781 1 219 . 1 1 33 33 LYS N N 33 115.130 115.130 116.018 -0.888 17919 89782 1 219 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.360 -0.023 17919 89783 1 219 . 1 1 33 33 LYS C C 33 177.870 177.870 177.412 0.458 17919 89784 1 219 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.051 -0.001 17919 89785 1 219 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.775 0.395 17919 89786 1 219 . 1 1 33 33 LYS H H 33 7.430 7.430 7.408 0.022 17919 89787 1 219 . 1 1 34 34 GLU N N 34 113.870 113.870 114.146 -0.276 17919 89788 1 219 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.493 0.132 17919 89789 1 219 . 1 1 34 34 GLU C C 34 177.840 177.840 176.951 0.889 17919 89790 1 219 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.525 -0.355 17919 89791 1 219 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.550 1.110 17919 89792 1 219 . 1 1 34 34 GLU H H 34 8.740 8.740 8.019 0.721 17919 89793 1 219 . 1 1 35 35 GLY N N 35 108.650 108.650 109.348 -0.698 17919 89794 1 219 . 1 1 35 35 GLY C C 35 173.960 173.960 174.487 -0.527 17919 89795 1 219 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.963 0.117 17919 89796 1 219 . 1 1 35 35 GLY H H 35 8.530 8.530 8.132 0.398 17919 89797 1 219 . 1 1 36 36 ILE N N 36 119.880 119.880 120.898 -1.018 17919 89798 1 219 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.336 0.109 17919 89799 1 219 . 1 1 36 36 ILE C C 36 173.590 173.590 173.964 -0.374 17919 89800 1 219 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.826 -0.076 17919 89801 1 219 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.340 2.240 17919 89802 1 219 . 1 1 36 36 ILE H H 36 6.150 6.150 7.639 -1.489 17919 89803 1 219 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.676 -0.042 17919 89804 1 219 . 1 1 37 37 PRO C C 37 176.940 176.940 176.226 0.714 17919 89805 1 219 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.857 -0.197 17919 89806 1 219 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.516 0.334 17919 89807 1 219 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.130 -0.013 17919 89808 1 219 . 1 1 38 38 PRO C C 38 178.320 178.320 178.430 -0.110 17919 89809 1 219 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.802 0.458 17919 89810 1 219 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.872 1.018 17919 89811 1 219 . 1 1 39 39 ASP N N 39 113.380 113.380 114.348 -0.968 17919 89812 1 219 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.439 -0.009 17919 89813 1 219 . 1 1 39 39 ASP C C 39 177.090 177.090 177.255 -0.165 17919 89814 1 219 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.363 -0.723 17919 89815 1 219 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.321 -0.781 17919 89816 1 219 . 1 1 39 39 ASP H H 39 8.550 8.550 8.701 -0.151 17919 89817 1 219 . 1 1 40 40 GLN N N 40 116.780 116.780 116.631 0.149 17919 89818 1 219 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.685 -0.221 17919 89819 1 219 . 1 1 40 40 GLN C C 40 175.380 175.380 175.680 -0.300 17919 89820 1 219 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.263 0.377 17919 89821 1 219 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.841 0.299 17919 89822 1 219 . 1 1 40 40 GLN H H 40 7.820 7.820 8.016 -0.196 17919 89823 1 219 . 1 1 41 41 GLN N N 41 117.720 117.720 119.743 -2.023 17919 89824 1 219 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.463 -0.219 17919 89825 1 219 . 1 1 41 41 GLN C C 41 176.300 176.300 175.512 0.788 17919 89826 1 219 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.696 -0.226 17919 89827 1 219 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.575 2.075 17919 89828 1 219 . 1 1 41 41 GLN H H 41 7.480 7.480 7.158 0.322 17919 89829 1 219 . 1 1 42 42 ARG N N 42 122.680 122.680 122.022 0.658 17919 89830 1 219 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.643 -0.143 17919 89831 1 219 . 1 1 42 42 ARG C C 42 174.050 174.050 174.555 -0.505 17919 89832 1 219 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.819 0.231 17919 89833 1 219 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.993 -2.243 17919 89834 1 219 . 1 1 42 42 ARG H H 42 8.530 8.530 9.044 -0.514 17919 89835 1 219 . 1 1 43 43 LEU N N 43 124.040 124.040 123.386 0.654 17919 89836 1 219 . 1 1 43 43 LEU C C 43 175.290 175.290 175.774 -0.484 17919 89837 1 219 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.691 -0.711 17919 89838 1 219 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.689 1.101 17919 89839 1 219 . 1 1 43 43 LEU H H 43 8.820 8.820 8.726 0.094 17919 89840 1 219 . 1 1 44 44 ILE N N 44 121.920 121.920 117.400 4.520 17919 89841 1 219 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.055 -0.063 17919 89842 1 219 . 1 1 44 44 ILE C C 44 176.060 176.060 173.829 2.231 17919 89843 1 219 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.285 -1.305 17919 89844 1 219 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.016 0.404 17919 89845 1 219 . 1 1 44 44 ILE H H 44 9.030 9.030 8.805 0.225 17919 89846 1 219 . 1 1 45 45 PHE N N 45 125.390 125.390 128.438 -3.048 17919 89847 1 219 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.237 -0.192 17919 89848 1 219 . 1 1 45 45 PHE C C 45 174.470 174.470 174.759 -0.289 17919 89849 1 219 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.754 0.266 17919 89850 1 219 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.324 0.436 17919 89851 1 219 . 1 1 45 45 PHE H H 45 8.830 8.830 8.486 0.344 17919 89852 1 219 . 1 1 46 46 ALA N N 46 132.200 132.200 128.593 3.607 17919 89853 1 219 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.410 0.280 17919 89854 1 219 . 1 1 46 46 ALA C C 46 177.290 177.290 177.444 -0.154 17919 89855 1 219 . 1 1 46 46 ALA CA C 46 52.540 52.540 53.120 -0.580 17919 89856 1 219 . 1 1 46 46 ALA CB C 46 16.570 16.570 17.059 -0.489 17919 89857 1 219 . 1 1 46 46 ALA H H 46 8.810 8.810 8.286 0.524 17919 89858 1 219 . 1 1 47 47 GLY N N 47 102.340 102.340 102.355 -0.015 17919 89859 1 219 . 1 1 47 47 GLY C C 47 173.810 173.810 174.573 -0.763 17919 89860 1 219 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.433 -0.083 17919 89861 1 219 . 1 1 47 47 GLY H H 47 8.130 8.130 8.390 -0.260 17919 89862 1 219 . 1 1 48 48 LYS N N 48 121.570 121.570 120.376 1.194 17919 89863 1 219 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.638 -0.016 17919 89864 1 219 . 1 1 48 48 LYS C C 48 174.700 174.700 175.364 -0.664 17919 89865 1 219 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.583 -0.033 17919 89866 1 219 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.617 -0.087 17919 89867 1 219 . 1 1 48 48 LYS H H 48 7.980 7.980 7.942 0.038 17919 89868 1 219 . 1 1 49 49 GLN N N 49 122.410 122.410 122.883 -0.473 17919 89869 1 219 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.508 0.052 17919 89870 1 219 . 1 1 49 49 GLN C C 49 175.670 175.670 175.669 0.001 17919 89871 1 219 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.822 -0.082 17919 89872 1 219 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.397 -0.397 17919 89873 1 219 . 1 1 49 49 GLN H H 49 8.600 8.600 8.395 0.205 17919 89874 1 219 . 1 1 50 50 LEU N N 50 125.520 125.520 125.332 0.188 17919 89875 1 219 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.473 -0.383 17919 89876 1 219 . 1 1 50 50 LEU C C 50 176.660 176.660 176.409 0.251 17919 89877 1 219 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.099 0.142 17919 89878 1 219 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.874 -0.304 17919 89879 1 219 . 1 1 50 50 LEU H H 50 8.530 8.530 8.812 -0.282 17919 89880 1 219 . 1 1 51 51 GLU N N 51 122.940 122.940 125.022 -2.082 17919 89881 1 219 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.588 -0.100 17919 89882 1 219 . 1 1 51 51 GLU C C 51 175.870 175.870 176.802 -0.932 17919 89883 1 219 . 1 1 51 51 GLU CA C 51 55.960 55.960 54.904 1.056 17919 89884 1 219 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.339 0.231 17919 89885 1 219 . 1 1 51 51 GLU H H 51 8.400 8.400 8.665 -0.265 17919 89886 1 219 . 1 1 52 52 ASP N N 52 120.030 120.030 122.744 -2.714 17919 89887 1 219 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.415 -0.056 17919 89888 1 219 . 1 1 52 52 ASP C C 52 177.330 177.330 178.043 -0.713 17919 89889 1 219 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.753 -0.793 17919 89890 1 219 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.705 0.145 17919 89891 1 219 . 1 1 52 52 ASP H H 52 8.160 8.160 8.852 -0.692 17919 89892 1 219 . 1 1 53 53 GLY N N 53 106.660 106.660 106.263 0.397 17919 89893 1 219 . 1 1 53 53 GLY C C 53 174.870 174.870 174.711 0.159 17919 89894 1 219 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.154 0.016 17919 89895 1 219 . 1 1 53 53 GLY H H 53 9.390 9.390 8.599 0.791 17919 89896 1 219 . 1 1 54 54 ARG N N 54 119.050 119.050 120.048 -0.998 17919 89897 1 219 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.413 0.282 17919 89898 1 219 . 1 1 54 54 ARG C C 54 175.350 175.350 175.677 -0.327 17919 89899 1 219 . 1 1 54 54 ARG CA C 54 54.390 54.390 55.645 -1.255 17919 89900 1 219 . 1 1 54 54 ARG CB C 54 32.650 32.650 31.614 1.036 17919 89901 1 219 . 1 1 54 54 ARG H H 54 7.460 7.460 7.483 -0.023 17919 89902 1 219 . 1 1 55 55 THR N N 55 108.400 108.400 110.575 -2.175 17919 89903 1 219 . 1 1 55 55 THR HA H 55 5.240 5.240 4.961 0.279 17919 89904 1 219 . 1 1 55 55 THR C C 55 176.560 176.560 175.914 0.646 17919 89905 1 219 . 1 1 55 55 THR CA C 55 59.690 59.690 59.987 -0.297 17919 89906 1 219 . 1 1 55 55 THR CB C 55 72.260 72.260 72.094 0.166 17919 89907 1 219 . 1 1 55 55 THR H H 55 8.730 8.730 8.133 0.597 17919 89908 1 219 . 1 1 56 56 LEU N N 56 117.920 117.920 121.839 -3.919 17919 89909 1 219 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.042 0.018 17919 89910 1 219 . 1 1 56 56 LEU C C 56 180.810 180.810 179.047 1.763 17919 89911 1 219 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.695 0.015 17919 89912 1 219 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.436 -1.066 17919 89913 1 219 . 1 1 56 56 LEU H H 56 8.140 8.140 8.878 -0.738 17919 89914 1 219 . 1 1 57 57 SER N N 57 113.330 113.330 113.424 -0.094 17919 89915 1 219 . 1 1 57 57 SER HA H 57 4.370 4.370 4.121 0.249 17919 89916 1 219 . 1 1 57 57 SER C C 57 178.310 178.310 176.812 1.498 17919 89917 1 219 . 1 1 57 57 SER CA C 57 61.080 61.080 61.175 -0.095 17919 89918 1 219 . 1 1 57 57 SER CB C 57 62.530 62.530 62.589 -0.059 17919 89919 1 219 . 1 1 57 57 SER H H 57 8.470 8.470 8.267 0.203 17919 89920 1 219 . 1 1 58 58 ASP N N 58 124.190 124.190 123.176 1.014 17919 89921 1 219 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.296 -0.000 17919 89922 1 219 . 1 1 58 58 ASP C C 58 177.400 177.400 177.106 0.294 17919 89923 1 219 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.627 0.553 17919 89924 1 219 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.521 -0.421 17919 89925 1 219 . 1 1 58 58 ASP H H 58 7.930 7.930 7.842 0.088 17919 89926 1 219 . 1 1 59 59 TYR N N 59 115.510 115.510 114.550 0.960 17919 89927 1 219 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.549 0.121 17919 89928 1 219 . 1 1 59 59 TYR C C 59 174.700 174.700 174.983 -0.283 17919 89929 1 219 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.976 0.274 17919 89930 1 219 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.642 1.428 17919 89931 1 219 . 1 1 59 59 TYR H H 59 7.250 7.250 7.295 -0.045 17919 89932 1 219 . 1 1 60 60 ASN N N 60 115.900 115.900 115.841 0.059 17919 89933 1 219 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.450 -0.095 17919 89934 1 219 . 1 1 60 60 ASN C C 60 174.340 174.340 174.632 -0.292 17919 89935 1 219 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.403 -0.283 17919 89936 1 219 . 1 1 60 60 ASN CB C 60 37.410 37.410 36.574 0.836 17919 89937 1 219 . 1 1 60 60 ASN H H 60 8.150 8.150 8.027 0.123 17919 89938 1 219 . 1 1 61 61 ILE N N 61 118.600 118.600 120.175 -1.575 17919 89939 1 219 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.969 -0.576 17919 89940 1 219 . 1 1 61 61 ILE C C 61 174.610 174.610 175.846 -1.236 17919 89941 1 219 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.796 0.624 17919 89942 1 219 . 1 1 61 61 ILE CB C 61 36.740 36.740 38.332 -1.592 17919 89943 1 219 . 1 1 61 61 ILE H H 61 7.250 7.250 7.550 -0.300 17919 89944 1 219 . 1 1 62 62 GLN N N 62 124.740 124.740 126.756 -2.016 17919 89945 1 219 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.647 -0.141 17919 89946 1 219 . 1 1 62 62 GLN C C 62 175.970 175.970 174.910 1.060 17919 89947 1 219 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.860 -0.200 17919 89948 1 219 . 1 1 62 62 GLN CB C 62 31.650 31.650 30.740 0.910 17919 89949 1 219 . 1 1 62 62 GLN H H 62 7.610 7.610 8.321 -0.711 17919 89950 1 219 . 1 1 63 63 LYS N N 63 120.300 120.300 118.782 1.518 17919 89951 1 219 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.071 -0.070 17919 89952 1 219 . 1 1 63 63 LYS C C 63 175.810 175.810 176.888 -1.078 17919 89953 1 219 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.869 -0.079 17919 89954 1 219 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.431 0.219 17919 89955 1 219 . 1 1 63 63 LYS H H 63 8.490 8.490 8.407 0.083 17919 89956 1 219 . 1 1 64 64 GLU N N 64 113.950 113.950 116.725 -2.775 17919 89957 1 219 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.642 -0.177 17919 89958 1 219 . 1 1 64 64 GLU C C 64 175.250 175.250 175.923 -0.673 17919 89959 1 219 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.706 0.184 17919 89960 1 219 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.431 -2.531 17919 89961 1 219 . 1 1 64 64 GLU H H 64 9.280 9.280 8.788 0.492 17919 89962 1 219 . 1 1 65 65 SER N N 65 114.730 114.730 115.659 -0.929 17919 89963 1 219 . 1 1 65 65 SER HA H 65 4.640 4.640 4.412 0.228 17919 89964 1 219 . 1 1 65 65 SER C C 65 172.160 172.160 173.467 -1.307 17919 89965 1 219 . 1 1 65 65 SER CA C 65 60.890 60.890 59.981 0.909 17919 89966 1 219 . 1 1 65 65 SER CB C 65 64.910 64.910 63.905 1.005 17919 89967 1 219 . 1 1 65 65 SER H H 65 7.670 7.670 7.518 0.152 17919 89968 1 219 . 1 1 66 66 THR N N 66 117.110 117.110 118.736 -1.626 17919 89969 1 219 . 1 1 66 66 THR HA H 66 5.270 5.270 4.920 0.350 17919 89970 1 219 . 1 1 66 66 THR C C 66 173.950 173.950 173.144 0.806 17919 89971 1 219 . 1 1 66 66 THR CA C 66 62.340 62.340 61.697 0.643 17919 89972 1 219 . 1 1 66 66 THR CB C 66 70.080 70.080 70.092 -0.012 17919 89973 1 219 . 1 1 66 66 THR H H 66 8.730 8.730 8.021 0.709 17919 89974 1 219 . 1 1 67 67 LEU N N 67 127.110 127.110 125.232 1.878 17919 89975 1 219 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.688 0.372 17919 89976 1 219 . 1 1 67 67 LEU C C 67 175.770 175.770 175.424 0.346 17919 89977 1 219 . 1 1 67 67 LEU CA C 67 53.900 53.900 52.495 1.405 17919 89978 1 219 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.199 1.061 17919 89979 1 219 . 1 1 67 67 LEU H H 67 9.410 9.410 9.017 0.393 17919 89980 1 219 . 1 1 68 68 HIS N N 68 118.380 118.380 118.572 -0.192 17919 89981 1 219 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.207 0.033 17919 89982 1 219 . 1 1 68 68 HIS C C 68 173.150 173.150 174.459 -1.309 17919 89983 1 219 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.897 0.103 17919 89984 1 219 . 1 1 68 68 HIS CB C 68 30.530 30.530 31.989 -1.459 17919 89985 1 219 . 1 1 68 68 HIS H H 68 9.230 9.230 8.428 0.802 17919 89986 1 219 . 1 1 69 69 LEU N N 69 124.460 124.460 126.871 -2.411 17919 89987 1 219 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.023 0.167 17919 89988 1 219 . 1 1 69 69 LEU C C 69 175.270 175.270 174.877 0.393 17919 89989 1 219 . 1 1 69 69 LEU CA C 69 53.890 53.890 55.119 -1.229 17919 89990 1 219 . 1 1 69 69 LEU CB C 69 44.380 44.380 43.599 0.781 17919 89991 1 219 . 1 1 69 69 LEU H H 69 8.340 8.340 8.809 -0.469 17919 89992 1 219 . 1 1 70 70 VAL N N 70 126.940 126.940 123.638 3.302 17919 89993 1 219 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.453 -0.103 17919 89994 1 219 . 1 1 70 70 VAL C C 70 174.000 174.000 173.665 0.335 17919 89995 1 219 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.941 0.859 17919 89996 1 219 . 1 1 70 70 VAL CB C 70 34.910 34.910 36.857 -1.947 17919 89997 1 219 . 1 1 70 70 VAL H H 70 9.200 9.200 8.697 0.503 17919 89998 1 219 . 1 1 71 71 LEU N N 71 123.130 123.130 126.356 -3.226 17919 89999 1 219 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.056 0.004 17919 90000 1 219 . 1 1 71 71 LEU C C 71 177.830 177.830 175.891 1.939 17919 90001 1 219 . 1 1 71 71 LEU CA C 71 53.940 53.940 54.418 -0.478 17919 90002 1 219 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.268 0.582 17919 90003 1 219 . 1 1 71 71 LEU H H 71 8.120 8.120 8.420 -0.300 17919 90004 1 219 . 1 1 72 72 ARG N N 72 123.490 123.490 128.947 -5.457 17919 90005 1 219 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.470 -0.169 17919 90006 1 219 . 1 1 72 72 ARG C C 72 175.350 175.350 175.664 -0.314 17919 90007 1 219 . 1 1 72 72 ARG CA C 72 55.610 55.610 54.995 0.615 17919 90008 1 219 . 1 1 72 72 ARG CB C 72 31.350 31.350 29.807 1.543 17919 90009 1 219 . 1 1 72 72 ARG H H 72 8.580 8.580 8.812 -0.232 17919 90010 1 220 . 1 1 2 2 GLN N N 2 123.220 123.220 119.808 3.412 17919 90011 1 220 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.233 0.016 17919 90012 1 220 . 1 1 2 2 GLN C C 2 175.920 175.920 174.669 1.251 17919 90013 1 220 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.505 0.575 17919 90014 1 220 . 1 1 2 2 GLN CB C 2 30.760 30.760 32.251 -1.491 17919 90015 1 220 . 1 1 2 2 GLN H H 2 8.900 8.900 8.289 0.611 17919 90016 1 220 . 1 1 3 3 ILE N N 3 115.340 115.340 116.361 -1.021 17919 90017 1 220 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.543 -0.330 17919 90018 1 220 . 1 1 3 3 ILE C C 3 172.450 172.450 173.205 -0.755 17919 90019 1 220 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.605 -0.035 17919 90020 1 220 . 1 1 3 3 ILE CB C 3 42.210 42.210 42.028 0.182 17919 90021 1 220 . 1 1 3 3 ILE H H 3 8.320 8.320 8.637 -0.317 17919 90022 1 220 . 1 1 4 4 PHE N N 4 118.110 118.110 120.264 -2.154 17919 90023 1 220 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.447 0.183 17919 90024 1 220 . 1 1 4 4 PHE C C 4 175.320 175.320 175.179 0.141 17919 90025 1 220 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.725 -0.515 17919 90026 1 220 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.403 0.077 17919 90027 1 220 . 1 1 4 4 PHE H H 4 8.610 8.610 8.867 -0.257 17919 90028 1 220 . 1 1 5 5 VAL N N 5 121.000 121.000 124.786 -3.786 17919 90029 1 220 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.795 -0.070 17919 90030 1 220 . 1 1 5 5 VAL C C 5 174.870 174.870 175.884 -1.014 17919 90031 1 220 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.072 -0.452 17919 90032 1 220 . 1 1 5 5 VAL CB C 5 34.230 34.230 32.003 2.227 17919 90033 1 220 . 1 1 5 5 VAL H H 5 9.300 9.300 9.261 0.039 17919 90034 1 220 . 1 1 6 6 LYS N N 6 127.520 127.520 128.923 -1.403 17919 90035 1 220 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.025 0.342 17919 90036 1 220 . 1 1 6 6 LYS C C 6 177.140 177.140 176.583 0.557 17919 90037 1 220 . 1 1 6 6 LYS CA C 6 54.520 54.520 55.885 -1.365 17919 90038 1 220 . 1 1 6 6 LYS CB C 6 35.050 35.050 33.923 1.127 17919 90039 1 220 . 1 1 6 6 LYS H H 6 8.820 8.820 9.335 -0.515 17919 90040 1 220 . 1 1 7 7 THR N N 7 115.400 115.400 114.263 1.137 17919 90041 1 220 . 1 1 7 7 THR HA H 7 4.970 4.970 4.895 0.075 17919 90042 1 220 . 1 1 7 7 THR C C 7 176.910 176.910 175.706 1.204 17919 90043 1 220 . 1 1 7 7 THR CA C 7 60.470 60.470 59.291 1.179 17919 90044 1 220 . 1 1 7 7 THR CB C 7 70.630 70.630 71.643 -1.013 17919 90045 1 220 . 1 1 7 7 THR H H 7 8.730 8.730 8.562 0.168 17919 90046 1 220 . 1 1 8 8 LEU N N 8 121.330 121.330 120.010 1.320 17919 90047 1 220 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.325 -0.015 17919 90048 1 220 . 1 1 8 8 LEU C C 8 178.800 178.800 177.928 0.872 17919 90049 1 220 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.114 0.466 17919 90050 1 220 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.636 0.334 17919 90051 1 220 . 1 1 8 8 LEU H H 8 9.100 9.100 8.964 0.136 17919 90052 1 220 . 1 1 9 9 THR N N 9 105.590 105.590 107.251 -1.661 17919 90053 1 220 . 1 1 9 9 THR HA H 9 4.428 4.428 4.321 0.107 17919 90054 1 220 . 1 1 9 9 THR C C 9 175.520 175.520 175.567 -0.047 17919 90055 1 220 . 1 1 9 9 THR CA C 9 61.400 61.400 61.895 -0.495 17919 90056 1 220 . 1 1 9 9 THR CB C 9 69.140 69.140 69.221 -0.080 17919 90057 1 220 . 1 1 9 9 THR H H 9 7.630 7.630 7.601 0.029 17919 90058 1 220 . 1 1 10 10 GLY N N 10 108.890 108.890 111.308 -2.418 17919 90059 1 220 . 1 1 10 10 GLY C C 10 174.070 174.070 173.733 0.337 17919 90060 1 220 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.795 0.665 17919 90061 1 220 . 1 1 10 10 GLY H H 10 7.810 7.810 7.971 -0.161 17919 90062 1 220 . 1 1 11 11 LYS N N 11 121.600 121.600 119.167 2.433 17919 90063 1 220 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.804 -0.443 17919 90064 1 220 . 1 1 11 11 LYS C C 11 175.940 175.940 175.250 0.690 17919 90065 1 220 . 1 1 11 11 LYS CA C 11 56.280 56.280 53.862 2.418 17919 90066 1 220 . 1 1 11 11 LYS CB C 11 33.200 33.200 34.749 -1.549 17919 90067 1 220 . 1 1 11 11 LYS H H 11 7.280 7.280 7.810 -0.530 17919 90068 1 220 . 1 1 12 12 THR N N 12 120.440 120.440 119.965 0.475 17919 90069 1 220 . 1 1 12 12 THR HA H 12 5.046 5.046 4.767 0.279 17919 90070 1 220 . 1 1 12 12 THR C C 12 174.320 174.320 175.188 -0.868 17919 90071 1 220 . 1 1 12 12 THR CA C 12 62.390 62.390 62.694 -0.305 17919 90072 1 220 . 1 1 12 12 THR CB C 12 69.910 69.910 69.342 0.568 17919 90073 1 220 . 1 1 12 12 THR H H 12 8.650 8.650 8.448 0.202 17919 90074 1 220 . 1 1 13 13 ILE N N 13 127.110 127.110 122.768 4.342 17919 90075 1 220 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.714 -0.170 17919 90076 1 220 . 1 1 13 13 ILE C C 13 175.220 175.220 175.602 -0.382 17919 90077 1 220 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.340 0.640 17919 90078 1 220 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.228 0.722 17919 90079 1 220 . 1 1 13 13 ILE H H 13 9.450 9.450 9.134 0.316 17919 90080 1 220 . 1 1 14 14 THR N N 14 121.520 121.520 117.867 3.653 17919 90081 1 220 . 1 1 14 14 THR HA H 14 4.964 4.964 4.707 0.257 17919 90082 1 220 . 1 1 14 14 THR C C 14 173.790 173.790 173.735 0.055 17919 90083 1 220 . 1 1 14 14 THR CA C 14 61.940 61.940 61.176 0.764 17919 90084 1 220 . 1 1 14 14 THR CB C 14 69.650 69.650 69.004 0.646 17919 90085 1 220 . 1 1 14 14 THR H H 14 8.710 8.710 8.560 0.150 17919 90086 1 220 . 1 1 15 15 LEU N N 15 124.800 124.800 125.277 -0.477 17919 90087 1 220 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.792 -0.012 17919 90088 1 220 . 1 1 15 15 LEU C C 15 174.670 174.670 174.101 0.569 17919 90089 1 220 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.929 -1.099 17919 90090 1 220 . 1 1 15 15 LEU CB C 15 47.070 47.070 46.546 0.524 17919 90091 1 220 . 1 1 15 15 LEU H H 15 8.710 8.710 8.339 0.371 17919 90092 1 220 . 1 1 16 16 GLU N N 16 122.160 122.160 122.395 -0.235 17919 90093 1 220 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.097 -0.180 17919 90094 1 220 . 1 1 16 16 GLU C C 16 175.860 175.860 175.519 0.341 17919 90095 1 220 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.180 -0.360 17919 90096 1 220 . 1 1 16 16 GLU CB C 16 29.450 29.450 31.400 -1.950 17919 90097 1 220 . 1 1 16 16 GLU H H 16 8.140 8.140 8.567 -0.427 17919 90098 1 220 . 1 1 17 17 VAL N N 17 117.210 117.210 119.463 -2.253 17919 90099 1 220 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.450 0.264 17919 90100 1 220 . 1 1 17 17 VAL C C 17 174.160 174.160 174.919 -0.759 17919 90101 1 220 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.876 -0.446 17919 90102 1 220 . 1 1 17 17 VAL CB C 17 36.400 36.400 34.849 1.551 17919 90103 1 220 . 1 1 17 17 VAL H H 17 8.900 8.900 8.253 0.647 17919 90104 1 220 . 1 1 18 18 GLU N N 18 118.990 118.990 119.218 -0.228 17919 90105 1 220 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.846 0.233 17919 90106 1 220 . 1 1 18 18 GLU C C 18 176.160 176.160 175.204 0.956 17919 90107 1 220 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.457 0.263 17919 90108 1 220 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.807 -0.497 17919 90109 1 220 . 1 1 18 18 GLU H H 18 8.640 8.640 8.335 0.305 17919 90110 1 220 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.371 -0.230 17919 90111 1 220 . 1 1 19 19 PRO C C 19 175.310 175.310 177.427 -2.117 17919 90112 1 220 . 1 1 19 19 PRO CA C 19 65.470 65.470 64.978 0.492 17919 90113 1 220 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.134 -0.184 17919 90114 1 220 . 1 1 20 20 SER N N 20 103.400 103.400 111.393 -7.993 17919 90115 1 220 . 1 1 20 20 SER HA H 20 4.370 4.370 4.460 -0.090 17919 90116 1 220 . 1 1 20 20 SER C C 20 174.660 174.660 173.748 0.912 17919 90117 1 220 . 1 1 20 20 SER CA C 20 57.400 57.400 57.959 -0.559 17919 90118 1 220 . 1 1 20 20 SER CB C 20 63.370 63.370 63.231 0.139 17919 90119 1 220 . 1 1 20 20 SER H H 20 7.040 7.040 8.206 -1.166 17919 90120 1 220 . 1 1 21 21 ASP N N 21 123.480 123.480 122.869 0.611 17919 90121 1 220 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.944 -0.249 17919 90122 1 220 . 1 1 21 21 ASP C C 21 176.360 176.360 175.231 1.129 17919 90123 1 220 . 1 1 21 21 ASP CA C 21 55.700 55.700 53.823 1.877 17919 90124 1 220 . 1 1 21 21 ASP CB C 21 40.800 40.800 42.183 -1.383 17919 90125 1 220 . 1 1 21 21 ASP H H 21 8.030 8.030 7.717 0.313 17919 90126 1 220 . 1 1 22 22 THR N N 22 108.800 108.800 110.784 -1.984 17919 90127 1 220 . 1 1 22 22 THR HA H 22 4.920 4.920 5.012 -0.092 17919 90128 1 220 . 1 1 22 22 THR C C 22 176.750 176.750 176.183 0.567 17919 90129 1 220 . 1 1 22 22 THR CA C 22 59.690 59.690 60.784 -1.094 17919 90130 1 220 . 1 1 22 22 THR CB C 22 71.200 71.200 70.730 0.470 17919 90131 1 220 . 1 1 22 22 THR H H 22 7.900 7.900 8.201 -0.301 17919 90132 1 220 . 1 1 23 23 ILE N N 23 121.190 121.190 120.491 0.699 17919 90133 1 220 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.840 -0.183 17919 90134 1 220 . 1 1 23 23 ILE C C 23 179.040 179.040 177.605 1.435 17919 90135 1 220 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.163 0.097 17919 90136 1 220 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.425 -2.075 17919 90137 1 220 . 1 1 23 23 ILE H H 23 8.560 8.560 8.348 0.212 17919 90138 1 220 . 1 1 24 24 GLU N N 24 120.830 120.830 120.857 -0.027 17919 90139 1 220 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.872 0.045 17919 90140 1 220 . 1 1 24 24 GLU C C 24 178.640 178.640 178.305 0.335 17919 90141 1 220 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.945 0.275 17919 90142 1 220 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.381 -1.101 17919 90143 1 220 . 1 1 24 24 GLU H H 24 9.760 9.760 8.019 1.741 17919 90144 1 220 . 1 1 25 25 ASN N N 25 120.570 120.570 117.718 2.852 17919 90145 1 220 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.568 -0.043 17919 90146 1 220 . 1 1 25 25 ASN C C 25 178.380 178.380 177.712 0.668 17919 90147 1 220 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.884 0.176 17919 90148 1 220 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.417 0.033 17919 90149 1 220 . 1 1 25 25 ASN H H 25 7.920 7.920 7.677 0.243 17919 90150 1 220 . 1 1 26 26 VAL N N 26 121.710 121.710 120.702 1.008 17919 90151 1 220 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.629 -0.232 17919 90152 1 220 . 1 1 26 26 VAL C C 26 177.950 177.950 178.032 -0.082 17919 90153 1 220 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.488 1.172 17919 90154 1 220 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.000 -0.160 17919 90155 1 220 . 1 1 26 26 VAL H H 26 8.070 8.070 7.579 0.491 17919 90156 1 220 . 1 1 27 27 LYS N N 27 118.860 118.860 119.752 -0.892 17919 90157 1 220 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.154 0.426 17919 90158 1 220 . 1 1 27 27 LYS C C 27 180.550 180.550 179.127 1.423 17919 90159 1 220 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.552 -0.302 17919 90160 1 220 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.179 1.551 17919 90161 1 220 . 1 1 27 27 LYS H H 27 8.560 8.560 7.957 0.603 17919 90162 1 220 . 1 1 28 28 ALA N N 28 123.440 123.440 122.402 1.038 17919 90163 1 220 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.133 0.027 17919 90164 1 220 . 1 1 28 28 ALA C C 28 180.300 180.300 179.224 1.076 17919 90165 1 220 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.914 0.456 17919 90166 1 220 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.372 -0.662 17919 90167 1 220 . 1 1 28 28 ALA H H 28 8.060 8.060 8.279 -0.219 17919 90168 1 220 . 1 1 29 29 LYS N N 29 119.940 119.940 118.999 0.941 17919 90169 1 220 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.038 0.169 17919 90170 1 220 . 1 1 29 29 LYS C C 29 180.320 180.320 179.137 1.183 17919 90171 1 220 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.553 0.097 17919 90172 1 220 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.294 0.996 17919 90173 1 220 . 1 1 29 29 LYS H H 29 7.850 7.850 8.037 -0.187 17919 90174 1 220 . 1 1 30 30 ILE N N 30 121.080 121.080 120.905 0.175 17919 90175 1 220 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.552 -0.045 17919 90176 1 220 . 1 1 30 30 ILE C C 30 178.310 178.310 177.304 1.006 17919 90177 1 220 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.863 0.287 17919 90178 1 220 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.713 -0.913 17919 90179 1 220 . 1 1 30 30 ILE H H 30 8.280 8.280 7.900 0.380 17919 90180 1 220 . 1 1 31 31 GLN N N 31 123.490 123.490 120.078 3.412 17919 90181 1 220 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.988 -0.159 17919 90182 1 220 . 1 1 31 31 GLN C C 31 178.890 178.890 178.609 0.281 17919 90183 1 220 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.419 0.581 17919 90184 1 220 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.352 -0.632 17919 90185 1 220 . 1 1 31 31 GLN H H 31 8.580 8.580 8.025 0.555 17919 90186 1 220 . 1 1 32 32 ASP N N 32 119.360 119.360 119.433 -0.073 17919 90187 1 220 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.420 -0.066 17919 90188 1 220 . 1 1 32 32 ASP C C 32 177.250 177.250 177.789 -0.539 17919 90189 1 220 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.577 0.613 17919 90190 1 220 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.736 -0.156 17919 90191 1 220 . 1 1 32 32 ASP H H 32 8.010 8.010 8.367 -0.357 17919 90192 1 220 . 1 1 33 33 LYS N N 33 115.130 115.130 118.411 -3.281 17919 90193 1 220 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.241 0.096 17919 90194 1 220 . 1 1 33 33 LYS C C 33 177.870 177.870 178.189 -0.319 17919 90195 1 220 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.373 -0.323 17919 90196 1 220 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.825 0.345 17919 90197 1 220 . 1 1 33 33 LYS H H 33 7.430 7.430 7.478 -0.048 17919 90198 1 220 . 1 1 34 34 GLU N N 34 113.870 113.870 114.276 -0.406 17919 90199 1 220 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.504 0.121 17919 90200 1 220 . 1 1 34 34 GLU C C 34 177.840 177.840 176.027 1.813 17919 90201 1 220 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.729 -0.559 17919 90202 1 220 . 1 1 34 34 GLU CB C 34 32.660 32.660 30.963 1.697 17919 90203 1 220 . 1 1 34 34 GLU H H 34 8.740 8.740 8.154 0.586 17919 90204 1 220 . 1 1 35 35 GLY N N 35 108.650 108.650 109.376 -0.726 17919 90205 1 220 . 1 1 35 35 GLY C C 35 173.960 173.960 174.549 -0.589 17919 90206 1 220 . 1 1 35 35 GLY CA C 35 46.080 46.080 46.090 -0.010 17919 90207 1 220 . 1 1 35 35 GLY H H 35 8.530 8.530 8.378 0.152 17919 90208 1 220 . 1 1 36 36 ILE N N 36 119.880 119.880 121.256 -1.376 17919 90209 1 220 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.323 0.122 17919 90210 1 220 . 1 1 36 36 ILE C C 36 173.590 173.590 174.044 -0.454 17919 90211 1 220 . 1 1 36 36 ILE CA C 36 57.750 57.750 56.567 1.183 17919 90212 1 220 . 1 1 36 36 ILE CB C 36 40.580 40.580 37.125 3.455 17919 90213 1 220 . 1 1 36 36 ILE H H 36 6.150 6.150 7.636 -1.486 17919 90214 1 220 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.603 0.031 17919 90215 1 220 . 1 1 37 37 PRO C C 37 176.940 176.940 176.196 0.744 17919 90216 1 220 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.893 -0.233 17919 90217 1 220 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.409 0.441 17919 90218 1 220 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.089 0.028 17919 90219 1 220 . 1 1 38 38 PRO C C 38 178.320 178.320 178.741 -0.421 17919 90220 1 220 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.828 0.432 17919 90221 1 220 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.909 0.981 17919 90222 1 220 . 1 1 39 39 ASP N N 39 113.380 113.380 115.192 -1.812 17919 90223 1 220 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.315 0.115 17919 90224 1 220 . 1 1 39 39 ASP C C 39 177.090 177.090 177.422 -0.332 17919 90225 1 220 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.964 -1.324 17919 90226 1 220 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.458 -0.918 17919 90227 1 220 . 1 1 39 39 ASP H H 39 8.550 8.550 8.598 -0.048 17919 90228 1 220 . 1 1 40 40 GLN N N 40 116.780 116.780 115.714 1.066 17919 90229 1 220 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.208 0.256 17919 90230 1 220 . 1 1 40 40 GLN C C 40 175.380 175.380 176.652 -1.272 17919 90231 1 220 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.312 -0.672 17919 90232 1 220 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.121 1.019 17919 90233 1 220 . 1 1 40 40 GLN H H 40 7.820 7.820 7.572 0.248 17919 90234 1 220 . 1 1 41 41 GLN N N 41 117.720 117.720 119.353 -1.633 17919 90235 1 220 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.501 -0.257 17919 90236 1 220 . 1 1 41 41 GLN C C 41 176.300 176.300 174.885 1.415 17919 90237 1 220 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.638 0.832 17919 90238 1 220 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.906 1.744 17919 90239 1 220 . 1 1 41 41 GLN H H 41 7.480 7.480 7.983 -0.503 17919 90240 1 220 . 1 1 42 42 ARG N N 42 122.680 122.680 124.296 -1.616 17919 90241 1 220 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.613 -0.113 17919 90242 1 220 . 1 1 42 42 ARG C C 42 174.050 174.050 174.581 -0.531 17919 90243 1 220 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.000 0.050 17919 90244 1 220 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.369 -0.619 17919 90245 1 220 . 1 1 42 42 ARG H H 42 8.530 8.530 8.688 -0.158 17919 90246 1 220 . 1 1 43 43 LEU N N 43 124.040 124.040 126.101 -2.061 17919 90247 1 220 . 1 1 43 43 LEU C C 43 175.290 175.290 175.563 -0.273 17919 90248 1 220 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.665 -0.685 17919 90249 1 220 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.188 1.602 17919 90250 1 220 . 1 1 43 43 LEU H H 43 8.820 8.820 8.846 -0.026 17919 90251 1 220 . 1 1 44 44 ILE N N 44 121.920 121.920 122.356 -0.436 17919 90252 1 220 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.195 -0.203 17919 90253 1 220 . 1 1 44 44 ILE C C 44 176.060 176.060 174.298 1.762 17919 90254 1 220 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.975 -0.995 17919 90255 1 220 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.929 -0.510 17919 90256 1 220 . 1 1 44 44 ILE H H 44 9.030 9.030 8.846 0.184 17919 90257 1 220 . 1 1 45 45 PHE N N 45 125.390 125.390 127.189 -1.799 17919 90258 1 220 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.024 0.021 17919 90259 1 220 . 1 1 45 45 PHE C C 45 174.470 174.470 174.169 0.301 17919 90260 1 220 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.686 0.334 17919 90261 1 220 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.851 0.909 17919 90262 1 220 . 1 1 45 45 PHE H H 45 8.830 8.830 8.806 0.024 17919 90263 1 220 . 1 1 46 46 ALA N N 46 132.200 132.200 130.303 1.897 17919 90264 1 220 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.661 0.029 17919 90265 1 220 . 1 1 46 46 ALA C C 46 177.290 177.290 177.499 -0.209 17919 90266 1 220 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.387 0.153 17919 90267 1 220 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.288 0.282 17919 90268 1 220 . 1 1 46 46 ALA H H 46 8.810 8.810 9.071 -0.261 17919 90269 1 220 . 1 1 47 47 GLY N N 47 102.340 102.340 105.931 -3.591 17919 90270 1 220 . 1 1 47 47 GLY C C 47 173.810 173.810 174.429 -0.619 17919 90271 1 220 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.926 0.423 17919 90272 1 220 . 1 1 47 47 GLY H H 47 8.130 8.130 8.505 -0.375 17919 90273 1 220 . 1 1 48 48 LYS N N 48 121.570 121.570 122.511 -0.941 17919 90274 1 220 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.462 0.160 17919 90275 1 220 . 1 1 48 48 LYS C C 48 174.700 174.700 175.576 -0.876 17919 90276 1 220 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.727 -1.177 17919 90277 1 220 . 1 1 48 48 LYS CB C 48 34.530 34.530 33.908 0.622 17919 90278 1 220 . 1 1 48 48 LYS H H 48 7.980 7.980 7.643 0.337 17919 90279 1 220 . 1 1 49 49 GLN N N 49 122.410 122.410 124.199 -1.789 17919 90280 1 220 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.589 -0.029 17919 90281 1 220 . 1 1 49 49 GLN C C 49 175.670 175.670 175.855 -0.185 17919 90282 1 220 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.980 -0.240 17919 90283 1 220 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.572 -0.572 17919 90284 1 220 . 1 1 49 49 GLN H H 49 8.600 8.600 8.519 0.081 17919 90285 1 220 . 1 1 50 50 LEU N N 50 125.520 125.520 127.839 -2.319 17919 90286 1 220 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.298 -0.208 17919 90287 1 220 . 1 1 50 50 LEU C C 50 176.660 176.660 176.552 0.108 17919 90288 1 220 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.711 -0.471 17919 90289 1 220 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.399 -0.829 17919 90290 1 220 . 1 1 50 50 LEU H H 50 8.530 8.530 8.914 -0.384 17919 90291 1 220 . 1 1 51 51 GLU N N 51 122.940 122.940 121.531 1.409 17919 90292 1 220 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.696 -0.208 17919 90293 1 220 . 1 1 51 51 GLU C C 51 175.870 175.870 176.591 -0.721 17919 90294 1 220 . 1 1 51 51 GLU CA C 51 55.960 55.960 54.803 1.157 17919 90295 1 220 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.181 -0.611 17919 90296 1 220 . 1 1 51 51 GLU H H 51 8.400 8.400 8.894 -0.494 17919 90297 1 220 . 1 1 52 52 ASP N N 52 120.030 120.030 126.214 -6.184 17919 90298 1 220 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.320 0.039 17919 90299 1 220 . 1 1 52 52 ASP C C 52 177.330 177.330 177.499 -0.169 17919 90300 1 220 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.464 -0.504 17919 90301 1 220 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.774 0.076 17919 90302 1 220 . 1 1 52 52 ASP H H 52 8.160 8.160 8.836 -0.676 17919 90303 1 220 . 1 1 53 53 GLY N N 53 106.660 106.660 105.301 1.359 17919 90304 1 220 . 1 1 53 53 GLY C C 53 174.870 174.870 174.419 0.451 17919 90305 1 220 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.630 0.540 17919 90306 1 220 . 1 1 53 53 GLY H H 53 9.390 9.390 8.420 0.970 17919 90307 1 220 . 1 1 54 54 ARG N N 54 119.050 119.050 122.000 -2.950 17919 90308 1 220 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.479 0.216 17919 90309 1 220 . 1 1 54 54 ARG C C 54 175.350 175.350 175.933 -0.583 17919 90310 1 220 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.995 -0.605 17919 90311 1 220 . 1 1 54 54 ARG CB C 54 32.650 32.650 31.061 1.589 17919 90312 1 220 . 1 1 54 54 ARG H H 54 7.460 7.460 7.912 -0.452 17919 90313 1 220 . 1 1 55 55 THR N N 55 108.400 108.400 113.791 -5.391 17919 90314 1 220 . 1 1 55 55 THR HA H 55 5.240 5.240 4.791 0.449 17919 90315 1 220 . 1 1 55 55 THR C C 55 176.560 176.560 175.681 0.879 17919 90316 1 220 . 1 1 55 55 THR CA C 55 59.690 59.690 61.758 -2.068 17919 90317 1 220 . 1 1 55 55 THR CB C 55 72.260 72.260 70.109 2.151 17919 90318 1 220 . 1 1 55 55 THR H H 55 8.730 8.730 8.083 0.647 17919 90319 1 220 . 1 1 56 56 LEU N N 56 117.920 117.920 120.535 -2.615 17919 90320 1 220 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.248 -0.188 17919 90321 1 220 . 1 1 56 56 LEU C C 56 180.810 180.810 178.922 1.888 17919 90322 1 220 . 1 1 56 56 LEU CA C 56 58.710 58.710 57.949 0.761 17919 90323 1 220 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.586 -1.216 17919 90324 1 220 . 1 1 56 56 LEU H H 56 8.140 8.140 8.271 -0.131 17919 90325 1 220 . 1 1 57 57 SER N N 57 113.330 113.330 114.959 -1.629 17919 90326 1 220 . 1 1 57 57 SER HA H 57 4.370 4.370 4.124 0.246 17919 90327 1 220 . 1 1 57 57 SER C C 57 178.310 178.310 176.934 1.376 17919 90328 1 220 . 1 1 57 57 SER CA C 57 61.080 61.080 61.595 -0.515 17919 90329 1 220 . 1 1 57 57 SER CB C 57 62.530 62.530 62.573 -0.043 17919 90330 1 220 . 1 1 57 57 SER H H 57 8.470 8.470 8.585 -0.115 17919 90331 1 220 . 1 1 58 58 ASP N N 58 124.190 124.190 121.292 2.898 17919 90332 1 220 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.423 -0.127 17919 90333 1 220 . 1 1 58 58 ASP C C 58 177.400 177.400 176.391 1.009 17919 90334 1 220 . 1 1 58 58 ASP CA C 58 57.180 57.180 55.797 1.383 17919 90335 1 220 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.612 -0.512 17919 90336 1 220 . 1 1 58 58 ASP H H 58 7.930 7.930 7.864 0.066 17919 90337 1 220 . 1 1 59 59 TYR N N 59 115.510 115.510 116.068 -0.558 17919 90338 1 220 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.568 0.102 17919 90339 1 220 . 1 1 59 59 TYR C C 59 174.700 174.700 175.276 -0.576 17919 90340 1 220 . 1 1 59 59 TYR CA C 59 58.250 58.250 58.070 0.180 17919 90341 1 220 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.392 1.678 17919 90342 1 220 . 1 1 59 59 TYR H H 59 7.250 7.250 7.244 0.006 17919 90343 1 220 . 1 1 60 60 ASN N N 60 115.900 115.900 117.111 -1.211 17919 90344 1 220 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.365 -0.010 17919 90345 1 220 . 1 1 60 60 ASN C C 60 174.340 174.340 174.556 -0.216 17919 90346 1 220 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.677 -0.557 17919 90347 1 220 . 1 1 60 60 ASN CB C 60 37.410 37.410 36.962 0.448 17919 90348 1 220 . 1 1 60 60 ASN H H 60 8.150 8.150 7.992 0.158 17919 90349 1 220 . 1 1 61 61 ILE N N 61 118.600 118.600 119.594 -0.994 17919 90350 1 220 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.775 -0.382 17919 90351 1 220 . 1 1 61 61 ILE C C 61 174.610 174.610 175.380 -0.770 17919 90352 1 220 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.835 0.585 17919 90353 1 220 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.796 -1.056 17919 90354 1 220 . 1 1 61 61 ILE H H 61 7.250 7.250 7.768 -0.518 17919 90355 1 220 . 1 1 62 62 GLN N N 62 124.740 124.740 124.991 -0.251 17919 90356 1 220 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.798 -0.292 17919 90357 1 220 . 1 1 62 62 GLN C C 62 175.970 175.970 175.679 0.291 17919 90358 1 220 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.689 -0.029 17919 90359 1 220 . 1 1 62 62 GLN CB C 62 31.650 31.650 32.870 -1.220 17919 90360 1 220 . 1 1 62 62 GLN H H 62 7.610 7.610 7.929 -0.319 17919 90361 1 220 . 1 1 63 63 LYS N N 63 120.300 120.300 120.664 -0.364 17919 90362 1 220 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.245 -0.244 17919 90363 1 220 . 1 1 63 63 LYS C C 63 175.810 175.810 177.039 -1.229 17919 90364 1 220 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.593 0.197 17919 90365 1 220 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.392 0.258 17919 90366 1 220 . 1 1 63 63 LYS H H 63 8.490 8.490 8.656 -0.166 17919 90367 1 220 . 1 1 64 64 GLU N N 64 113.950 113.950 119.490 -5.540 17919 90368 1 220 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.852 -0.387 17919 90369 1 220 . 1 1 64 64 GLU C C 64 175.250 175.250 176.408 -1.158 17919 90370 1 220 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.913 -0.023 17919 90371 1 220 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.717 -2.817 17919 90372 1 220 . 1 1 64 64 GLU H H 64 9.280 9.280 8.942 0.338 17919 90373 1 220 . 1 1 65 65 SER N N 65 114.730 114.730 115.737 -1.007 17919 90374 1 220 . 1 1 65 65 SER HA H 65 4.640 4.640 4.474 0.166 17919 90375 1 220 . 1 1 65 65 SER C C 65 172.160 172.160 174.118 -1.958 17919 90376 1 220 . 1 1 65 65 SER CA C 65 60.890 60.890 60.589 0.301 17919 90377 1 220 . 1 1 65 65 SER CB C 65 64.910 64.910 64.373 0.537 17919 90378 1 220 . 1 1 65 65 SER H H 65 7.670 7.670 7.392 0.278 17919 90379 1 220 . 1 1 66 66 THR N N 66 117.110 117.110 119.160 -2.050 17919 90380 1 220 . 1 1 66 66 THR HA H 66 5.270 5.270 5.419 -0.149 17919 90381 1 220 . 1 1 66 66 THR C C 66 173.950 173.950 174.019 -0.069 17919 90382 1 220 . 1 1 66 66 THR CA C 66 62.340 62.340 62.054 0.286 17919 90383 1 220 . 1 1 66 66 THR CB C 66 70.080 70.080 70.879 -0.799 17919 90384 1 220 . 1 1 66 66 THR H H 66 8.730 8.730 8.501 0.229 17919 90385 1 220 . 1 1 67 67 LEU N N 67 127.110 127.110 127.318 -0.208 17919 90386 1 220 . 1 1 67 67 LEU HA H 67 5.060 5.060 5.074 -0.014 17919 90387 1 220 . 1 1 67 67 LEU C C 67 175.770 175.770 175.068 0.702 17919 90388 1 220 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.700 0.200 17919 90389 1 220 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.805 -0.545 17919 90390 1 220 . 1 1 67 67 LEU H H 67 9.410 9.410 9.278 0.132 17919 90391 1 220 . 1 1 68 68 HIS N N 68 118.380 118.380 122.277 -3.897 17919 90392 1 220 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.407 -0.167 17919 90393 1 220 . 1 1 68 68 HIS C C 68 173.150 173.150 174.121 -0.971 17919 90394 1 220 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.510 0.490 17919 90395 1 220 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.335 -1.805 17919 90396 1 220 . 1 1 68 68 HIS H H 68 9.230 9.230 9.250 -0.020 17919 90397 1 220 . 1 1 69 69 LEU N N 69 124.460 124.460 128.935 -4.475 17919 90398 1 220 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.289 -0.099 17919 90399 1 220 . 1 1 69 69 LEU C C 69 175.270 175.270 174.740 0.530 17919 90400 1 220 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.467 0.423 17919 90401 1 220 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.420 -0.040 17919 90402 1 220 . 1 1 69 69 LEU H H 69 8.340 8.340 8.645 -0.305 17919 90403 1 220 . 1 1 70 70 VAL N N 70 126.940 126.940 125.343 1.597 17919 90404 1 220 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.340 0.010 17919 90405 1 220 . 1 1 70 70 VAL C C 70 174.000 174.000 174.303 -0.303 17919 90406 1 220 . 1 1 70 70 VAL CA C 70 60.800 60.800 61.287 -0.487 17919 90407 1 220 . 1 1 70 70 VAL CB C 70 34.910 34.910 36.052 -1.142 17919 90408 1 220 . 1 1 70 70 VAL H H 70 9.200 9.200 8.821 0.379 17919 90409 1 220 . 1 1 71 71 LEU N N 71 123.130 123.130 124.127 -0.997 17919 90410 1 220 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.205 -0.145 17919 90411 1 220 . 1 1 71 71 LEU C C 71 177.830 177.830 177.207 0.623 17919 90412 1 220 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.128 0.812 17919 90413 1 220 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.379 -0.529 17919 90414 1 220 . 1 1 71 71 LEU H H 71 8.120 8.120 8.355 -0.235 17919 90415 1 220 . 1 1 72 72 ARG N N 72 123.490 123.490 122.195 1.295 17919 90416 1 220 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.490 -0.189 17919 90417 1 220 . 1 1 72 72 ARG C C 72 175.350 175.350 174.815 0.535 17919 90418 1 220 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.250 -0.640 17919 90419 1 220 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.294 1.056 17919 90420 1 220 . 1 1 72 72 ARG H H 72 8.580 8.580 8.181 0.399 17919 90421 1 221 . 1 1 2 2 GLN N N 2 123.220 123.220 120.358 2.862 17919 90422 1 221 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.036 0.213 17919 90423 1 221 . 1 1 2 2 GLN C C 2 175.920 175.920 176.048 -0.128 17919 90424 1 221 . 1 1 2 2 GLN CA C 2 55.080 55.080 55.815 -0.735 17919 90425 1 221 . 1 1 2 2 GLN CB C 2 30.760 30.760 29.630 1.130 17919 90426 1 221 . 1 1 2 2 GLN H H 2 8.900 8.900 8.390 0.510 17919 90427 1 221 . 1 1 3 3 ILE N N 3 115.340 115.340 115.880 -0.540 17919 90428 1 221 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.196 0.017 17919 90429 1 221 . 1 1 3 3 ILE C C 3 172.450 172.450 173.856 -1.406 17919 90430 1 221 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.662 -0.092 17919 90431 1 221 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.712 0.498 17919 90432 1 221 . 1 1 3 3 ILE H H 3 8.320 8.320 8.610 -0.289 17919 90433 1 221 . 1 1 4 4 PHE N N 4 118.110 118.110 119.163 -1.053 17919 90434 1 221 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.529 0.101 17919 90435 1 221 . 1 1 4 4 PHE C C 4 175.320 175.320 175.542 -0.222 17919 90436 1 221 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.453 -0.243 17919 90437 1 221 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.196 0.284 17919 90438 1 221 . 1 1 4 4 PHE H H 4 8.610 8.610 8.455 0.155 17919 90439 1 221 . 1 1 5 5 VAL N N 5 121.000 121.000 121.851 -0.851 17919 90440 1 221 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.844 -0.119 17919 90441 1 221 . 1 1 5 5 VAL C C 5 174.870 174.870 174.188 0.682 17919 90442 1 221 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.391 -0.771 17919 90443 1 221 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.840 -0.610 17919 90444 1 221 . 1 1 5 5 VAL H H 5 9.300 9.300 9.400 -0.100 17919 90445 1 221 . 1 1 6 6 LYS N N 6 127.520 127.520 128.531 -1.011 17919 90446 1 221 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.252 0.115 17919 90447 1 221 . 1 1 6 6 LYS C C 6 177.140 177.140 175.548 1.592 17919 90448 1 221 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.091 0.429 17919 90449 1 221 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.889 -0.840 17919 90450 1 221 . 1 1 6 6 LYS H H 6 8.820 8.820 9.233 -0.413 17919 90451 1 221 . 1 1 7 7 THR N N 7 115.400 115.400 117.400 -2.000 17919 90452 1 221 . 1 1 7 7 THR HA H 7 4.970 4.970 4.936 0.034 17919 90453 1 221 . 1 1 7 7 THR C C 7 176.910 176.910 175.974 0.936 17919 90454 1 221 . 1 1 7 7 THR CA C 7 60.470 60.470 60.165 0.305 17919 90455 1 221 . 1 1 7 7 THR CB C 7 70.630 70.630 70.792 -0.162 17919 90456 1 221 . 1 1 7 7 THR H H 7 8.730 8.730 8.870 -0.140 17919 90457 1 221 . 1 1 8 8 LEU N N 8 121.330 121.330 121.913 -0.583 17919 90458 1 221 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.404 -0.094 17919 90459 1 221 . 1 1 8 8 LEU C C 8 178.800 178.800 177.324 1.476 17919 90460 1 221 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.019 0.561 17919 90461 1 221 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.384 -0.414 17919 90462 1 221 . 1 1 8 8 LEU H H 8 9.100 9.100 8.591 0.509 17919 90463 1 221 . 1 1 9 9 THR N N 9 105.590 105.590 109.305 -3.715 17919 90464 1 221 . 1 1 9 9 THR HA H 9 4.428 4.428 4.389 0.039 17919 90465 1 221 . 1 1 9 9 THR C C 9 175.520 175.520 175.337 0.183 17919 90466 1 221 . 1 1 9 9 THR CA C 9 61.400 61.400 61.502 -0.102 17919 90467 1 221 . 1 1 9 9 THR CB C 9 69.140 69.140 69.317 -0.177 17919 90468 1 221 . 1 1 9 9 THR H H 9 7.630 7.630 7.451 0.179 17919 90469 1 221 . 1 1 10 10 GLY N N 10 108.890 108.890 110.887 -1.997 17919 90470 1 221 . 1 1 10 10 GLY C C 10 174.070 174.070 174.079 -0.009 17919 90471 1 221 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.186 0.274 17919 90472 1 221 . 1 1 10 10 GLY H H 10 7.810 7.810 7.752 0.058 17919 90473 1 221 . 1 1 11 11 LYS N N 11 121.600 121.600 121.739 -0.139 17919 90474 1 221 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.499 -0.138 17919 90475 1 221 . 1 1 11 11 LYS C C 11 175.940 175.940 175.207 0.733 17919 90476 1 221 . 1 1 11 11 LYS CA C 11 56.280 56.280 55.709 0.571 17919 90477 1 221 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.998 -0.798 17919 90478 1 221 . 1 1 11 11 LYS H H 11 7.280 7.280 7.847 -0.567 17919 90479 1 221 . 1 1 12 12 THR N N 12 120.440 120.440 118.465 1.975 17919 90480 1 221 . 1 1 12 12 THR HA H 12 5.046 5.046 5.298 -0.252 17919 90481 1 221 . 1 1 12 12 THR C C 12 174.320 174.320 174.354 -0.034 17919 90482 1 221 . 1 1 12 12 THR CA C 12 62.390 62.390 61.316 1.074 17919 90483 1 221 . 1 1 12 12 THR CB C 12 69.910 69.910 70.268 -0.358 17919 90484 1 221 . 1 1 12 12 THR H H 12 8.650 8.650 8.329 0.321 17919 90485 1 221 . 1 1 13 13 ILE N N 13 127.110 127.110 123.475 3.635 17919 90486 1 221 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.685 -0.141 17919 90487 1 221 . 1 1 13 13 ILE C C 13 175.220 175.220 174.818 0.402 17919 90488 1 221 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.145 0.835 17919 90489 1 221 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.122 -0.172 17919 90490 1 221 . 1 1 13 13 ILE H H 13 9.450 9.450 9.189 0.261 17919 90491 1 221 . 1 1 14 14 THR N N 14 121.520 121.520 121.161 0.359 17919 90492 1 221 . 1 1 14 14 THR HA H 14 4.964 4.964 5.268 -0.304 17919 90493 1 221 . 1 1 14 14 THR C C 14 173.790 173.790 173.986 -0.196 17919 90494 1 221 . 1 1 14 14 THR CA C 14 61.940 61.940 62.269 -0.329 17919 90495 1 221 . 1 1 14 14 THR CB C 14 69.650 69.650 69.960 -0.310 17919 90496 1 221 . 1 1 14 14 THR H H 14 8.710 8.710 8.483 0.227 17919 90497 1 221 . 1 1 15 15 LEU N N 15 124.800 124.800 127.831 -3.031 17919 90498 1 221 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.731 0.049 17919 90499 1 221 . 1 1 15 15 LEU C C 15 174.670 174.670 174.983 -0.313 17919 90500 1 221 . 1 1 15 15 LEU CA C 15 52.830 52.830 54.065 -1.235 17919 90501 1 221 . 1 1 15 15 LEU CB C 15 47.070 47.070 46.003 1.067 17919 90502 1 221 . 1 1 15 15 LEU H H 15 8.710 8.710 9.047 -0.337 17919 90503 1 221 . 1 1 16 16 GLU N N 16 122.160 122.160 123.078 -0.918 17919 90504 1 221 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.433 -0.516 17919 90505 1 221 . 1 1 16 16 GLU C C 16 175.860 175.860 176.261 -0.401 17919 90506 1 221 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.480 -0.660 17919 90507 1 221 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.423 -0.973 17919 90508 1 221 . 1 1 16 16 GLU H H 16 8.140 8.140 8.659 -0.519 17919 90509 1 221 . 1 1 17 17 VAL N N 17 117.210 117.210 118.616 -1.406 17919 90510 1 221 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.993 -0.279 17919 90511 1 221 . 1 1 17 17 VAL C C 17 174.160 174.160 174.677 -0.517 17919 90512 1 221 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.938 -0.508 17919 90513 1 221 . 1 1 17 17 VAL CB C 17 36.400 36.400 36.034 0.366 17919 90514 1 221 . 1 1 17 17 VAL H H 17 8.900 8.900 8.898 0.002 17919 90515 1 221 . 1 1 18 18 GLU N N 18 118.990 118.990 119.345 -0.355 17919 90516 1 221 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.797 0.282 17919 90517 1 221 . 1 1 18 18 GLU C C 18 176.160 176.160 174.901 1.259 17919 90518 1 221 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.729 -0.009 17919 90519 1 221 . 1 1 18 18 GLU CB C 18 30.310 30.310 31.281 -0.971 17919 90520 1 221 . 1 1 18 18 GLU H H 18 8.640 8.640 9.031 -0.391 17919 90521 1 221 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.251 -0.110 17919 90522 1 221 . 1 1 19 19 PRO C C 19 175.310 175.310 177.494 -2.184 17919 90523 1 221 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.168 0.302 17919 90524 1 221 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.871 0.079 17919 90525 1 221 . 1 1 20 20 SER N N 20 103.400 103.400 109.386 -5.986 17919 90526 1 221 . 1 1 20 20 SER HA H 20 4.370 4.370 4.370 0.000 17919 90527 1 221 . 1 1 20 20 SER C C 20 174.660 174.660 174.405 0.255 17919 90528 1 221 . 1 1 20 20 SER CA C 20 57.400 57.400 57.865 -0.465 17919 90529 1 221 . 1 1 20 20 SER CB C 20 63.370 63.370 63.479 -0.109 17919 90530 1 221 . 1 1 20 20 SER H H 20 7.040 7.040 7.961 -0.921 17919 90531 1 221 . 1 1 21 21 ASP N N 21 123.480 123.480 125.024 -1.544 17919 90532 1 221 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.799 -0.104 17919 90533 1 221 . 1 1 21 21 ASP C C 21 176.360 176.360 175.949 0.411 17919 90534 1 221 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.256 0.444 17919 90535 1 221 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.662 -0.862 17919 90536 1 221 . 1 1 21 21 ASP H H 21 8.030 8.030 7.755 0.275 17919 90537 1 221 . 1 1 22 22 THR N N 22 108.800 108.800 112.555 -3.755 17919 90538 1 221 . 1 1 22 22 THR HA H 22 4.920 4.920 4.835 0.085 17919 90539 1 221 . 1 1 22 22 THR C C 22 176.750 176.750 176.240 0.510 17919 90540 1 221 . 1 1 22 22 THR CA C 22 59.690 59.690 61.093 -1.403 17919 90541 1 221 . 1 1 22 22 THR CB C 22 71.200 71.200 70.541 0.659 17919 90542 1 221 . 1 1 22 22 THR H H 22 7.900 7.900 8.221 -0.321 17919 90543 1 221 . 1 1 23 23 ILE N N 23 121.190 121.190 122.545 -1.355 17919 90544 1 221 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.765 -0.108 17919 90545 1 221 . 1 1 23 23 ILE C C 23 179.040 179.040 177.613 1.427 17919 90546 1 221 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.034 -0.774 17919 90547 1 221 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.258 -1.908 17919 90548 1 221 . 1 1 23 23 ILE H H 23 8.560 8.560 8.892 -0.332 17919 90549 1 221 . 1 1 24 24 GLU N N 24 120.830 120.830 120.873 -0.043 17919 90550 1 221 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.858 0.059 17919 90551 1 221 . 1 1 24 24 GLU C C 24 178.640 178.640 178.395 0.245 17919 90552 1 221 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.152 0.068 17919 90553 1 221 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.523 -1.243 17919 90554 1 221 . 1 1 24 24 GLU H H 24 9.760 9.760 8.722 1.038 17919 90555 1 221 . 1 1 25 25 ASN N N 25 120.570 120.570 118.032 2.538 17919 90556 1 221 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.478 0.047 17919 90557 1 221 . 1 1 25 25 ASN C C 25 178.380 178.380 177.887 0.493 17919 90558 1 221 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.204 -0.144 17919 90559 1 221 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.594 -0.144 17919 90560 1 221 . 1 1 25 25 ASN H H 25 7.920 7.920 7.537 0.383 17919 90561 1 221 . 1 1 26 26 VAL N N 26 121.710 121.710 120.538 1.172 17919 90562 1 221 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.574 -0.177 17919 90563 1 221 . 1 1 26 26 VAL C C 26 177.950 177.950 177.938 0.012 17919 90564 1 221 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.978 0.682 17919 90565 1 221 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.622 -0.782 17919 90566 1 221 . 1 1 26 26 VAL H H 26 8.070 8.070 8.076 -0.006 17919 90567 1 221 . 1 1 27 27 LYS N N 27 118.860 118.860 119.377 -0.517 17919 90568 1 221 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.289 0.291 17919 90569 1 221 . 1 1 27 27 LYS C C 27 180.550 180.550 179.000 1.550 17919 90570 1 221 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.243 0.007 17919 90571 1 221 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.476 1.254 17919 90572 1 221 . 1 1 27 27 LYS H H 27 8.560 8.560 8.308 0.252 17919 90573 1 221 . 1 1 28 28 ALA N N 28 123.440 123.440 122.802 0.638 17919 90574 1 221 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.149 0.011 17919 90575 1 221 . 1 1 28 28 ALA C C 28 180.300 180.300 179.181 1.119 17919 90576 1 221 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.954 0.416 17919 90577 1 221 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.386 -0.676 17919 90578 1 221 . 1 1 28 28 ALA H H 28 8.060 8.060 7.848 0.212 17919 90579 1 221 . 1 1 29 29 LYS N N 29 119.940 119.940 118.960 0.980 17919 90580 1 221 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.034 0.173 17919 90581 1 221 . 1 1 29 29 LYS C C 29 180.320 180.320 179.102 1.218 17919 90582 1 221 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.385 0.265 17919 90583 1 221 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.351 0.939 17919 90584 1 221 . 1 1 29 29 LYS H H 29 7.850 7.850 7.786 0.064 17919 90585 1 221 . 1 1 30 30 ILE N N 30 121.080 121.080 120.235 0.845 17919 90586 1 221 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.627 -0.120 17919 90587 1 221 . 1 1 30 30 ILE C C 30 178.310 178.310 177.252 1.058 17919 90588 1 221 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.508 0.642 17919 90589 1 221 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.874 -1.074 17919 90590 1 221 . 1 1 30 30 ILE H H 30 8.280 8.280 7.713 0.567 17919 90591 1 221 . 1 1 31 31 GLN N N 31 123.490 123.490 120.607 2.883 17919 90592 1 221 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.145 -0.316 17919 90593 1 221 . 1 1 31 31 GLN C C 31 178.890 178.890 178.408 0.482 17919 90594 1 221 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.153 0.847 17919 90595 1 221 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.521 -0.801 17919 90596 1 221 . 1 1 31 31 GLN H H 31 8.580 8.580 8.083 0.497 17919 90597 1 221 . 1 1 32 32 ASP N N 32 119.360 119.360 119.779 -0.419 17919 90598 1 221 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.380 -0.026 17919 90599 1 221 . 1 1 32 32 ASP C C 32 177.250 177.250 177.536 -0.286 17919 90600 1 221 . 1 1 32 32 ASP CA C 32 57.190 57.190 57.048 0.142 17919 90601 1 221 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.880 -0.300 17919 90602 1 221 . 1 1 32 32 ASP H H 32 8.010 8.010 8.064 -0.054 17919 90603 1 221 . 1 1 33 33 LYS N N 33 115.130 115.130 117.577 -2.447 17919 90604 1 221 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.238 0.099 17919 90605 1 221 . 1 1 33 33 LYS C C 33 177.870 177.870 177.782 0.088 17919 90606 1 221 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.864 0.186 17919 90607 1 221 . 1 1 33 33 LYS CB C 33 34.170 34.170 32.503 1.667 17919 90608 1 221 . 1 1 33 33 LYS H H 33 7.430 7.430 7.725 -0.295 17919 90609 1 221 . 1 1 34 34 GLU N N 34 113.870 113.870 115.323 -1.453 17919 90610 1 221 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.476 0.149 17919 90611 1 221 . 1 1 34 34 GLU C C 34 177.840 177.840 177.519 0.321 17919 90612 1 221 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.967 -0.797 17919 90613 1 221 . 1 1 34 34 GLU CB C 34 32.660 32.660 30.430 2.230 17919 90614 1 221 . 1 1 34 34 GLU H H 34 8.740 8.740 7.983 0.757 17919 90615 1 221 . 1 1 35 35 GLY N N 35 108.650 108.650 108.364 0.286 17919 90616 1 221 . 1 1 35 35 GLY C C 35 173.960 173.960 174.136 -0.176 17919 90617 1 221 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.784 0.296 17919 90618 1 221 . 1 1 35 35 GLY H H 35 8.530 8.530 8.395 0.135 17919 90619 1 221 . 1 1 36 36 ILE N N 36 119.880 119.880 121.442 -1.562 17919 90620 1 221 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.487 -0.042 17919 90621 1 221 . 1 1 36 36 ILE C C 36 173.590 173.590 174.173 -0.583 17919 90622 1 221 . 1 1 36 36 ILE CA C 36 57.750 57.750 56.292 1.458 17919 90623 1 221 . 1 1 36 36 ILE CB C 36 40.580 40.580 37.433 3.147 17919 90624 1 221 . 1 1 36 36 ILE H H 36 6.150 6.150 7.709 -1.559 17919 90625 1 221 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.638 -0.004 17919 90626 1 221 . 1 1 37 37 PRO C C 37 176.940 176.940 176.600 0.340 17919 90627 1 221 . 1 1 37 37 PRO CA C 37 61.660 61.660 62.188 -0.528 17919 90628 1 221 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.272 0.578 17919 90629 1 221 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.261 -0.144 17919 90630 1 221 . 1 1 38 38 PRO C C 38 178.320 178.320 178.325 -0.005 17919 90631 1 221 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.562 0.698 17919 90632 1 221 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.933 0.957 17919 90633 1 221 . 1 1 39 39 ASP N N 39 113.380 113.380 118.284 -4.904 17919 90634 1 221 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.411 0.019 17919 90635 1 221 . 1 1 39 39 ASP C C 39 177.090 177.090 178.035 -0.945 17919 90636 1 221 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.840 -1.200 17919 90637 1 221 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.554 -1.014 17919 90638 1 221 . 1 1 39 39 ASP H H 39 8.550 8.550 8.677 -0.127 17919 90639 1 221 . 1 1 40 40 GLN N N 40 116.780 116.780 117.718 -0.938 17919 90640 1 221 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.156 0.308 17919 90641 1 221 . 1 1 40 40 GLN C C 40 175.380 175.380 176.968 -1.588 17919 90642 1 221 . 1 1 40 40 GLN CA C 40 55.640 55.640 57.475 -1.835 17919 90643 1 221 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.485 0.655 17919 90644 1 221 . 1 1 40 40 GLN H H 40 7.820 7.820 7.956 -0.136 17919 90645 1 221 . 1 1 41 41 GLN N N 41 117.720 117.720 118.705 -0.985 17919 90646 1 221 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.584 -0.340 17919 90647 1 221 . 1 1 41 41 GLN C C 41 176.300 176.300 175.498 0.802 17919 90648 1 221 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.890 0.580 17919 90649 1 221 . 1 1 41 41 GLN CB C 41 31.650 31.650 28.924 2.726 17919 90650 1 221 . 1 1 41 41 GLN H H 41 7.480 7.480 7.305 0.175 17919 90651 1 221 . 1 1 42 42 ARG N N 42 122.680 122.680 125.519 -2.839 17919 90652 1 221 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.574 -0.074 17919 90653 1 221 . 1 1 42 42 ARG C C 42 174.050 174.050 174.528 -0.478 17919 90654 1 221 . 1 1 42 42 ARG CA C 42 55.050 55.050 53.891 1.159 17919 90655 1 221 . 1 1 42 42 ARG CB C 42 31.750 31.750 30.904 0.846 17919 90656 1 221 . 1 1 42 42 ARG H H 42 8.530 8.530 8.324 0.206 17919 90657 1 221 . 1 1 43 43 LEU N N 43 124.040 124.040 126.632 -2.592 17919 90658 1 221 . 1 1 43 43 LEU C C 43 175.290 175.290 175.993 -0.703 17919 90659 1 221 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.837 -0.858 17919 90660 1 221 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.655 2.135 17919 90661 1 221 . 1 1 43 43 LEU H H 43 8.820 8.820 8.792 0.028 17919 90662 1 221 . 1 1 44 44 ILE N N 44 121.920 121.920 122.211 -0.291 17919 90663 1 221 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.000 -0.008 17919 90664 1 221 . 1 1 44 44 ILE C C 44 176.060 176.060 174.720 1.340 17919 90665 1 221 . 1 1 44 44 ILE CA C 44 58.980 58.980 57.836 1.145 17919 90666 1 221 . 1 1 44 44 ILE CB C 44 41.420 41.420 39.570 1.850 17919 90667 1 221 . 1 1 44 44 ILE H H 44 9.030 9.030 9.118 -0.088 17919 90668 1 221 . 1 1 45 45 PHE N N 45 125.390 125.390 127.178 -1.788 17919 90669 1 221 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.910 0.135 17919 90670 1 221 . 1 1 45 45 PHE C C 45 174.470 174.470 175.422 -0.952 17919 90671 1 221 . 1 1 45 45 PHE CA C 45 57.020 57.020 55.420 1.599 17919 90672 1 221 . 1 1 45 45 PHE CB C 45 43.760 43.760 41.627 2.133 17919 90673 1 221 . 1 1 45 45 PHE H H 45 8.830 8.830 8.843 -0.013 17919 90674 1 221 . 1 1 46 46 ALA N N 46 132.200 132.200 130.779 1.421 17919 90675 1 221 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.680 0.010 17919 90676 1 221 . 1 1 46 46 ALA C C 46 177.290 177.290 177.351 -0.061 17919 90677 1 221 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.761 -0.221 17919 90678 1 221 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.211 0.359 17919 90679 1 221 . 1 1 46 46 ALA H H 46 8.810 8.810 9.124 -0.314 17919 90680 1 221 . 1 1 47 47 GLY N N 47 102.340 102.340 103.174 -0.834 17919 90681 1 221 . 1 1 47 47 GLY C C 47 173.810 173.810 173.963 -0.153 17919 90682 1 221 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.630 0.720 17919 90683 1 221 . 1 1 47 47 GLY H H 47 8.130 8.130 8.328 -0.198 17919 90684 1 221 . 1 1 48 48 LYS N N 48 121.570 121.570 121.927 -0.357 17919 90685 1 221 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.624 -0.002 17919 90686 1 221 . 1 1 48 48 LYS C C 48 174.700 174.700 175.286 -0.586 17919 90687 1 221 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.930 -0.380 17919 90688 1 221 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.301 0.229 17919 90689 1 221 . 1 1 48 48 LYS H H 48 7.980 7.980 8.017 -0.037 17919 90690 1 221 . 1 1 49 49 GLN N N 49 122.410 122.410 124.474 -2.064 17919 90691 1 221 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.636 -0.076 17919 90692 1 221 . 1 1 49 49 GLN C C 49 175.670 175.670 175.769 -0.099 17919 90693 1 221 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.801 -0.061 17919 90694 1 221 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.556 -0.556 17919 90695 1 221 . 1 1 49 49 GLN H H 49 8.600 8.600 8.572 0.028 17919 90696 1 221 . 1 1 50 50 LEU N N 50 125.520 125.520 127.089 -1.569 17919 90697 1 221 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.190 -0.100 17919 90698 1 221 . 1 1 50 50 LEU C C 50 176.660 176.660 176.612 0.048 17919 90699 1 221 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.209 0.031 17919 90700 1 221 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.147 -0.577 17919 90701 1 221 . 1 1 50 50 LEU H H 50 8.530 8.530 8.050 0.480 17919 90702 1 221 . 1 1 51 51 GLU N N 51 122.940 122.940 123.674 -0.734 17919 90703 1 221 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.514 -0.026 17919 90704 1 221 . 1 1 51 51 GLU C C 51 175.870 175.870 176.997 -1.127 17919 90705 1 221 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.636 0.324 17919 90706 1 221 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.038 0.532 17919 90707 1 221 . 1 1 51 51 GLU H H 51 8.400 8.400 8.630 -0.230 17919 90708 1 221 . 1 1 52 52 ASP N N 52 120.030 120.030 123.965 -3.935 17919 90709 1 221 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.433 -0.074 17919 90710 1 221 . 1 1 52 52 ASP C C 52 177.330 177.330 177.363 -0.033 17919 90711 1 221 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.235 -0.275 17919 90712 1 221 . 1 1 52 52 ASP CB C 52 40.850 40.850 41.098 -0.248 17919 90713 1 221 . 1 1 52 52 ASP H H 52 8.160 8.160 8.822 -0.662 17919 90714 1 221 . 1 1 53 53 GLY N N 53 106.660 106.660 105.397 1.263 17919 90715 1 221 . 1 1 53 53 GLY C C 53 174.870 174.870 173.971 0.899 17919 90716 1 221 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.643 0.527 17919 90717 1 221 . 1 1 53 53 GLY H H 53 9.390 9.390 8.473 0.917 17919 90718 1 221 . 1 1 54 54 ARG N N 54 119.050 119.050 120.916 -1.866 17919 90719 1 221 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.735 -0.040 17919 90720 1 221 . 1 1 54 54 ARG C C 54 175.350 175.350 175.571 -0.221 17919 90721 1 221 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.448 -0.058 17919 90722 1 221 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.278 -0.628 17919 90723 1 221 . 1 1 54 54 ARG H H 54 7.460 7.460 7.484 -0.024 17919 90724 1 221 . 1 1 55 55 THR N N 55 108.400 108.400 111.629 -3.229 17919 90725 1 221 . 1 1 55 55 THR HA H 55 5.240 5.240 5.045 0.195 17919 90726 1 221 . 1 1 55 55 THR C C 55 176.560 176.560 176.144 0.416 17919 90727 1 221 . 1 1 55 55 THR CA C 55 59.690 59.690 60.480 -0.790 17919 90728 1 221 . 1 1 55 55 THR CB C 55 72.260 72.260 71.046 1.214 17919 90729 1 221 . 1 1 55 55 THR H H 55 8.730 8.730 9.071 -0.341 17919 90730 1 221 . 1 1 56 56 LEU N N 56 117.920 117.920 122.338 -4.418 17919 90731 1 221 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.883 0.177 17919 90732 1 221 . 1 1 56 56 LEU C C 56 180.810 180.810 178.809 2.001 17919 90733 1 221 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.937 -0.227 17919 90734 1 221 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.601 -1.231 17919 90735 1 221 . 1 1 56 56 LEU H H 56 8.140 8.140 8.940 -0.800 17919 90736 1 221 . 1 1 57 57 SER N N 57 113.330 113.330 114.736 -1.406 17919 90737 1 221 . 1 1 57 57 SER HA H 57 4.370 4.370 4.144 0.226 17919 90738 1 221 . 1 1 57 57 SER C C 57 178.310 178.310 176.790 1.520 17919 90739 1 221 . 1 1 57 57 SER CA C 57 61.080 61.080 62.239 -1.159 17919 90740 1 221 . 1 1 57 57 SER CB C 57 62.530 62.530 62.772 -0.242 17919 90741 1 221 . 1 1 57 57 SER H H 57 8.470 8.470 8.319 0.151 17919 90742 1 221 . 1 1 58 58 ASP N N 58 124.190 124.190 120.544 3.646 17919 90743 1 221 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.396 -0.100 17919 90744 1 221 . 1 1 58 58 ASP C C 58 177.400 177.400 176.853 0.547 17919 90745 1 221 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.443 0.737 17919 90746 1 221 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.176 -0.076 17919 90747 1 221 . 1 1 58 58 ASP H H 58 7.930 7.930 7.797 0.133 17919 90748 1 221 . 1 1 59 59 TYR N N 59 115.510 115.510 115.854 -0.344 17919 90749 1 221 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.626 0.044 17919 90750 1 221 . 1 1 59 59 TYR C C 59 174.700 174.700 174.900 -0.200 17919 90751 1 221 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.690 0.560 17919 90752 1 221 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.935 1.135 17919 90753 1 221 . 1 1 59 59 TYR H H 59 7.250 7.250 7.319 -0.069 17919 90754 1 221 . 1 1 60 60 ASN N N 60 115.900 115.900 114.427 1.473 17919 90755 1 221 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.359 -0.004 17919 90756 1 221 . 1 1 60 60 ASN C C 60 174.340 174.340 174.281 0.059 17919 90757 1 221 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.344 -0.224 17919 90758 1 221 . 1 1 60 60 ASN CB C 60 37.410 37.410 36.631 0.779 17919 90759 1 221 . 1 1 60 60 ASN H H 60 8.150 8.150 7.993 0.157 17919 90760 1 221 . 1 1 61 61 ILE N N 61 118.600 118.600 120.859 -2.259 17919 90761 1 221 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.802 -0.409 17919 90762 1 221 . 1 1 61 61 ILE C C 61 174.610 174.610 175.292 -0.682 17919 90763 1 221 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.262 1.158 17919 90764 1 221 . 1 1 61 61 ILE CB C 61 36.740 36.740 36.958 -0.217 17919 90765 1 221 . 1 1 61 61 ILE H H 61 7.250 7.250 7.809 -0.559 17919 90766 1 221 . 1 1 62 62 GLN N N 62 124.740 124.740 126.122 -1.382 17919 90767 1 221 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.597 -0.091 17919 90768 1 221 . 1 1 62 62 GLN C C 62 175.970 175.970 176.000 -0.030 17919 90769 1 221 . 1 1 62 62 GLN CA C 62 53.660 53.660 54.214 -0.554 17919 90770 1 221 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.637 0.013 17919 90771 1 221 . 1 1 62 62 GLN H H 62 7.610 7.610 8.066 -0.456 17919 90772 1 221 . 1 1 63 63 LYS N N 63 120.300 120.300 122.236 -1.936 17919 90773 1 221 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.024 -0.023 17919 90774 1 221 . 1 1 63 63 LYS C C 63 175.810 175.810 176.788 -0.978 17919 90775 1 221 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.221 0.569 17919 90776 1 221 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.779 0.871 17919 90777 1 221 . 1 1 63 63 LYS H H 63 8.490 8.490 8.565 -0.075 17919 90778 1 221 . 1 1 64 64 GLU N N 64 113.950 113.950 119.119 -5.169 17919 90779 1 221 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.233 0.232 17919 90780 1 221 . 1 1 64 64 GLU C C 64 175.250 175.250 176.082 -0.832 17919 90781 1 221 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.780 0.110 17919 90782 1 221 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.449 -2.549 17919 90783 1 221 . 1 1 64 64 GLU H H 64 9.280 9.280 8.967 0.313 17919 90784 1 221 . 1 1 65 65 SER N N 65 114.730 114.730 115.834 -1.104 17919 90785 1 221 . 1 1 65 65 SER HA H 65 4.640 4.640 4.486 0.154 17919 90786 1 221 . 1 1 65 65 SER C C 65 172.160 172.160 174.143 -1.983 17919 90787 1 221 . 1 1 65 65 SER CA C 65 60.890 60.890 59.850 1.040 17919 90788 1 221 . 1 1 65 65 SER CB C 65 64.910 64.910 64.006 0.904 17919 90789 1 221 . 1 1 65 65 SER H H 65 7.670 7.670 7.526 0.144 17919 90790 1 221 . 1 1 66 66 THR N N 66 117.110 117.110 119.985 -2.875 17919 90791 1 221 . 1 1 66 66 THR HA H 66 5.270 5.270 4.942 0.328 17919 90792 1 221 . 1 1 66 66 THR C C 66 173.950 173.950 173.683 0.267 17919 90793 1 221 . 1 1 66 66 THR CA C 66 62.340 62.340 62.216 0.124 17919 90794 1 221 . 1 1 66 66 THR CB C 66 70.080 70.080 69.777 0.303 17919 90795 1 221 . 1 1 66 66 THR H H 66 8.730 8.730 8.525 0.205 17919 90796 1 221 . 1 1 67 67 LEU N N 67 127.110 127.110 127.432 -0.322 17919 90797 1 221 . 1 1 67 67 LEU HA H 67 5.060 5.060 5.043 0.017 17919 90798 1 221 . 1 1 67 67 LEU C C 67 175.770 175.770 175.354 0.416 17919 90799 1 221 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.841 0.059 17919 90800 1 221 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.175 0.085 17919 90801 1 221 . 1 1 67 67 LEU H H 67 9.410 9.410 9.058 0.352 17919 90802 1 221 . 1 1 68 68 HIS N N 68 118.380 118.380 123.104 -4.724 17919 90803 1 221 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.395 -0.155 17919 90804 1 221 . 1 1 68 68 HIS C C 68 173.150 173.150 173.806 -0.656 17919 90805 1 221 . 1 1 68 68 HIS CA C 68 55.000 55.000 55.131 -0.131 17919 90806 1 221 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.321 -1.791 17919 90807 1 221 . 1 1 68 68 HIS H H 68 9.230 9.230 9.154 0.076 17919 90808 1 221 . 1 1 69 69 LEU N N 69 124.460 124.460 129.955 -5.495 17919 90809 1 221 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.151 0.039 17919 90810 1 221 . 1 1 69 69 LEU C C 69 175.270 175.270 174.328 0.942 17919 90811 1 221 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.556 0.334 17919 90812 1 221 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.465 -0.085 17919 90813 1 221 . 1 1 69 69 LEU H H 69 8.340 8.340 8.479 -0.139 17919 90814 1 221 . 1 1 70 70 VAL N N 70 126.940 126.940 127.084 -0.144 17919 90815 1 221 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.515 -0.165 17919 90816 1 221 . 1 1 70 70 VAL C C 70 174.000 174.000 174.971 -0.971 17919 90817 1 221 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.550 0.250 17919 90818 1 221 . 1 1 70 70 VAL CB C 70 34.910 34.910 34.416 0.494 17919 90819 1 221 . 1 1 70 70 VAL H H 70 9.200 9.200 8.919 0.281 17919 90820 1 221 . 1 1 71 71 LEU N N 71 123.130 123.130 123.530 -0.400 17919 90821 1 221 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.907 0.153 17919 90822 1 221 . 1 1 71 71 LEU C C 71 177.830 177.830 177.000 0.830 17919 90823 1 221 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.589 0.351 17919 90824 1 221 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.449 -0.599 17919 90825 1 221 . 1 1 71 71 LEU H H 71 8.120 8.120 8.394 -0.274 17919 90826 1 221 . 1 1 72 72 ARG N N 72 123.490 123.490 121.423 2.067 17919 90827 1 221 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.352 -0.051 17919 90828 1 221 . 1 1 72 72 ARG C C 72 175.350 175.350 175.893 -0.543 17919 90829 1 221 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.786 -0.176 17919 90830 1 221 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.828 0.523 17919 90831 1 221 . 1 1 72 72 ARG H H 72 8.580 8.580 8.074 0.506 17919 90832 1 222 . 1 1 2 2 GLN N N 2 123.220 123.220 125.900 -2.680 17919 90833 1 222 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.371 -0.122 17919 90834 1 222 . 1 1 2 2 GLN C C 2 175.920 175.920 174.406 1.514 17919 90835 1 222 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.417 0.663 17919 90836 1 222 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.748 0.012 17919 90837 1 222 . 1 1 2 2 GLN H H 2 8.900 8.900 8.602 0.298 17919 90838 1 222 . 1 1 3 3 ILE N N 3 115.340 115.340 118.699 -3.359 17919 90839 1 222 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.722 -0.509 17919 90840 1 222 . 1 1 3 3 ILE C C 3 172.450 172.450 173.344 -0.894 17919 90841 1 222 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.448 0.122 17919 90842 1 222 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.869 0.341 17919 90843 1 222 . 1 1 3 3 ILE H H 3 8.320 8.320 8.110 0.210 17919 90844 1 222 . 1 1 4 4 PHE N N 4 118.110 118.110 121.030 -2.920 17919 90845 1 222 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.478 0.152 17919 90846 1 222 . 1 1 4 4 PHE C C 4 175.320 175.320 175.299 0.021 17919 90847 1 222 . 1 1 4 4 PHE CA C 4 55.210 55.210 56.308 -1.098 17919 90848 1 222 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.289 -0.809 17919 90849 1 222 . 1 1 4 4 PHE H H 4 8.610 8.610 8.461 0.149 17919 90850 1 222 . 1 1 5 5 VAL N N 5 121.000 121.000 117.347 3.653 17919 90851 1 222 . 1 1 5 5 VAL HA H 5 4.725 4.725 5.086 -0.361 17919 90852 1 222 . 1 1 5 5 VAL C C 5 174.870 174.870 174.500 0.370 17919 90853 1 222 . 1 1 5 5 VAL CA C 5 60.620 60.620 60.121 0.499 17919 90854 1 222 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.643 -0.413 17919 90855 1 222 . 1 1 5 5 VAL H H 5 9.300 9.300 9.205 0.095 17919 90856 1 222 . 1 1 6 6 LYS N N 6 127.520 127.520 128.310 -0.790 17919 90857 1 222 . 1 1 6 6 LYS HA H 6 5.367 5.367 4.642 0.725 17919 90858 1 222 . 1 1 6 6 LYS C C 6 177.140 177.140 176.063 1.077 17919 90859 1 222 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.540 -0.020 17919 90860 1 222 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.570 0.480 17919 90861 1 222 . 1 1 6 6 LYS H H 6 8.820 8.820 9.081 -0.261 17919 90862 1 222 . 1 1 7 7 THR N N 7 115.400 115.400 119.431 -4.031 17919 90863 1 222 . 1 1 7 7 THR HA H 7 4.970 4.970 4.469 0.501 17919 90864 1 222 . 1 1 7 7 THR C C 7 176.910 176.910 176.285 0.625 17919 90865 1 222 . 1 1 7 7 THR CA C 7 60.470 60.470 62.205 -1.735 17919 90866 1 222 . 1 1 7 7 THR CB C 7 70.630 70.630 70.179 0.451 17919 90867 1 222 . 1 1 7 7 THR H H 7 8.730 8.730 8.210 0.520 17919 90868 1 222 . 1 1 8 8 LEU N N 8 121.330 121.330 124.358 -3.028 17919 90869 1 222 . 1 1 8 8 LEU HA H 8 4.310 4.310 3.984 0.326 17919 90870 1 222 . 1 1 8 8 LEU C C 8 178.800 178.800 177.275 1.525 17919 90871 1 222 . 1 1 8 8 LEU CA C 8 57.580 57.580 58.083 -0.502 17919 90872 1 222 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.020 -0.050 17919 90873 1 222 . 1 1 8 8 LEU H H 8 9.100 9.100 8.465 0.635 17919 90874 1 222 . 1 1 9 9 THR N N 9 105.590 105.590 106.694 -1.104 17919 90875 1 222 . 1 1 9 9 THR HA H 9 4.428 4.428 4.287 0.141 17919 90876 1 222 . 1 1 9 9 THR C C 9 175.520 175.520 175.347 0.173 17919 90877 1 222 . 1 1 9 9 THR CA C 9 61.400 61.400 62.208 -0.808 17919 90878 1 222 . 1 1 9 9 THR CB C 9 69.140 69.140 68.729 0.411 17919 90879 1 222 . 1 1 9 9 THR H H 9 7.630 7.630 7.670 -0.040 17919 90880 1 222 . 1 1 10 10 GLY N N 10 108.890 108.890 111.492 -2.602 17919 90881 1 222 . 1 1 10 10 GLY C C 10 174.070 174.070 173.244 0.826 17919 90882 1 222 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.904 0.556 17919 90883 1 222 . 1 1 10 10 GLY H H 10 7.810 7.810 7.879 -0.069 17919 90884 1 222 . 1 1 11 11 LYS N N 11 121.600 121.600 120.195 1.405 17919 90885 1 222 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.587 -0.226 17919 90886 1 222 . 1 1 11 11 LYS C C 11 175.940 175.940 175.423 0.517 17919 90887 1 222 . 1 1 11 11 LYS CA C 11 56.280 56.280 55.247 1.033 17919 90888 1 222 . 1 1 11 11 LYS CB C 11 33.200 33.200 35.599 -2.399 17919 90889 1 222 . 1 1 11 11 LYS H H 11 7.280 7.280 8.087 -0.807 17919 90890 1 222 . 1 1 12 12 THR N N 12 120.440 120.440 118.264 2.176 17919 90891 1 222 . 1 1 12 12 THR HA H 12 5.046 5.046 4.828 0.218 17919 90892 1 222 . 1 1 12 12 THR C C 12 174.320 174.320 175.100 -0.780 17919 90893 1 222 . 1 1 12 12 THR CA C 12 62.390 62.390 63.014 -0.624 17919 90894 1 222 . 1 1 12 12 THR CB C 12 69.910 69.910 69.203 0.707 17919 90895 1 222 . 1 1 12 12 THR H H 12 8.650 8.650 8.536 0.114 17919 90896 1 222 . 1 1 13 13 ILE N N 13 127.110 127.110 127.591 -0.481 17919 90897 1 222 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.408 0.136 17919 90898 1 222 . 1 1 13 13 ILE C C 13 175.220 175.220 175.463 -0.243 17919 90899 1 222 . 1 1 13 13 ILE CA C 13 59.980 59.980 61.045 -1.065 17919 90900 1 222 . 1 1 13 13 ILE CB C 13 40.950 40.950 39.893 1.057 17919 90901 1 222 . 1 1 13 13 ILE H H 13 9.450 9.450 8.781 0.669 17919 90902 1 222 . 1 1 14 14 THR N N 14 121.520 121.520 122.744 -1.224 17919 90903 1 222 . 1 1 14 14 THR HA H 14 4.964 4.964 4.920 0.044 17919 90904 1 222 . 1 1 14 14 THR C C 14 173.790 173.790 173.919 -0.129 17919 90905 1 222 . 1 1 14 14 THR CA C 14 61.940 61.940 61.634 0.306 17919 90906 1 222 . 1 1 14 14 THR CB C 14 69.650 69.650 69.656 -0.006 17919 90907 1 222 . 1 1 14 14 THR H H 14 8.710 8.710 8.308 0.402 17919 90908 1 222 . 1 1 15 15 LEU N N 15 124.800 124.800 127.619 -2.819 17919 90909 1 222 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.682 0.098 17919 90910 1 222 . 1 1 15 15 LEU C C 15 174.670 174.670 175.463 -0.793 17919 90911 1 222 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.586 -0.756 17919 90912 1 222 . 1 1 15 15 LEU CB C 15 47.070 47.070 44.717 2.353 17919 90913 1 222 . 1 1 15 15 LEU H H 15 8.710 8.710 8.862 -0.152 17919 90914 1 222 . 1 1 16 16 GLU N N 16 122.160 122.160 121.943 0.217 17919 90915 1 222 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.424 -0.507 17919 90916 1 222 . 1 1 16 16 GLU C C 16 175.860 175.860 176.033 -0.173 17919 90917 1 222 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.172 -0.352 17919 90918 1 222 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.911 -1.461 17919 90919 1 222 . 1 1 16 16 GLU H H 16 8.140 8.140 8.587 -0.447 17919 90920 1 222 . 1 1 17 17 VAL N N 17 117.210 117.210 118.400 -1.190 17919 90921 1 222 . 1 1 17 17 VAL HA H 17 4.714 4.714 5.095 -0.381 17919 90922 1 222 . 1 1 17 17 VAL C C 17 174.160 174.160 174.299 -0.139 17919 90923 1 222 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.113 -0.683 17919 90924 1 222 . 1 1 17 17 VAL CB C 17 36.400 36.400 36.054 0.346 17919 90925 1 222 . 1 1 17 17 VAL H H 17 8.900 8.900 8.640 0.260 17919 90926 1 222 . 1 1 18 18 GLU N N 18 118.990 118.990 121.081 -2.091 17919 90927 1 222 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.876 0.203 17919 90928 1 222 . 1 1 18 18 GLU C C 18 176.160 176.160 175.137 1.023 17919 90929 1 222 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.039 -0.319 17919 90930 1 222 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.125 0.185 17919 90931 1 222 . 1 1 18 18 GLU H H 18 8.640 8.640 9.300 -0.660 17919 90932 1 222 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.333 -0.192 17919 90933 1 222 . 1 1 19 19 PRO C C 19 175.310 175.310 177.307 -1.997 17919 90934 1 222 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.115 0.355 17919 90935 1 222 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.728 0.222 17919 90936 1 222 . 1 1 20 20 SER N N 20 103.400 103.400 110.774 -7.374 17919 90937 1 222 . 1 1 20 20 SER HA H 20 4.370 4.370 4.321 0.049 17919 90938 1 222 . 1 1 20 20 SER C C 20 174.660 174.660 173.745 0.915 17919 90939 1 222 . 1 1 20 20 SER CA C 20 57.400 57.400 59.371 -1.971 17919 90940 1 222 . 1 1 20 20 SER CB C 20 63.370 63.370 63.197 0.173 17919 90941 1 222 . 1 1 20 20 SER H H 20 7.040 7.040 8.095 -1.055 17919 90942 1 222 . 1 1 21 21 ASP N N 21 123.480 123.480 122.786 0.694 17919 90943 1 222 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.688 0.007 17919 90944 1 222 . 1 1 21 21 ASP C C 21 176.360 176.360 175.983 0.377 17919 90945 1 222 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.402 0.298 17919 90946 1 222 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.544 -0.744 17919 90947 1 222 . 1 1 21 21 ASP H H 21 8.030 8.030 7.746 0.284 17919 90948 1 222 . 1 1 22 22 THR N N 22 108.800 108.800 113.421 -4.621 17919 90949 1 222 . 1 1 22 22 THR HA H 22 4.920 4.920 4.967 -0.047 17919 90950 1 222 . 1 1 22 22 THR C C 22 176.750 176.750 176.227 0.523 17919 90951 1 222 . 1 1 22 22 THR CA C 22 59.690 59.690 61.230 -1.540 17919 90952 1 222 . 1 1 22 22 THR CB C 22 71.200 71.200 70.853 0.347 17919 90953 1 222 . 1 1 22 22 THR H H 22 7.900 7.900 8.249 -0.349 17919 90954 1 222 . 1 1 23 23 ILE N N 23 121.190 121.190 122.364 -1.174 17919 90955 1 222 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.774 -0.117 17919 90956 1 222 . 1 1 23 23 ILE C C 23 179.040 179.040 177.745 1.295 17919 90957 1 222 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.767 -1.507 17919 90958 1 222 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.634 -2.284 17919 90959 1 222 . 1 1 23 23 ILE H H 23 8.560 8.560 8.403 0.157 17919 90960 1 222 . 1 1 24 24 GLU N N 24 120.830 120.830 121.229 -0.399 17919 90961 1 222 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.842 0.075 17919 90962 1 222 . 1 1 24 24 GLU C C 24 178.640 178.640 178.348 0.292 17919 90963 1 222 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.235 -0.015 17919 90964 1 222 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.375 -1.095 17919 90965 1 222 . 1 1 24 24 GLU H H 24 9.760 9.760 8.152 1.608 17919 90966 1 222 . 1 1 25 25 ASN N N 25 120.570 120.570 117.490 3.080 17919 90967 1 222 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.512 0.013 17919 90968 1 222 . 1 1 25 25 ASN C C 25 178.380 178.380 178.071 0.309 17919 90969 1 222 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.069 -0.009 17919 90970 1 222 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.723 -0.273 17919 90971 1 222 . 1 1 25 25 ASN H H 25 7.920 7.920 7.991 -0.071 17919 90972 1 222 . 1 1 26 26 VAL N N 26 121.710 121.710 120.899 0.811 17919 90973 1 222 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.680 -0.283 17919 90974 1 222 . 1 1 26 26 VAL C C 26 177.950 177.950 177.772 0.178 17919 90975 1 222 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.211 1.449 17919 90976 1 222 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.290 -0.450 17919 90977 1 222 . 1 1 26 26 VAL H H 26 8.070 8.070 7.924 0.146 17919 90978 1 222 . 1 1 27 27 LYS N N 27 118.860 118.860 120.182 -1.322 17919 90979 1 222 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.293 0.287 17919 90980 1 222 . 1 1 27 27 LYS C C 27 180.550 180.550 179.176 1.374 17919 90981 1 222 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.644 -0.394 17919 90982 1 222 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.347 1.383 17919 90983 1 222 . 1 1 27 27 LYS H H 27 8.560 8.560 8.429 0.131 17919 90984 1 222 . 1 1 28 28 ALA N N 28 123.440 123.440 121.877 1.563 17919 90985 1 222 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.263 -0.103 17919 90986 1 222 . 1 1 28 28 ALA C C 28 180.300 180.300 179.212 1.088 17919 90987 1 222 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.531 0.839 17919 90988 1 222 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.585 -0.875 17919 90989 1 222 . 1 1 28 28 ALA H H 28 8.060 8.060 8.554 -0.494 17919 90990 1 222 . 1 1 29 29 LYS N N 29 119.940 119.940 119.950 -0.010 17919 90991 1 222 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.005 0.202 17919 90992 1 222 . 1 1 29 29 LYS C C 29 180.320 180.320 179.145 1.175 17919 90993 1 222 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.333 0.317 17919 90994 1 222 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.435 0.855 17919 90995 1 222 . 1 1 29 29 LYS H H 29 7.850 7.850 7.756 0.094 17919 90996 1 222 . 1 1 30 30 ILE N N 30 121.080 121.080 119.911 1.169 17919 90997 1 222 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.677 -0.170 17919 90998 1 222 . 1 1 30 30 ILE C C 30 178.310 178.310 177.339 0.971 17919 90999 1 222 . 1 1 30 30 ILE CA C 30 66.150 66.150 64.832 1.318 17919 91000 1 222 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.857 -1.057 17919 91001 1 222 . 1 1 30 30 ILE H H 30 8.280 8.280 8.197 0.083 17919 91002 1 222 . 1 1 31 31 GLN N N 31 123.490 123.490 120.506 2.984 17919 91003 1 222 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.051 -0.222 17919 91004 1 222 . 1 1 31 31 GLN C C 31 178.890 178.890 177.626 1.264 17919 91005 1 222 . 1 1 31 31 GLN CA C 31 60.000 60.000 58.809 1.192 17919 91006 1 222 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.633 -0.912 17919 91007 1 222 . 1 1 31 31 GLN H H 31 8.580 8.580 8.169 0.411 17919 91008 1 222 . 1 1 32 32 ASP N N 32 119.360 119.360 117.799 1.561 17919 91009 1 222 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.489 -0.135 17919 91010 1 222 . 1 1 32 32 ASP C C 32 177.250 177.250 177.759 -0.509 17919 91011 1 222 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.246 0.944 17919 91012 1 222 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.941 -0.361 17919 91013 1 222 . 1 1 32 32 ASP H H 32 8.010 8.010 7.791 0.219 17919 91014 1 222 . 1 1 33 33 LYS N N 33 115.130 115.130 119.033 -3.903 17919 91015 1 222 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.334 0.003 17919 91016 1 222 . 1 1 33 33 LYS C C 33 177.870 177.870 177.864 0.006 17919 91017 1 222 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.715 0.335 17919 91018 1 222 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.499 0.671 17919 91019 1 222 . 1 1 33 33 LYS H H 33 7.430 7.430 7.544 -0.114 17919 91020 1 222 . 1 1 34 34 GLU N N 34 113.870 113.870 114.200 -0.330 17919 91021 1 222 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.582 0.043 17919 91022 1 222 . 1 1 34 34 GLU C C 34 177.840 177.840 176.421 1.419 17919 91023 1 222 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.867 -0.697 17919 91024 1 222 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.209 1.451 17919 91025 1 222 . 1 1 34 34 GLU H H 34 8.740 8.740 8.135 0.605 17919 91026 1 222 . 1 1 35 35 GLY N N 35 108.650 108.650 108.288 0.362 17919 91027 1 222 . 1 1 35 35 GLY C C 35 173.960 173.960 174.607 -0.647 17919 91028 1 222 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.651 0.429 17919 91029 1 222 . 1 1 35 35 GLY H H 35 8.530 8.530 7.790 0.740 17919 91030 1 222 . 1 1 36 36 ILE N N 36 119.880 119.880 122.060 -2.180 17919 91031 1 222 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.282 0.163 17919 91032 1 222 . 1 1 36 36 ILE C C 36 173.590 173.590 174.009 -0.419 17919 91033 1 222 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.473 -0.723 17919 91034 1 222 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.178 2.402 17919 91035 1 222 . 1 1 36 36 ILE H H 36 6.150 6.150 7.748 -1.598 17919 91036 1 222 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.578 0.056 17919 91037 1 222 . 1 1 37 37 PRO C C 37 176.940 176.940 175.880 1.060 17919 91038 1 222 . 1 1 37 37 PRO CA C 37 61.660 61.660 62.423 -0.763 17919 91039 1 222 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.246 0.604 17919 91040 1 222 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.122 -0.005 17919 91041 1 222 . 1 1 38 38 PRO C C 38 178.320 178.320 178.550 -0.230 17919 91042 1 222 . 1 1 38 38 PRO CA C 38 66.260 66.260 66.000 0.260 17919 91043 1 222 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.889 1.001 17919 91044 1 222 . 1 1 39 39 ASP N N 39 113.380 113.380 115.047 -1.667 17919 91045 1 222 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.391 0.039 17919 91046 1 222 . 1 1 39 39 ASP C C 39 177.090 177.090 177.800 -0.710 17919 91047 1 222 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.779 -1.139 17919 91048 1 222 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.370 -0.830 17919 91049 1 222 . 1 1 39 39 ASP H H 39 8.550 8.550 8.873 -0.323 17919 91050 1 222 . 1 1 40 40 GLN N N 40 116.780 116.780 117.344 -0.564 17919 91051 1 222 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.330 0.134 17919 91052 1 222 . 1 1 40 40 GLN C C 40 175.380 175.380 176.066 -0.686 17919 91053 1 222 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.281 -0.641 17919 91054 1 222 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.809 0.331 17919 91055 1 222 . 1 1 40 40 GLN H H 40 7.820 7.820 7.910 -0.090 17919 91056 1 222 . 1 1 41 41 GLN N N 41 117.720 117.720 119.740 -2.020 17919 91057 1 222 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.233 0.011 17919 91058 1 222 . 1 1 41 41 GLN C C 41 176.300 176.300 174.512 1.788 17919 91059 1 222 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.642 -0.172 17919 91060 1 222 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.488 2.162 17919 91061 1 222 . 1 1 41 41 GLN H H 41 7.480 7.480 7.569 -0.089 17919 91062 1 222 . 1 1 42 42 ARG N N 42 122.680 122.680 123.818 -1.138 17919 91063 1 222 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.560 -0.060 17919 91064 1 222 . 1 1 42 42 ARG C C 42 174.050 174.050 173.985 0.065 17919 91065 1 222 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.141 -0.091 17919 91066 1 222 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.657 -0.907 17919 91067 1 222 . 1 1 42 42 ARG H H 42 8.530 8.530 8.715 -0.185 17919 91068 1 222 . 1 1 43 43 LEU N N 43 124.040 124.040 125.781 -1.741 17919 91069 1 222 . 1 1 43 43 LEU C C 43 175.290 175.290 175.750 -0.460 17919 91070 1 222 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.306 -0.326 17919 91071 1 222 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.837 1.953 17919 91072 1 222 . 1 1 43 43 LEU H H 43 8.820 8.820 8.770 0.050 17919 91073 1 222 . 1 1 44 44 ILE N N 44 121.920 121.920 121.065 0.855 17919 91074 1 222 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.026 -0.034 17919 91075 1 222 . 1 1 44 44 ILE C C 44 176.060 176.060 174.286 1.774 17919 91076 1 222 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.509 -0.529 17919 91077 1 222 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.857 -0.437 17919 91078 1 222 . 1 1 44 44 ILE H H 44 9.030 9.030 8.695 0.335 17919 91079 1 222 . 1 1 45 45 PHE N N 45 125.390 125.390 125.049 0.341 17919 91080 1 222 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.890 0.155 17919 91081 1 222 . 1 1 45 45 PHE C C 45 174.470 174.470 174.201 0.269 17919 91082 1 222 . 1 1 45 45 PHE CA C 45 57.020 57.020 57.740 -0.720 17919 91083 1 222 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.680 1.080 17919 91084 1 222 . 1 1 45 45 PHE H H 45 8.830 8.830 8.920 -0.090 17919 91085 1 222 . 1 1 46 46 ALA N N 46 132.200 132.200 130.078 2.122 17919 91086 1 222 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.604 0.086 17919 91087 1 222 . 1 1 46 46 ALA C C 46 177.290 177.290 177.567 -0.277 17919 91088 1 222 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.956 -0.416 17919 91089 1 222 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.835 -0.265 17919 91090 1 222 . 1 1 46 46 ALA H H 46 8.810 8.810 8.386 0.424 17919 91091 1 222 . 1 1 47 47 GLY N N 47 102.340 102.340 103.333 -0.993 17919 91092 1 222 . 1 1 47 47 GLY C C 47 173.810 173.810 174.326 -0.516 17919 91093 1 222 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.064 0.286 17919 91094 1 222 . 1 1 47 47 GLY H H 47 8.130 8.130 8.453 -0.323 17919 91095 1 222 . 1 1 48 48 LYS N N 48 121.570 121.570 121.790 -0.220 17919 91096 1 222 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.537 0.085 17919 91097 1 222 . 1 1 48 48 LYS C C 48 174.700 174.700 175.345 -0.645 17919 91098 1 222 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.133 -0.583 17919 91099 1 222 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.270 0.260 17919 91100 1 222 . 1 1 48 48 LYS H H 48 7.980 7.980 7.556 0.424 17919 91101 1 222 . 1 1 49 49 GLN N N 49 122.410 122.410 125.380 -2.970 17919 91102 1 222 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.389 0.171 17919 91103 1 222 . 1 1 49 49 GLN C C 49 175.670 175.670 175.322 0.348 17919 91104 1 222 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.265 -0.525 17919 91105 1 222 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.482 -0.482 17919 91106 1 222 . 1 1 49 49 GLN H H 49 8.600 8.600 8.631 -0.031 17919 91107 1 222 . 1 1 50 50 LEU N N 50 125.520 125.520 128.651 -3.131 17919 91108 1 222 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.187 -0.097 17919 91109 1 222 . 1 1 50 50 LEU C C 50 176.660 176.660 175.961 0.699 17919 91110 1 222 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.526 0.714 17919 91111 1 222 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.261 -0.691 17919 91112 1 222 . 1 1 50 50 LEU H H 50 8.530 8.530 8.236 0.294 17919 91113 1 222 . 1 1 51 51 GLU N N 51 122.940 122.940 123.268 -0.328 17919 91114 1 222 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.455 0.033 17919 91115 1 222 . 1 1 51 51 GLU C C 51 175.870 175.870 177.036 -1.166 17919 91116 1 222 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.632 0.328 17919 91117 1 222 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.233 0.337 17919 91118 1 222 . 1 1 51 51 GLU H H 51 8.400 8.400 8.234 0.166 17919 91119 1 222 . 1 1 52 52 ASP N N 52 120.030 120.030 125.605 -5.575 17919 91120 1 222 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.373 -0.014 17919 91121 1 222 . 1 1 52 52 ASP C C 52 177.330 177.330 177.785 -0.455 17919 91122 1 222 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.634 -0.674 17919 91123 1 222 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.643 0.207 17919 91124 1 222 . 1 1 52 52 ASP H H 52 8.160 8.160 8.783 -0.623 17919 91125 1 222 . 1 1 53 53 GLY N N 53 106.660 106.660 105.867 0.793 17919 91126 1 222 . 1 1 53 53 GLY C C 53 174.870 174.870 174.556 0.314 17919 91127 1 222 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.137 0.033 17919 91128 1 222 . 1 1 53 53 GLY H H 53 9.390 9.390 8.631 0.759 17919 91129 1 222 . 1 1 54 54 ARG N N 54 119.050 119.050 120.781 -1.731 17919 91130 1 222 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.754 -0.059 17919 91131 1 222 . 1 1 54 54 ARG C C 54 175.350 175.350 175.970 -0.620 17919 91132 1 222 . 1 1 54 54 ARG CA C 54 54.390 54.390 52.558 1.832 17919 91133 1 222 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.718 -0.068 17919 91134 1 222 . 1 1 54 54 ARG H H 54 7.460 7.460 7.477 -0.017 17919 91135 1 222 . 1 1 55 55 THR N N 55 108.400 108.400 112.231 -3.831 17919 91136 1 222 . 1 1 55 55 THR HA H 55 5.240 5.240 4.825 0.415 17919 91137 1 222 . 1 1 55 55 THR C C 55 176.560 176.560 176.392 0.168 17919 91138 1 222 . 1 1 55 55 THR CA C 55 59.690 59.690 61.289 -1.599 17919 91139 1 222 . 1 1 55 55 THR CB C 55 72.260 72.260 70.311 1.949 17919 91140 1 222 . 1 1 55 55 THR H H 55 8.730 8.730 9.065 -0.335 17919 91141 1 222 . 1 1 56 56 LEU N N 56 117.920 117.920 121.856 -3.936 17919 91142 1 222 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.972 0.088 17919 91143 1 222 . 1 1 56 56 LEU C C 56 180.810 180.810 178.885 1.925 17919 91144 1 222 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.095 0.615 17919 91145 1 222 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.416 -1.046 17919 91146 1 222 . 1 1 56 56 LEU H H 56 8.140 8.140 9.169 -1.029 17919 91147 1 222 . 1 1 57 57 SER N N 57 113.330 113.330 114.099 -0.769 17919 91148 1 222 . 1 1 57 57 SER HA H 57 4.370 4.370 4.222 0.148 17919 91149 1 222 . 1 1 57 57 SER C C 57 178.310 178.310 176.982 1.328 17919 91150 1 222 . 1 1 57 57 SER CA C 57 61.080 61.080 61.601 -0.521 17919 91151 1 222 . 1 1 57 57 SER CB C 57 62.530 62.530 62.397 0.133 17919 91152 1 222 . 1 1 57 57 SER H H 57 8.470 8.470 8.615 -0.145 17919 91153 1 222 . 1 1 58 58 ASP N N 58 124.190 124.190 122.827 1.363 17919 91154 1 222 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.292 0.004 17919 91155 1 222 . 1 1 58 58 ASP C C 58 177.400 177.400 176.835 0.565 17919 91156 1 222 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.753 0.427 17919 91157 1 222 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.187 -0.087 17919 91158 1 222 . 1 1 58 58 ASP H H 58 7.930 7.930 7.656 0.274 17919 91159 1 222 . 1 1 59 59 TYR N N 59 115.510 115.510 115.522 -0.012 17919 91160 1 222 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.605 0.065 17919 91161 1 222 . 1 1 59 59 TYR C C 59 174.700 174.700 174.698 0.002 17919 91162 1 222 . 1 1 59 59 TYR CA C 59 58.250 58.250 56.839 1.411 17919 91163 1 222 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.351 1.719 17919 91164 1 222 . 1 1 59 59 TYR H H 59 7.250 7.250 7.198 0.052 17919 91165 1 222 . 1 1 60 60 ASN N N 60 115.900 115.900 115.577 0.323 17919 91166 1 222 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.371 -0.016 17919 91167 1 222 . 1 1 60 60 ASN C C 60 174.340 174.340 174.733 -0.393 17919 91168 1 222 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.355 -0.235 17919 91169 1 222 . 1 1 60 60 ASN CB C 60 37.410 37.410 36.898 0.512 17919 91170 1 222 . 1 1 60 60 ASN H H 60 8.150 8.150 7.985 0.165 17919 91171 1 222 . 1 1 61 61 ILE N N 61 118.600 118.600 119.466 -0.866 17919 91172 1 222 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.723 -0.330 17919 91173 1 222 . 1 1 61 61 ILE C C 61 174.610 174.610 175.485 -0.875 17919 91174 1 222 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.236 0.184 17919 91175 1 222 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.706 -0.966 17919 91176 1 222 . 1 1 61 61 ILE H H 61 7.250 7.250 7.527 -0.277 17919 91177 1 222 . 1 1 62 62 GLN N N 62 124.740 124.740 124.633 0.107 17919 91178 1 222 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.773 -0.267 17919 91179 1 222 . 1 1 62 62 GLN C C 62 175.970 175.970 175.402 0.568 17919 91180 1 222 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.528 0.132 17919 91181 1 222 . 1 1 62 62 GLN CB C 62 31.650 31.650 33.439 -1.789 17919 91182 1 222 . 1 1 62 62 GLN H H 62 7.610 7.610 7.906 -0.296 17919 91183 1 222 . 1 1 63 63 LYS N N 63 120.300 120.300 121.509 -1.209 17919 91184 1 222 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.184 -0.183 17919 91185 1 222 . 1 1 63 63 LYS C C 63 175.810 175.810 177.241 -1.431 17919 91186 1 222 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.047 -0.257 17919 91187 1 222 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.301 0.349 17919 91188 1 222 . 1 1 63 63 LYS H H 63 8.490 8.490 8.789 -0.299 17919 91189 1 222 . 1 1 64 64 GLU N N 64 113.950 113.950 117.877 -3.927 17919 91190 1 222 . 1 1 64 64 GLU HA H 64 3.465 3.465 4.066 -0.601 17919 91191 1 222 . 1 1 64 64 GLU C C 64 175.250 175.250 175.982 -0.732 17919 91192 1 222 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.622 0.268 17919 91193 1 222 . 1 1 64 64 GLU CB C 64 25.900 25.900 27.624 -1.724 17919 91194 1 222 . 1 1 64 64 GLU H H 64 9.280 9.280 9.135 0.145 17919 91195 1 222 . 1 1 65 65 SER N N 65 114.730 114.730 116.410 -1.680 17919 91196 1 222 . 1 1 65 65 SER HA H 65 4.640 4.640 4.619 0.021 17919 91197 1 222 . 1 1 65 65 SER C C 65 172.160 172.160 173.766 -1.606 17919 91198 1 222 . 1 1 65 65 SER CA C 65 60.890 60.890 59.988 0.902 17919 91199 1 222 . 1 1 65 65 SER CB C 65 64.910 64.910 64.352 0.558 17919 91200 1 222 . 1 1 65 65 SER H H 65 7.670 7.670 7.543 0.127 17919 91201 1 222 . 1 1 66 66 THR N N 66 117.110 117.110 120.377 -3.267 17919 91202 1 222 . 1 1 66 66 THR HA H 66 5.270 5.270 5.156 0.114 17919 91203 1 222 . 1 1 66 66 THR C C 66 173.950 173.950 174.006 -0.056 17919 91204 1 222 . 1 1 66 66 THR CA C 66 62.340 62.340 61.448 0.892 17919 91205 1 222 . 1 1 66 66 THR CB C 66 70.080 70.080 70.816 -0.736 17919 91206 1 222 . 1 1 66 66 THR H H 66 8.730 8.730 8.566 0.164 17919 91207 1 222 . 1 1 67 67 LEU N N 67 127.110 127.110 127.222 -0.112 17919 91208 1 222 . 1 1 67 67 LEU HA H 67 5.060 5.060 5.085 -0.025 17919 91209 1 222 . 1 1 67 67 LEU C C 67 175.770 175.770 175.711 0.059 17919 91210 1 222 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.736 0.164 17919 91211 1 222 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.261 -0.001 17919 91212 1 222 . 1 1 67 67 LEU H H 67 9.410 9.410 8.818 0.592 17919 91213 1 222 . 1 1 68 68 HIS N N 68 118.380 118.380 119.412 -1.032 17919 91214 1 222 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.112 0.128 17919 91215 1 222 . 1 1 68 68 HIS C C 68 173.150 173.150 173.943 -0.793 17919 91216 1 222 . 1 1 68 68 HIS CA C 68 55.000 55.000 55.639 -0.639 17919 91217 1 222 . 1 1 68 68 HIS CB C 68 30.530 30.530 31.946 -1.416 17919 91218 1 222 . 1 1 68 68 HIS H H 68 9.230 9.230 8.706 0.524 17919 91219 1 222 . 1 1 69 69 LEU N N 69 124.460 124.460 127.812 -3.352 17919 91220 1 222 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.096 0.094 17919 91221 1 222 . 1 1 69 69 LEU C C 69 175.270 175.270 174.337 0.933 17919 91222 1 222 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.732 0.158 17919 91223 1 222 . 1 1 69 69 LEU CB C 69 44.380 44.380 43.895 0.485 17919 91224 1 222 . 1 1 69 69 LEU H H 69 8.340 8.340 9.020 -0.680 17919 91225 1 222 . 1 1 70 70 VAL N N 70 126.940 126.940 122.314 4.626 17919 91226 1 222 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.654 -0.304 17919 91227 1 222 . 1 1 70 70 VAL C C 70 174.000 174.000 173.513 0.487 17919 91228 1 222 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.800 1.000 17919 91229 1 222 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.882 -0.972 17919 91230 1 222 . 1 1 70 70 VAL H H 70 9.200 9.200 9.053 0.147 17919 91231 1 222 . 1 1 71 71 LEU N N 71 123.130 123.130 124.206 -1.076 17919 91232 1 222 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.050 0.010 17919 91233 1 222 . 1 1 71 71 LEU C C 71 177.830 177.830 177.684 0.146 17919 91234 1 222 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.785 0.155 17919 91235 1 222 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.809 -0.959 17919 91236 1 222 . 1 1 71 71 LEU H H 71 8.120 8.120 8.446 -0.326 17919 91237 1 222 . 1 1 72 72 ARG N N 72 123.490 123.490 122.359 1.131 17919 91238 1 222 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.154 0.147 17919 91239 1 222 . 1 1 72 72 ARG C C 72 175.350 175.350 178.224 -2.874 17919 91240 1 222 . 1 1 72 72 ARG CA C 72 55.610 55.610 57.919 -2.309 17919 91241 1 222 . 1 1 72 72 ARG CB C 72 31.350 31.350 29.609 1.741 17919 91242 1 222 . 1 1 72 72 ARG H H 72 8.580 8.580 8.669 -0.089 17919 91243 1 223 . 1 1 2 2 GLN N N 2 123.220 123.220 120.206 3.014 17919 91244 1 223 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.472 -0.223 17919 91245 1 223 . 1 1 2 2 GLN C C 2 175.920 175.920 175.652 0.268 17919 91246 1 223 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.595 0.485 17919 91247 1 223 . 1 1 2 2 GLN CB C 2 30.760 30.760 31.011 -0.251 17919 91248 1 223 . 1 1 2 2 GLN H H 2 8.900 8.900 8.370 0.530 17919 91249 1 223 . 1 1 3 3 ILE N N 3 115.340 115.340 114.577 0.763 17919 91250 1 223 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.090 0.123 17919 91251 1 223 . 1 1 3 3 ILE C C 3 172.450 172.450 173.416 -0.966 17919 91252 1 223 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.176 0.394 17919 91253 1 223 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.974 0.236 17919 91254 1 223 . 1 1 3 3 ILE H H 3 8.320 8.320 8.609 -0.289 17919 91255 1 223 . 1 1 4 4 PHE N N 4 118.110 118.110 118.542 -0.432 17919 91256 1 223 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.327 0.303 17919 91257 1 223 . 1 1 4 4 PHE C C 4 175.320 175.320 174.881 0.439 17919 91258 1 223 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.252 -0.042 17919 91259 1 223 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.603 -0.123 17919 91260 1 223 . 1 1 4 4 PHE H H 4 8.610 8.610 8.137 0.473 17919 91261 1 223 . 1 1 5 5 VAL N N 5 121.000 121.000 122.323 -1.323 17919 91262 1 223 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.688 0.037 17919 91263 1 223 . 1 1 5 5 VAL C C 5 174.870 174.870 174.445 0.425 17919 91264 1 223 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.517 -0.896 17919 91265 1 223 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.055 0.175 17919 91266 1 223 . 1 1 5 5 VAL H H 5 9.300 9.300 9.154 0.146 17919 91267 1 223 . 1 1 6 6 LYS N N 6 127.520 127.520 128.004 -0.484 17919 91268 1 223 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.646 -0.279 17919 91269 1 223 . 1 1 6 6 LYS C C 6 177.140 177.140 175.833 1.307 17919 91270 1 223 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.021 0.499 17919 91271 1 223 . 1 1 6 6 LYS CB C 6 35.050 35.050 36.918 -1.868 17919 91272 1 223 . 1 1 6 6 LYS H H 6 8.820 8.820 9.273 -0.453 17919 91273 1 223 . 1 1 7 7 THR N N 7 115.400 115.400 115.604 -0.204 17919 91274 1 223 . 1 1 7 7 THR HA H 7 4.970 4.970 4.790 0.180 17919 91275 1 223 . 1 1 7 7 THR C C 7 176.910 176.910 176.552 0.358 17919 91276 1 223 . 1 1 7 7 THR CA C 7 60.470 60.470 59.577 0.893 17919 91277 1 223 . 1 1 7 7 THR CB C 7 70.630 70.630 70.990 -0.360 17919 91278 1 223 . 1 1 7 7 THR H H 7 8.730 8.730 8.100 0.630 17919 91279 1 223 . 1 1 8 8 LEU N N 8 121.330 121.330 120.503 0.827 17919 91280 1 223 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.462 -0.152 17919 91281 1 223 . 1 1 8 8 LEU C C 8 178.800 178.800 178.279 0.521 17919 91282 1 223 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.402 0.178 17919 91283 1 223 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.802 0.168 17919 91284 1 223 . 1 1 8 8 LEU H H 8 9.100 9.100 8.875 0.225 17919 91285 1 223 . 1 1 9 9 THR N N 9 105.590 105.590 109.995 -4.405 17919 91286 1 223 . 1 1 9 9 THR HA H 9 4.428 4.428 4.289 0.139 17919 91287 1 223 . 1 1 9 9 THR C C 9 175.520 175.520 175.815 -0.295 17919 91288 1 223 . 1 1 9 9 THR CA C 9 61.400 61.400 62.316 -0.916 17919 91289 1 223 . 1 1 9 9 THR CB C 9 69.140 69.140 69.323 -0.183 17919 91290 1 223 . 1 1 9 9 THR H H 9 7.630 7.630 7.749 -0.119 17919 91291 1 223 . 1 1 10 10 GLY N N 10 108.890 108.890 111.359 -2.469 17919 91292 1 223 . 1 1 10 10 GLY C C 10 174.070 174.070 173.321 0.749 17919 91293 1 223 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.065 0.395 17919 91294 1 223 . 1 1 10 10 GLY H H 10 7.810 7.810 7.656 0.154 17919 91295 1 223 . 1 1 11 11 LYS N N 11 121.600 121.600 121.112 0.488 17919 91296 1 223 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.416 -0.055 17919 91297 1 223 . 1 1 11 11 LYS C C 11 175.940 175.940 175.504 0.436 17919 91298 1 223 . 1 1 11 11 LYS CA C 11 56.280 56.280 55.971 0.309 17919 91299 1 223 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.626 -0.426 17919 91300 1 223 . 1 1 11 11 LYS H H 11 7.280 7.280 7.751 -0.471 17919 91301 1 223 . 1 1 12 12 THR N N 12 120.440 120.440 121.206 -0.766 17919 91302 1 223 . 1 1 12 12 THR HA H 12 5.046 5.046 5.316 -0.270 17919 91303 1 223 . 1 1 12 12 THR C C 12 174.320 174.320 174.492 -0.172 17919 91304 1 223 . 1 1 12 12 THR CA C 12 62.390 62.390 61.634 0.756 17919 91305 1 223 . 1 1 12 12 THR CB C 12 69.910 69.910 69.651 0.259 17919 91306 1 223 . 1 1 12 12 THR H H 12 8.650 8.650 8.106 0.544 17919 91307 1 223 . 1 1 13 13 ILE N N 13 127.110 127.110 125.220 1.890 17919 91308 1 223 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.604 -0.060 17919 91309 1 223 . 1 1 13 13 ILE C C 13 175.220 175.220 174.690 0.530 17919 91310 1 223 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.254 0.726 17919 91311 1 223 . 1 1 13 13 ILE CB C 13 40.950 40.950 39.924 1.026 17919 91312 1 223 . 1 1 13 13 ILE H H 13 9.450 9.450 9.107 0.343 17919 91313 1 223 . 1 1 14 14 THR N N 14 121.520 121.520 121.498 0.022 17919 91314 1 223 . 1 1 14 14 THR HA H 14 4.964 4.964 5.012 -0.048 17919 91315 1 223 . 1 1 14 14 THR C C 14 173.790 173.790 173.907 -0.117 17919 91316 1 223 . 1 1 14 14 THR CA C 14 61.940 61.940 62.341 -0.401 17919 91317 1 223 . 1 1 14 14 THR CB C 14 69.650 69.650 69.800 -0.150 17919 91318 1 223 . 1 1 14 14 THR H H 14 8.710 8.710 8.609 0.101 17919 91319 1 223 . 1 1 15 15 LEU N N 15 124.800 124.800 125.550 -0.750 17919 91320 1 223 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.829 -0.049 17919 91321 1 223 . 1 1 15 15 LEU C C 15 174.670 174.670 175.320 -0.650 17919 91322 1 223 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.676 -0.846 17919 91323 1 223 . 1 1 15 15 LEU CB C 15 47.070 47.070 44.968 2.102 17919 91324 1 223 . 1 1 15 15 LEU H H 15 8.710 8.710 8.691 0.019 17919 91325 1 223 . 1 1 16 16 GLU N N 16 122.160 122.160 125.589 -3.429 17919 91326 1 223 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.027 -0.110 17919 91327 1 223 . 1 1 16 16 GLU C C 16 175.860 175.860 176.012 -0.152 17919 91328 1 223 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.986 -1.166 17919 91329 1 223 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.422 -0.972 17919 91330 1 223 . 1 1 16 16 GLU H H 16 8.140 8.140 8.743 -0.603 17919 91331 1 223 . 1 1 17 17 VAL N N 17 117.210 117.210 120.835 -3.625 17919 91332 1 223 . 1 1 17 17 VAL HA H 17 4.714 4.714 5.000 -0.286 17919 91333 1 223 . 1 1 17 17 VAL C C 17 174.160 174.160 174.532 -0.372 17919 91334 1 223 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.797 -0.367 17919 91335 1 223 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.440 0.961 17919 91336 1 223 . 1 1 17 17 VAL H H 17 8.900 8.900 9.025 -0.125 17919 91337 1 223 . 1 1 18 18 GLU N N 18 118.990 118.990 122.987 -3.997 17919 91338 1 223 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.903 0.176 17919 91339 1 223 . 1 1 18 18 GLU C C 18 176.160 176.160 175.280 0.880 17919 91340 1 223 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.732 -0.012 17919 91341 1 223 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.899 -0.589 17919 91342 1 223 . 1 1 18 18 GLU H H 18 8.640 8.640 8.607 0.033 17919 91343 1 223 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.430 -0.289 17919 91344 1 223 . 1 1 19 19 PRO C C 19 175.310 175.310 177.131 -1.821 17919 91345 1 223 . 1 1 19 19 PRO CA C 19 65.470 65.470 64.956 0.514 17919 91346 1 223 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.222 -0.272 17919 91347 1 223 . 1 1 20 20 SER N N 20 103.400 103.400 111.066 -7.666 17919 91348 1 223 . 1 1 20 20 SER HA H 20 4.370 4.370 4.348 0.022 17919 91349 1 223 . 1 1 20 20 SER C C 20 174.660 174.660 174.130 0.530 17919 91350 1 223 . 1 1 20 20 SER CA C 20 57.400 57.400 58.262 -0.862 17919 91351 1 223 . 1 1 20 20 SER CB C 20 63.370 63.370 62.879 0.491 17919 91352 1 223 . 1 1 20 20 SER H H 20 7.040 7.040 8.037 -0.997 17919 91353 1 223 . 1 1 21 21 ASP N N 21 123.480 123.480 124.082 -0.602 17919 91354 1 223 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.712 -0.017 17919 91355 1 223 . 1 1 21 21 ASP C C 21 176.360 176.360 175.818 0.542 17919 91356 1 223 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.064 0.636 17919 91357 1 223 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.282 -0.482 17919 91358 1 223 . 1 1 21 21 ASP H H 21 8.030 8.030 7.649 0.381 17919 91359 1 223 . 1 1 22 22 THR N N 22 108.800 108.800 113.745 -4.945 17919 91360 1 223 . 1 1 22 22 THR HA H 22 4.920 4.920 4.765 0.155 17919 91361 1 223 . 1 1 22 22 THR C C 22 176.750 176.750 176.371 0.379 17919 91362 1 223 . 1 1 22 22 THR CA C 22 59.690 59.690 60.976 -1.286 17919 91363 1 223 . 1 1 22 22 THR CB C 22 71.200 71.200 70.362 0.838 17919 91364 1 223 . 1 1 22 22 THR H H 22 7.900 7.900 8.399 -0.499 17919 91365 1 223 . 1 1 23 23 ILE N N 23 121.190 121.190 122.913 -1.723 17919 91366 1 223 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.703 -0.046 17919 91367 1 223 . 1 1 23 23 ILE C C 23 179.040 179.040 177.848 1.192 17919 91368 1 223 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.226 -0.966 17919 91369 1 223 . 1 1 23 23 ILE CB C 23 34.350 34.350 35.994 -1.644 17919 91370 1 223 . 1 1 23 23 ILE H H 23 8.560 8.560 8.669 -0.109 17919 91371 1 223 . 1 1 24 24 GLU N N 24 120.830 120.830 120.563 0.267 17919 91372 1 223 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.896 0.021 17919 91373 1 223 . 1 1 24 24 GLU C C 24 178.640 178.640 178.942 -0.302 17919 91374 1 223 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.886 0.334 17919 91375 1 223 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.516 -1.236 17919 91376 1 223 . 1 1 24 24 GLU H H 24 9.760 9.760 7.960 1.800 17919 91377 1 223 . 1 1 25 25 ASN N N 25 120.570 120.570 118.139 2.431 17919 91378 1 223 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.467 0.058 17919 91379 1 223 . 1 1 25 25 ASN C C 25 178.380 178.380 177.791 0.589 17919 91380 1 223 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.291 -0.231 17919 91381 1 223 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.622 -0.172 17919 91382 1 223 . 1 1 25 25 ASN H H 25 7.920 7.920 7.764 0.156 17919 91383 1 223 . 1 1 26 26 VAL N N 26 121.710 121.710 120.673 1.037 17919 91384 1 223 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.593 -0.196 17919 91385 1 223 . 1 1 26 26 VAL C C 26 177.950 177.950 177.947 0.003 17919 91386 1 223 . 1 1 26 26 VAL CA C 26 67.660 67.660 67.075 0.585 17919 91387 1 223 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.520 -0.680 17919 91388 1 223 . 1 1 26 26 VAL H H 26 8.070 8.070 8.433 -0.363 17919 91389 1 223 . 1 1 27 27 LYS N N 27 118.860 118.860 119.934 -1.074 17919 91390 1 223 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.161 0.419 17919 91391 1 223 . 1 1 27 27 LYS C C 27 180.550 180.550 178.970 1.580 17919 91392 1 223 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.551 -0.301 17919 91393 1 223 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.277 1.453 17919 91394 1 223 . 1 1 27 27 LYS H H 27 8.560 8.560 8.124 0.436 17919 91395 1 223 . 1 1 28 28 ALA N N 28 123.440 123.440 122.701 0.739 17919 91396 1 223 . 1 1 28 28 ALA HA H 28 4.160 4.160 3.976 0.184 17919 91397 1 223 . 1 1 28 28 ALA C C 28 180.300 180.300 179.125 1.175 17919 91398 1 223 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.308 0.062 17919 91399 1 223 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.325 -0.615 17919 91400 1 223 . 1 1 28 28 ALA H H 28 8.060 8.060 8.414 -0.354 17919 91401 1 223 . 1 1 29 29 LYS N N 29 119.940 119.940 118.827 1.113 17919 91402 1 223 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.052 0.155 17919 91403 1 223 . 1 1 29 29 LYS C C 29 180.320 180.320 178.925 1.395 17919 91404 1 223 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.261 0.389 17919 91405 1 223 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.486 0.804 17919 91406 1 223 . 1 1 29 29 LYS H H 29 7.850 7.850 7.993 -0.143 17919 91407 1 223 . 1 1 30 30 ILE N N 30 121.080 121.080 118.975 2.105 17919 91408 1 223 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.646 -0.139 17919 91409 1 223 . 1 1 30 30 ILE C C 30 178.310 178.310 177.822 0.488 17919 91410 1 223 . 1 1 30 30 ILE CA C 30 66.150 66.150 64.597 1.553 17919 91411 1 223 . 1 1 30 30 ILE CB C 30 36.800 36.800 38.131 -1.331 17919 91412 1 223 . 1 1 30 30 ILE H H 30 8.280 8.280 8.268 0.012 17919 91413 1 223 . 1 1 31 31 GLN N N 31 123.490 123.490 119.640 3.850 17919 91414 1 223 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.017 -0.188 17919 91415 1 223 . 1 1 31 31 GLN C C 31 178.890 178.890 178.032 0.858 17919 91416 1 223 . 1 1 31 31 GLN CA C 31 60.000 60.000 58.394 1.606 17919 91417 1 223 . 1 1 31 31 GLN CB C 31 27.720 27.720 27.592 0.128 17919 91418 1 223 . 1 1 31 31 GLN H H 31 8.580 8.580 8.304 0.276 17919 91419 1 223 . 1 1 32 32 ASP N N 32 119.360 119.360 119.574 -0.214 17919 91420 1 223 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.468 -0.114 17919 91421 1 223 . 1 1 32 32 ASP C C 32 177.250 177.250 177.480 -0.230 17919 91422 1 223 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.321 0.869 17919 91423 1 223 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.718 -0.138 17919 91424 1 223 . 1 1 32 32 ASP H H 32 8.010 8.010 7.862 0.148 17919 91425 1 223 . 1 1 33 33 LYS N N 33 115.130 115.130 118.078 -2.948 17919 91426 1 223 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.344 -0.007 17919 91427 1 223 . 1 1 33 33 LYS C C 33 177.870 177.870 177.990 -0.120 17919 91428 1 223 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.930 0.120 17919 91429 1 223 . 1 1 33 33 LYS CB C 33 34.170 34.170 34.241 -0.071 17919 91430 1 223 . 1 1 33 33 LYS H H 33 7.430 7.430 7.422 0.008 17919 91431 1 223 . 1 1 34 34 GLU N N 34 113.870 113.870 115.798 -1.928 17919 91432 1 223 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.455 0.170 17919 91433 1 223 . 1 1 34 34 GLU C C 34 177.840 177.840 177.360 0.480 17919 91434 1 223 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.387 -1.217 17919 91435 1 223 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.319 1.341 17919 91436 1 223 . 1 1 34 34 GLU H H 34 8.740 8.740 7.968 0.772 17919 91437 1 223 . 1 1 35 35 GLY N N 35 108.650 108.650 109.559 -0.909 17919 91438 1 223 . 1 1 35 35 GLY C C 35 173.960 173.960 174.079 -0.119 17919 91439 1 223 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.836 0.244 17919 91440 1 223 . 1 1 35 35 GLY H H 35 8.530 8.530 8.485 0.045 17919 91441 1 223 . 1 1 36 36 ILE N N 36 119.880 119.880 122.200 -2.320 17919 91442 1 223 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.397 0.048 17919 91443 1 223 . 1 1 36 36 ILE C C 36 173.590 173.590 174.125 -0.535 17919 91444 1 223 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.765 -0.015 17919 91445 1 223 . 1 1 36 36 ILE CB C 36 40.580 40.580 39.566 1.014 17919 91446 1 223 . 1 1 36 36 ILE H H 36 6.150 6.150 7.599 -1.449 17919 91447 1 223 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.754 -0.120 17919 91448 1 223 . 1 1 37 37 PRO C C 37 176.940 176.940 175.928 1.012 17919 91449 1 223 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.242 0.418 17919 91450 1 223 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.455 0.395 17919 91451 1 223 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.269 -0.152 17919 91452 1 223 . 1 1 38 38 PRO C C 38 178.320 178.320 178.203 0.117 17919 91453 1 223 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.249 1.011 17919 91454 1 223 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.783 1.107 17919 91455 1 223 . 1 1 39 39 ASP N N 39 113.380 113.380 117.313 -3.933 17919 91456 1 223 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.442 -0.012 17919 91457 1 223 . 1 1 39 39 ASP C C 39 177.090 177.090 177.806 -0.716 17919 91458 1 223 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.796 -1.156 17919 91459 1 223 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.617 -1.077 17919 91460 1 223 . 1 1 39 39 ASP H H 39 8.550 8.550 8.530 0.020 17919 91461 1 223 . 1 1 40 40 GLN N N 40 116.780 116.780 117.040 -0.260 17919 91462 1 223 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.381 0.083 17919 91463 1 223 . 1 1 40 40 GLN C C 40 175.380 175.380 175.411 -0.031 17919 91464 1 223 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.734 -0.094 17919 91465 1 223 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.262 0.878 17919 91466 1 223 . 1 1 40 40 GLN H H 40 7.820 7.820 7.892 -0.072 17919 91467 1 223 . 1 1 41 41 GLN N N 41 117.720 117.720 119.272 -1.552 17919 91468 1 223 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.525 -0.281 17919 91469 1 223 . 1 1 41 41 GLN C C 41 176.300 176.300 174.728 1.572 17919 91470 1 223 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.703 0.767 17919 91471 1 223 . 1 1 41 41 GLN CB C 41 31.650 31.650 30.695 0.955 17919 91472 1 223 . 1 1 41 41 GLN H H 41 7.480 7.480 7.440 0.040 17919 91473 1 223 . 1 1 42 42 ARG N N 42 122.680 122.680 125.090 -2.410 17919 91474 1 223 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.656 -0.156 17919 91475 1 223 . 1 1 42 42 ARG C C 42 174.050 174.050 173.983 0.067 17919 91476 1 223 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.082 -0.032 17919 91477 1 223 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.883 -1.133 17919 91478 1 223 . 1 1 42 42 ARG H H 42 8.530 8.530 8.634 -0.104 17919 91479 1 223 . 1 1 43 43 LEU N N 43 124.040 124.040 127.210 -3.170 17919 91480 1 223 . 1 1 43 43 LEU C C 43 175.290 175.290 175.841 -0.551 17919 91481 1 223 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.552 -0.572 17919 91482 1 223 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.509 1.281 17919 91483 1 223 . 1 1 43 43 LEU H H 43 8.820 8.820 8.811 0.009 17919 91484 1 223 . 1 1 44 44 ILE N N 44 121.920 121.920 117.409 4.511 17919 91485 1 223 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.976 0.016 17919 91486 1 223 . 1 1 44 44 ILE C C 44 176.060 176.060 173.479 2.581 17919 91487 1 223 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.147 -1.167 17919 91488 1 223 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.794 -0.374 17919 91489 1 223 . 1 1 44 44 ILE H H 44 9.030 9.030 8.453 0.577 17919 91490 1 223 . 1 1 45 45 PHE N N 45 125.390 125.390 128.258 -2.868 17919 91491 1 223 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.123 -0.078 17919 91492 1 223 . 1 1 45 45 PHE C C 45 174.470 174.470 175.042 -0.572 17919 91493 1 223 . 1 1 45 45 PHE CA C 45 57.020 57.020 55.631 1.389 17919 91494 1 223 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.045 0.715 17919 91495 1 223 . 1 1 45 45 PHE H H 45 8.830 8.830 8.745 0.085 17919 91496 1 223 . 1 1 46 46 ALA N N 46 132.200 132.200 130.554 1.646 17919 91497 1 223 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.745 -0.055 17919 91498 1 223 . 1 1 46 46 ALA C C 46 177.290 177.290 178.358 -1.068 17919 91499 1 223 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.567 -0.027 17919 91500 1 223 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.664 -0.094 17919 91501 1 223 . 1 1 46 46 ALA H H 46 8.810 8.810 8.688 0.122 17919 91502 1 223 . 1 1 47 47 GLY N N 47 102.340 102.340 105.465 -3.125 17919 91503 1 223 . 1 1 47 47 GLY C C 47 173.810 173.810 174.061 -0.251 17919 91504 1 223 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.754 -0.404 17919 91505 1 223 . 1 1 47 47 GLY H H 47 8.130 8.130 8.720 -0.590 17919 91506 1 223 . 1 1 48 48 LYS N N 48 121.570 121.570 119.739 1.831 17919 91507 1 223 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.553 0.069 17919 91508 1 223 . 1 1 48 48 LYS C C 48 174.700 174.700 175.148 -0.448 17919 91509 1 223 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.085 -0.535 17919 91510 1 223 . 1 1 48 48 LYS CB C 48 34.530 34.530 35.469 -0.939 17919 91511 1 223 . 1 1 48 48 LYS H H 48 7.980 7.980 7.652 0.328 17919 91512 1 223 . 1 1 49 49 GLN N N 49 122.410 122.410 124.435 -2.025 17919 91513 1 223 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.049 0.511 17919 91514 1 223 . 1 1 49 49 GLN C C 49 175.670 175.670 175.562 0.108 17919 91515 1 223 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.952 -1.212 17919 91516 1 223 . 1 1 49 49 GLN CB C 49 29.000 29.000 28.179 0.821 17919 91517 1 223 . 1 1 49 49 GLN H H 49 8.600 8.600 8.643 -0.043 17919 91518 1 223 . 1 1 50 50 LEU N N 50 125.520 125.520 130.762 -5.242 17919 91519 1 223 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.117 -0.027 17919 91520 1 223 . 1 1 50 50 LEU C C 50 176.660 176.660 175.715 0.945 17919 91521 1 223 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.818 0.422 17919 91522 1 223 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.050 -0.480 17919 91523 1 223 . 1 1 50 50 LEU H H 50 8.530 8.530 8.474 0.056 17919 91524 1 223 . 1 1 51 51 GLU N N 51 122.940 122.940 122.741 0.199 17919 91525 1 223 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.565 -0.077 17919 91526 1 223 . 1 1 51 51 GLU C C 51 175.870 175.870 177.009 -1.139 17919 91527 1 223 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.151 0.809 17919 91528 1 223 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.766 -0.196 17919 91529 1 223 . 1 1 51 51 GLU H H 51 8.400 8.400 8.190 0.210 17919 91530 1 223 . 1 1 52 52 ASP N N 52 120.030 120.030 123.629 -3.599 17919 91531 1 223 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.440 -0.081 17919 91532 1 223 . 1 1 52 52 ASP C C 52 177.330 177.330 178.069 -0.739 17919 91533 1 223 . 1 1 52 52 ASP CA C 52 56.960 56.960 58.548 -1.588 17919 91534 1 223 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.766 0.084 17919 91535 1 223 . 1 1 52 52 ASP H H 52 8.160 8.160 8.907 -0.747 17919 91536 1 223 . 1 1 53 53 GLY N N 53 106.660 106.660 104.499 2.161 17919 91537 1 223 . 1 1 53 53 GLY C C 53 174.870 174.870 174.979 -0.109 17919 91538 1 223 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.846 0.324 17919 91539 1 223 . 1 1 53 53 GLY H H 53 9.390 9.390 8.275 1.115 17919 91540 1 223 . 1 1 54 54 ARG N N 54 119.050 119.050 119.813 -0.763 17919 91541 1 223 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.769 -0.074 17919 91542 1 223 . 1 1 54 54 ARG C C 54 175.350 175.350 175.744 -0.394 17919 91543 1 223 . 1 1 54 54 ARG CA C 54 54.390 54.390 53.157 1.233 17919 91544 1 223 . 1 1 54 54 ARG CB C 54 32.650 32.650 31.404 1.246 17919 91545 1 223 . 1 1 54 54 ARG H H 54 7.460 7.460 7.438 0.022 17919 91546 1 223 . 1 1 55 55 THR N N 55 108.400 108.400 110.722 -2.322 17919 91547 1 223 . 1 1 55 55 THR HA H 55 5.240 5.240 5.027 0.213 17919 91548 1 223 . 1 1 55 55 THR C C 55 176.560 176.560 176.130 0.430 17919 91549 1 223 . 1 1 55 55 THR CA C 55 59.690 59.690 59.844 -0.154 17919 91550 1 223 . 1 1 55 55 THR CB C 55 72.260 72.260 71.602 0.658 17919 91551 1 223 . 1 1 55 55 THR H H 55 8.730 8.730 9.022 -0.292 17919 91552 1 223 . 1 1 56 56 LEU N N 56 117.920 117.920 122.195 -4.275 17919 91553 1 223 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.994 0.066 17919 91554 1 223 . 1 1 56 56 LEU C C 56 180.810 180.810 178.780 2.030 17919 91555 1 223 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.789 -0.080 17919 91556 1 223 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.489 -1.119 17919 91557 1 223 . 1 1 56 56 LEU H H 56 8.140 8.140 9.201 -1.061 17919 91558 1 223 . 1 1 57 57 SER N N 57 113.330 113.330 114.245 -0.915 17919 91559 1 223 . 1 1 57 57 SER HA H 57 4.370 4.370 4.127 0.243 17919 91560 1 223 . 1 1 57 57 SER C C 57 178.310 178.310 177.053 1.257 17919 91561 1 223 . 1 1 57 57 SER CA C 57 61.080 61.080 61.553 -0.473 17919 91562 1 223 . 1 1 57 57 SER CB C 57 62.530 62.530 63.013 -0.483 17919 91563 1 223 . 1 1 57 57 SER H H 57 8.470 8.470 8.338 0.132 17919 91564 1 223 . 1 1 58 58 ASP N N 58 124.190 124.190 122.689 1.501 17919 91565 1 223 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.314 -0.018 17919 91566 1 223 . 1 1 58 58 ASP C C 58 177.400 177.400 177.675 -0.275 17919 91567 1 223 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.851 0.329 17919 91568 1 223 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.530 -0.430 17919 91569 1 223 . 1 1 58 58 ASP H H 58 7.930 7.930 7.639 0.291 17919 91570 1 223 . 1 1 59 59 TYR N N 59 115.510 115.510 115.781 -0.271 17919 91571 1 223 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.584 0.086 17919 91572 1 223 . 1 1 59 59 TYR C C 59 174.700 174.700 174.920 -0.220 17919 91573 1 223 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.396 0.854 17919 91574 1 223 . 1 1 59 59 TYR CB C 59 40.070 40.070 37.715 2.355 17919 91575 1 223 . 1 1 59 59 TYR H H 59 7.250 7.250 7.667 -0.417 17919 91576 1 223 . 1 1 60 60 ASN N N 60 115.900 115.900 117.842 -1.942 17919 91577 1 223 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.374 -0.019 17919 91578 1 223 . 1 1 60 60 ASN C C 60 174.340 174.340 174.522 -0.182 17919 91579 1 223 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.203 -0.083 17919 91580 1 223 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.337 0.073 17919 91581 1 223 . 1 1 60 60 ASN H H 60 8.150 8.150 7.704 0.446 17919 91582 1 223 . 1 1 61 61 ILE N N 61 118.600 118.600 119.237 -0.637 17919 91583 1 223 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.962 -0.569 17919 91584 1 223 . 1 1 61 61 ILE C C 61 174.610 174.610 174.541 0.069 17919 91585 1 223 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.304 1.116 17919 91586 1 223 . 1 1 61 61 ILE CB C 61 36.740 36.740 38.370 -1.630 17919 91587 1 223 . 1 1 61 61 ILE H H 61 7.250 7.250 8.229 -0.979 17919 91588 1 223 . 1 1 62 62 GLN N N 62 124.740 124.740 125.171 -0.431 17919 91589 1 223 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.788 -0.282 17919 91590 1 223 . 1 1 62 62 GLN C C 62 175.970 175.970 175.205 0.765 17919 91591 1 223 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.280 0.380 17919 91592 1 223 . 1 1 62 62 GLN CB C 62 31.650 31.650 32.457 -0.807 17919 91593 1 223 . 1 1 62 62 GLN H H 62 7.610 7.610 7.894 -0.284 17919 91594 1 223 . 1 1 63 63 LYS N N 63 120.300 120.300 120.570 -0.270 17919 91595 1 223 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.076 -0.075 17919 91596 1 223 . 1 1 63 63 LYS C C 63 175.810 175.810 177.368 -1.558 17919 91597 1 223 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.697 0.093 17919 91598 1 223 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.982 0.668 17919 91599 1 223 . 1 1 63 63 LYS H H 63 8.490 8.490 8.583 -0.093 17919 91600 1 223 . 1 1 64 64 GLU N N 64 113.950 113.950 118.951 -5.001 17919 91601 1 223 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.503 -0.038 17919 91602 1 223 . 1 1 64 64 GLU C C 64 175.250 175.250 176.048 -0.798 17919 91603 1 223 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.405 0.485 17919 91604 1 223 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.788 -2.888 17919 91605 1 223 . 1 1 64 64 GLU H H 64 9.280 9.280 8.786 0.494 17919 91606 1 223 . 1 1 65 65 SER N N 65 114.730 114.730 115.013 -0.283 17919 91607 1 223 . 1 1 65 65 SER HA H 65 4.640 4.640 4.452 0.188 17919 91608 1 223 . 1 1 65 65 SER C C 65 172.160 172.160 173.713 -1.553 17919 91609 1 223 . 1 1 65 65 SER CA C 65 60.890 60.890 60.699 0.191 17919 91610 1 223 . 1 1 65 65 SER CB C 65 64.910 64.910 64.159 0.751 17919 91611 1 223 . 1 1 65 65 SER H H 65 7.670 7.670 7.155 0.515 17919 91612 1 223 . 1 1 66 66 THR N N 66 117.110 117.110 118.913 -1.803 17919 91613 1 223 . 1 1 66 66 THR HA H 66 5.270 5.270 5.286 -0.016 17919 91614 1 223 . 1 1 66 66 THR C C 66 173.950 173.950 174.481 -0.531 17919 91615 1 223 . 1 1 66 66 THR CA C 66 62.340 62.340 61.773 0.567 17919 91616 1 223 . 1 1 66 66 THR CB C 66 70.080 70.080 70.213 -0.133 17919 91617 1 223 . 1 1 66 66 THR H H 66 8.730 8.730 8.547 0.183 17919 91618 1 223 . 1 1 67 67 LEU N N 67 127.110 127.110 126.842 0.268 17919 91619 1 223 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.686 0.374 17919 91620 1 223 . 1 1 67 67 LEU C C 67 175.770 175.770 175.448 0.322 17919 91621 1 223 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.278 -0.378 17919 91622 1 223 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.346 0.914 17919 91623 1 223 . 1 1 67 67 LEU H H 67 9.410 9.410 9.250 0.160 17919 91624 1 223 . 1 1 68 68 HIS N N 68 118.380 118.380 122.834 -4.454 17919 91625 1 223 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.568 -0.328 17919 91626 1 223 . 1 1 68 68 HIS C C 68 173.150 173.150 173.640 -0.490 17919 91627 1 223 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.666 0.334 17919 91628 1 223 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.621 -2.091 17919 91629 1 223 . 1 1 68 68 HIS H H 68 9.230 9.230 8.391 0.839 17919 91630 1 223 . 1 1 69 69 LEU N N 69 124.460 124.460 128.562 -4.102 17919 91631 1 223 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.191 -0.001 17919 91632 1 223 . 1 1 69 69 LEU C C 69 175.270 175.270 174.560 0.710 17919 91633 1 223 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.456 0.434 17919 91634 1 223 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.862 -0.482 17919 91635 1 223 . 1 1 69 69 LEU H H 69 8.340 8.340 8.239 0.101 17919 91636 1 223 . 1 1 70 70 VAL N N 70 126.940 126.940 126.428 0.512 17919 91637 1 223 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.426 -0.076 17919 91638 1 223 . 1 1 70 70 VAL C C 70 174.000 174.000 174.164 -0.164 17919 91639 1 223 . 1 1 70 70 VAL CA C 70 60.800 60.800 61.260 -0.460 17919 91640 1 223 . 1 1 70 70 VAL CB C 70 34.910 34.910 36.331 -1.421 17919 91641 1 223 . 1 1 70 70 VAL H H 70 9.200 9.200 8.993 0.207 17919 91642 1 223 . 1 1 71 71 LEU N N 71 123.130 123.130 123.704 -0.574 17919 91643 1 223 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.076 -0.016 17919 91644 1 223 . 1 1 71 71 LEU C C 71 177.830 177.830 177.516 0.314 17919 91645 1 223 . 1 1 71 71 LEU CA C 71 53.940 53.940 52.856 1.083 17919 91646 1 223 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.681 0.169 17919 91647 1 223 . 1 1 71 71 LEU H H 71 8.120 8.120 8.476 -0.356 17919 91648 1 223 . 1 1 72 72 ARG N N 72 123.490 123.490 123.216 0.274 17919 91649 1 223 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.529 -0.228 17919 91650 1 223 . 1 1 72 72 ARG C C 72 175.350 175.350 175.701 -0.351 17919 91651 1 223 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.111 -0.501 17919 91652 1 223 . 1 1 72 72 ARG CB C 72 31.350 31.350 31.445 -0.095 17919 91653 1 223 . 1 1 72 72 ARG H H 72 8.580 8.580 8.327 0.253 17919 91654 1 224 . 1 1 2 2 GLN N N 2 123.220 123.220 120.667 2.553 17919 91655 1 224 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.524 -0.275 17919 91656 1 224 . 1 1 2 2 GLN C C 2 175.920 175.920 175.149 0.771 17919 91657 1 224 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.581 0.499 17919 91658 1 224 . 1 1 2 2 GLN CB C 2 30.760 30.760 31.162 -0.402 17919 91659 1 224 . 1 1 2 2 GLN H H 2 8.900 8.900 8.401 0.499 17919 91660 1 224 . 1 1 3 3 ILE N N 3 115.340 115.340 114.416 0.924 17919 91661 1 224 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.142 0.071 17919 91662 1 224 . 1 1 3 3 ILE C C 3 172.450 172.450 173.665 -1.215 17919 91663 1 224 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.311 0.259 17919 91664 1 224 . 1 1 3 3 ILE CB C 3 42.210 42.210 42.148 0.062 17919 91665 1 224 . 1 1 3 3 ILE H H 3 8.320 8.320 8.863 -0.543 17919 91666 1 224 . 1 1 4 4 PHE N N 4 118.110 118.110 119.889 -1.779 17919 91667 1 224 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.319 0.311 17919 91668 1 224 . 1 1 4 4 PHE C C 4 175.320 175.320 175.065 0.255 17919 91669 1 224 . 1 1 4 4 PHE CA C 4 55.210 55.210 54.700 0.510 17919 91670 1 224 . 1 1 4 4 PHE CB C 4 41.480 41.480 40.350 1.130 17919 91671 1 224 . 1 1 4 4 PHE H H 4 8.610 8.610 8.607 0.003 17919 91672 1 224 . 1 1 5 5 VAL N N 5 121.000 121.000 123.441 -2.441 17919 91673 1 224 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.612 0.113 17919 91674 1 224 . 1 1 5 5 VAL C C 5 174.870 174.870 174.564 0.306 17919 91675 1 224 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.509 -0.889 17919 91676 1 224 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.817 0.413 17919 91677 1 224 . 1 1 5 5 VAL H H 5 9.300 9.300 9.402 -0.102 17919 91678 1 224 . 1 1 6 6 LYS N N 6 127.520 127.520 129.620 -2.100 17919 91679 1 224 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.020 0.347 17919 91680 1 224 . 1 1 6 6 LYS C C 6 177.140 177.140 176.118 1.022 17919 91681 1 224 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.718 -0.198 17919 91682 1 224 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.623 0.427 17919 91683 1 224 . 1 1 6 6 LYS H H 6 8.820 8.820 9.258 -0.438 17919 91684 1 224 . 1 1 7 7 THR N N 7 115.400 115.400 119.338 -3.938 17919 91685 1 224 . 1 1 7 7 THR HA H 7 4.970 4.970 4.455 0.515 17919 91686 1 224 . 1 1 7 7 THR C C 7 176.910 176.910 176.142 0.768 17919 91687 1 224 . 1 1 7 7 THR CA C 7 60.470 60.470 61.075 -0.605 17919 91688 1 224 . 1 1 7 7 THR CB C 7 70.630 70.630 70.562 0.068 17919 91689 1 224 . 1 1 7 7 THR H H 7 8.730 8.730 8.165 0.565 17919 91690 1 224 . 1 1 8 8 LEU N N 8 121.330 121.330 121.735 -0.405 17919 91691 1 224 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.100 0.210 17919 91692 1 224 . 1 1 8 8 LEU C C 8 178.800 178.800 178.563 0.237 17919 91693 1 224 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.495 0.085 17919 91694 1 224 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.834 0.136 17919 91695 1 224 . 1 1 8 8 LEU H H 8 9.100 9.100 8.880 0.220 17919 91696 1 224 . 1 1 9 9 THR N N 9 105.590 105.590 107.624 -2.034 17919 91697 1 224 . 1 1 9 9 THR HA H 9 4.428 4.428 4.327 0.101 17919 91698 1 224 . 1 1 9 9 THR C C 9 175.520 175.520 175.985 -0.465 17919 91699 1 224 . 1 1 9 9 THR CA C 9 61.400 61.400 61.737 -0.337 17919 91700 1 224 . 1 1 9 9 THR CB C 9 69.140 69.140 68.614 0.526 17919 91701 1 224 . 1 1 9 9 THR H H 9 7.630 7.630 7.855 -0.225 17919 91702 1 224 . 1 1 10 10 GLY N N 10 108.890 108.890 110.317 -1.427 17919 91703 1 224 . 1 1 10 10 GLY C C 10 174.070 174.070 174.771 -0.701 17919 91704 1 224 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.630 -0.170 17919 91705 1 224 . 1 1 10 10 GLY H H 10 7.810 7.810 7.918 -0.108 17919 91706 1 224 . 1 1 11 11 LYS N N 11 121.600 121.600 120.157 1.443 17919 91707 1 224 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.432 -0.071 17919 91708 1 224 . 1 1 11 11 LYS C C 11 175.940 175.940 175.654 0.286 17919 91709 1 224 . 1 1 11 11 LYS CA C 11 56.280 56.280 55.794 0.486 17919 91710 1 224 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.549 -0.349 17919 91711 1 224 . 1 1 11 11 LYS H H 11 7.280 7.280 7.526 -0.246 17919 91712 1 224 . 1 1 12 12 THR N N 12 120.440 120.440 116.072 4.368 17919 91713 1 224 . 1 1 12 12 THR HA H 12 5.046 5.046 4.941 0.105 17919 91714 1 224 . 1 1 12 12 THR C C 12 174.320 174.320 174.500 -0.180 17919 91715 1 224 . 1 1 12 12 THR CA C 12 62.390 62.390 61.690 0.700 17919 91716 1 224 . 1 1 12 12 THR CB C 12 69.910 69.910 70.312 -0.402 17919 91717 1 224 . 1 1 12 12 THR H H 12 8.650 8.650 8.308 0.342 17919 91718 1 224 . 1 1 13 13 ILE N N 13 127.110 127.110 122.438 4.672 17919 91719 1 224 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.825 -0.281 17919 91720 1 224 . 1 1 13 13 ILE C C 13 175.220 175.220 174.645 0.575 17919 91721 1 224 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.464 0.516 17919 91722 1 224 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.926 0.024 17919 91723 1 224 . 1 1 13 13 ILE H H 13 9.450 9.450 8.870 0.580 17919 91724 1 224 . 1 1 14 14 THR N N 14 121.520 121.520 122.909 -1.389 17919 91725 1 224 . 1 1 14 14 THR HA H 14 4.964 4.964 5.295 -0.331 17919 91726 1 224 . 1 1 14 14 THR C C 14 173.790 173.790 174.183 -0.393 17919 91727 1 224 . 1 1 14 14 THR CA C 14 61.940 61.940 61.914 0.026 17919 91728 1 224 . 1 1 14 14 THR CB C 14 69.650 69.650 69.971 -0.321 17919 91729 1 224 . 1 1 14 14 THR H H 14 8.710 8.710 8.340 0.370 17919 91730 1 224 . 1 1 15 15 LEU N N 15 124.800 124.800 126.985 -2.185 17919 91731 1 224 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.769 0.011 17919 91732 1 224 . 1 1 15 15 LEU C C 15 174.670 174.670 175.351 -0.681 17919 91733 1 224 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.478 -0.648 17919 91734 1 224 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.693 1.377 17919 91735 1 224 . 1 1 15 15 LEU H H 15 8.710 8.710 9.048 -0.338 17919 91736 1 224 . 1 1 16 16 GLU N N 16 122.160 122.160 121.540 0.620 17919 91737 1 224 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.419 -0.502 17919 91738 1 224 . 1 1 16 16 GLU C C 16 175.860 175.860 175.965 -0.105 17919 91739 1 224 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.610 -0.790 17919 91740 1 224 . 1 1 16 16 GLU CB C 16 29.450 29.450 31.246 -1.796 17919 91741 1 224 . 1 1 16 16 GLU H H 16 8.140 8.140 8.689 -0.549 17919 91742 1 224 . 1 1 17 17 VAL N N 17 117.210 117.210 120.356 -3.146 17919 91743 1 224 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.825 -0.111 17919 91744 1 224 . 1 1 17 17 VAL C C 17 174.160 174.160 174.382 -0.222 17919 91745 1 224 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.599 -1.169 17919 91746 1 224 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.617 0.783 17919 91747 1 224 . 1 1 17 17 VAL H H 17 8.900 8.900 8.809 0.091 17919 91748 1 224 . 1 1 18 18 GLU N N 18 118.990 118.990 120.919 -1.929 17919 91749 1 224 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.834 0.245 17919 91750 1 224 . 1 1 18 18 GLU C C 18 176.160 176.160 175.796 0.364 17919 91751 1 224 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.275 -0.555 17919 91752 1 224 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.612 -0.302 17919 91753 1 224 . 1 1 18 18 GLU H H 18 8.640 8.640 9.200 -0.560 17919 91754 1 224 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.258 -0.117 17919 91755 1 224 . 1 1 19 19 PRO C C 19 175.310 175.310 177.450 -2.140 17919 91756 1 224 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.193 0.277 17919 91757 1 224 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.762 0.188 17919 91758 1 224 . 1 1 20 20 SER N N 20 103.400 103.400 112.061 -8.661 17919 91759 1 224 . 1 1 20 20 SER HA H 20 4.370 4.370 4.396 -0.026 17919 91760 1 224 . 1 1 20 20 SER C C 20 174.660 174.660 174.202 0.458 17919 91761 1 224 . 1 1 20 20 SER CA C 20 57.400 57.400 58.865 -1.465 17919 91762 1 224 . 1 1 20 20 SER CB C 20 63.370 63.370 63.149 0.221 17919 91763 1 224 . 1 1 20 20 SER H H 20 7.040 7.040 8.303 -1.263 17919 91764 1 224 . 1 1 21 21 ASP N N 21 123.480 123.480 123.545 -0.065 17919 91765 1 224 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.600 0.095 17919 91766 1 224 . 1 1 21 21 ASP C C 21 176.360 176.360 176.454 -0.094 17919 91767 1 224 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.351 0.349 17919 91768 1 224 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.205 -0.405 17919 91769 1 224 . 1 1 21 21 ASP H H 21 8.030 8.030 7.497 0.533 17919 91770 1 224 . 1 1 22 22 THR N N 22 108.800 108.800 114.088 -5.288 17919 91771 1 224 . 1 1 22 22 THR HA H 22 4.920 4.920 4.959 -0.039 17919 91772 1 224 . 1 1 22 22 THR C C 22 176.750 176.750 176.481 0.269 17919 91773 1 224 . 1 1 22 22 THR CA C 22 59.690 59.690 60.771 -1.081 17919 91774 1 224 . 1 1 22 22 THR CB C 22 71.200 71.200 70.360 0.840 17919 91775 1 224 . 1 1 22 22 THR H H 22 7.900 7.900 8.921 -1.021 17919 91776 1 224 . 1 1 23 23 ILE N N 23 121.190 121.190 122.161 -0.971 17919 91777 1 224 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.745 -0.088 17919 91778 1 224 . 1 1 23 23 ILE C C 23 179.040 179.040 177.622 1.418 17919 91779 1 224 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.176 -0.916 17919 91780 1 224 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.141 -1.791 17919 91781 1 224 . 1 1 23 23 ILE H H 23 8.560 8.560 8.799 -0.239 17919 91782 1 224 . 1 1 24 24 GLU N N 24 120.830 120.830 122.104 -1.274 17919 91783 1 224 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.924 -0.007 17919 91784 1 224 . 1 1 24 24 GLU C C 24 178.640 178.640 178.340 0.300 17919 91785 1 224 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.209 0.011 17919 91786 1 224 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.371 -1.091 17919 91787 1 224 . 1 1 24 24 GLU H H 24 9.760 9.760 8.322 1.438 17919 91788 1 224 . 1 1 25 25 ASN N N 25 120.570 120.570 118.879 1.691 17919 91789 1 224 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.384 0.141 17919 91790 1 224 . 1 1 25 25 ASN C C 25 178.380 178.380 178.016 0.364 17919 91791 1 224 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.237 -0.177 17919 91792 1 224 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.386 0.064 17919 91793 1 224 . 1 1 25 25 ASN H H 25 7.920 7.920 7.812 0.108 17919 91794 1 224 . 1 1 26 26 VAL N N 26 121.710 121.710 120.227 1.483 17919 91795 1 224 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.581 -0.184 17919 91796 1 224 . 1 1 26 26 VAL C C 26 177.950 177.950 177.792 0.158 17919 91797 1 224 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.317 1.343 17919 91798 1 224 . 1 1 26 26 VAL CB C 26 30.840 30.840 30.795 0.045 17919 91799 1 224 . 1 1 26 26 VAL H H 26 8.070 8.070 8.086 -0.016 17919 91800 1 224 . 1 1 27 27 LYS N N 27 118.860 118.860 119.864 -1.004 17919 91801 1 224 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.159 0.421 17919 91802 1 224 . 1 1 27 27 LYS C C 27 180.550 180.550 179.136 1.414 17919 91803 1 224 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.685 -0.435 17919 91804 1 224 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.271 1.459 17919 91805 1 224 . 1 1 27 27 LYS H H 27 8.560 8.560 8.300 0.260 17919 91806 1 224 . 1 1 28 28 ALA N N 28 123.440 123.440 121.573 1.867 17919 91807 1 224 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.210 -0.050 17919 91808 1 224 . 1 1 28 28 ALA C C 28 180.300 180.300 179.189 1.111 17919 91809 1 224 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.463 0.907 17919 91810 1 224 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.578 -0.868 17919 91811 1 224 . 1 1 28 28 ALA H H 28 8.060 8.060 8.441 -0.381 17919 91812 1 224 . 1 1 29 29 LYS N N 29 119.940 119.940 119.397 0.543 17919 91813 1 224 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.092 0.115 17919 91814 1 224 . 1 1 29 29 LYS C C 29 180.320 180.320 178.870 1.450 17919 91815 1 224 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.005 0.645 17919 91816 1 224 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.598 0.692 17919 91817 1 224 . 1 1 29 29 LYS H H 29 7.850 7.850 7.955 -0.105 17919 91818 1 224 . 1 1 30 30 ILE N N 30 121.080 121.080 119.748 1.332 17919 91819 1 224 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.737 -0.230 17919 91820 1 224 . 1 1 30 30 ILE C C 30 178.310 178.310 177.059 1.251 17919 91821 1 224 . 1 1 30 30 ILE CA C 30 66.150 66.150 64.312 1.838 17919 91822 1 224 . 1 1 30 30 ILE CB C 30 36.800 36.800 38.093 -1.293 17919 91823 1 224 . 1 1 30 30 ILE H H 30 8.280 8.280 8.001 0.279 17919 91824 1 224 . 1 1 31 31 GLN N N 31 123.490 123.490 120.883 2.607 17919 91825 1 224 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.004 -0.175 17919 91826 1 224 . 1 1 31 31 GLN C C 31 178.890 178.890 177.988 0.902 17919 91827 1 224 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.238 0.762 17919 91828 1 224 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.478 -0.758 17919 91829 1 224 . 1 1 31 31 GLN H H 31 8.580 8.580 7.992 0.588 17919 91830 1 224 . 1 1 32 32 ASP N N 32 119.360 119.360 118.400 0.960 17919 91831 1 224 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.452 -0.098 17919 91832 1 224 . 1 1 32 32 ASP C C 32 177.250 177.250 177.736 -0.486 17919 91833 1 224 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.446 0.744 17919 91834 1 224 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.742 -0.162 17919 91835 1 224 . 1 1 32 32 ASP H H 32 8.010 8.010 7.822 0.188 17919 91836 1 224 . 1 1 33 33 LYS N N 33 115.130 115.130 118.187 -3.057 17919 91837 1 224 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.396 -0.059 17919 91838 1 224 . 1 1 33 33 LYS C C 33 177.870 177.870 178.062 -0.192 17919 91839 1 224 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.556 0.494 17919 91840 1 224 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.488 0.682 17919 91841 1 224 . 1 1 33 33 LYS H H 33 7.430 7.430 7.722 -0.292 17919 91842 1 224 . 1 1 34 34 GLU N N 34 113.870 113.870 115.203 -1.333 17919 91843 1 224 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.482 0.143 17919 91844 1 224 . 1 1 34 34 GLU C C 34 177.840 177.840 177.447 0.393 17919 91845 1 224 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.387 -1.217 17919 91846 1 224 . 1 1 34 34 GLU CB C 34 32.660 32.660 32.265 0.395 17919 91847 1 224 . 1 1 34 34 GLU H H 34 8.740 8.740 7.987 0.753 17919 91848 1 224 . 1 1 35 35 GLY N N 35 108.650 108.650 109.005 -0.355 17919 91849 1 224 . 1 1 35 35 GLY C C 35 173.960 173.960 174.257 -0.297 17919 91850 1 224 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.580 0.500 17919 91851 1 224 . 1 1 35 35 GLY H H 35 8.530 8.530 8.266 0.264 17919 91852 1 224 . 1 1 36 36 ILE N N 36 119.880 119.880 122.501 -2.621 17919 91853 1 224 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.287 0.158 17919 91854 1 224 . 1 1 36 36 ILE C C 36 173.590 173.590 174.166 -0.576 17919 91855 1 224 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.894 -0.144 17919 91856 1 224 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.411 2.169 17919 91857 1 224 . 1 1 36 36 ILE H H 36 6.150 6.150 7.599 -1.449 17919 91858 1 224 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.494 0.140 17919 91859 1 224 . 1 1 37 37 PRO C C 37 176.940 176.940 176.096 0.844 17919 91860 1 224 . 1 1 37 37 PRO CA C 37 61.660 61.660 62.150 -0.490 17919 91861 1 224 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.143 0.707 17919 91862 1 224 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.122 -0.005 17919 91863 1 224 . 1 1 38 38 PRO C C 38 178.320 178.320 178.037 0.283 17919 91864 1 224 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.807 0.453 17919 91865 1 224 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.943 0.947 17919 91866 1 224 . 1 1 39 39 ASP N N 39 113.380 113.380 113.536 -0.156 17919 91867 1 224 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.445 -0.015 17919 91868 1 224 . 1 1 39 39 ASP C C 39 177.090 177.090 177.132 -0.042 17919 91869 1 224 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.088 -0.448 17919 91870 1 224 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.665 -1.125 17919 91871 1 224 . 1 1 39 39 ASP H H 39 8.550 8.550 8.406 0.144 17919 91872 1 224 . 1 1 40 40 GLN N N 40 116.780 116.780 116.928 -0.148 17919 91873 1 224 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.396 0.068 17919 91874 1 224 . 1 1 40 40 GLN C C 40 175.380 175.380 175.666 -0.286 17919 91875 1 224 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.722 -0.082 17919 91876 1 224 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.621 0.519 17919 91877 1 224 . 1 1 40 40 GLN H H 40 7.820 7.820 8.056 -0.236 17919 91878 1 224 . 1 1 41 41 GLN N N 41 117.720 117.720 119.967 -2.247 17919 91879 1 224 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.505 -0.261 17919 91880 1 224 . 1 1 41 41 GLN C C 41 176.300 176.300 175.028 1.272 17919 91881 1 224 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.265 0.205 17919 91882 1 224 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.375 2.275 17919 91883 1 224 . 1 1 41 41 GLN H H 41 7.480 7.480 7.200 0.280 17919 91884 1 224 . 1 1 42 42 ARG N N 42 122.680 122.680 123.462 -0.782 17919 91885 1 224 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.656 -0.156 17919 91886 1 224 . 1 1 42 42 ARG C C 42 174.050 174.050 174.619 -0.569 17919 91887 1 224 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.919 0.131 17919 91888 1 224 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.155 -1.405 17919 91889 1 224 . 1 1 42 42 ARG H H 42 8.530 8.530 8.842 -0.312 17919 91890 1 224 . 1 1 43 43 LEU N N 43 124.040 124.040 125.445 -1.405 17919 91891 1 224 . 1 1 43 43 LEU C C 43 175.290 175.290 175.870 -0.580 17919 91892 1 224 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.577 -0.597 17919 91893 1 224 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.471 1.319 17919 91894 1 224 . 1 1 43 43 LEU H H 43 8.820 8.820 8.797 0.023 17919 91895 1 224 . 1 1 44 44 ILE N N 44 121.920 121.920 121.448 0.472 17919 91896 1 224 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.202 -0.210 17919 91897 1 224 . 1 1 44 44 ILE C C 44 176.060 176.060 174.700 1.360 17919 91898 1 224 . 1 1 44 44 ILE CA C 44 58.980 58.980 58.951 0.029 17919 91899 1 224 . 1 1 44 44 ILE CB C 44 41.420 41.420 39.439 1.981 17919 91900 1 224 . 1 1 44 44 ILE H H 44 9.030 9.030 8.955 0.075 17919 91901 1 224 . 1 1 45 45 PHE N N 45 125.390 125.390 127.683 -2.293 17919 91902 1 224 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.906 0.139 17919 91903 1 224 . 1 1 45 45 PHE C C 45 174.470 174.470 174.181 0.289 17919 91904 1 224 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.579 0.441 17919 91905 1 224 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.217 0.543 17919 91906 1 224 . 1 1 45 45 PHE H H 45 8.830 8.830 8.909 -0.079 17919 91907 1 224 . 1 1 46 46 ALA N N 46 132.200 132.200 128.520 3.680 17919 91908 1 224 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.667 0.023 17919 91909 1 224 . 1 1 46 46 ALA C C 46 177.290 177.290 177.802 -0.512 17919 91910 1 224 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.670 -0.130 17919 91911 1 224 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.600 -0.030 17919 91912 1 224 . 1 1 46 46 ALA H H 46 8.810 8.810 8.750 0.060 17919 91913 1 224 . 1 1 47 47 GLY N N 47 102.340 102.340 106.150 -3.810 17919 91914 1 224 . 1 1 47 47 GLY C C 47 173.810 173.810 174.370 -0.560 17919 91915 1 224 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.810 0.540 17919 91916 1 224 . 1 1 47 47 GLY H H 47 8.130 8.130 8.428 -0.298 17919 91917 1 224 . 1 1 48 48 LYS N N 48 121.570 121.570 123.284 -1.714 17919 91918 1 224 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.588 0.034 17919 91919 1 224 . 1 1 48 48 LYS C C 48 174.700 174.700 175.326 -0.626 17919 91920 1 224 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.481 -0.931 17919 91921 1 224 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.161 0.369 17919 91922 1 224 . 1 1 48 48 LYS H H 48 7.980 7.980 7.752 0.228 17919 91923 1 224 . 1 1 49 49 GLN N N 49 122.410 122.410 124.485 -2.075 17919 91924 1 224 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.844 -0.284 17919 91925 1 224 . 1 1 49 49 GLN C C 49 175.670 175.670 175.566 0.104 17919 91926 1 224 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.106 -0.366 17919 91927 1 224 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.953 -0.953 17919 91928 1 224 . 1 1 49 49 GLN H H 49 8.600 8.600 8.638 -0.038 17919 91929 1 224 . 1 1 50 50 LEU N N 50 125.520 125.520 127.022 -1.502 17919 91930 1 224 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.335 -0.245 17919 91931 1 224 . 1 1 50 50 LEU C C 50 176.660 176.660 176.331 0.329 17919 91932 1 224 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.162 0.078 17919 91933 1 224 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.238 -0.668 17919 91934 1 224 . 1 1 50 50 LEU H H 50 8.530 8.530 8.430 0.100 17919 91935 1 224 . 1 1 51 51 GLU N N 51 122.940 122.940 124.056 -1.116 17919 91936 1 224 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.378 0.110 17919 91937 1 224 . 1 1 51 51 GLU C C 51 175.870 175.870 177.139 -1.269 17919 91938 1 224 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.361 0.599 17919 91939 1 224 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.969 -0.399 17919 91940 1 224 . 1 1 51 51 GLU H H 51 8.400 8.400 8.411 -0.011 17919 91941 1 224 . 1 1 52 52 ASP N N 52 120.030 120.030 124.773 -4.743 17919 91942 1 224 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.453 -0.094 17919 91943 1 224 . 1 1 52 52 ASP C C 52 177.330 177.330 177.695 -0.365 17919 91944 1 224 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.489 -0.529 17919 91945 1 224 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.759 0.091 17919 91946 1 224 . 1 1 52 52 ASP H H 52 8.160 8.160 8.795 -0.635 17919 91947 1 224 . 1 1 53 53 GLY N N 53 106.660 106.660 104.817 1.843 17919 91948 1 224 . 1 1 53 53 GLY C C 53 174.870 174.870 174.121 0.749 17919 91949 1 224 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.749 0.421 17919 91950 1 224 . 1 1 53 53 GLY H H 53 9.390 9.390 8.463 0.926 17919 91951 1 224 . 1 1 54 54 ARG N N 54 119.050 119.050 120.123 -1.073 17919 91952 1 224 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.636 0.059 17919 91953 1 224 . 1 1 54 54 ARG C C 54 175.350 175.350 175.664 -0.314 17919 91954 1 224 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.771 -0.381 17919 91955 1 224 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.307 0.343 17919 91956 1 224 . 1 1 54 54 ARG H H 54 7.460 7.460 7.404 0.056 17919 91957 1 224 . 1 1 55 55 THR N N 55 108.400 108.400 110.781 -2.381 17919 91958 1 224 . 1 1 55 55 THR HA H 55 5.240 5.240 5.074 0.166 17919 91959 1 224 . 1 1 55 55 THR C C 55 176.560 176.560 176.251 0.309 17919 91960 1 224 . 1 1 55 55 THR CA C 55 59.690 59.690 59.882 -0.192 17919 91961 1 224 . 1 1 55 55 THR CB C 55 72.260 72.260 71.301 0.959 17919 91962 1 224 . 1 1 55 55 THR H H 55 8.730 8.730 9.001 -0.271 17919 91963 1 224 . 1 1 56 56 LEU N N 56 117.920 117.920 121.082 -3.162 17919 91964 1 224 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.915 0.145 17919 91965 1 224 . 1 1 56 56 LEU C C 56 180.810 180.810 178.718 2.092 17919 91966 1 224 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.299 0.411 17919 91967 1 224 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.542 -1.172 17919 91968 1 224 . 1 1 56 56 LEU H H 56 8.140 8.140 8.477 -0.337 17919 91969 1 224 . 1 1 57 57 SER N N 57 113.330 113.330 114.889 -1.559 17919 91970 1 224 . 1 1 57 57 SER HA H 57 4.370 4.370 4.204 0.166 17919 91971 1 224 . 1 1 57 57 SER C C 57 178.310 178.310 176.522 1.788 17919 91972 1 224 . 1 1 57 57 SER CA C 57 61.080 61.080 62.286 -1.206 17919 91973 1 224 . 1 1 57 57 SER CB C 57 62.530 62.530 62.925 -0.395 17919 91974 1 224 . 1 1 57 57 SER H H 57 8.470 8.470 8.023 0.447 17919 91975 1 224 . 1 1 58 58 ASP N N 58 124.190 124.190 121.256 2.934 17919 91976 1 224 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.426 -0.130 17919 91977 1 224 . 1 1 58 58 ASP C C 58 177.400 177.400 176.970 0.430 17919 91978 1 224 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.083 1.097 17919 91979 1 224 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.298 -0.198 17919 91980 1 224 . 1 1 58 58 ASP H H 58 7.930 7.930 7.833 0.097 17919 91981 1 224 . 1 1 59 59 TYR N N 59 115.510 115.510 117.292 -1.782 17919 91982 1 224 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.608 0.062 17919 91983 1 224 . 1 1 59 59 TYR C C 59 174.700 174.700 175.853 -1.153 17919 91984 1 224 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.569 0.681 17919 91985 1 224 . 1 1 59 59 TYR CB C 59 40.070 40.070 39.328 0.742 17919 91986 1 224 . 1 1 59 59 TYR H H 59 7.250 7.250 7.495 -0.245 17919 91987 1 224 . 1 1 60 60 ASN N N 60 115.900 115.900 117.508 -1.608 17919 91988 1 224 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.359 -0.004 17919 91989 1 224 . 1 1 60 60 ASN C C 60 174.340 174.340 174.590 -0.250 17919 91990 1 224 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.598 -0.478 17919 91991 1 224 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.406 0.004 17919 91992 1 224 . 1 1 60 60 ASN H H 60 8.150 8.150 8.021 0.129 17919 91993 1 224 . 1 1 61 61 ILE N N 61 118.600 118.600 119.624 -1.024 17919 91994 1 224 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.913 -0.520 17919 91995 1 224 . 1 1 61 61 ILE C C 61 174.610 174.610 175.784 -1.174 17919 91996 1 224 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.669 0.751 17919 91997 1 224 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.700 -0.960 17919 91998 1 224 . 1 1 61 61 ILE H H 61 7.250 7.250 7.463 -0.213 17919 91999 1 224 . 1 1 62 62 GLN N N 62 124.740 124.740 126.708 -1.968 17919 92000 1 224 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.583 -0.077 17919 92001 1 224 . 1 1 62 62 GLN C C 62 175.970 175.970 176.196 -0.226 17919 92002 1 224 . 1 1 62 62 GLN CA C 62 53.660 53.660 54.284 -0.624 17919 92003 1 224 . 1 1 62 62 GLN CB C 62 31.650 31.650 30.640 1.010 17919 92004 1 224 . 1 1 62 62 GLN H H 62 7.610 7.610 8.048 -0.438 17919 92005 1 224 . 1 1 63 63 LYS N N 63 120.300 120.300 120.597 -0.297 17919 92006 1 224 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.999 0.002 17919 92007 1 224 . 1 1 63 63 LYS C C 63 175.810 175.810 176.935 -1.125 17919 92008 1 224 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.744 0.046 17919 92009 1 224 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.901 0.750 17919 92010 1 224 . 1 1 63 63 LYS H H 63 8.490 8.490 8.651 -0.161 17919 92011 1 224 . 1 1 64 64 GLU N N 64 113.950 113.950 119.435 -5.485 17919 92012 1 224 . 1 1 64 64 GLU HA H 64 3.465 3.465 2.984 0.481 17919 92013 1 224 . 1 1 64 64 GLU C C 64 175.250 175.250 175.834 -0.584 17919 92014 1 224 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.197 0.693 17919 92015 1 224 . 1 1 64 64 GLU CB C 64 25.900 25.900 27.739 -1.839 17919 92016 1 224 . 1 1 64 64 GLU H H 64 9.280 9.280 8.762 0.518 17919 92017 1 224 . 1 1 65 65 SER N N 65 114.730 114.730 114.725 0.005 17919 92018 1 224 . 1 1 65 65 SER HA H 65 4.640 4.640 4.486 0.154 17919 92019 1 224 . 1 1 65 65 SER C C 65 172.160 172.160 173.933 -1.773 17919 92020 1 224 . 1 1 65 65 SER CA C 65 60.890 60.890 60.227 0.663 17919 92021 1 224 . 1 1 65 65 SER CB C 65 64.910 64.910 63.994 0.916 17919 92022 1 224 . 1 1 65 65 SER H H 65 7.670 7.670 7.527 0.143 17919 92023 1 224 . 1 1 66 66 THR N N 66 117.110 117.110 120.651 -3.541 17919 92024 1 224 . 1 1 66 66 THR HA H 66 5.270 5.270 5.149 0.121 17919 92025 1 224 . 1 1 66 66 THR C C 66 173.950 173.950 174.003 -0.053 17919 92026 1 224 . 1 1 66 66 THR CA C 66 62.340 62.340 62.116 0.224 17919 92027 1 224 . 1 1 66 66 THR CB C 66 70.080 70.080 69.734 0.346 17919 92028 1 224 . 1 1 66 66 THR H H 66 8.730 8.730 8.377 0.353 17919 92029 1 224 . 1 1 67 67 LEU N N 67 127.110 127.110 127.705 -0.595 17919 92030 1 224 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.818 0.242 17919 92031 1 224 . 1 1 67 67 LEU C C 67 175.770 175.770 175.618 0.152 17919 92032 1 224 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.631 0.269 17919 92033 1 224 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.923 0.337 17919 92034 1 224 . 1 1 67 67 LEU H H 67 9.410 9.410 9.161 0.249 17919 92035 1 224 . 1 1 68 68 HIS N N 68 118.380 118.380 121.157 -2.777 17919 92036 1 224 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.393 -0.153 17919 92037 1 224 . 1 1 68 68 HIS C C 68 173.150 173.150 173.791 -0.641 17919 92038 1 224 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.299 0.701 17919 92039 1 224 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.659 -2.129 17919 92040 1 224 . 1 1 68 68 HIS H H 68 9.230 9.230 8.622 0.608 17919 92041 1 224 . 1 1 69 69 LEU N N 69 124.460 124.460 129.636 -5.176 17919 92042 1 224 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.109 0.081 17919 92043 1 224 . 1 1 69 69 LEU C C 69 175.270 175.270 174.566 0.704 17919 92044 1 224 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.574 0.316 17919 92045 1 224 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.219 0.161 17919 92046 1 224 . 1 1 69 69 LEU H H 69 8.340 8.340 8.223 0.117 17919 92047 1 224 . 1 1 70 70 VAL N N 70 126.940 126.940 123.190 3.750 17919 92048 1 224 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.481 -0.131 17919 92049 1 224 . 1 1 70 70 VAL C C 70 174.000 174.000 174.215 -0.215 17919 92050 1 224 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.522 1.278 17919 92051 1 224 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.261 -0.351 17919 92052 1 224 . 1 1 70 70 VAL H H 70 9.200 9.200 9.031 0.169 17919 92053 1 224 . 1 1 71 71 LEU N N 71 123.130 123.130 121.641 1.489 17919 92054 1 224 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.990 0.070 17919 92055 1 224 . 1 1 71 71 LEU C C 71 177.830 177.830 177.606 0.224 17919 92056 1 224 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.245 0.695 17919 92057 1 224 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.609 0.241 17919 92058 1 224 . 1 1 71 71 LEU H H 71 8.120 8.120 8.424 -0.304 17919 92059 1 224 . 1 1 72 72 ARG N N 72 123.490 123.490 124.488 -0.998 17919 92060 1 224 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.101 0.200 17919 92061 1 224 . 1 1 72 72 ARG C C 72 175.350 175.350 175.641 -0.291 17919 92062 1 224 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.858 -1.248 17919 92063 1 224 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.809 0.541 17919 92064 1 224 . 1 1 72 72 ARG H H 72 8.580 8.580 8.177 0.403 17919 92065 1 225 . 1 1 2 2 GLN N N 2 123.220 123.220 121.484 1.736 17919 92066 1 225 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.316 -0.067 17919 92067 1 225 . 1 1 2 2 GLN C C 2 175.920 175.920 174.762 1.158 17919 92068 1 225 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.787 0.293 17919 92069 1 225 . 1 1 2 2 GLN CB C 2 30.760 30.760 31.024 -0.264 17919 92070 1 225 . 1 1 2 2 GLN H H 2 8.900 8.900 8.433 0.467 17919 92071 1 225 . 1 1 3 3 ILE N N 3 115.340 115.340 118.019 -2.679 17919 92072 1 225 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.823 -0.610 17919 92073 1 225 . 1 1 3 3 ILE C C 3 172.450 172.450 173.479 -1.029 17919 92074 1 225 . 1 1 3 3 ILE CA C 3 59.570 59.570 58.902 0.668 17919 92075 1 225 . 1 1 3 3 ILE CB C 3 42.210 42.210 42.232 -0.022 17919 92076 1 225 . 1 1 3 3 ILE H H 3 8.320 8.320 8.626 -0.306 17919 92077 1 225 . 1 1 4 4 PHE N N 4 118.110 118.110 120.039 -1.929 17919 92078 1 225 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.559 0.071 17919 92079 1 225 . 1 1 4 4 PHE C C 4 175.320 175.320 175.223 0.097 17919 92080 1 225 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.633 -0.423 17919 92081 1 225 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.460 0.020 17919 92082 1 225 . 1 1 4 4 PHE H H 4 8.610 8.610 8.574 0.036 17919 92083 1 225 . 1 1 5 5 VAL N N 5 121.000 121.000 122.831 -1.831 17919 92084 1 225 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.997 -0.272 17919 92085 1 225 . 1 1 5 5 VAL C C 5 174.870 174.870 174.720 0.150 17919 92086 1 225 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.014 -0.394 17919 92087 1 225 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.633 0.597 17919 92088 1 225 . 1 1 5 5 VAL H H 5 9.300 9.300 9.273 0.027 17919 92089 1 225 . 1 1 6 6 LYS N N 6 127.520 127.520 128.455 -0.935 17919 92090 1 225 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.429 -0.062 17919 92091 1 225 . 1 1 6 6 LYS C C 6 177.140 177.140 176.613 0.527 17919 92092 1 225 . 1 1 6 6 LYS CA C 6 54.520 54.520 53.976 0.544 17919 92093 1 225 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.460 -0.410 17919 92094 1 225 . 1 1 6 6 LYS H H 6 8.820 8.820 9.157 -0.337 17919 92095 1 225 . 1 1 7 7 THR N N 7 115.400 115.400 118.843 -3.443 17919 92096 1 225 . 1 1 7 7 THR HA H 7 4.970 4.970 4.375 0.595 17919 92097 1 225 . 1 1 7 7 THR C C 7 176.910 176.910 176.957 -0.047 17919 92098 1 225 . 1 1 7 7 THR CA C 7 60.470 60.470 61.173 -0.703 17919 92099 1 225 . 1 1 7 7 THR CB C 7 70.630 70.630 70.123 0.507 17919 92100 1 225 . 1 1 7 7 THR H H 7 8.730 8.730 8.622 0.108 17919 92101 1 225 . 1 1 8 8 LEU N N 8 121.330 121.330 121.106 0.224 17919 92102 1 225 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.452 -0.142 17919 92103 1 225 . 1 1 8 8 LEU C C 8 178.800 178.800 177.255 1.545 17919 92104 1 225 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.731 -0.151 17919 92105 1 225 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.443 0.527 17919 92106 1 225 . 1 1 8 8 LEU H H 8 9.100 9.100 8.334 0.766 17919 92107 1 225 . 1 1 9 9 THR N N 9 105.590 105.590 107.988 -2.398 17919 92108 1 225 . 1 1 9 9 THR HA H 9 4.428 4.428 4.400 0.028 17919 92109 1 225 . 1 1 9 9 THR C C 9 175.520 175.520 175.621 -0.101 17919 92110 1 225 . 1 1 9 9 THR CA C 9 61.400 61.400 61.578 -0.178 17919 92111 1 225 . 1 1 9 9 THR CB C 9 69.140 69.140 69.397 -0.257 17919 92112 1 225 . 1 1 9 9 THR H H 9 7.630 7.630 7.517 0.113 17919 92113 1 225 . 1 1 10 10 GLY N N 10 108.890 108.890 111.018 -2.128 17919 92114 1 225 . 1 1 10 10 GLY C C 10 174.070 174.070 173.778 0.292 17919 92115 1 225 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.058 0.402 17919 92116 1 225 . 1 1 10 10 GLY H H 10 7.810 7.810 8.400 -0.590 17919 92117 1 225 . 1 1 11 11 LYS N N 11 121.600 121.600 120.819 0.781 17919 92118 1 225 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.479 -0.118 17919 92119 1 225 . 1 1 11 11 LYS C C 11 175.940 175.940 175.291 0.649 17919 92120 1 225 . 1 1 11 11 LYS CA C 11 56.280 56.280 55.887 0.393 17919 92121 1 225 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.379 -0.179 17919 92122 1 225 . 1 1 11 11 LYS H H 11 7.280 7.280 7.629 -0.349 17919 92123 1 225 . 1 1 12 12 THR N N 12 120.440 120.440 118.997 1.443 17919 92124 1 225 . 1 1 12 12 THR HA H 12 5.046 5.046 4.982 0.064 17919 92125 1 225 . 1 1 12 12 THR C C 12 174.320 174.320 174.302 0.018 17919 92126 1 225 . 1 1 12 12 THR CA C 12 62.390 62.390 62.658 -0.268 17919 92127 1 225 . 1 1 12 12 THR CB C 12 69.910 69.910 69.731 0.179 17919 92128 1 225 . 1 1 12 12 THR H H 12 8.650 8.650 8.310 0.340 17919 92129 1 225 . 1 1 13 13 ILE N N 13 127.110 127.110 128.936 -1.826 17919 92130 1 225 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.502 0.042 17919 92131 1 225 . 1 1 13 13 ILE C C 13 175.220 175.220 175.503 -0.283 17919 92132 1 225 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.120 -0.140 17919 92133 1 225 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.113 -0.163 17919 92134 1 225 . 1 1 13 13 ILE H H 13 9.450 9.450 9.256 0.194 17919 92135 1 225 . 1 1 14 14 THR N N 14 121.520 121.520 121.140 0.380 17919 92136 1 225 . 1 1 14 14 THR HA H 14 4.964 4.964 4.734 0.230 17919 92137 1 225 . 1 1 14 14 THR C C 14 173.790 173.790 174.220 -0.430 17919 92138 1 225 . 1 1 14 14 THR CA C 14 61.940 61.940 62.053 -0.113 17919 92139 1 225 . 1 1 14 14 THR CB C 14 69.650 69.650 69.312 0.338 17919 92140 1 225 . 1 1 14 14 THR H H 14 8.710 8.710 8.503 0.207 17919 92141 1 225 . 1 1 15 15 LEU N N 15 124.800 124.800 126.703 -1.903 17919 92142 1 225 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.679 0.101 17919 92143 1 225 . 1 1 15 15 LEU C C 15 174.670 174.670 175.460 -0.790 17919 92144 1 225 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.702 -0.872 17919 92145 1 225 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.472 1.598 17919 92146 1 225 . 1 1 15 15 LEU H H 15 8.710 8.710 8.302 0.408 17919 92147 1 225 . 1 1 16 16 GLU N N 16 122.160 122.160 124.574 -2.414 17919 92148 1 225 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.865 0.052 17919 92149 1 225 . 1 1 16 16 GLU C C 16 175.860 175.860 176.012 -0.152 17919 92150 1 225 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.715 -0.895 17919 92151 1 225 . 1 1 16 16 GLU CB C 16 29.450 29.450 29.824 -0.374 17919 92152 1 225 . 1 1 16 16 GLU H H 16 8.140 8.140 8.691 -0.551 17919 92153 1 225 . 1 1 17 17 VAL N N 17 117.210 117.210 121.232 -4.022 17919 92154 1 225 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.963 -0.249 17919 92155 1 225 . 1 1 17 17 VAL C C 17 174.160 174.160 175.320 -1.160 17919 92156 1 225 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.776 -0.346 17919 92157 1 225 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.803 0.597 17919 92158 1 225 . 1 1 17 17 VAL H H 17 8.900 8.900 9.043 -0.143 17919 92159 1 225 . 1 1 18 18 GLU N N 18 118.990 118.990 121.708 -2.718 17919 92160 1 225 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.673 0.406 17919 92161 1 225 . 1 1 18 18 GLU C C 18 176.160 176.160 175.872 0.288 17919 92162 1 225 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.382 -0.662 17919 92163 1 225 . 1 1 18 18 GLU CB C 18 30.310 30.310 29.636 0.674 17919 92164 1 225 . 1 1 18 18 GLU H H 18 8.640 8.640 8.499 0.141 17919 92165 1 225 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.397 -0.256 17919 92166 1 225 . 1 1 19 19 PRO C C 19 175.310 175.310 177.047 -1.737 17919 92167 1 225 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.128 0.342 17919 92168 1 225 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.077 -0.127 17919 92169 1 225 . 1 1 20 20 SER N N 20 103.400 103.400 112.090 -8.690 17919 92170 1 225 . 1 1 20 20 SER HA H 20 4.370 4.370 4.427 -0.057 17919 92171 1 225 . 1 1 20 20 SER C C 20 174.660 174.660 173.978 0.682 17919 92172 1 225 . 1 1 20 20 SER CA C 20 57.400 57.400 58.022 -0.622 17919 92173 1 225 . 1 1 20 20 SER CB C 20 63.370 63.370 63.223 0.147 17919 92174 1 225 . 1 1 20 20 SER H H 20 7.040 7.040 8.312 -1.272 17919 92175 1 225 . 1 1 21 21 ASP N N 21 123.480 123.480 123.430 0.050 17919 92176 1 225 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.729 -0.034 17919 92177 1 225 . 1 1 21 21 ASP C C 21 176.360 176.360 176.017 0.343 17919 92178 1 225 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.156 0.545 17919 92179 1 225 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.742 -0.942 17919 92180 1 225 . 1 1 21 21 ASP H H 21 8.030 8.030 7.365 0.665 17919 92181 1 225 . 1 1 22 22 THR N N 22 108.800 108.800 113.024 -4.224 17919 92182 1 225 . 1 1 22 22 THR HA H 22 4.920 4.920 4.809 0.111 17919 92183 1 225 . 1 1 22 22 THR C C 22 176.750 176.750 176.470 0.280 17919 92184 1 225 . 1 1 22 22 THR CA C 22 59.690 59.690 61.581 -1.891 17919 92185 1 225 . 1 1 22 22 THR CB C 22 71.200 71.200 71.167 0.033 17919 92186 1 225 . 1 1 22 22 THR H H 22 7.900 7.900 8.175 -0.275 17919 92187 1 225 . 1 1 23 23 ILE N N 23 121.190 121.190 122.614 -1.424 17919 92188 1 225 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.797 -0.140 17919 92189 1 225 . 1 1 23 23 ILE C C 23 179.040 179.040 178.041 0.999 17919 92190 1 225 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.688 -1.428 17919 92191 1 225 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.374 -2.024 17919 92192 1 225 . 1 1 23 23 ILE H H 23 8.560 8.560 8.748 -0.188 17919 92193 1 225 . 1 1 24 24 GLU N N 24 120.830 120.830 120.413 0.417 17919 92194 1 225 . 1 1 24 24 GLU HA H 24 3.917 3.917 4.007 -0.090 17919 92195 1 225 . 1 1 24 24 GLU C C 24 178.640 178.640 178.444 0.196 17919 92196 1 225 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.257 0.963 17919 92197 1 225 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.198 -0.918 17919 92198 1 225 . 1 1 24 24 GLU H H 24 9.760 9.760 8.070 1.690 17919 92199 1 225 . 1 1 25 25 ASN N N 25 120.570 120.570 118.520 2.050 17919 92200 1 225 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.473 0.052 17919 92201 1 225 . 1 1 25 25 ASN C C 25 178.380 178.380 177.723 0.657 17919 92202 1 225 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.443 -0.383 17919 92203 1 225 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.621 -0.171 17919 92204 1 225 . 1 1 25 25 ASN H H 25 7.920 7.920 7.770 0.150 17919 92205 1 225 . 1 1 26 26 VAL N N 26 121.710 121.710 119.924 1.786 17919 92206 1 225 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.612 -0.215 17919 92207 1 225 . 1 1 26 26 VAL C C 26 177.950 177.950 178.125 -0.175 17919 92208 1 225 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.308 1.353 17919 92209 1 225 . 1 1 26 26 VAL CB C 26 30.840 30.840 30.913 -0.073 17919 92210 1 225 . 1 1 26 26 VAL H H 26 8.070 8.070 8.251 -0.181 17919 92211 1 225 . 1 1 27 27 LYS N N 27 118.860 118.860 120.194 -1.334 17919 92212 1 225 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.146 0.434 17919 92213 1 225 . 1 1 27 27 LYS C C 27 180.550 180.550 179.324 1.226 17919 92214 1 225 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.695 -0.445 17919 92215 1 225 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.118 1.612 17919 92216 1 225 . 1 1 27 27 LYS H H 27 8.560 8.560 8.375 0.185 17919 92217 1 225 . 1 1 28 28 ALA N N 28 123.440 123.440 121.353 2.087 17919 92218 1 225 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.111 0.049 17919 92219 1 225 . 1 1 28 28 ALA C C 28 180.300 180.300 179.311 0.989 17919 92220 1 225 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.912 0.458 17919 92221 1 225 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.384 -0.674 17919 92222 1 225 . 1 1 28 28 ALA H H 28 8.060 8.060 8.438 -0.378 17919 92223 1 225 . 1 1 29 29 LYS N N 29 119.940 119.940 118.356 1.584 17919 92224 1 225 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.127 0.080 17919 92225 1 225 . 1 1 29 29 LYS C C 29 180.320 180.320 178.595 1.725 17919 92226 1 225 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.137 0.513 17919 92227 1 225 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.457 0.833 17919 92228 1 225 . 1 1 29 29 LYS H H 29 7.850 7.850 7.695 0.155 17919 92229 1 225 . 1 1 30 30 ILE N N 30 121.080 121.080 119.453 1.627 17919 92230 1 225 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.900 -0.393 17919 92231 1 225 . 1 1 30 30 ILE C C 30 178.310 178.310 177.277 1.033 17919 92232 1 225 . 1 1 30 30 ILE CA C 30 66.150 66.150 63.664 2.486 17919 92233 1 225 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.698 -0.898 17919 92234 1 225 . 1 1 30 30 ILE H H 30 8.280 8.280 7.703 0.577 17919 92235 1 225 . 1 1 31 31 GLN N N 31 123.490 123.490 121.940 1.550 17919 92236 1 225 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.010 -0.181 17919 92237 1 225 . 1 1 31 31 GLN C C 31 178.890 178.890 178.093 0.797 17919 92238 1 225 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.700 0.300 17919 92239 1 225 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.485 -0.765 17919 92240 1 225 . 1 1 31 31 GLN H H 31 8.580 8.580 8.564 0.016 17919 92241 1 225 . 1 1 32 32 ASP N N 32 119.360 119.360 119.096 0.264 17919 92242 1 225 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.438 -0.084 17919 92243 1 225 . 1 1 32 32 ASP C C 32 177.250 177.250 177.877 -0.627 17919 92244 1 225 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.605 0.585 17919 92245 1 225 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.708 -0.128 17919 92246 1 225 . 1 1 32 32 ASP H H 32 8.010 8.010 7.924 0.086 17919 92247 1 225 . 1 1 33 33 LYS N N 33 115.130 115.130 117.585 -2.455 17919 92248 1 225 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.317 0.020 17919 92249 1 225 . 1 1 33 33 LYS C C 33 177.870 177.870 177.761 0.109 17919 92250 1 225 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.659 0.391 17919 92251 1 225 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.395 0.775 17919 92252 1 225 . 1 1 33 33 LYS H H 33 7.430 7.430 7.315 0.115 17919 92253 1 225 . 1 1 34 34 GLU N N 34 113.870 113.870 114.788 -0.918 17919 92254 1 225 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.485 0.140 17919 92255 1 225 . 1 1 34 34 GLU C C 34 177.840 177.840 177.099 0.741 17919 92256 1 225 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.288 -1.118 17919 92257 1 225 . 1 1 34 34 GLU CB C 34 32.660 32.660 32.626 0.034 17919 92258 1 225 . 1 1 34 34 GLU H H 34 8.740 8.740 8.301 0.439 17919 92259 1 225 . 1 1 35 35 GLY N N 35 108.650 108.650 109.142 -0.492 17919 92260 1 225 . 1 1 35 35 GLY C C 35 173.960 173.960 174.276 -0.316 17919 92261 1 225 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.791 0.289 17919 92262 1 225 . 1 1 35 35 GLY H H 35 8.530 8.530 8.440 0.090 17919 92263 1 225 . 1 1 36 36 ILE N N 36 119.880 119.880 122.595 -2.715 17919 92264 1 225 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.309 0.136 17919 92265 1 225 . 1 1 36 36 ILE C C 36 173.590 173.590 174.446 -0.856 17919 92266 1 225 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.844 -0.094 17919 92267 1 225 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.124 2.456 17919 92268 1 225 . 1 1 36 36 ILE H H 36 6.150 6.150 7.596 -1.446 17919 92269 1 225 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.534 0.100 17919 92270 1 225 . 1 1 37 37 PRO C C 37 176.940 176.940 175.874 1.066 17919 92271 1 225 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.776 -0.116 17919 92272 1 225 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.016 0.834 17919 92273 1 225 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.341 -0.224 17919 92274 1 225 . 1 1 38 38 PRO C C 38 178.320 178.320 177.615 0.705 17919 92275 1 225 . 1 1 38 38 PRO CA C 38 66.260 66.260 64.971 1.289 17919 92276 1 225 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.879 1.011 17919 92277 1 225 . 1 1 39 39 ASP N N 39 113.380 113.380 115.617 -2.237 17919 92278 1 225 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.419 0.011 17919 92279 1 225 . 1 1 39 39 ASP C C 39 177.090 177.090 177.601 -0.511 17919 92280 1 225 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.517 -0.877 17919 92281 1 225 . 1 1 39 39 ASP CB C 39 39.540 39.540 39.600 -0.060 17919 92282 1 225 . 1 1 39 39 ASP H H 39 8.550 8.550 8.895 -0.345 17919 92283 1 225 . 1 1 40 40 GLN N N 40 116.780 116.780 119.035 -2.255 17919 92284 1 225 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.706 -0.242 17919 92285 1 225 . 1 1 40 40 GLN C C 40 175.380 175.380 175.472 -0.092 17919 92286 1 225 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.787 -0.147 17919 92287 1 225 . 1 1 40 40 GLN CB C 40 30.140 30.140 30.490 -0.350 17919 92288 1 225 . 1 1 40 40 GLN H H 40 7.820 7.820 7.580 0.240 17919 92289 1 225 . 1 1 41 41 GLN N N 41 117.720 117.720 118.751 -1.031 17919 92290 1 225 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.428 -0.184 17919 92291 1 225 . 1 1 41 41 GLN C C 41 176.300 176.300 175.369 0.931 17919 92292 1 225 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.865 0.605 17919 92293 1 225 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.881 1.769 17919 92294 1 225 . 1 1 41 41 GLN H H 41 7.480 7.480 7.383 0.097 17919 92295 1 225 . 1 1 42 42 ARG N N 42 122.680 122.680 124.795 -2.115 17919 92296 1 225 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.630 -0.130 17919 92297 1 225 . 1 1 42 42 ARG C C 42 174.050 174.050 174.054 -0.004 17919 92298 1 225 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.559 0.491 17919 92299 1 225 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.737 -1.988 17919 92300 1 225 . 1 1 42 42 ARG H H 42 8.530 8.530 8.763 -0.233 17919 92301 1 225 . 1 1 43 43 LEU N N 43 124.040 124.040 124.438 -0.398 17919 92302 1 225 . 1 1 43 43 LEU C C 43 175.290 175.290 175.655 -0.365 17919 92303 1 225 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.763 -0.783 17919 92304 1 225 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.859 0.931 17919 92305 1 225 . 1 1 43 43 LEU H H 43 8.820 8.820 8.785 0.035 17919 92306 1 225 . 1 1 44 44 ILE N N 44 121.920 121.920 120.481 1.439 17919 92307 1 225 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.872 0.120 17919 92308 1 225 . 1 1 44 44 ILE C C 44 176.060 176.060 174.727 1.333 17919 92309 1 225 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.782 -1.802 17919 92310 1 225 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.010 0.410 17919 92311 1 225 . 1 1 44 44 ILE H H 44 9.030 9.030 9.149 -0.119 17919 92312 1 225 . 1 1 45 45 PHE N N 45 125.390 125.390 129.919 -4.529 17919 92313 1 225 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.844 0.201 17919 92314 1 225 . 1 1 45 45 PHE C C 45 174.470 174.470 175.159 -0.689 17919 92315 1 225 . 1 1 45 45 PHE CA C 45 57.020 57.020 58.132 -1.112 17919 92316 1 225 . 1 1 45 45 PHE CB C 45 43.760 43.760 41.099 2.661 17919 92317 1 225 . 1 1 45 45 PHE H H 45 8.830 8.830 8.446 0.384 17919 92318 1 225 . 1 1 46 46 ALA N N 46 132.200 132.200 122.242 9.958 17919 92319 1 225 . 1 1 46 46 ALA HA H 46 3.690 3.690 4.353 -0.663 17919 92320 1 225 . 1 1 46 46 ALA C C 46 177.290 177.290 177.167 0.123 17919 92321 1 225 . 1 1 46 46 ALA CA C 46 52.540 52.540 50.840 1.700 17919 92322 1 225 . 1 1 46 46 ALA CB C 46 16.570 16.570 17.030 -0.460 17919 92323 1 225 . 1 1 46 46 ALA H H 46 8.810 8.810 8.278 0.532 17919 92324 1 225 . 1 1 47 47 GLY N N 47 102.340 102.340 107.155 -4.815 17919 92325 1 225 . 1 1 47 47 GLY C C 47 173.810 173.810 173.879 -0.069 17919 92326 1 225 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.500 -0.150 17919 92327 1 225 . 1 1 47 47 GLY H H 47 8.130 8.130 8.249 -0.119 17919 92328 1 225 . 1 1 48 48 LYS N N 48 121.570 121.570 120.463 1.107 17919 92329 1 225 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.618 0.004 17919 92330 1 225 . 1 1 48 48 LYS C C 48 174.700 174.700 174.997 -0.297 17919 92331 1 225 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.923 -0.373 17919 92332 1 225 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.689 -0.159 17919 92333 1 225 . 1 1 48 48 LYS H H 48 7.980 7.980 7.790 0.190 17919 92334 1 225 . 1 1 49 49 GLN N N 49 122.410 122.410 121.709 0.701 17919 92335 1 225 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.604 -0.044 17919 92336 1 225 . 1 1 49 49 GLN C C 49 175.670 175.670 175.449 0.221 17919 92337 1 225 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.825 -0.085 17919 92338 1 225 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.284 -0.284 17919 92339 1 225 . 1 1 49 49 GLN H H 49 8.600 8.600 8.466 0.134 17919 92340 1 225 . 1 1 50 50 LEU N N 50 125.520 125.520 125.753 -0.233 17919 92341 1 225 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.234 -0.144 17919 92342 1 225 . 1 1 50 50 LEU C C 50 176.660 176.660 176.294 0.366 17919 92343 1 225 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.446 -0.206 17919 92344 1 225 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.337 -0.766 17919 92345 1 225 . 1 1 50 50 LEU H H 50 8.530 8.530 8.600 -0.070 17919 92346 1 225 . 1 1 51 51 GLU N N 51 122.940 122.940 121.296 1.644 17919 92347 1 225 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.644 -0.156 17919 92348 1 225 . 1 1 51 51 GLU C C 51 175.870 175.870 176.988 -1.118 17919 92349 1 225 . 1 1 51 51 GLU CA C 51 55.960 55.960 54.966 0.994 17919 92350 1 225 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.367 -0.797 17919 92351 1 225 . 1 1 51 51 GLU H H 51 8.400 8.400 8.426 -0.026 17919 92352 1 225 . 1 1 52 52 ASP N N 52 120.030 120.030 124.024 -3.994 17919 92353 1 225 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.447 -0.088 17919 92354 1 225 . 1 1 52 52 ASP C C 52 177.330 177.330 177.718 -0.388 17919 92355 1 225 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.300 -0.340 17919 92356 1 225 . 1 1 52 52 ASP CB C 52 40.850 40.850 41.169 -0.319 17919 92357 1 225 . 1 1 52 52 ASP H H 52 8.160 8.160 8.885 -0.725 17919 92358 1 225 . 1 1 53 53 GLY N N 53 106.660 106.660 107.211 -0.551 17919 92359 1 225 . 1 1 53 53 GLY C C 53 174.870 174.870 174.877 -0.007 17919 92360 1 225 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.995 0.175 17919 92361 1 225 . 1 1 53 53 GLY H H 53 9.390 9.390 8.424 0.966 17919 92362 1 225 . 1 1 54 54 ARG N N 54 119.050 119.050 121.259 -2.209 17919 92363 1 225 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.230 0.465 17919 92364 1 225 . 1 1 54 54 ARG C C 54 175.350 175.350 176.051 -0.701 17919 92365 1 225 . 1 1 54 54 ARG CA C 54 54.390 54.390 56.347 -1.957 17919 92366 1 225 . 1 1 54 54 ARG CB C 54 32.650 32.650 31.041 1.609 17919 92367 1 225 . 1 1 54 54 ARG H H 54 7.460 7.460 7.531 -0.071 17919 92368 1 225 . 1 1 55 55 THR N N 55 108.400 108.400 111.859 -3.459 17919 92369 1 225 . 1 1 55 55 THR HA H 55 5.240 5.240 4.845 0.395 17919 92370 1 225 . 1 1 55 55 THR C C 55 176.560 176.560 176.306 0.254 17919 92371 1 225 . 1 1 55 55 THR CA C 55 59.690 59.690 61.040 -1.350 17919 92372 1 225 . 1 1 55 55 THR CB C 55 72.260 72.260 70.338 1.922 17919 92373 1 225 . 1 1 55 55 THR H H 55 8.730 8.730 8.341 0.389 17919 92374 1 225 . 1 1 56 56 LEU N N 56 117.920 117.920 121.558 -3.638 17919 92375 1 225 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.075 -0.015 17919 92376 1 225 . 1 1 56 56 LEU C C 56 180.810 180.810 178.952 1.858 17919 92377 1 225 . 1 1 56 56 LEU CA C 56 58.710 58.710 57.998 0.712 17919 92378 1 225 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.399 -1.029 17919 92379 1 225 . 1 1 56 56 LEU H H 56 8.140 8.140 8.861 -0.721 17919 92380 1 225 . 1 1 57 57 SER N N 57 113.330 113.330 115.625 -2.295 17919 92381 1 225 . 1 1 57 57 SER HA H 57 4.370 4.370 4.213 0.157 17919 92382 1 225 . 1 1 57 57 SER C C 57 178.310 178.310 176.789 1.521 17919 92383 1 225 . 1 1 57 57 SER CA C 57 61.080 61.080 62.522 -1.442 17919 92384 1 225 . 1 1 57 57 SER CB C 57 62.530 62.530 63.100 -0.570 17919 92385 1 225 . 1 1 57 57 SER H H 57 8.470 8.470 8.370 0.100 17919 92386 1 225 . 1 1 58 58 ASP N N 58 124.190 124.190 123.047 1.143 17919 92387 1 225 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.358 -0.062 17919 92388 1 225 . 1 1 58 58 ASP C C 58 177.400 177.400 177.527 -0.127 17919 92389 1 225 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.808 0.372 17919 92390 1 225 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.355 -0.255 17919 92391 1 225 . 1 1 58 58 ASP H H 58 7.930 7.930 7.728 0.202 17919 92392 1 225 . 1 1 59 59 TYR N N 59 115.510 115.510 115.985 -0.475 17919 92393 1 225 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.499 0.171 17919 92394 1 225 . 1 1 59 59 TYR C C 59 174.700 174.700 174.624 0.076 17919 92395 1 225 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.829 0.421 17919 92396 1 225 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.487 1.583 17919 92397 1 225 . 1 1 59 59 TYR H H 59 7.250 7.250 7.534 -0.284 17919 92398 1 225 . 1 1 60 60 ASN N N 60 115.900 115.900 116.277 -0.377 17919 92399 1 225 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.346 0.009 17919 92400 1 225 . 1 1 60 60 ASN C C 60 174.340 174.340 174.467 -0.127 17919 92401 1 225 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.232 -0.112 17919 92402 1 225 . 1 1 60 60 ASN CB C 60 37.410 37.410 36.882 0.528 17919 92403 1 225 . 1 1 60 60 ASN H H 60 8.150 8.150 7.709 0.441 17919 92404 1 225 . 1 1 61 61 ILE N N 61 118.600 118.600 118.437 0.163 17919 92405 1 225 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.949 -0.556 17919 92406 1 225 . 1 1 61 61 ILE C C 61 174.610 174.610 175.557 -0.947 17919 92407 1 225 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.174 1.246 17919 92408 1 225 . 1 1 61 61 ILE CB C 61 36.740 36.740 38.555 -1.815 17919 92409 1 225 . 1 1 61 61 ILE H H 61 7.250 7.250 7.793 -0.543 17919 92410 1 225 . 1 1 62 62 GLN N N 62 124.740 124.740 125.244 -0.504 17919 92411 1 225 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.722 -0.216 17919 92412 1 225 . 1 1 62 62 GLN C C 62 175.970 175.970 175.763 0.207 17919 92413 1 225 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.844 -0.184 17919 92414 1 225 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.346 0.304 17919 92415 1 225 . 1 1 62 62 GLN H H 62 7.610 7.610 8.090 -0.480 17919 92416 1 225 . 1 1 63 63 LYS N N 63 120.300 120.300 121.805 -1.505 17919 92417 1 225 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.045 -0.044 17919 92418 1 225 . 1 1 63 63 LYS C C 63 175.810 175.810 176.645 -0.835 17919 92419 1 225 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.720 0.070 17919 92420 1 225 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.041 0.609 17919 92421 1 225 . 1 1 63 63 LYS H H 63 8.490 8.490 8.650 -0.160 17919 92422 1 225 . 1 1 64 64 GLU N N 64 113.950 113.950 117.663 -3.713 17919 92423 1 225 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.824 -0.359 17919 92424 1 225 . 1 1 64 64 GLU C C 64 175.250 175.250 175.808 -0.558 17919 92425 1 225 . 1 1 64 64 GLU CA C 64 57.890 57.890 58.191 -0.301 17919 92426 1 225 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.818 -2.918 17919 92427 1 225 . 1 1 64 64 GLU H H 64 9.280 9.280 9.198 0.082 17919 92428 1 225 . 1 1 65 65 SER N N 65 114.730 114.730 116.057 -1.327 17919 92429 1 225 . 1 1 65 65 SER HA H 65 4.640 4.640 4.410 0.230 17919 92430 1 225 . 1 1 65 65 SER C C 65 172.160 172.160 174.025 -1.865 17919 92431 1 225 . 1 1 65 65 SER CA C 65 60.890 60.890 60.775 0.115 17919 92432 1 225 . 1 1 65 65 SER CB C 65 64.910 64.910 63.846 1.064 17919 92433 1 225 . 1 1 65 65 SER H H 65 7.670 7.670 7.710 -0.040 17919 92434 1 225 . 1 1 66 66 THR N N 66 117.110 117.110 119.396 -2.286 17919 92435 1 225 . 1 1 66 66 THR HA H 66 5.270 5.270 5.141 0.129 17919 92436 1 225 . 1 1 66 66 THR C C 66 173.950 173.950 174.363 -0.413 17919 92437 1 225 . 1 1 66 66 THR CA C 66 62.340 62.340 62.283 0.057 17919 92438 1 225 . 1 1 66 66 THR CB C 66 70.080 70.080 69.734 0.346 17919 92439 1 225 . 1 1 66 66 THR H H 66 8.730 8.730 8.289 0.441 17919 92440 1 225 . 1 1 67 67 LEU N N 67 127.110 127.110 126.980 0.130 17919 92441 1 225 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.841 0.219 17919 92442 1 225 . 1 1 67 67 LEU C C 67 175.770 175.770 174.961 0.809 17919 92443 1 225 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.992 -0.092 17919 92444 1 225 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.665 -0.405 17919 92445 1 225 . 1 1 67 67 LEU H H 67 9.410 9.410 9.217 0.193 17919 92446 1 225 . 1 1 68 68 HIS N N 68 118.380 118.380 121.921 -3.541 17919 92447 1 225 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.347 -0.107 17919 92448 1 225 . 1 1 68 68 HIS C C 68 173.150 173.150 173.617 -0.467 17919 92449 1 225 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.287 0.713 17919 92450 1 225 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.497 -1.967 17919 92451 1 225 . 1 1 68 68 HIS H H 68 9.230 9.230 9.105 0.125 17919 92452 1 225 . 1 1 69 69 LEU N N 69 124.460 124.460 129.150 -4.690 17919 92453 1 225 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.249 -0.059 17919 92454 1 225 . 1 1 69 69 LEU C C 69 175.270 175.270 174.511 0.759 17919 92455 1 225 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.438 0.452 17919 92456 1 225 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.378 0.002 17919 92457 1 225 . 1 1 69 69 LEU H H 69 8.340 8.340 7.853 0.487 17919 92458 1 225 . 1 1 70 70 VAL N N 70 126.940 126.940 121.805 5.135 17919 92459 1 225 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.548 -0.199 17919 92460 1 225 . 1 1 70 70 VAL C C 70 174.000 174.000 173.972 0.028 17919 92461 1 225 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.001 0.799 17919 92462 1 225 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.553 -0.643 17919 92463 1 225 . 1 1 70 70 VAL H H 70 9.200 9.200 8.919 0.281 17919 92464 1 225 . 1 1 71 71 LEU N N 71 123.130 123.130 124.905 -1.775 17919 92465 1 225 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.793 0.267 17919 92466 1 225 . 1 1 71 71 LEU C C 71 177.830 177.830 177.128 0.702 17919 92467 1 225 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.862 0.078 17919 92468 1 225 . 1 1 71 71 LEU CB C 71 42.850 42.850 40.708 2.142 17919 92469 1 225 . 1 1 71 71 LEU H H 71 8.120 8.120 8.449 -0.329 17919 92470 1 225 . 1 1 72 72 ARG N N 72 123.490 123.490 127.485 -3.995 17919 92471 1 225 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.420 -0.119 17919 92472 1 225 . 1 1 72 72 ARG C C 72 175.350 175.350 174.676 0.674 17919 92473 1 225 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.181 -0.571 17919 92474 1 225 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.233 1.117 17919 92475 1 225 . 1 1 72 72 ARG H H 72 8.580 8.580 8.463 0.117 17919 92476 1 226 . 1 1 2 2 GLN N N 2 123.220 123.220 120.143 3.077 17919 92477 1 226 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.280 -0.031 17919 92478 1 226 . 1 1 2 2 GLN C C 2 175.920 175.920 175.978 -0.058 17919 92479 1 226 . 1 1 2 2 GLN CA C 2 55.080 55.080 55.199 -0.119 17919 92480 1 226 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.114 0.646 17919 92481 1 226 . 1 1 2 2 GLN H H 2 8.900 8.900 8.606 0.294 17919 92482 1 226 . 1 1 3 3 ILE N N 3 115.340 115.340 114.497 0.843 17919 92483 1 226 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.597 -0.384 17919 92484 1 226 . 1 1 3 3 ILE C C 3 172.450 172.450 173.509 -1.059 17919 92485 1 226 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.207 0.363 17919 92486 1 226 . 1 1 3 3 ILE CB C 3 42.210 42.210 42.077 0.133 17919 92487 1 226 . 1 1 3 3 ILE H H 3 8.320 8.320 8.516 -0.196 17919 92488 1 226 . 1 1 4 4 PHE N N 4 118.110 118.110 119.897 -1.787 17919 92489 1 226 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.606 0.024 17919 92490 1 226 . 1 1 4 4 PHE C C 4 175.320 175.320 175.725 -0.405 17919 92491 1 226 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.542 -0.332 17919 92492 1 226 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.461 0.019 17919 92493 1 226 . 1 1 4 4 PHE H H 4 8.610 8.610 8.805 -0.195 17919 92494 1 226 . 1 1 5 5 VAL N N 5 121.000 121.000 120.102 0.898 17919 92495 1 226 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.918 -0.193 17919 92496 1 226 . 1 1 5 5 VAL C C 5 174.870 174.870 174.469 0.401 17919 92497 1 226 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.169 -0.549 17919 92498 1 226 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.655 -0.425 17919 92499 1 226 . 1 1 5 5 VAL H H 5 9.300 9.300 9.241 0.059 17919 92500 1 226 . 1 1 6 6 LYS N N 6 127.520 127.520 126.984 0.536 17919 92501 1 226 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.282 0.085 17919 92502 1 226 . 1 1 6 6 LYS C C 6 177.140 177.140 175.915 1.225 17919 92503 1 226 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.547 -0.028 17919 92504 1 226 . 1 1 6 6 LYS CB C 6 35.050 35.050 36.466 -1.416 17919 92505 1 226 . 1 1 6 6 LYS H H 6 8.820 8.820 9.166 -0.346 17919 92506 1 226 . 1 1 7 7 THR N N 7 115.400 115.400 116.345 -0.945 17919 92507 1 226 . 1 1 7 7 THR HA H 7 4.970 4.970 4.796 0.174 17919 92508 1 226 . 1 1 7 7 THR C C 7 176.910 176.910 175.939 0.971 17919 92509 1 226 . 1 1 7 7 THR CA C 7 60.470 60.470 60.155 0.315 17919 92510 1 226 . 1 1 7 7 THR CB C 7 70.630 70.630 71.321 -0.691 17919 92511 1 226 . 1 1 7 7 THR H H 7 8.730 8.730 8.827 -0.097 17919 92512 1 226 . 1 1 8 8 LEU N N 8 121.330 121.330 122.013 -0.683 17919 92513 1 226 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.298 0.011 17919 92514 1 226 . 1 1 8 8 LEU C C 8 178.800 178.800 177.527 1.273 17919 92515 1 226 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.298 0.282 17919 92516 1 226 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.257 -0.287 17919 92517 1 226 . 1 1 8 8 LEU H H 8 9.100 9.100 8.970 0.130 17919 92518 1 226 . 1 1 9 9 THR N N 9 105.590 105.590 109.266 -3.676 17919 92519 1 226 . 1 1 9 9 THR HA H 9 4.428 4.428 4.413 0.015 17919 92520 1 226 . 1 1 9 9 THR C C 9 175.520 175.520 175.668 -0.148 17919 92521 1 226 . 1 1 9 9 THR CA C 9 61.400 61.400 61.287 0.113 17919 92522 1 226 . 1 1 9 9 THR CB C 9 69.140 69.140 69.330 -0.190 17919 92523 1 226 . 1 1 9 9 THR H H 9 7.630 7.630 7.593 0.037 17919 92524 1 226 . 1 1 10 10 GLY N N 10 108.890 108.890 110.724 -1.834 17919 92525 1 226 . 1 1 10 10 GLY C C 10 174.070 174.070 174.797 -0.727 17919 92526 1 226 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.225 0.235 17919 92527 1 226 . 1 1 10 10 GLY H H 10 7.810 7.810 8.005 -0.195 17919 92528 1 226 . 1 1 11 11 LYS N N 11 121.600 121.600 121.864 -0.264 17919 92529 1 226 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.574 -0.213 17919 92530 1 226 . 1 1 11 11 LYS C C 11 175.940 175.940 175.454 0.486 17919 92531 1 226 . 1 1 11 11 LYS CA C 11 56.280 56.280 55.686 0.594 17919 92532 1 226 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.850 -0.650 17919 92533 1 226 . 1 1 11 11 LYS H H 11 7.280 7.280 7.715 -0.435 17919 92534 1 226 . 1 1 12 12 THR N N 12 120.440 120.440 117.713 2.727 17919 92535 1 226 . 1 1 12 12 THR HA H 12 5.046 5.046 5.351 -0.305 17919 92536 1 226 . 1 1 12 12 THR C C 12 174.320 174.320 174.562 -0.242 17919 92537 1 226 . 1 1 12 12 THR CA C 12 62.390 62.390 61.055 1.335 17919 92538 1 226 . 1 1 12 12 THR CB C 12 69.910 69.910 70.252 -0.342 17919 92539 1 226 . 1 1 12 12 THR H H 12 8.650 8.650 8.226 0.424 17919 92540 1 226 . 1 1 13 13 ILE N N 13 127.110 127.110 122.106 5.004 17919 92541 1 226 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.691 -0.147 17919 92542 1 226 . 1 1 13 13 ILE C C 13 175.220 175.220 174.645 0.575 17919 92543 1 226 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.641 0.339 17919 92544 1 226 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.009 0.941 17919 92545 1 226 . 1 1 13 13 ILE H H 13 9.450 9.450 9.327 0.123 17919 92546 1 226 . 1 1 14 14 THR N N 14 121.520 121.520 120.470 1.050 17919 92547 1 226 . 1 1 14 14 THR HA H 14 4.964 4.964 5.048 -0.084 17919 92548 1 226 . 1 1 14 14 THR C C 14 173.790 173.790 173.534 0.256 17919 92549 1 226 . 1 1 14 14 THR CA C 14 61.940 61.940 61.839 0.101 17919 92550 1 226 . 1 1 14 14 THR CB C 14 69.650 69.650 70.326 -0.676 17919 92551 1 226 . 1 1 14 14 THR H H 14 8.710 8.710 8.466 0.244 17919 92552 1 226 . 1 1 15 15 LEU N N 15 124.800 124.800 123.556 1.244 17919 92553 1 226 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.821 -0.041 17919 92554 1 226 . 1 1 15 15 LEU C C 15 174.670 174.670 175.403 -0.733 17919 92555 1 226 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.100 -0.270 17919 92556 1 226 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.977 1.093 17919 92557 1 226 . 1 1 15 15 LEU H H 15 8.710 8.710 8.912 -0.202 17919 92558 1 226 . 1 1 16 16 GLU N N 16 122.160 122.160 121.896 0.264 17919 92559 1 226 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.229 -0.312 17919 92560 1 226 . 1 1 16 16 GLU C C 16 175.860 175.860 175.567 0.293 17919 92561 1 226 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.377 -0.557 17919 92562 1 226 . 1 1 16 16 GLU CB C 16 29.450 29.450 31.107 -1.657 17919 92563 1 226 . 1 1 16 16 GLU H H 16 8.140 8.140 8.576 -0.436 17919 92564 1 226 . 1 1 17 17 VAL N N 17 117.210 117.210 118.710 -1.500 17919 92565 1 226 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.827 -0.113 17919 92566 1 226 . 1 1 17 17 VAL C C 17 174.160 174.160 174.644 -0.484 17919 92567 1 226 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.435 -0.005 17919 92568 1 226 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.210 1.190 17919 92569 1 226 . 1 1 17 17 VAL H H 17 8.900 8.900 8.524 0.376 17919 92570 1 226 . 1 1 18 18 GLU N N 18 118.990 118.990 120.922 -1.932 17919 92571 1 226 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.859 0.220 17919 92572 1 226 . 1 1 18 18 GLU C C 18 176.160 176.160 175.623 0.537 17919 92573 1 226 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.083 0.637 17919 92574 1 226 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.015 0.294 17919 92575 1 226 . 1 1 18 18 GLU H H 18 8.640 8.640 8.346 0.294 17919 92576 1 226 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.334 -0.193 17919 92577 1 226 . 1 1 19 19 PRO C C 19 175.310 175.310 177.557 -2.247 17919 92578 1 226 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.178 0.292 17919 92579 1 226 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.044 -0.094 17919 92580 1 226 . 1 1 20 20 SER N N 20 103.400 103.400 111.409 -8.009 17919 92581 1 226 . 1 1 20 20 SER HA H 20 4.370 4.370 4.338 0.032 17919 92582 1 226 . 1 1 20 20 SER C C 20 174.660 174.660 174.845 -0.185 17919 92583 1 226 . 1 1 20 20 SER CA C 20 57.400 57.400 59.264 -1.864 17919 92584 1 226 . 1 1 20 20 SER CB C 20 63.370 63.370 62.622 0.748 17919 92585 1 226 . 1 1 20 20 SER H H 20 7.040 7.040 8.131 -1.091 17919 92586 1 226 . 1 1 21 21 ASP N N 21 123.480 123.480 125.078 -1.598 17919 92587 1 226 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.699 -0.004 17919 92588 1 226 . 1 1 21 21 ASP C C 21 176.360 176.360 175.785 0.575 17919 92589 1 226 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.571 0.130 17919 92590 1 226 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.410 -0.610 17919 92591 1 226 . 1 1 21 21 ASP H H 21 8.030 8.030 7.976 0.054 17919 92592 1 226 . 1 1 22 22 THR N N 22 108.800 108.800 110.726 -1.926 17919 92593 1 226 . 1 1 22 22 THR HA H 22 4.920 4.920 4.734 0.186 17919 92594 1 226 . 1 1 22 22 THR C C 22 176.750 176.750 176.070 0.680 17919 92595 1 226 . 1 1 22 22 THR CA C 22 59.690 59.690 61.154 -1.464 17919 92596 1 226 . 1 1 22 22 THR CB C 22 71.200 71.200 70.343 0.857 17919 92597 1 226 . 1 1 22 22 THR H H 22 7.900 7.900 8.233 -0.333 17919 92598 1 226 . 1 1 23 23 ILE N N 23 121.190 121.190 121.534 -0.344 17919 92599 1 226 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.782 -0.125 17919 92600 1 226 . 1 1 23 23 ILE C C 23 179.040 179.040 177.537 1.503 17919 92601 1 226 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.009 -0.749 17919 92602 1 226 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.430 -2.080 17919 92603 1 226 . 1 1 23 23 ILE H H 23 8.560 8.560 8.643 -0.083 17919 92604 1 226 . 1 1 24 24 GLU N N 24 120.830 120.830 121.196 -0.366 17919 92605 1 226 . 1 1 24 24 GLU HA H 24 3.917 3.917 4.031 -0.114 17919 92606 1 226 . 1 1 24 24 GLU C C 24 178.640 178.640 178.633 0.007 17919 92607 1 226 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.928 0.292 17919 92608 1 226 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.566 -1.286 17919 92609 1 226 . 1 1 24 24 GLU H H 24 9.760 9.760 8.143 1.617 17919 92610 1 226 . 1 1 25 25 ASN N N 25 120.570 120.570 117.187 3.383 17919 92611 1 226 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.581 -0.056 17919 92612 1 226 . 1 1 25 25 ASN C C 25 178.380 178.380 177.995 0.385 17919 92613 1 226 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.565 0.496 17919 92614 1 226 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.640 -0.190 17919 92615 1 226 . 1 1 25 25 ASN H H 25 7.920 7.920 7.733 0.187 17919 92616 1 226 . 1 1 26 26 VAL N N 26 121.710 121.710 121.614 0.096 17919 92617 1 226 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.656 -0.259 17919 92618 1 226 . 1 1 26 26 VAL C C 26 177.950 177.950 177.541 0.409 17919 92619 1 226 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.553 1.107 17919 92620 1 226 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.668 -0.828 17919 92621 1 226 . 1 1 26 26 VAL H H 26 8.070 8.070 7.846 0.224 17919 92622 1 226 . 1 1 27 27 LYS N N 27 118.860 118.860 121.006 -2.146 17919 92623 1 226 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.184 0.396 17919 92624 1 226 . 1 1 27 27 LYS C C 27 180.550 180.550 179.063 1.487 17919 92625 1 226 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.887 -0.637 17919 92626 1 226 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.347 1.383 17919 92627 1 226 . 1 1 27 27 LYS H H 27 8.560 8.560 8.171 0.389 17919 92628 1 226 . 1 1 28 28 ALA N N 28 123.440 123.440 121.375 2.065 17919 92629 1 226 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.140 0.020 17919 92630 1 226 . 1 1 28 28 ALA C C 28 180.300 180.300 179.351 0.949 17919 92631 1 226 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.944 0.426 17919 92632 1 226 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.426 -0.716 17919 92633 1 226 . 1 1 28 28 ALA H H 28 8.060 8.060 8.206 -0.146 17919 92634 1 226 . 1 1 29 29 LYS N N 29 119.940 119.940 119.075 0.865 17919 92635 1 226 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.057 0.150 17919 92636 1 226 . 1 1 29 29 LYS C C 29 180.320 180.320 178.777 1.543 17919 92637 1 226 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.028 0.622 17919 92638 1 226 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.396 0.894 17919 92639 1 226 . 1 1 29 29 LYS H H 29 7.850 7.850 7.555 0.295 17919 92640 1 226 . 1 1 30 30 ILE N N 30 121.080 121.080 119.862 1.218 17919 92641 1 226 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.698 -0.191 17919 92642 1 226 . 1 1 30 30 ILE C C 30 178.310 178.310 177.280 1.030 17919 92643 1 226 . 1 1 30 30 ILE CA C 30 66.150 66.150 64.664 1.486 17919 92644 1 226 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.917 -1.117 17919 92645 1 226 . 1 1 30 30 ILE H H 30 8.280 8.280 8.281 -0.001 17919 92646 1 226 . 1 1 31 31 GLN N N 31 123.490 123.490 121.311 2.179 17919 92647 1 226 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.990 -0.161 17919 92648 1 226 . 1 1 31 31 GLN C C 31 178.890 178.890 178.269 0.621 17919 92649 1 226 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.263 0.737 17919 92650 1 226 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.604 -0.884 17919 92651 1 226 . 1 1 31 31 GLN H H 31 8.580 8.580 8.247 0.333 17919 92652 1 226 . 1 1 32 32 ASP N N 32 119.360 119.360 118.127 1.233 17919 92653 1 226 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.487 -0.133 17919 92654 1 226 . 1 1 32 32 ASP C C 32 177.250 177.250 177.076 0.174 17919 92655 1 226 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.170 1.020 17919 92656 1 226 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.722 -0.142 17919 92657 1 226 . 1 1 32 32 ASP H H 32 8.010 8.010 7.951 0.059 17919 92658 1 226 . 1 1 33 33 LYS N N 33 115.130 115.130 118.361 -3.231 17919 92659 1 226 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.354 -0.017 17919 92660 1 226 . 1 1 33 33 LYS C C 33 177.870 177.870 178.023 -0.153 17919 92661 1 226 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.829 0.221 17919 92662 1 226 . 1 1 33 33 LYS CB C 33 34.170 34.170 34.373 -0.203 17919 92663 1 226 . 1 1 33 33 LYS H H 33 7.430 7.430 7.408 0.022 17919 92664 1 226 . 1 1 34 34 GLU N N 34 113.870 113.870 115.980 -2.110 17919 92665 1 226 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.447 0.178 17919 92666 1 226 . 1 1 34 34 GLU C C 34 177.840 177.840 177.473 0.367 17919 92667 1 226 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.632 -1.462 17919 92668 1 226 . 1 1 34 34 GLU CB C 34 32.660 32.660 30.984 1.676 17919 92669 1 226 . 1 1 34 34 GLU H H 34 8.740 8.740 8.502 0.238 17919 92670 1 226 . 1 1 35 35 GLY N N 35 108.650 108.650 108.764 -0.114 17919 92671 1 226 . 1 1 35 35 GLY C C 35 173.960 173.960 174.199 -0.239 17919 92672 1 226 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.176 0.904 17919 92673 1 226 . 1 1 35 35 GLY H H 35 8.530 8.530 8.289 0.241 17919 92674 1 226 . 1 1 36 36 ILE N N 36 119.880 119.880 118.285 1.595 17919 92675 1 226 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.612 -0.167 17919 92676 1 226 . 1 1 36 36 ILE C C 36 173.590 173.590 173.660 -0.070 17919 92677 1 226 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.566 0.185 17919 92678 1 226 . 1 1 36 36 ILE CB C 36 40.580 40.580 37.939 2.641 17919 92679 1 226 . 1 1 36 36 ILE H H 36 6.150 6.150 7.679 -1.529 17919 92680 1 226 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.586 0.048 17919 92681 1 226 . 1 1 37 37 PRO C C 37 176.940 176.940 176.125 0.815 17919 92682 1 226 . 1 1 37 37 PRO CA C 37 61.660 61.660 62.129 -0.469 17919 92683 1 226 . 1 1 37 37 PRO CB C 37 31.850 31.850 30.888 0.962 17919 92684 1 226 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.084 0.033 17919 92685 1 226 . 1 1 38 38 PRO C C 38 178.320 178.320 178.530 -0.210 17919 92686 1 226 . 1 1 38 38 PRO CA C 38 66.260 66.260 66.010 0.250 17919 92687 1 226 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.619 1.271 17919 92688 1 226 . 1 1 39 39 ASP N N 39 113.380 113.380 114.948 -1.568 17919 92689 1 226 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.364 0.066 17919 92690 1 226 . 1 1 39 39 ASP C C 39 177.090 177.090 177.553 -0.463 17919 92691 1 226 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.638 -0.998 17919 92692 1 226 . 1 1 39 39 ASP CB C 39 39.540 39.540 39.651 -0.111 17919 92693 1 226 . 1 1 39 39 ASP H H 39 8.550 8.550 8.661 -0.111 17919 92694 1 226 . 1 1 40 40 GLN N N 40 116.780 116.780 115.532 1.248 17919 92695 1 226 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.163 0.301 17919 92696 1 226 . 1 1 40 40 GLN C C 40 175.380 175.380 176.504 -1.124 17919 92697 1 226 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.279 -0.639 17919 92698 1 226 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.009 1.131 17919 92699 1 226 . 1 1 40 40 GLN H H 40 7.820 7.820 7.764 0.056 17919 92700 1 226 . 1 1 41 41 GLN N N 41 117.720 117.720 118.820 -1.100 17919 92701 1 226 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.679 -0.435 17919 92702 1 226 . 1 1 41 41 GLN C C 41 176.300 176.300 175.742 0.558 17919 92703 1 226 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.563 0.907 17919 92704 1 226 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.839 1.811 17919 92705 1 226 . 1 1 41 41 GLN H H 41 7.480 7.480 7.755 -0.275 17919 92706 1 226 . 1 1 42 42 ARG N N 42 122.680 122.680 125.720 -3.040 17919 92707 1 226 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.590 -0.090 17919 92708 1 226 . 1 1 42 42 ARG C C 42 174.050 174.050 173.968 0.082 17919 92709 1 226 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.952 0.098 17919 92710 1 226 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.031 -1.281 17919 92711 1 226 . 1 1 42 42 ARG H H 42 8.530 8.530 8.769 -0.239 17919 92712 1 226 . 1 1 43 43 LEU N N 43 124.040 124.040 127.985 -3.945 17919 92713 1 226 . 1 1 43 43 LEU C C 43 175.290 175.290 175.381 -0.091 17919 92714 1 226 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.996 -1.016 17919 92715 1 226 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.705 2.085 17919 92716 1 226 . 1 1 43 43 LEU H H 43 8.820 8.820 8.874 -0.054 17919 92717 1 226 . 1 1 44 44 ILE N N 44 121.920 121.920 121.882 0.038 17919 92718 1 226 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.788 0.204 17919 92719 1 226 . 1 1 44 44 ILE C C 44 176.060 176.060 174.344 1.716 17919 92720 1 226 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.144 -1.164 17919 92721 1 226 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.285 0.135 17919 92722 1 226 . 1 1 44 44 ILE H H 44 9.030 9.030 8.387 0.643 17919 92723 1 226 . 1 1 45 45 PHE N N 45 125.390 125.390 127.330 -1.940 17919 92724 1 226 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.068 -0.023 17919 92725 1 226 . 1 1 45 45 PHE C C 45 174.470 174.470 174.574 -0.104 17919 92726 1 226 . 1 1 45 45 PHE CA C 45 57.020 57.020 55.841 1.179 17919 92727 1 226 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.270 0.490 17919 92728 1 226 . 1 1 45 45 PHE H H 45 8.830 8.830 8.910 -0.080 17919 92729 1 226 . 1 1 46 46 ALA N N 46 132.200 132.200 129.121 3.079 17919 92730 1 226 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.675 0.015 17919 92731 1 226 . 1 1 46 46 ALA C C 46 177.290 177.290 177.906 -0.616 17919 92732 1 226 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.280 0.260 17919 92733 1 226 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.492 0.078 17919 92734 1 226 . 1 1 46 46 ALA H H 46 8.810 8.810 8.560 0.250 17919 92735 1 226 . 1 1 47 47 GLY N N 47 102.340 102.340 105.602 -3.262 17919 92736 1 226 . 1 1 47 47 GLY C C 47 173.810 173.810 174.173 -0.363 17919 92737 1 226 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.169 0.180 17919 92738 1 226 . 1 1 47 47 GLY H H 47 8.130 8.130 8.552 -0.422 17919 92739 1 226 . 1 1 48 48 LYS N N 48 121.570 121.570 120.925 0.645 17919 92740 1 226 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.613 0.009 17919 92741 1 226 . 1 1 48 48 LYS C C 48 174.700 174.700 175.322 -0.622 17919 92742 1 226 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.022 -0.471 17919 92743 1 226 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.775 -0.245 17919 92744 1 226 . 1 1 48 48 LYS H H 48 7.980 7.980 8.040 -0.060 17919 92745 1 226 . 1 1 49 49 GLN N N 49 122.410 122.410 123.540 -1.130 17919 92746 1 226 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.495 0.065 17919 92747 1 226 . 1 1 49 49 GLN C C 49 175.670 175.670 175.865 -0.195 17919 92748 1 226 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.193 -0.453 17919 92749 1 226 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.264 -0.264 17919 92750 1 226 . 1 1 49 49 GLN H H 49 8.600 8.600 8.562 0.038 17919 92751 1 226 . 1 1 50 50 LEU N N 50 125.520 125.520 128.165 -2.645 17919 92752 1 226 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.258 -0.168 17919 92753 1 226 . 1 1 50 50 LEU C C 50 176.660 176.660 175.793 0.867 17919 92754 1 226 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.780 0.460 17919 92755 1 226 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.791 -0.221 17919 92756 1 226 . 1 1 50 50 LEU H H 50 8.530 8.530 8.723 -0.193 17919 92757 1 226 . 1 1 51 51 GLU N N 51 122.940 122.940 124.860 -1.920 17919 92758 1 226 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.397 0.091 17919 92759 1 226 . 1 1 51 51 GLU C C 51 175.870 175.870 177.127 -1.257 17919 92760 1 226 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.466 0.494 17919 92761 1 226 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.583 -0.013 17919 92762 1 226 . 1 1 51 51 GLU H H 51 8.400 8.400 8.302 0.098 17919 92763 1 226 . 1 1 52 52 ASP N N 52 120.030 120.030 127.790 -7.760 17919 92764 1 226 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.346 0.013 17919 92765 1 226 . 1 1 52 52 ASP C C 52 177.330 177.330 177.835 -0.505 17919 92766 1 226 . 1 1 52 52 ASP CA C 52 56.960 56.960 58.498 -1.538 17919 92767 1 226 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.820 0.030 17919 92768 1 226 . 1 1 52 52 ASP H H 52 8.160 8.160 8.772 -0.612 17919 92769 1 226 . 1 1 53 53 GLY N N 53 106.660 106.660 104.881 1.779 17919 92770 1 226 . 1 1 53 53 GLY C C 53 174.870 174.870 174.180 0.690 17919 92771 1 226 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.998 0.172 17919 92772 1 226 . 1 1 53 53 GLY H H 53 9.390 9.390 8.726 0.664 17919 92773 1 226 . 1 1 54 54 ARG N N 54 119.050 119.050 119.568 -0.518 17919 92774 1 226 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.651 0.044 17919 92775 1 226 . 1 1 54 54 ARG C C 54 175.350 175.350 174.796 0.554 17919 92776 1 226 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.122 0.268 17919 92777 1 226 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.233 0.417 17919 92778 1 226 . 1 1 54 54 ARG H H 54 7.460 7.460 7.384 0.076 17919 92779 1 226 . 1 1 55 55 THR N N 55 108.400 108.400 110.293 -1.893 17919 92780 1 226 . 1 1 55 55 THR HA H 55 5.240 5.240 5.166 0.074 17919 92781 1 226 . 1 1 55 55 THR C C 55 176.560 176.560 175.798 0.762 17919 92782 1 226 . 1 1 55 55 THR CA C 55 59.690 59.690 59.807 -0.117 17919 92783 1 226 . 1 1 55 55 THR CB C 55 72.260 72.260 72.104 0.156 17919 92784 1 226 . 1 1 55 55 THR H H 55 8.730 8.730 8.867 -0.137 17919 92785 1 226 . 1 1 56 56 LEU N N 56 117.920 117.920 120.805 -2.885 17919 92786 1 226 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.103 -0.043 17919 92787 1 226 . 1 1 56 56 LEU C C 56 180.810 180.810 179.205 1.605 17919 92788 1 226 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.327 0.383 17919 92789 1 226 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.694 -1.324 17919 92790 1 226 . 1 1 56 56 LEU H H 56 8.140 8.140 8.383 -0.243 17919 92791 1 226 . 1 1 57 57 SER N N 57 113.330 113.330 115.078 -1.748 17919 92792 1 226 . 1 1 57 57 SER HA H 57 4.370 4.370 4.261 0.109 17919 92793 1 226 . 1 1 57 57 SER C C 57 178.310 178.310 176.726 1.584 17919 92794 1 226 . 1 1 57 57 SER CA C 57 61.080 61.080 61.778 -0.698 17919 92795 1 226 . 1 1 57 57 SER CB C 57 62.530 62.530 62.839 -0.309 17919 92796 1 226 . 1 1 57 57 SER H H 57 8.470 8.470 8.047 0.423 17919 92797 1 226 . 1 1 58 58 ASP N N 58 124.190 124.190 121.887 2.303 17919 92798 1 226 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.315 -0.019 17919 92799 1 226 . 1 1 58 58 ASP C C 58 177.400 177.400 177.110 0.290 17919 92800 1 226 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.810 0.370 17919 92801 1 226 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.523 -0.423 17919 92802 1 226 . 1 1 58 58 ASP H H 58 7.930 7.930 7.665 0.265 17919 92803 1 226 . 1 1 59 59 TYR N N 59 115.510 115.510 114.788 0.722 17919 92804 1 226 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.732 -0.062 17919 92805 1 226 . 1 1 59 59 TYR C C 59 174.700 174.700 174.659 0.041 17919 92806 1 226 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.326 0.924 17919 92807 1 226 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.477 1.593 17919 92808 1 226 . 1 1 59 59 TYR H H 59 7.250 7.250 7.393 -0.143 17919 92809 1 226 . 1 1 60 60 ASN N N 60 115.900 115.900 116.556 -0.656 17919 92810 1 226 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.323 0.032 17919 92811 1 226 . 1 1 60 60 ASN C C 60 174.340 174.340 174.117 0.223 17919 92812 1 226 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.334 -0.214 17919 92813 1 226 . 1 1 60 60 ASN CB C 60 37.410 37.410 36.675 0.735 17919 92814 1 226 . 1 1 60 60 ASN H H 60 8.150 8.150 7.712 0.438 17919 92815 1 226 . 1 1 61 61 ILE N N 61 118.600 118.600 120.317 -1.717 17919 92816 1 226 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.788 -0.395 17919 92817 1 226 . 1 1 61 61 ILE C C 61 174.610 174.610 174.897 -0.287 17919 92818 1 226 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.867 0.553 17919 92819 1 226 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.684 -0.944 17919 92820 1 226 . 1 1 61 61 ILE H H 61 7.250 7.250 7.881 -0.631 17919 92821 1 226 . 1 1 62 62 GLN N N 62 124.740 124.740 125.498 -0.758 17919 92822 1 226 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.794 -0.288 17919 92823 1 226 . 1 1 62 62 GLN C C 62 175.970 175.970 175.831 0.139 17919 92824 1 226 . 1 1 62 62 GLN CA C 62 53.660 53.660 52.796 0.864 17919 92825 1 226 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.889 -0.239 17919 92826 1 226 . 1 1 62 62 GLN H H 62 7.610 7.610 7.977 -0.367 17919 92827 1 226 . 1 1 63 63 LYS N N 63 120.300 120.300 119.883 0.417 17919 92828 1 226 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.245 -0.244 17919 92829 1 226 . 1 1 63 63 LYS C C 63 175.810 175.810 177.512 -1.702 17919 92830 1 226 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.675 0.115 17919 92831 1 226 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.369 0.281 17919 92832 1 226 . 1 1 63 63 LYS H H 63 8.490 8.490 8.627 -0.137 17919 92833 1 226 . 1 1 64 64 GLU N N 64 113.950 113.950 119.498 -5.548 17919 92834 1 226 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.585 -0.120 17919 92835 1 226 . 1 1 64 64 GLU C C 64 175.250 175.250 176.266 -1.016 17919 92836 1 226 . 1 1 64 64 GLU CA C 64 57.890 57.890 58.415 -0.525 17919 92837 1 226 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.840 -2.940 17919 92838 1 226 . 1 1 64 64 GLU H H 64 9.280 9.280 9.014 0.266 17919 92839 1 226 . 1 1 65 65 SER N N 65 114.730 114.730 115.847 -1.117 17919 92840 1 226 . 1 1 65 65 SER HA H 65 4.640 4.640 4.537 0.103 17919 92841 1 226 . 1 1 65 65 SER C C 65 172.160 172.160 174.046 -1.886 17919 92842 1 226 . 1 1 65 65 SER CA C 65 60.890 60.890 60.568 0.322 17919 92843 1 226 . 1 1 65 65 SER CB C 65 64.910 64.910 63.859 1.050 17919 92844 1 226 . 1 1 65 65 SER H H 65 7.670 7.670 7.662 0.008 17919 92845 1 226 . 1 1 66 66 THR N N 66 117.110 117.110 119.256 -2.146 17919 92846 1 226 . 1 1 66 66 THR HA H 66 5.270 5.270 5.023 0.247 17919 92847 1 226 . 1 1 66 66 THR C C 66 173.950 173.950 174.380 -0.430 17919 92848 1 226 . 1 1 66 66 THR CA C 66 62.340 62.340 62.249 0.091 17919 92849 1 226 . 1 1 66 66 THR CB C 66 70.080 70.080 70.133 -0.053 17919 92850 1 226 . 1 1 66 66 THR H H 66 8.730 8.730 8.423 0.307 17919 92851 1 226 . 1 1 67 67 LEU N N 67 127.110 127.110 125.232 1.878 17919 92852 1 226 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.822 0.238 17919 92853 1 226 . 1 1 67 67 LEU C C 67 175.770 175.770 175.591 0.179 17919 92854 1 226 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.903 -0.003 17919 92855 1 226 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.564 0.696 17919 92856 1 226 . 1 1 67 67 LEU H H 67 9.410 9.410 9.155 0.255 17919 92857 1 226 . 1 1 68 68 HIS N N 68 118.380 118.380 121.292 -2.912 17919 92858 1 226 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.243 -0.003 17919 92859 1 226 . 1 1 68 68 HIS C C 68 173.150 173.150 174.115 -0.965 17919 92860 1 226 . 1 1 68 68 HIS CA C 68 55.000 55.000 53.908 1.092 17919 92861 1 226 . 1 1 68 68 HIS CB C 68 30.530 30.530 30.928 -0.398 17919 92862 1 226 . 1 1 68 68 HIS H H 68 9.230 9.230 9.126 0.104 17919 92863 1 226 . 1 1 69 69 LEU N N 69 124.460 124.460 130.610 -6.150 17919 92864 1 226 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.606 0.584 17919 92865 1 226 . 1 1 69 69 LEU C C 69 175.270 175.270 174.258 1.012 17919 92866 1 226 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.213 -0.323 17919 92867 1 226 . 1 1 69 69 LEU CB C 69 44.380 44.380 43.095 1.285 17919 92868 1 226 . 1 1 69 69 LEU H H 69 8.340 8.340 7.689 0.651 17919 92869 1 226 . 1 1 70 70 VAL N N 70 126.940 126.940 127.083 -0.143 17919 92870 1 226 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.329 0.021 17919 92871 1 226 . 1 1 70 70 VAL C C 70 174.000 174.000 174.649 -0.649 17919 92872 1 226 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.755 0.045 17919 92873 1 226 . 1 1 70 70 VAL CB C 70 34.910 34.910 34.252 0.658 17919 92874 1 226 . 1 1 70 70 VAL H H 70 9.200 9.200 8.855 0.345 17919 92875 1 226 . 1 1 71 71 LEU N N 71 123.130 123.130 125.254 -2.124 17919 92876 1 226 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.189 -0.129 17919 92877 1 226 . 1 1 71 71 LEU C C 71 177.830 177.830 177.223 0.607 17919 92878 1 226 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.026 0.914 17919 92879 1 226 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.960 -1.110 17919 92880 1 226 . 1 1 71 71 LEU H H 71 8.120 8.120 8.345 -0.225 17919 92881 1 226 . 1 1 72 72 ARG N N 72 123.490 123.490 124.381 -0.891 17919 92882 1 226 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.293 0.008 17919 92883 1 226 . 1 1 72 72 ARG C C 72 175.350 175.350 175.477 -0.127 17919 92884 1 226 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.426 -0.816 17919 92885 1 226 . 1 1 72 72 ARG CB C 72 31.350 31.350 31.003 0.347 17919 92886 1 226 . 1 1 72 72 ARG H H 72 8.580 8.580 8.183 0.397 17919 92887 1 227 . 1 1 2 2 GLN N N 2 123.220 123.220 124.843 -1.623 17919 92888 1 227 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.576 -0.327 17919 92889 1 227 . 1 1 2 2 GLN C C 2 175.920 175.920 174.974 0.946 17919 92890 1 227 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.127 0.953 17919 92891 1 227 . 1 1 2 2 GLN CB C 2 30.760 30.760 31.472 -0.712 17919 92892 1 227 . 1 1 2 2 GLN H H 2 8.900 8.900 8.400 0.500 17919 92893 1 227 . 1 1 3 3 ILE N N 3 115.340 115.340 113.396 1.944 17919 92894 1 227 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.222 -0.009 17919 92895 1 227 . 1 1 3 3 ILE C C 3 172.450 172.450 173.385 -0.935 17919 92896 1 227 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.581 -0.011 17919 92897 1 227 . 1 1 3 3 ILE CB C 3 42.210 42.210 42.198 0.012 17919 92898 1 227 . 1 1 3 3 ILE H H 3 8.320 8.320 8.717 -0.397 17919 92899 1 227 . 1 1 4 4 PHE N N 4 118.110 118.110 118.062 0.048 17919 92900 1 227 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.538 0.092 17919 92901 1 227 . 1 1 4 4 PHE C C 4 175.320 175.320 175.115 0.205 17919 92902 1 227 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.010 0.200 17919 92903 1 227 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.249 -0.769 17919 92904 1 227 . 1 1 4 4 PHE H H 4 8.610 8.610 8.735 -0.125 17919 92905 1 227 . 1 1 5 5 VAL N N 5 121.000 121.000 121.693 -0.693 17919 92906 1 227 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.998 -0.273 17919 92907 1 227 . 1 1 5 5 VAL C C 5 174.870 174.870 174.872 -0.002 17919 92908 1 227 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.203 -0.583 17919 92909 1 227 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.986 0.244 17919 92910 1 227 . 1 1 5 5 VAL H H 5 9.300 9.300 9.421 -0.121 17919 92911 1 227 . 1 1 6 6 LYS N N 6 127.520 127.520 127.906 -0.386 17919 92912 1 227 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.270 0.097 17919 92913 1 227 . 1 1 6 6 LYS C C 6 177.140 177.140 176.464 0.676 17919 92914 1 227 . 1 1 6 6 LYS CA C 6 54.520 54.520 53.951 0.569 17919 92915 1 227 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.143 -0.093 17919 92916 1 227 . 1 1 6 6 LYS H H 6 8.820 8.820 9.402 -0.582 17919 92917 1 227 . 1 1 7 7 THR N N 7 115.400 115.400 115.557 -0.157 17919 92918 1 227 . 1 1 7 7 THR HA H 7 4.970 4.970 4.599 0.371 17919 92919 1 227 . 1 1 7 7 THR C C 7 176.910 176.910 176.029 0.881 17919 92920 1 227 . 1 1 7 7 THR CA C 7 60.470 60.470 60.432 0.038 17919 92921 1 227 . 1 1 7 7 THR CB C 7 70.630 70.630 70.378 0.252 17919 92922 1 227 . 1 1 7 7 THR H H 7 8.730 8.730 8.730 0.000 17919 92923 1 227 . 1 1 8 8 LEU N N 8 121.330 121.330 119.153 2.177 17919 92924 1 227 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.427 -0.117 17919 92925 1 227 . 1 1 8 8 LEU C C 8 178.800 178.800 177.919 0.881 17919 92926 1 227 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.069 0.511 17919 92927 1 227 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.058 -0.088 17919 92928 1 227 . 1 1 8 8 LEU H H 8 9.100 9.100 8.536 0.564 17919 92929 1 227 . 1 1 9 9 THR N N 9 105.590 105.590 107.172 -1.582 17919 92930 1 227 . 1 1 9 9 THR HA H 9 4.428 4.428 4.237 0.191 17919 92931 1 227 . 1 1 9 9 THR C C 9 175.520 175.520 175.629 -0.109 17919 92932 1 227 . 1 1 9 9 THR CA C 9 61.400 61.400 62.167 -0.767 17919 92933 1 227 . 1 1 9 9 THR CB C 9 69.140 69.140 68.894 0.245 17919 92934 1 227 . 1 1 9 9 THR H H 9 7.630 7.630 7.780 -0.150 17919 92935 1 227 . 1 1 10 10 GLY N N 10 108.890 108.890 109.620 -0.730 17919 92936 1 227 . 1 1 10 10 GLY C C 10 174.070 174.070 174.157 -0.087 17919 92937 1 227 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.251 0.209 17919 92938 1 227 . 1 1 10 10 GLY H H 10 7.810 7.810 7.681 0.129 17919 92939 1 227 . 1 1 11 11 LYS N N 11 121.600 121.600 120.846 0.754 17919 92940 1 227 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.769 -0.408 17919 92941 1 227 . 1 1 11 11 LYS C C 11 175.940 175.940 175.795 0.145 17919 92942 1 227 . 1 1 11 11 LYS CA C 11 56.280 56.280 53.773 2.507 17919 92943 1 227 . 1 1 11 11 LYS CB C 11 33.200 33.200 34.321 -1.121 17919 92944 1 227 . 1 1 11 11 LYS H H 11 7.280 7.280 8.262 -0.982 17919 92945 1 227 . 1 1 12 12 THR N N 12 120.440 120.440 116.102 4.338 17919 92946 1 227 . 1 1 12 12 THR HA H 12 5.046 5.046 5.086 -0.040 17919 92947 1 227 . 1 1 12 12 THR C C 12 174.320 174.320 175.589 -1.269 17919 92948 1 227 . 1 1 12 12 THR CA C 12 62.390 62.390 61.147 1.243 17919 92949 1 227 . 1 1 12 12 THR CB C 12 69.910 69.910 69.443 0.467 17919 92950 1 227 . 1 1 12 12 THR H H 12 8.650 8.650 8.421 0.229 17919 92951 1 227 . 1 1 13 13 ILE N N 13 127.110 127.110 120.344 6.766 17919 92952 1 227 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.688 -0.144 17919 92953 1 227 . 1 1 13 13 ILE C C 13 175.220 175.220 174.614 0.606 17919 92954 1 227 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.098 -0.118 17919 92955 1 227 . 1 1 13 13 ILE CB C 13 40.950 40.950 39.617 1.333 17919 92956 1 227 . 1 1 13 13 ILE H H 13 9.450 9.450 8.916 0.534 17919 92957 1 227 . 1 1 14 14 THR N N 14 121.520 121.520 121.048 0.472 17919 92958 1 227 . 1 1 14 14 THR HA H 14 4.964 4.964 5.488 -0.524 17919 92959 1 227 . 1 1 14 14 THR C C 14 173.790 173.790 174.159 -0.369 17919 92960 1 227 . 1 1 14 14 THR CA C 14 61.940 61.940 61.800 0.140 17919 92961 1 227 . 1 1 14 14 THR CB C 14 69.650 69.650 70.792 -1.142 17919 92962 1 227 . 1 1 14 14 THR H H 14 8.710 8.710 8.305 0.405 17919 92963 1 227 . 1 1 15 15 LEU N N 15 124.800 124.800 124.484 0.316 17919 92964 1 227 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.778 0.002 17919 92965 1 227 . 1 1 15 15 LEU C C 15 174.670 174.670 175.140 -0.470 17919 92966 1 227 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.672 -0.842 17919 92967 1 227 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.637 1.433 17919 92968 1 227 . 1 1 15 15 LEU H H 15 8.710 8.710 9.115 -0.405 17919 92969 1 227 . 1 1 16 16 GLU N N 16 122.160 122.160 122.802 -0.642 17919 92970 1 227 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.905 0.012 17919 92971 1 227 . 1 1 16 16 GLU C C 16 175.860 175.860 176.111 -0.251 17919 92972 1 227 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.839 -1.019 17919 92973 1 227 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.325 -0.875 17919 92974 1 227 . 1 1 16 16 GLU H H 16 8.140 8.140 8.689 -0.549 17919 92975 1 227 . 1 1 17 17 VAL N N 17 117.210 117.210 118.310 -1.100 17919 92976 1 227 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.956 -0.242 17919 92977 1 227 . 1 1 17 17 VAL C C 17 174.160 174.160 174.797 -0.637 17919 92978 1 227 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.888 -0.458 17919 92979 1 227 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.878 0.522 17919 92980 1 227 . 1 1 17 17 VAL H H 17 8.900 8.900 8.896 0.004 17919 92981 1 227 . 1 1 18 18 GLU N N 18 118.990 118.990 120.918 -1.928 17919 92982 1 227 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.863 0.216 17919 92983 1 227 . 1 1 18 18 GLU C C 18 176.160 176.160 175.391 0.769 17919 92984 1 227 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.810 -0.090 17919 92985 1 227 . 1 1 18 18 GLU CB C 18 30.310 30.310 31.029 -0.720 17919 92986 1 227 . 1 1 18 18 GLU H H 18 8.640 8.640 8.760 -0.120 17919 92987 1 227 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.291 -0.150 17919 92988 1 227 . 1 1 19 19 PRO C C 19 175.310 175.310 177.815 -2.505 17919 92989 1 227 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.321 0.149 17919 92990 1 227 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.027 -0.077 17919 92991 1 227 . 1 1 20 20 SER N N 20 103.400 103.400 109.855 -6.455 17919 92992 1 227 . 1 1 20 20 SER HA H 20 4.370 4.370 4.293 0.077 17919 92993 1 227 . 1 1 20 20 SER C C 20 174.660 174.660 174.775 -0.115 17919 92994 1 227 . 1 1 20 20 SER CA C 20 57.400 57.400 59.124 -1.724 17919 92995 1 227 . 1 1 20 20 SER CB C 20 63.370 63.370 62.554 0.816 17919 92996 1 227 . 1 1 20 20 SER H H 20 7.040 7.040 8.073 -1.033 17919 92997 1 227 . 1 1 21 21 ASP N N 21 123.480 123.480 124.955 -1.475 17919 92998 1 227 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.830 -0.135 17919 92999 1 227 . 1 1 21 21 ASP C C 21 176.360 176.360 176.009 0.351 17919 93000 1 227 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.786 0.914 17919 93001 1 227 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.791 -0.991 17919 93002 1 227 . 1 1 21 21 ASP H H 21 8.030 8.030 7.831 0.199 17919 93003 1 227 . 1 1 22 22 THR N N 22 108.800 108.800 113.208 -4.408 17919 93004 1 227 . 1 1 22 22 THR HA H 22 4.920 4.920 4.727 0.193 17919 93005 1 227 . 1 1 22 22 THR C C 22 176.750 176.750 176.179 0.571 17919 93006 1 227 . 1 1 22 22 THR CA C 22 59.690 59.690 61.095 -1.405 17919 93007 1 227 . 1 1 22 22 THR CB C 22 71.200 71.200 70.663 0.537 17919 93008 1 227 . 1 1 22 22 THR H H 22 7.900 7.900 8.219 -0.319 17919 93009 1 227 . 1 1 23 23 ILE N N 23 121.190 121.190 122.714 -1.524 17919 93010 1 227 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.717 -0.060 17919 93011 1 227 . 1 1 23 23 ILE C C 23 179.040 179.040 177.773 1.267 17919 93012 1 227 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.851 -0.591 17919 93013 1 227 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.341 -1.991 17919 93014 1 227 . 1 1 23 23 ILE H H 23 8.560 8.560 8.655 -0.095 17919 93015 1 227 . 1 1 24 24 GLU N N 24 120.830 120.830 121.000 -0.170 17919 93016 1 227 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.833 0.084 17919 93017 1 227 . 1 1 24 24 GLU C C 24 178.640 178.640 178.813 -0.173 17919 93018 1 227 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.026 0.194 17919 93019 1 227 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.349 -1.069 17919 93020 1 227 . 1 1 24 24 GLU H H 24 9.760 9.760 8.093 1.667 17919 93021 1 227 . 1 1 25 25 ASN N N 25 120.570 120.570 117.509 3.061 17919 93022 1 227 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.501 0.024 17919 93023 1 227 . 1 1 25 25 ASN C C 25 178.380 178.380 177.845 0.535 17919 93024 1 227 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.084 -0.024 17919 93025 1 227 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.737 -0.287 17919 93026 1 227 . 1 1 25 25 ASN H H 25 7.920 7.920 7.633 0.286 17919 93027 1 227 . 1 1 26 26 VAL N N 26 121.710 121.710 120.489 1.221 17919 93028 1 227 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.604 -0.207 17919 93029 1 227 . 1 1 26 26 VAL C C 26 177.950 177.950 177.674 0.276 17919 93030 1 227 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.627 1.033 17919 93031 1 227 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.622 -0.782 17919 93032 1 227 . 1 1 26 26 VAL H H 26 8.070 8.070 7.867 0.203 17919 93033 1 227 . 1 1 27 27 LYS N N 27 118.860 118.860 120.112 -1.252 17919 93034 1 227 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.193 0.387 17919 93035 1 227 . 1 1 27 27 LYS C C 27 180.550 180.550 178.971 1.579 17919 93036 1 227 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.567 -0.317 17919 93037 1 227 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.184 1.546 17919 93038 1 227 . 1 1 27 27 LYS H H 27 8.560 8.560 8.469 0.091 17919 93039 1 227 . 1 1 28 28 ALA N N 28 123.440 123.440 122.719 0.721 17919 93040 1 227 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.110 0.050 17919 93041 1 227 . 1 1 28 28 ALA C C 28 180.300 180.300 179.287 1.013 17919 93042 1 227 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.032 0.338 17919 93043 1 227 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.384 -0.673 17919 93044 1 227 . 1 1 28 28 ALA H H 28 8.060 8.060 8.014 0.046 17919 93045 1 227 . 1 1 29 29 LYS N N 29 119.940 119.940 118.920 1.020 17919 93046 1 227 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.044 0.163 17919 93047 1 227 . 1 1 29 29 LYS C C 29 180.320 180.320 179.195 1.125 17919 93048 1 227 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.600 0.050 17919 93049 1 227 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.368 0.922 17919 93050 1 227 . 1 1 29 29 LYS H H 29 7.850 7.850 7.704 0.146 17919 93051 1 227 . 1 1 30 30 ILE N N 30 121.080 121.080 120.674 0.406 17919 93052 1 227 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.574 -0.067 17919 93053 1 227 . 1 1 30 30 ILE C C 30 178.310 178.310 177.410 0.900 17919 93054 1 227 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.500 0.650 17919 93055 1 227 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.653 -0.853 17919 93056 1 227 . 1 1 30 30 ILE H H 30 8.280 8.280 8.067 0.213 17919 93057 1 227 . 1 1 31 31 GLN N N 31 123.490 123.490 120.575 2.915 17919 93058 1 227 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.869 -0.040 17919 93059 1 227 . 1 1 31 31 GLN C C 31 178.890 178.890 178.367 0.523 17919 93060 1 227 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.354 0.646 17919 93061 1 227 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.471 -0.751 17919 93062 1 227 . 1 1 31 31 GLN H H 31 8.580 8.580 8.202 0.378 17919 93063 1 227 . 1 1 32 32 ASP N N 32 119.360 119.360 118.875 0.485 17919 93064 1 227 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.402 -0.048 17919 93065 1 227 . 1 1 32 32 ASP C C 32 177.250 177.250 178.107 -0.857 17919 93066 1 227 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.676 0.514 17919 93067 1 227 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.789 -0.209 17919 93068 1 227 . 1 1 32 32 ASP H H 32 8.010 8.010 7.855 0.155 17919 93069 1 227 . 1 1 33 33 LYS N N 33 115.130 115.130 119.138 -4.008 17919 93070 1 227 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.209 0.128 17919 93071 1 227 . 1 1 33 33 LYS C C 33 177.870 177.870 178.577 -0.707 17919 93072 1 227 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.065 -0.015 17919 93073 1 227 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.080 1.090 17919 93074 1 227 . 1 1 33 33 LYS H H 33 7.430 7.430 7.542 -0.112 17919 93075 1 227 . 1 1 34 34 GLU N N 34 113.870 113.870 115.214 -1.344 17919 93076 1 227 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.467 0.158 17919 93077 1 227 . 1 1 34 34 GLU C C 34 177.840 177.840 177.286 0.554 17919 93078 1 227 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.084 -0.914 17919 93079 1 227 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.164 1.496 17919 93080 1 227 . 1 1 34 34 GLU H H 34 8.740 8.740 8.094 0.646 17919 93081 1 227 . 1 1 35 35 GLY N N 35 108.650 108.650 109.952 -1.302 17919 93082 1 227 . 1 1 35 35 GLY C C 35 173.960 173.960 174.150 -0.190 17919 93083 1 227 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.684 0.396 17919 93084 1 227 . 1 1 35 35 GLY H H 35 8.530 8.530 8.238 0.292 17919 93085 1 227 . 1 1 36 36 ILE N N 36 119.880 119.880 116.975 2.905 17919 93086 1 227 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.622 -0.177 17919 93087 1 227 . 1 1 36 36 ILE C C 36 173.590 173.590 173.868 -0.278 17919 93088 1 227 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.303 0.447 17919 93089 1 227 . 1 1 36 36 ILE CB C 36 40.580 40.580 39.234 1.345 17919 93090 1 227 . 1 1 36 36 ILE H H 36 6.150 6.150 7.502 -1.352 17919 93091 1 227 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.659 -0.025 17919 93092 1 227 . 1 1 37 37 PRO C C 37 176.940 176.940 176.154 0.786 17919 93093 1 227 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.437 0.223 17919 93094 1 227 . 1 1 37 37 PRO CB C 37 31.850 31.850 30.925 0.925 17919 93095 1 227 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.143 -0.026 17919 93096 1 227 . 1 1 38 38 PRO C C 38 178.320 178.320 178.195 0.125 17919 93097 1 227 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.802 0.458 17919 93098 1 227 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.850 1.040 17919 93099 1 227 . 1 1 39 39 ASP N N 39 113.380 113.380 115.554 -2.174 17919 93100 1 227 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.408 0.022 17919 93101 1 227 . 1 1 39 39 ASP C C 39 177.090 177.090 178.017 -0.927 17919 93102 1 227 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.900 -1.260 17919 93103 1 227 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.611 -1.071 17919 93104 1 227 . 1 1 39 39 ASP H H 39 8.550 8.550 8.597 -0.047 17919 93105 1 227 . 1 1 40 40 GLN N N 40 116.780 116.780 117.274 -0.494 17919 93106 1 227 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.393 0.071 17919 93107 1 227 . 1 1 40 40 GLN C C 40 175.380 175.380 175.529 -0.149 17919 93108 1 227 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.749 -0.109 17919 93109 1 227 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.312 0.828 17919 93110 1 227 . 1 1 40 40 GLN H H 40 7.820 7.820 7.805 0.015 17919 93111 1 227 . 1 1 41 41 GLN N N 41 117.720 117.720 119.054 -1.334 17919 93112 1 227 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.499 -0.255 17919 93113 1 227 . 1 1 41 41 GLN C C 41 176.300 176.300 174.836 1.464 17919 93114 1 227 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.837 0.633 17919 93115 1 227 . 1 1 41 41 GLN CB C 41 31.650 31.650 30.278 1.372 17919 93116 1 227 . 1 1 41 41 GLN H H 41 7.480 7.480 7.204 0.276 17919 93117 1 227 . 1 1 42 42 ARG N N 42 122.680 122.680 122.169 0.511 17919 93118 1 227 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.666 -0.166 17919 93119 1 227 . 1 1 42 42 ARG C C 42 174.050 174.050 174.498 -0.448 17919 93120 1 227 . 1 1 42 42 ARG CA C 42 55.050 55.050 53.542 1.508 17919 93121 1 227 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.896 -1.146 17919 93122 1 227 . 1 1 42 42 ARG H H 42 8.530 8.530 8.806 -0.276 17919 93123 1 227 . 1 1 43 43 LEU N N 43 124.040 124.040 124.342 -0.302 17919 93124 1 227 . 1 1 43 43 LEU C C 43 175.290 175.290 175.581 -0.291 17919 93125 1 227 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.791 -0.811 17919 93126 1 227 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.644 1.147 17919 93127 1 227 . 1 1 43 43 LEU H H 43 8.820 8.820 8.719 0.101 17919 93128 1 227 . 1 1 44 44 ILE N N 44 121.920 121.920 121.191 0.729 17919 93129 1 227 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.168 -0.176 17919 93130 1 227 . 1 1 44 44 ILE C C 44 176.060 176.060 174.187 1.873 17919 93131 1 227 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.138 -1.157 17919 93132 1 227 . 1 1 44 44 ILE CB C 44 41.420 41.420 42.179 -0.759 17919 93133 1 227 . 1 1 44 44 ILE H H 44 9.030 9.030 8.929 0.101 17919 93134 1 227 . 1 1 45 45 PHE N N 45 125.390 125.390 126.888 -1.498 17919 93135 1 227 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.061 -0.016 17919 93136 1 227 . 1 1 45 45 PHE C C 45 174.470 174.470 174.560 -0.090 17919 93137 1 227 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.595 0.425 17919 93138 1 227 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.827 0.933 17919 93139 1 227 . 1 1 45 45 PHE H H 45 8.830 8.830 9.062 -0.232 17919 93140 1 227 . 1 1 46 46 ALA N N 46 132.200 132.200 130.098 2.102 17919 93141 1 227 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.733 -0.043 17919 93142 1 227 . 1 1 46 46 ALA C C 46 177.290 177.290 178.330 -1.040 17919 93143 1 227 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.074 0.466 17919 93144 1 227 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.614 -0.044 17919 93145 1 227 . 1 1 46 46 ALA H H 46 8.810 8.810 9.074 -0.264 17919 93146 1 227 . 1 1 47 47 GLY N N 47 102.340 102.340 103.395 -1.055 17919 93147 1 227 . 1 1 47 47 GLY C C 47 173.810 173.810 174.567 -0.757 17919 93148 1 227 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.251 0.099 17919 93149 1 227 . 1 1 47 47 GLY H H 47 8.130 8.130 8.695 -0.565 17919 93150 1 227 . 1 1 48 48 LYS N N 48 121.570 121.570 121.461 0.109 17919 93151 1 227 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.563 0.059 17919 93152 1 227 . 1 1 48 48 LYS C C 48 174.700 174.700 175.439 -0.739 17919 93153 1 227 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.978 -0.428 17919 93154 1 227 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.019 0.511 17919 93155 1 227 . 1 1 48 48 LYS H H 48 7.980 7.980 7.441 0.539 17919 93156 1 227 . 1 1 49 49 GLN N N 49 122.410 122.410 123.496 -1.086 17919 93157 1 227 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.500 0.060 17919 93158 1 227 . 1 1 49 49 GLN C C 49 175.670 175.670 175.918 -0.248 17919 93159 1 227 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.106 -0.366 17919 93160 1 227 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.379 -0.379 17919 93161 1 227 . 1 1 49 49 GLN H H 49 8.600 8.600 8.582 0.018 17919 93162 1 227 . 1 1 50 50 LEU N N 50 125.520 125.520 129.348 -3.828 17919 93163 1 227 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.059 0.031 17919 93164 1 227 . 1 1 50 50 LEU C C 50 176.660 176.660 176.060 0.600 17919 93165 1 227 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.249 -0.009 17919 93166 1 227 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.637 -0.067 17919 93167 1 227 . 1 1 50 50 LEU H H 50 8.530 8.530 8.782 -0.252 17919 93168 1 227 . 1 1 51 51 GLU N N 51 122.940 122.940 121.882 1.058 17919 93169 1 227 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.652 -0.164 17919 93170 1 227 . 1 1 51 51 GLU C C 51 175.870 175.870 177.084 -1.214 17919 93171 1 227 . 1 1 51 51 GLU CA C 51 55.960 55.960 54.378 1.582 17919 93172 1 227 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.777 -1.207 17919 93173 1 227 . 1 1 51 51 GLU H H 51 8.400 8.400 8.194 0.206 17919 93174 1 227 . 1 1 52 52 ASP N N 52 120.030 120.030 123.148 -3.118 17919 93175 1 227 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.405 -0.046 17919 93176 1 227 . 1 1 52 52 ASP C C 52 177.330 177.330 177.594 -0.264 17919 93177 1 227 . 1 1 52 52 ASP CA C 52 56.960 56.960 58.338 -1.378 17919 93178 1 227 . 1 1 52 52 ASP CB C 52 40.850 40.850 41.066 -0.216 17919 93179 1 227 . 1 1 52 52 ASP H H 52 8.160 8.160 8.883 -0.723 17919 93180 1 227 . 1 1 53 53 GLY N N 53 106.660 106.660 106.039 0.621 17919 93181 1 227 . 1 1 53 53 GLY C C 53 174.870 174.870 174.194 0.676 17919 93182 1 227 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.656 0.514 17919 93183 1 227 . 1 1 53 53 GLY H H 53 9.390 9.390 8.338 1.052 17919 93184 1 227 . 1 1 54 54 ARG N N 54 119.050 119.050 121.595 -2.545 17919 93185 1 227 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.648 0.047 17919 93186 1 227 . 1 1 54 54 ARG C C 54 175.350 175.350 175.967 -0.617 17919 93187 1 227 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.953 -0.563 17919 93188 1 227 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.451 0.199 17919 93189 1 227 . 1 1 54 54 ARG H H 54 7.460 7.460 7.599 -0.139 17919 93190 1 227 . 1 1 55 55 THR N N 55 108.400 108.400 111.960 -3.560 17919 93191 1 227 . 1 1 55 55 THR HA H 55 5.240 5.240 5.100 0.140 17919 93192 1 227 . 1 1 55 55 THR C C 55 176.560 176.560 176.504 0.056 17919 93193 1 227 . 1 1 55 55 THR CA C 55 59.690 59.690 60.270 -0.580 17919 93194 1 227 . 1 1 55 55 THR CB C 55 72.260 72.260 71.124 1.136 17919 93195 1 227 . 1 1 55 55 THR H H 55 8.730 8.730 9.145 -0.415 17919 93196 1 227 . 1 1 56 56 LEU N N 56 117.920 117.920 122.551 -4.631 17919 93197 1 227 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.864 0.196 17919 93198 1 227 . 1 1 56 56 LEU C C 56 180.810 180.810 179.146 1.664 17919 93199 1 227 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.531 0.179 17919 93200 1 227 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.467 -1.097 17919 93201 1 227 . 1 1 56 56 LEU H H 56 8.140 8.140 8.919 -0.779 17919 93202 1 227 . 1 1 57 57 SER N N 57 113.330 113.330 114.448 -1.118 17919 93203 1 227 . 1 1 57 57 SER HA H 57 4.370 4.370 4.209 0.161 17919 93204 1 227 . 1 1 57 57 SER C C 57 178.310 178.310 176.881 1.429 17919 93205 1 227 . 1 1 57 57 SER CA C 57 61.080 61.080 61.889 -0.809 17919 93206 1 227 . 1 1 57 57 SER CB C 57 62.530 62.530 62.566 -0.036 17919 93207 1 227 . 1 1 57 57 SER H H 57 8.470 8.470 8.035 0.435 17919 93208 1 227 . 1 1 58 58 ASP N N 58 124.190 124.190 123.609 0.581 17919 93209 1 227 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.336 -0.040 17919 93210 1 227 . 1 1 58 58 ASP C C 58 177.400 177.400 177.828 -0.428 17919 93211 1 227 . 1 1 58 58 ASP CA C 58 57.180 57.180 57.005 0.175 17919 93212 1 227 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.533 -0.433 17919 93213 1 227 . 1 1 58 58 ASP H H 58 7.930 7.930 7.943 -0.013 17919 93214 1 227 . 1 1 59 59 TYR N N 59 115.510 115.510 115.889 -0.379 17919 93215 1 227 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.531 0.139 17919 93216 1 227 . 1 1 59 59 TYR C C 59 174.700 174.700 174.999 -0.299 17919 93217 1 227 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.668 0.582 17919 93218 1 227 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.413 1.657 17919 93219 1 227 . 1 1 59 59 TYR H H 59 7.250 7.250 7.794 -0.544 17919 93220 1 227 . 1 1 60 60 ASN N N 60 115.900 115.900 117.415 -1.515 17919 93221 1 227 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.466 -0.111 17919 93222 1 227 . 1 1 60 60 ASN C C 60 174.340 174.340 174.950 -0.610 17919 93223 1 227 . 1 1 60 60 ASN CA C 60 54.120 54.120 53.884 0.236 17919 93224 1 227 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.337 0.073 17919 93225 1 227 . 1 1 60 60 ASN H H 60 8.150 8.150 7.728 0.422 17919 93226 1 227 . 1 1 61 61 ILE N N 61 118.600 118.600 120.307 -1.707 17919 93227 1 227 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.812 -0.419 17919 93228 1 227 . 1 1 61 61 ILE C C 61 174.610 174.610 175.671 -1.061 17919 93229 1 227 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.989 0.430 17919 93230 1 227 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.776 -1.036 17919 93231 1 227 . 1 1 61 61 ILE H H 61 7.250 7.250 8.110 -0.860 17919 93232 1 227 . 1 1 62 62 GLN N N 62 124.740 124.740 127.126 -2.386 17919 93233 1 227 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.663 -0.157 17919 93234 1 227 . 1 1 62 62 GLN C C 62 175.970 175.970 174.961 1.009 17919 93235 1 227 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.384 0.276 17919 93236 1 227 . 1 1 62 62 GLN CB C 62 31.650 31.650 30.467 1.183 17919 93237 1 227 . 1 1 62 62 GLN H H 62 7.610 7.610 8.219 -0.609 17919 93238 1 227 . 1 1 63 63 LYS N N 63 120.300 120.300 117.956 2.344 17919 93239 1 227 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.452 -0.451 17919 93240 1 227 . 1 1 63 63 LYS C C 63 175.810 175.810 177.354 -1.544 17919 93241 1 227 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.050 0.741 17919 93242 1 227 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.957 -0.307 17919 93243 1 227 . 1 1 63 63 LYS H H 63 8.490 8.490 8.243 0.247 17919 93244 1 227 . 1 1 64 64 GLU N N 64 113.950 113.950 119.183 -5.233 17919 93245 1 227 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.010 0.455 17919 93246 1 227 . 1 1 64 64 GLU C C 64 175.250 175.250 176.301 -1.051 17919 93247 1 227 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.495 0.395 17919 93248 1 227 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.425 -2.525 17919 93249 1 227 . 1 1 64 64 GLU H H 64 9.280 9.280 8.670 0.610 17919 93250 1 227 . 1 1 65 65 SER N N 65 114.730 114.730 116.062 -1.332 17919 93251 1 227 . 1 1 65 65 SER HA H 65 4.640 4.640 4.360 0.280 17919 93252 1 227 . 1 1 65 65 SER C C 65 172.160 172.160 173.730 -1.570 17919 93253 1 227 . 1 1 65 65 SER CA C 65 60.890 60.890 60.845 0.045 17919 93254 1 227 . 1 1 65 65 SER CB C 65 64.910 64.910 63.669 1.241 17919 93255 1 227 . 1 1 65 65 SER H H 65 7.670 7.670 7.442 0.228 17919 93256 1 227 . 1 1 66 66 THR N N 66 117.110 117.110 119.273 -2.163 17919 93257 1 227 . 1 1 66 66 THR HA H 66 5.270 5.270 5.181 0.089 17919 93258 1 227 . 1 1 66 66 THR C C 66 173.950 173.950 174.229 -0.279 17919 93259 1 227 . 1 1 66 66 THR CA C 66 62.340 62.340 61.728 0.612 17919 93260 1 227 . 1 1 66 66 THR CB C 66 70.080 70.080 69.924 0.156 17919 93261 1 227 . 1 1 66 66 THR H H 66 8.730 8.730 8.326 0.404 17919 93262 1 227 . 1 1 67 67 LEU N N 67 127.110 127.110 126.902 0.208 17919 93263 1 227 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.734 0.326 17919 93264 1 227 . 1 1 67 67 LEU C C 67 175.770 175.770 175.671 0.099 17919 93265 1 227 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.124 -0.224 17919 93266 1 227 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.370 0.890 17919 93267 1 227 . 1 1 67 67 LEU H H 67 9.410 9.410 9.179 0.231 17919 93268 1 227 . 1 1 68 68 HIS N N 68 118.380 118.380 122.187 -3.807 17919 93269 1 227 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.187 0.053 17919 93270 1 227 . 1 1 68 68 HIS C C 68 173.150 173.150 173.892 -0.742 17919 93271 1 227 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.118 0.882 17919 93272 1 227 . 1 1 68 68 HIS CB C 68 30.530 30.530 31.205 -0.675 17919 93273 1 227 . 1 1 68 68 HIS H H 68 9.230 9.230 9.284 -0.054 17919 93274 1 227 . 1 1 69 69 LEU N N 69 124.460 124.460 130.259 -5.799 17919 93275 1 227 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.156 0.034 17919 93276 1 227 . 1 1 69 69 LEU C C 69 175.270 175.270 174.450 0.820 17919 93277 1 227 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.458 0.432 17919 93278 1 227 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.601 -0.221 17919 93279 1 227 . 1 1 69 69 LEU H H 69 8.340 8.340 8.023 0.317 17919 93280 1 227 . 1 1 70 70 VAL N N 70 126.940 126.940 122.292 4.648 17919 93281 1 227 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.442 -0.092 17919 93282 1 227 . 1 1 70 70 VAL C C 70 174.000 174.000 173.464 0.536 17919 93283 1 227 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.501 0.299 17919 93284 1 227 . 1 1 70 70 VAL CB C 70 34.910 34.910 36.007 -1.097 17919 93285 1 227 . 1 1 70 70 VAL H H 70 9.200 9.200 8.880 0.320 17919 93286 1 227 . 1 1 71 71 LEU N N 71 123.130 123.130 123.079 0.051 17919 93287 1 227 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.034 0.026 17919 93288 1 227 . 1 1 71 71 LEU C C 71 177.830 177.830 177.713 0.117 17919 93289 1 227 . 1 1 71 71 LEU CA C 71 53.940 53.940 52.681 1.260 17919 93290 1 227 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.471 0.379 17919 93291 1 227 . 1 1 71 71 LEU H H 71 8.120 8.120 8.347 -0.227 17919 93292 1 227 . 1 1 72 72 ARG N N 72 123.490 123.490 123.856 -0.366 17919 93293 1 227 . 1 1 72 72 ARG HA H 72 4.301 4.301 3.983 0.318 17919 93294 1 227 . 1 1 72 72 ARG C C 72 175.350 175.350 175.423 -0.073 17919 93295 1 227 . 1 1 72 72 ARG CA C 72 55.610 55.610 57.600 -1.990 17919 93296 1 227 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.894 0.456 17919 93297 1 227 . 1 1 72 72 ARG H H 72 8.580 8.580 8.214 0.366 17919 93298 1 228 . 1 1 2 2 GLN N N 2 123.220 123.220 120.398 2.822 17919 93299 1 228 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.353 -0.104 17919 93300 1 228 . 1 1 2 2 GLN C C 2 175.920 175.920 174.905 1.015 17919 93301 1 228 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.608 0.472 17919 93302 1 228 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.690 0.070 17919 93303 1 228 . 1 1 2 2 GLN H H 2 8.900 8.900 8.379 0.521 17919 93304 1 228 . 1 1 3 3 ILE N N 3 115.340 115.340 116.425 -1.085 17919 93305 1 228 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.430 -0.217 17919 93306 1 228 . 1 1 3 3 ILE C C 3 172.450 172.450 173.162 -0.712 17919 93307 1 228 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.408 0.162 17919 93308 1 228 . 1 1 3 3 ILE CB C 3 42.210 42.210 42.219 -0.009 17919 93309 1 228 . 1 1 3 3 ILE H H 3 8.320 8.320 8.176 0.144 17919 93310 1 228 . 1 1 4 4 PHE N N 4 118.110 118.110 120.299 -2.189 17919 93311 1 228 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.337 0.293 17919 93312 1 228 . 1 1 4 4 PHE C C 4 175.320 175.320 175.142 0.178 17919 93313 1 228 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.553 -0.343 17919 93314 1 228 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.209 0.271 17919 93315 1 228 . 1 1 4 4 PHE H H 4 8.610 8.610 8.210 0.400 17919 93316 1 228 . 1 1 5 5 VAL N N 5 121.000 121.000 122.059 -1.059 17919 93317 1 228 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.787 -0.062 17919 93318 1 228 . 1 1 5 5 VAL C C 5 174.870 174.870 174.687 0.183 17919 93319 1 228 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.370 -0.750 17919 93320 1 228 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.045 0.185 17919 93321 1 228 . 1 1 5 5 VAL H H 5 9.300 9.300 8.904 0.396 17919 93322 1 228 . 1 1 6 6 LYS N N 6 127.520 127.520 126.821 0.699 17919 93323 1 228 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.434 -0.067 17919 93324 1 228 . 1 1 6 6 LYS C C 6 177.140 177.140 176.250 0.890 17919 93325 1 228 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.045 0.475 17919 93326 1 228 . 1 1 6 6 LYS CB C 6 35.050 35.050 36.474 -1.424 17919 93327 1 228 . 1 1 6 6 LYS H H 6 8.820 8.820 9.208 -0.388 17919 93328 1 228 . 1 1 7 7 THR N N 7 115.400 115.400 117.698 -2.298 17919 93329 1 228 . 1 1 7 7 THR HA H 7 4.970 4.970 4.633 0.337 17919 93330 1 228 . 1 1 7 7 THR C C 7 176.910 176.910 176.384 0.526 17919 93331 1 228 . 1 1 7 7 THR CA C 7 60.470 60.470 61.101 -0.631 17919 93332 1 228 . 1 1 7 7 THR CB C 7 70.630 70.630 70.035 0.595 17919 93333 1 228 . 1 1 7 7 THR H H 7 8.730 8.730 9.006 -0.276 17919 93334 1 228 . 1 1 8 8 LEU N N 8 121.330 121.330 123.158 -1.828 17919 93335 1 228 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.368 -0.058 17919 93336 1 228 . 1 1 8 8 LEU C C 8 178.800 178.800 177.257 1.543 17919 93337 1 228 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.704 -0.124 17919 93338 1 228 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.066 -0.096 17919 93339 1 228 . 1 1 8 8 LEU H H 8 9.100 9.100 8.564 0.536 17919 93340 1 228 . 1 1 9 9 THR N N 9 105.590 105.590 109.262 -3.672 17919 93341 1 228 . 1 1 9 9 THR HA H 9 4.428 4.428 4.325 0.103 17919 93342 1 228 . 1 1 9 9 THR C C 9 175.520 175.520 175.598 -0.078 17919 93343 1 228 . 1 1 9 9 THR CA C 9 61.400 61.400 61.789 -0.389 17919 93344 1 228 . 1 1 9 9 THR CB C 9 69.140 69.140 69.255 -0.115 17919 93345 1 228 . 1 1 9 9 THR H H 9 7.630 7.630 7.508 0.122 17919 93346 1 228 . 1 1 10 10 GLY N N 10 108.890 108.890 111.630 -2.740 17919 93347 1 228 . 1 1 10 10 GLY C C 10 174.070 174.070 173.870 0.200 17919 93348 1 228 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.302 0.158 17919 93349 1 228 . 1 1 10 10 GLY H H 10 7.810 7.810 8.362 -0.552 17919 93350 1 228 . 1 1 11 11 LYS N N 11 121.600 121.600 120.344 1.256 17919 93351 1 228 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.496 -0.135 17919 93352 1 228 . 1 1 11 11 LYS C C 11 175.940 175.940 175.397 0.543 17919 93353 1 228 . 1 1 11 11 LYS CA C 11 56.280 56.280 55.798 0.482 17919 93354 1 228 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.416 -0.216 17919 93355 1 228 . 1 1 11 11 LYS H H 11 7.280 7.280 7.571 -0.291 17919 93356 1 228 . 1 1 12 12 THR N N 12 120.440 120.440 117.517 2.923 17919 93357 1 228 . 1 1 12 12 THR HA H 12 5.046 5.046 5.349 -0.303 17919 93358 1 228 . 1 1 12 12 THR C C 12 174.320 174.320 174.492 -0.172 17919 93359 1 228 . 1 1 12 12 THR CA C 12 62.390 62.390 61.364 1.026 17919 93360 1 228 . 1 1 12 12 THR CB C 12 69.910 69.910 70.646 -0.736 17919 93361 1 228 . 1 1 12 12 THR H H 12 8.650 8.650 8.215 0.435 17919 93362 1 228 . 1 1 13 13 ILE N N 13 127.110 127.110 125.565 1.545 17919 93363 1 228 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.597 -0.053 17919 93364 1 228 . 1 1 13 13 ILE C C 13 175.220 175.220 175.398 -0.178 17919 93365 1 228 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.361 -0.381 17919 93366 1 228 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.480 0.470 17919 93367 1 228 . 1 1 13 13 ILE H H 13 9.450 9.450 8.642 0.808 17919 93368 1 228 . 1 1 14 14 THR N N 14 121.520 121.520 122.345 -0.825 17919 93369 1 228 . 1 1 14 14 THR HA H 14 4.964 4.964 4.800 0.164 17919 93370 1 228 . 1 1 14 14 THR C C 14 173.790 173.790 173.689 0.101 17919 93371 1 228 . 1 1 14 14 THR CA C 14 61.940 61.940 62.471 -0.531 17919 93372 1 228 . 1 1 14 14 THR CB C 14 69.650 69.650 69.449 0.201 17919 93373 1 228 . 1 1 14 14 THR H H 14 8.710 8.710 8.410 0.300 17919 93374 1 228 . 1 1 15 15 LEU N N 15 124.800 124.800 127.179 -2.379 17919 93375 1 228 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.775 0.005 17919 93376 1 228 . 1 1 15 15 LEU C C 15 174.670 174.670 175.308 -0.638 17919 93377 1 228 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.896 -1.066 17919 93378 1 228 . 1 1 15 15 LEU CB C 15 47.070 47.070 43.784 3.286 17919 93379 1 228 . 1 1 15 15 LEU H H 15 8.710 8.710 8.802 -0.092 17919 93380 1 228 . 1 1 16 16 GLU N N 16 122.160 122.160 124.292 -2.132 17919 93381 1 228 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.273 -0.356 17919 93382 1 228 . 1 1 16 16 GLU C C 16 175.860 175.860 176.279 -0.419 17919 93383 1 228 . 1 1 16 16 GLU CA C 16 54.820 54.820 56.124 -1.304 17919 93384 1 228 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.408 -0.958 17919 93385 1 228 . 1 1 16 16 GLU H H 16 8.140 8.140 8.816 -0.676 17919 93386 1 228 . 1 1 17 17 VAL N N 17 117.210 117.210 119.527 -2.317 17919 93387 1 228 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.683 0.031 17919 93388 1 228 . 1 1 17 17 VAL C C 17 174.160 174.160 174.333 -0.173 17919 93389 1 228 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.119 -0.689 17919 93390 1 228 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.584 0.817 17919 93391 1 228 . 1 1 17 17 VAL H H 17 8.900 8.900 8.664 0.236 17919 93392 1 228 . 1 1 18 18 GLU N N 18 118.990 118.990 121.738 -2.748 17919 93393 1 228 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.800 0.279 17919 93394 1 228 . 1 1 18 18 GLU C C 18 176.160 176.160 175.806 0.354 17919 93395 1 228 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.427 0.293 17919 93396 1 228 . 1 1 18 18 GLU CB C 18 30.310 30.310 29.229 1.081 17919 93397 1 228 . 1 1 18 18 GLU H H 18 8.640 8.640 8.601 0.039 17919 93398 1 228 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.304 -0.163 17919 93399 1 228 . 1 1 19 19 PRO C C 19 175.310 175.310 177.751 -2.441 17919 93400 1 228 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.326 0.144 17919 93401 1 228 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.859 0.091 17919 93402 1 228 . 1 1 20 20 SER N N 20 103.400 103.400 110.353 -6.953 17919 93403 1 228 . 1 1 20 20 SER HA H 20 4.370 4.370 4.276 0.094 17919 93404 1 228 . 1 1 20 20 SER C C 20 174.660 174.660 174.788 -0.128 17919 93405 1 228 . 1 1 20 20 SER CA C 20 57.400 57.400 59.223 -1.823 17919 93406 1 228 . 1 1 20 20 SER CB C 20 63.370 63.370 62.756 0.614 17919 93407 1 228 . 1 1 20 20 SER H H 20 7.040 7.040 8.056 -1.016 17919 93408 1 228 . 1 1 21 21 ASP N N 21 123.480 123.480 124.804 -1.324 17919 93409 1 228 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.677 0.018 17919 93410 1 228 . 1 1 21 21 ASP C C 21 176.360 176.360 176.342 0.018 17919 93411 1 228 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.160 0.540 17919 93412 1 228 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.421 -0.621 17919 93413 1 228 . 1 1 21 21 ASP H H 21 8.030 8.030 7.927 0.103 17919 93414 1 228 . 1 1 22 22 THR N N 22 108.800 108.800 113.909 -5.109 17919 93415 1 228 . 1 1 22 22 THR HA H 22 4.920 4.920 4.755 0.165 17919 93416 1 228 . 1 1 22 22 THR C C 22 176.750 176.750 176.195 0.555 17919 93417 1 228 . 1 1 22 22 THR CA C 22 59.690 59.690 61.675 -1.985 17919 93418 1 228 . 1 1 22 22 THR CB C 22 71.200 71.200 70.714 0.486 17919 93419 1 228 . 1 1 22 22 THR H H 22 7.900 7.900 8.065 -0.165 17919 93420 1 228 . 1 1 23 23 ILE N N 23 121.190 121.190 123.284 -2.094 17919 93421 1 228 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.721 -0.064 17919 93422 1 228 . 1 1 23 23 ILE C C 23 179.040 179.040 177.918 1.122 17919 93423 1 228 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.065 -0.805 17919 93424 1 228 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.093 -1.743 17919 93425 1 228 . 1 1 23 23 ILE H H 23 8.560 8.560 9.205 -0.645 17919 93426 1 228 . 1 1 24 24 GLU N N 24 120.830 120.830 120.206 0.624 17919 93427 1 228 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.908 0.009 17919 93428 1 228 . 1 1 24 24 GLU C C 24 178.640 178.640 178.621 0.019 17919 93429 1 228 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.001 0.219 17919 93430 1 228 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.447 -1.167 17919 93431 1 228 . 1 1 24 24 GLU H H 24 9.760 9.760 8.524 1.236 17919 93432 1 228 . 1 1 25 25 ASN N N 25 120.570 120.570 118.231 2.339 17919 93433 1 228 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.491 0.034 17919 93434 1 228 . 1 1 25 25 ASN C C 25 178.380 178.380 177.823 0.557 17919 93435 1 228 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.251 -0.191 17919 93436 1 228 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.781 -0.331 17919 93437 1 228 . 1 1 25 25 ASN H H 25 7.920 7.920 7.758 0.162 17919 93438 1 228 . 1 1 26 26 VAL N N 26 121.710 121.710 121.516 0.194 17919 93439 1 228 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.516 -0.119 17919 93440 1 228 . 1 1 26 26 VAL C C 26 177.950 177.950 177.775 0.175 17919 93441 1 228 . 1 1 26 26 VAL CA C 26 67.660 67.660 67.048 0.612 17919 93442 1 228 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.734 -0.894 17919 93443 1 228 . 1 1 26 26 VAL H H 26 8.070 8.070 8.295 -0.225 17919 93444 1 228 . 1 1 27 27 LYS N N 27 118.860 118.860 120.031 -1.171 17919 93445 1 228 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.170 0.410 17919 93446 1 228 . 1 1 27 27 LYS C C 27 180.550 180.550 179.152 1.398 17919 93447 1 228 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.708 -0.458 17919 93448 1 228 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.326 1.404 17919 93449 1 228 . 1 1 27 27 LYS H H 27 8.560 8.560 8.318 0.242 17919 93450 1 228 . 1 1 28 28 ALA N N 28 123.440 123.440 120.851 2.589 17919 93451 1 228 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.196 -0.036 17919 93452 1 228 . 1 1 28 28 ALA C C 28 180.300 180.300 179.076 1.224 17919 93453 1 228 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.555 0.815 17919 93454 1 228 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.468 -0.759 17919 93455 1 228 . 1 1 28 28 ALA H H 28 8.060 8.060 8.545 -0.485 17919 93456 1 228 . 1 1 29 29 LYS N N 29 119.940 119.940 120.384 -0.444 17919 93457 1 228 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.014 0.193 17919 93458 1 228 . 1 1 29 29 LYS C C 29 180.320 180.320 178.885 1.435 17919 93459 1 228 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.618 0.032 17919 93460 1 228 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.375 0.915 17919 93461 1 228 . 1 1 29 29 LYS H H 29 7.850 7.850 8.098 -0.248 17919 93462 1 228 . 1 1 30 30 ILE N N 30 121.080 121.080 120.382 0.698 17919 93463 1 228 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.550 -0.043 17919 93464 1 228 . 1 1 30 30 ILE C C 30 178.310 178.310 177.620 0.690 17919 93465 1 228 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.336 0.814 17919 93466 1 228 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.489 -0.689 17919 93467 1 228 . 1 1 30 30 ILE H H 30 8.280 8.280 8.450 -0.170 17919 93468 1 228 . 1 1 31 31 GLN N N 31 123.490 123.490 120.449 3.041 17919 93469 1 228 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.089 -0.260 17919 93470 1 228 . 1 1 31 31 GLN C C 31 178.890 178.890 178.107 0.783 17919 93471 1 228 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.004 0.996 17919 93472 1 228 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.573 -0.853 17919 93473 1 228 . 1 1 31 31 GLN H H 31 8.580 8.580 8.028 0.552 17919 93474 1 228 . 1 1 32 32 ASP N N 32 119.360 119.360 118.886 0.474 17919 93475 1 228 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.411 -0.057 17919 93476 1 228 . 1 1 32 32 ASP C C 32 177.250 177.250 178.525 -1.275 17919 93477 1 228 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.672 0.518 17919 93478 1 228 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.877 -0.297 17919 93479 1 228 . 1 1 32 32 ASP H H 32 8.010 8.010 8.184 -0.174 17919 93480 1 228 . 1 1 33 33 LYS N N 33 115.130 115.130 117.497 -2.367 17919 93481 1 228 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.254 0.083 17919 93482 1 228 . 1 1 33 33 LYS C C 33 177.870 177.870 177.909 -0.039 17919 93483 1 228 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.669 -0.619 17919 93484 1 228 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.455 0.715 17919 93485 1 228 . 1 1 33 33 LYS H H 33 7.430 7.430 7.704 -0.274 17919 93486 1 228 . 1 1 34 34 GLU N N 34 113.870 113.870 116.497 -2.627 17919 93487 1 228 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.440 0.185 17919 93488 1 228 . 1 1 34 34 GLU C C 34 177.840 177.840 176.958 0.882 17919 93489 1 228 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.544 -0.374 17919 93490 1 228 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.584 1.076 17919 93491 1 228 . 1 1 34 34 GLU H H 34 8.740 8.740 7.995 0.745 17919 93492 1 228 . 1 1 35 35 GLY N N 35 108.650 108.650 108.345 0.305 17919 93493 1 228 . 1 1 35 35 GLY C C 35 173.960 173.960 174.650 -0.690 17919 93494 1 228 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.612 0.468 17919 93495 1 228 . 1 1 35 35 GLY H H 35 8.530 8.530 7.987 0.543 17919 93496 1 228 . 1 1 36 36 ILE N N 36 119.880 119.880 121.928 -2.048 17919 93497 1 228 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.464 -0.019 17919 93498 1 228 . 1 1 36 36 ILE C C 36 173.590 173.590 174.157 -0.567 17919 93499 1 228 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.804 -0.054 17919 93500 1 228 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.625 1.955 17919 93501 1 228 . 1 1 36 36 ILE H H 36 6.150 6.150 7.537 -1.387 17919 93502 1 228 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.697 -0.063 17919 93503 1 228 . 1 1 37 37 PRO C C 37 176.940 176.940 176.056 0.884 17919 93504 1 228 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.258 0.402 17919 93505 1 228 . 1 1 37 37 PRO CB C 37 31.850 31.850 30.927 0.923 17919 93506 1 228 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.133 -0.016 17919 93507 1 228 . 1 1 38 38 PRO C C 38 178.320 178.320 178.695 -0.375 17919 93508 1 228 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.837 0.423 17919 93509 1 228 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.840 1.050 17919 93510 1 228 . 1 1 39 39 ASP N N 39 113.380 113.380 115.093 -1.713 17919 93511 1 228 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.426 0.004 17919 93512 1 228 . 1 1 39 39 ASP C C 39 177.090 177.090 177.121 -0.031 17919 93513 1 228 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.169 -0.529 17919 93514 1 228 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.597 -1.057 17919 93515 1 228 . 1 1 39 39 ASP H H 39 8.550 8.550 8.507 0.043 17919 93516 1 228 . 1 1 40 40 GLN N N 40 116.780 116.780 115.697 1.083 17919 93517 1 228 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.417 0.047 17919 93518 1 228 . 1 1 40 40 GLN C C 40 175.380 175.380 175.610 -0.230 17919 93519 1 228 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.641 -0.001 17919 93520 1 228 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.910 0.230 17919 93521 1 228 . 1 1 40 40 GLN H H 40 7.820 7.820 7.864 -0.044 17919 93522 1 228 . 1 1 41 41 GLN N N 41 117.720 117.720 118.804 -1.084 17919 93523 1 228 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.319 -0.075 17919 93524 1 228 . 1 1 41 41 GLN C C 41 176.300 176.300 175.544 0.756 17919 93525 1 228 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.920 0.550 17919 93526 1 228 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.708 1.942 17919 93527 1 228 . 1 1 41 41 GLN H H 41 7.480 7.480 7.170 0.310 17919 93528 1 228 . 1 1 42 42 ARG N N 42 122.680 122.680 125.152 -2.472 17919 93529 1 228 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.644 -0.144 17919 93530 1 228 . 1 1 42 42 ARG C C 42 174.050 174.050 173.714 0.336 17919 93531 1 228 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.851 0.199 17919 93532 1 228 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.677 -0.927 17919 93533 1 228 . 1 1 42 42 ARG H H 42 8.530 8.530 8.204 0.326 17919 93534 1 228 . 1 1 43 43 LEU N N 43 124.040 124.040 128.478 -4.438 17919 93535 1 228 . 1 1 43 43 LEU C C 43 175.290 175.290 175.084 0.206 17919 93536 1 228 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.632 -0.652 17919 93537 1 228 . 1 1 43 43 LEU CB C 43 45.790 45.790 45.014 0.776 17919 93538 1 228 . 1 1 43 43 LEU H H 43 8.820 8.820 8.760 0.060 17919 93539 1 228 . 1 1 44 44 ILE N N 44 121.920 121.920 120.511 1.409 17919 93540 1 228 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.254 -0.262 17919 93541 1 228 . 1 1 44 44 ILE C C 44 176.060 176.060 173.734 2.326 17919 93542 1 228 . 1 1 44 44 ILE CA C 44 58.980 58.980 58.845 0.135 17919 93543 1 228 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.612 -0.192 17919 93544 1 228 . 1 1 44 44 ILE H H 44 9.030 9.030 8.937 0.093 17919 93545 1 228 . 1 1 45 45 PHE N N 45 125.390 125.390 126.550 -1.160 17919 93546 1 228 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.983 0.062 17919 93547 1 228 . 1 1 45 45 PHE C C 45 174.470 174.470 175.482 -1.012 17919 93548 1 228 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.075 0.945 17919 93549 1 228 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.204 1.556 17919 93550 1 228 . 1 1 45 45 PHE H H 45 8.830 8.830 8.071 0.759 17919 93551 1 228 . 1 1 46 46 ALA N N 46 132.200 132.200 130.342 1.858 17919 93552 1 228 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.640 0.050 17919 93553 1 228 . 1 1 46 46 ALA C C 46 177.290 177.290 177.408 -0.118 17919 93554 1 228 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.411 0.129 17919 93555 1 228 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.124 0.446 17919 93556 1 228 . 1 1 46 46 ALA H H 46 8.810 8.810 8.622 0.188 17919 93557 1 228 . 1 1 47 47 GLY N N 47 102.340 102.340 104.205 -1.865 17919 93558 1 228 . 1 1 47 47 GLY C C 47 173.810 173.810 174.040 -0.230 17919 93559 1 228 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.249 0.101 17919 93560 1 228 . 1 1 47 47 GLY H H 47 8.130 8.130 8.393 -0.263 17919 93561 1 228 . 1 1 48 48 LYS N N 48 121.570 121.570 120.602 0.968 17919 93562 1 228 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.622 -0.000 17919 93563 1 228 . 1 1 48 48 LYS C C 48 174.700 174.700 175.269 -0.569 17919 93564 1 228 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.820 -0.270 17919 93565 1 228 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.965 -0.436 17919 93566 1 228 . 1 1 48 48 LYS H H 48 7.980 7.980 8.034 -0.054 17919 93567 1 228 . 1 1 49 49 GLN N N 49 122.410 122.410 124.422 -2.012 17919 93568 1 228 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.213 0.347 17919 93569 1 228 . 1 1 49 49 GLN C C 49 175.670 175.670 176.131 -0.461 17919 93570 1 228 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.123 -0.383 17919 93571 1 228 . 1 1 49 49 GLN CB C 49 29.000 29.000 28.928 0.072 17919 93572 1 228 . 1 1 49 49 GLN H H 49 8.600 8.600 8.613 -0.013 17919 93573 1 228 . 1 1 50 50 LEU N N 50 125.520 125.520 127.631 -2.111 17919 93574 1 228 . 1 1 50 50 LEU HA H 50 4.090 4.090 3.822 0.268 17919 93575 1 228 . 1 1 50 50 LEU C C 50 176.660 176.660 176.506 0.154 17919 93576 1 228 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.550 -0.310 17919 93577 1 228 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.260 0.310 17919 93578 1 228 . 1 1 50 50 LEU H H 50 8.530 8.530 7.752 0.778 17919 93579 1 228 . 1 1 51 51 GLU N N 51 122.940 122.940 123.925 -0.985 17919 93580 1 228 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.535 -0.047 17919 93581 1 228 . 1 1 51 51 GLU C C 51 175.870 175.870 176.489 -0.619 17919 93582 1 228 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.415 0.545 17919 93583 1 228 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.579 -0.010 17919 93584 1 228 . 1 1 51 51 GLU H H 51 8.400 8.400 8.204 0.196 17919 93585 1 228 . 1 1 52 52 ASP N N 52 120.030 120.030 124.076 -4.046 17919 93586 1 228 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.449 -0.090 17919 93587 1 228 . 1 1 52 52 ASP C C 52 177.330 177.330 177.792 -0.462 17919 93588 1 228 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.246 -0.286 17919 93589 1 228 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.820 0.030 17919 93590 1 228 . 1 1 52 52 ASP H H 52 8.160 8.160 8.817 -0.657 17919 93591 1 228 . 1 1 53 53 GLY N N 53 106.660 106.660 106.166 0.494 17919 93592 1 228 . 1 1 53 53 GLY C C 53 174.870 174.870 173.814 1.056 17919 93593 1 228 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.815 0.355 17919 93594 1 228 . 1 1 53 53 GLY H H 53 9.390 9.390 8.517 0.873 17919 93595 1 228 . 1 1 54 54 ARG N N 54 119.050 119.050 119.803 -0.753 17919 93596 1 228 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.700 -0.005 17919 93597 1 228 . 1 1 54 54 ARG C C 54 175.350 175.350 175.834 -0.484 17919 93598 1 228 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.159 0.231 17919 93599 1 228 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.325 -0.675 17919 93600 1 228 . 1 1 54 54 ARG H H 54 7.460 7.460 7.234 0.226 17919 93601 1 228 . 1 1 55 55 THR N N 55 108.400 108.400 111.477 -3.077 17919 93602 1 228 . 1 1 55 55 THR HA H 55 5.240 5.240 5.065 0.175 17919 93603 1 228 . 1 1 55 55 THR C C 55 176.560 176.560 176.269 0.291 17919 93604 1 228 . 1 1 55 55 THR CA C 55 59.690 59.690 60.140 -0.450 17919 93605 1 228 . 1 1 55 55 THR CB C 55 72.260 72.260 71.184 1.076 17919 93606 1 228 . 1 1 55 55 THR H H 55 8.730 8.730 9.194 -0.464 17919 93607 1 228 . 1 1 56 56 LEU N N 56 117.920 117.920 120.972 -3.052 17919 93608 1 228 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.046 0.014 17919 93609 1 228 . 1 1 56 56 LEU C C 56 180.810 180.810 178.673 2.137 17919 93610 1 228 . 1 1 56 56 LEU CA C 56 58.710 58.710 57.727 0.983 17919 93611 1 228 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.555 -1.185 17919 93612 1 228 . 1 1 56 56 LEU H H 56 8.140 8.140 8.608 -0.468 17919 93613 1 228 . 1 1 57 57 SER N N 57 113.330 113.330 115.509 -2.179 17919 93614 1 228 . 1 1 57 57 SER HA H 57 4.370 4.370 4.246 0.124 17919 93615 1 228 . 1 1 57 57 SER C C 57 178.310 178.310 176.748 1.562 17919 93616 1 228 . 1 1 57 57 SER CA C 57 61.080 61.080 62.296 -1.216 17919 93617 1 228 . 1 1 57 57 SER CB C 57 62.530 62.530 62.779 -0.249 17919 93618 1 228 . 1 1 57 57 SER H H 57 8.470 8.470 8.058 0.412 17919 93619 1 228 . 1 1 58 58 ASP N N 58 124.190 124.190 122.736 1.454 17919 93620 1 228 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.307 -0.011 17919 93621 1 228 . 1 1 58 58 ASP C C 58 177.400 177.400 176.995 0.405 17919 93622 1 228 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.923 0.257 17919 93623 1 228 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.620 -0.520 17919 93624 1 228 . 1 1 58 58 ASP H H 58 7.930 7.930 7.848 0.082 17919 93625 1 228 . 1 1 59 59 TYR N N 59 115.510 115.510 115.842 -0.332 17919 93626 1 228 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.583 0.087 17919 93627 1 228 . 1 1 59 59 TYR C C 59 174.700 174.700 174.473 0.227 17919 93628 1 228 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.947 0.303 17919 93629 1 228 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.541 1.529 17919 93630 1 228 . 1 1 59 59 TYR H H 59 7.250 7.250 7.396 -0.146 17919 93631 1 228 . 1 1 60 60 ASN N N 60 115.900 115.900 114.509 1.391 17919 93632 1 228 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.295 0.060 17919 93633 1 228 . 1 1 60 60 ASN C C 60 174.340 174.340 174.568 -0.228 17919 93634 1 228 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.329 -0.209 17919 93635 1 228 . 1 1 60 60 ASN CB C 60 37.410 37.410 36.649 0.761 17919 93636 1 228 . 1 1 60 60 ASN H H 60 8.150 8.150 8.051 0.099 17919 93637 1 228 . 1 1 61 61 ILE N N 61 118.600 118.600 119.271 -0.671 17919 93638 1 228 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.664 -0.271 17919 93639 1 228 . 1 1 61 61 ILE C C 61 174.610 174.610 175.204 -0.594 17919 93640 1 228 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.918 0.502 17919 93641 1 228 . 1 1 61 61 ILE CB C 61 36.740 36.740 38.178 -1.438 17919 93642 1 228 . 1 1 61 61 ILE H H 61 7.250 7.250 7.659 -0.409 17919 93643 1 228 . 1 1 62 62 GLN N N 62 124.740 124.740 124.190 0.550 17919 93644 1 228 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.733 -0.227 17919 93645 1 228 . 1 1 62 62 GLN C C 62 175.970 175.970 175.349 0.621 17919 93646 1 228 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.448 0.212 17919 93647 1 228 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.697 -0.047 17919 93648 1 228 . 1 1 62 62 GLN H H 62 7.610 7.610 7.926 -0.316 17919 93649 1 228 . 1 1 63 63 LYS N N 63 120.300 120.300 121.343 -1.043 17919 93650 1 228 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.033 -0.032 17919 93651 1 228 . 1 1 63 63 LYS C C 63 175.810 175.810 176.984 -1.174 17919 93652 1 228 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.843 -0.053 17919 93653 1 228 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.862 0.788 17919 93654 1 228 . 1 1 63 63 LYS H H 63 8.490 8.490 8.534 -0.044 17919 93655 1 228 . 1 1 64 64 GLU N N 64 113.950 113.950 118.456 -4.506 17919 93656 1 228 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.721 -0.256 17919 93657 1 228 . 1 1 64 64 GLU C C 64 175.250 175.250 175.817 -0.567 17919 93658 1 228 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.667 0.223 17919 93659 1 228 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.831 -2.931 17919 93660 1 228 . 1 1 64 64 GLU H H 64 9.280 9.280 8.894 0.386 17919 93661 1 228 . 1 1 65 65 SER N N 65 114.730 114.730 115.790 -1.060 17919 93662 1 228 . 1 1 65 65 SER HA H 65 4.640 4.640 4.435 0.205 17919 93663 1 228 . 1 1 65 65 SER C C 65 172.160 172.160 173.676 -1.516 17919 93664 1 228 . 1 1 65 65 SER CA C 65 60.890 60.890 60.662 0.228 17919 93665 1 228 . 1 1 65 65 SER CB C 65 64.910 64.910 64.135 0.775 17919 93666 1 228 . 1 1 65 65 SER H H 65 7.670 7.670 7.404 0.266 17919 93667 1 228 . 1 1 66 66 THR N N 66 117.110 117.110 119.241 -2.131 17919 93668 1 228 . 1 1 66 66 THR HA H 66 5.270 5.270 5.261 0.009 17919 93669 1 228 . 1 1 66 66 THR C C 66 173.950 173.950 174.010 -0.060 17919 93670 1 228 . 1 1 66 66 THR CA C 66 62.340 62.340 62.062 0.278 17919 93671 1 228 . 1 1 66 66 THR CB C 66 70.080 70.080 70.912 -0.832 17919 93672 1 228 . 1 1 66 66 THR H H 66 8.730 8.730 8.523 0.207 17919 93673 1 228 . 1 1 67 67 LEU N N 67 127.110 127.110 126.155 0.955 17919 93674 1 228 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.981 0.079 17919 93675 1 228 . 1 1 67 67 LEU C C 67 175.770 175.770 175.029 0.741 17919 93676 1 228 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.756 0.144 17919 93677 1 228 . 1 1 67 67 LEU CB C 67 44.260 44.260 45.366 -1.106 17919 93678 1 228 . 1 1 67 67 LEU H H 67 9.410 9.410 9.006 0.404 17919 93679 1 228 . 1 1 68 68 HIS N N 68 118.380 118.380 122.398 -4.018 17919 93680 1 228 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.254 -0.014 17919 93681 1 228 . 1 1 68 68 HIS C C 68 173.150 173.150 173.476 -0.326 17919 93682 1 228 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.550 0.450 17919 93683 1 228 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.386 -1.856 17919 93684 1 228 . 1 1 68 68 HIS H H 68 9.230 9.230 8.843 0.387 17919 93685 1 228 . 1 1 69 69 LEU N N 69 124.460 124.460 129.459 -4.999 17919 93686 1 228 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.996 0.194 17919 93687 1 228 . 1 1 69 69 LEU C C 69 175.270 175.270 174.196 1.074 17919 93688 1 228 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.228 0.662 17919 93689 1 228 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.425 -0.045 17919 93690 1 228 . 1 1 69 69 LEU H H 69 8.340 8.340 8.400 -0.060 17919 93691 1 228 . 1 1 70 70 VAL N N 70 126.940 126.940 126.637 0.303 17919 93692 1 228 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.332 0.018 17919 93693 1 228 . 1 1 70 70 VAL C C 70 174.000 174.000 174.666 -0.666 17919 93694 1 228 . 1 1 70 70 VAL CA C 70 60.800 60.800 61.092 -0.292 17919 93695 1 228 . 1 1 70 70 VAL CB C 70 34.910 34.910 33.645 1.265 17919 93696 1 228 . 1 1 70 70 VAL H H 70 9.200 9.200 9.137 0.063 17919 93697 1 228 . 1 1 71 71 LEU N N 71 123.130 123.130 126.313 -3.183 17919 93698 1 228 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.534 0.526 17919 93699 1 228 . 1 1 71 71 LEU C C 71 177.830 177.830 176.700 1.130 17919 93700 1 228 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.493 0.446 17919 93701 1 228 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.919 -0.069 17919 93702 1 228 . 1 1 71 71 LEU H H 71 8.120 8.120 8.536 -0.416 17919 93703 1 228 . 1 1 72 72 ARG N N 72 123.490 123.490 125.393 -1.903 17919 93704 1 228 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.211 0.090 17919 93705 1 228 . 1 1 72 72 ARG C C 72 175.350 175.350 175.362 -0.012 17919 93706 1 228 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.908 -1.298 17919 93707 1 228 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.215 1.135 17919 93708 1 228 . 1 1 72 72 ARG H H 72 8.580 8.580 8.428 0.152 17919 93709 1 229 . 1 1 2 2 GLN N N 2 123.220 123.220 120.633 2.587 17919 93710 1 229 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.306 -0.057 17919 93711 1 229 . 1 1 2 2 GLN C C 2 175.920 175.920 175.965 -0.045 17919 93712 1 229 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.988 0.092 17919 93713 1 229 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.151 0.609 17919 93714 1 229 . 1 1 2 2 GLN H H 2 8.900 8.900 8.421 0.479 17919 93715 1 229 . 1 1 3 3 ILE N N 3 115.340 115.340 114.867 0.473 17919 93716 1 229 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.228 -0.015 17919 93717 1 229 . 1 1 3 3 ILE C C 3 172.450 172.450 173.696 -1.246 17919 93718 1 229 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.252 0.318 17919 93719 1 229 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.852 0.357 17919 93720 1 229 . 1 1 3 3 ILE H H 3 8.320 8.320 8.698 -0.378 17919 93721 1 229 . 1 1 4 4 PHE N N 4 118.110 118.110 119.425 -1.315 17919 93722 1 229 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.496 0.134 17919 93723 1 229 . 1 1 4 4 PHE C C 4 175.320 175.320 175.031 0.289 17919 93724 1 229 . 1 1 4 4 PHE CA C 4 55.210 55.210 54.845 0.365 17919 93725 1 229 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.489 -0.009 17919 93726 1 229 . 1 1 4 4 PHE H H 4 8.610 8.610 8.546 0.064 17919 93727 1 229 . 1 1 5 5 VAL N N 5 121.000 121.000 124.037 -3.037 17919 93728 1 229 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.708 0.017 17919 93729 1 229 . 1 1 5 5 VAL C C 5 174.870 174.870 174.982 -0.112 17919 93730 1 229 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.138 -0.518 17919 93731 1 229 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.198 0.032 17919 93732 1 229 . 1 1 5 5 VAL H H 5 9.300 9.300 9.190 0.110 17919 93733 1 229 . 1 1 6 6 LYS N N 6 127.520 127.520 128.388 -0.868 17919 93734 1 229 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.236 0.131 17919 93735 1 229 . 1 1 6 6 LYS C C 6 177.140 177.140 176.578 0.562 17919 93736 1 229 . 1 1 6 6 LYS CA C 6 54.520 54.520 55.139 -0.619 17919 93737 1 229 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.377 0.673 17919 93738 1 229 . 1 1 6 6 LYS H H 6 8.820 8.820 9.086 -0.266 17919 93739 1 229 . 1 1 7 7 THR N N 7 115.400 115.400 114.694 0.706 17919 93740 1 229 . 1 1 7 7 THR HA H 7 4.970 4.970 4.801 0.169 17919 93741 1 229 . 1 1 7 7 THR C C 7 176.910 176.910 176.173 0.737 17919 93742 1 229 . 1 1 7 7 THR CA C 7 60.470 60.470 60.296 0.174 17919 93743 1 229 . 1 1 7 7 THR CB C 7 70.630 70.630 71.238 -0.608 17919 93744 1 229 . 1 1 7 7 THR H H 7 8.730 8.730 8.747 -0.017 17919 93745 1 229 . 1 1 8 8 LEU N N 8 121.330 121.330 124.857 -3.527 17919 93746 1 229 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.123 0.187 17919 93747 1 229 . 1 1 8 8 LEU C C 8 178.800 178.800 177.197 1.603 17919 93748 1 229 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.559 0.021 17919 93749 1 229 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.119 -0.149 17919 93750 1 229 . 1 1 8 8 LEU H H 8 9.100 9.100 8.916 0.184 17919 93751 1 229 . 1 1 9 9 THR N N 9 105.590 105.590 109.334 -3.744 17919 93752 1 229 . 1 1 9 9 THR HA H 9 4.428 4.428 4.356 0.072 17919 93753 1 229 . 1 1 9 9 THR C C 9 175.520 175.520 175.096 0.424 17919 93754 1 229 . 1 1 9 9 THR CA C 9 61.400 61.400 61.329 0.071 17919 93755 1 229 . 1 1 9 9 THR CB C 9 69.140 69.140 68.933 0.207 17919 93756 1 229 . 1 1 9 9 THR H H 9 7.630 7.630 7.409 0.221 17919 93757 1 229 . 1 1 10 10 GLY N N 10 108.890 108.890 111.582 -2.692 17919 93758 1 229 . 1 1 10 10 GLY C C 10 174.070 174.070 173.312 0.758 17919 93759 1 229 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.517 -0.056 17919 93760 1 229 . 1 1 10 10 GLY H H 10 7.810 7.810 8.097 -0.287 17919 93761 1 229 . 1 1 11 11 LYS N N 11 121.600 121.600 117.954 3.646 17919 93762 1 229 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.720 -0.359 17919 93763 1 229 . 1 1 11 11 LYS C C 11 175.940 175.940 175.216 0.724 17919 93764 1 229 . 1 1 11 11 LYS CA C 11 56.280 56.280 54.158 2.122 17919 93765 1 229 . 1 1 11 11 LYS CB C 11 33.200 33.200 35.222 -2.022 17919 93766 1 229 . 1 1 11 11 LYS H H 11 7.280 7.280 7.497 -0.217 17919 93767 1 229 . 1 1 12 12 THR N N 12 120.440 120.440 117.709 2.731 17919 93768 1 229 . 1 1 12 12 THR HA H 12 5.046 5.046 5.000 0.046 17919 93769 1 229 . 1 1 12 12 THR C C 12 174.320 174.320 174.307 0.013 17919 93770 1 229 . 1 1 12 12 THR CA C 12 62.390 62.390 61.695 0.695 17919 93771 1 229 . 1 1 12 12 THR CB C 12 69.910 69.910 69.535 0.375 17919 93772 1 229 . 1 1 12 12 THR H H 12 8.650 8.650 8.369 0.281 17919 93773 1 229 . 1 1 13 13 ILE N N 13 127.110 127.110 129.470 -2.360 17919 93774 1 229 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.258 0.286 17919 93775 1 229 . 1 1 13 13 ILE C C 13 175.220 175.220 175.394 -0.174 17919 93776 1 229 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.256 0.724 17919 93777 1 229 . 1 1 13 13 ILE CB C 13 40.950 40.950 37.754 3.196 17919 93778 1 229 . 1 1 13 13 ILE H H 13 9.450 9.450 9.178 0.273 17919 93779 1 229 . 1 1 14 14 THR N N 14 121.520 121.520 123.300 -1.780 17919 93780 1 229 . 1 1 14 14 THR HA H 14 4.964 4.964 5.196 -0.232 17919 93781 1 229 . 1 1 14 14 THR C C 14 173.790 173.790 173.862 -0.072 17919 93782 1 229 . 1 1 14 14 THR CA C 14 61.940 61.940 61.555 0.385 17919 93783 1 229 . 1 1 14 14 THR CB C 14 69.650 69.650 69.681 -0.031 17919 93784 1 229 . 1 1 14 14 THR H H 14 8.710 8.710 8.555 0.155 17919 93785 1 229 . 1 1 15 15 LEU N N 15 124.800 124.800 127.831 -3.031 17919 93786 1 229 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.702 0.078 17919 93787 1 229 . 1 1 15 15 LEU C C 15 174.670 174.670 175.393 -0.723 17919 93788 1 229 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.910 -1.080 17919 93789 1 229 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.046 2.024 17919 93790 1 229 . 1 1 15 15 LEU H H 15 8.710 8.710 8.611 0.099 17919 93791 1 229 . 1 1 16 16 GLU N N 16 122.160 122.160 124.510 -2.350 17919 93792 1 229 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.695 0.222 17919 93793 1 229 . 1 1 16 16 GLU C C 16 175.860 175.860 175.924 -0.064 17919 93794 1 229 . 1 1 16 16 GLU CA C 16 54.820 54.820 56.613 -1.793 17919 93795 1 229 . 1 1 16 16 GLU CB C 16 29.450 29.450 29.751 -0.301 17919 93796 1 229 . 1 1 16 16 GLU H H 16 8.140 8.140 8.860 -0.720 17919 93797 1 229 . 1 1 17 17 VAL N N 17 117.210 117.210 120.885 -3.675 17919 93798 1 229 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.874 -0.160 17919 93799 1 229 . 1 1 17 17 VAL C C 17 174.160 174.160 174.671 -0.511 17919 93800 1 229 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.406 -0.976 17919 93801 1 229 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.737 0.663 17919 93802 1 229 . 1 1 17 17 VAL H H 17 8.900 8.900 8.761 0.139 17919 93803 1 229 . 1 1 18 18 GLU N N 18 118.990 118.990 121.682 -2.692 17919 93804 1 229 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.807 0.272 17919 93805 1 229 . 1 1 18 18 GLU C C 18 176.160 176.160 176.067 0.093 17919 93806 1 229 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.752 -0.032 17919 93807 1 229 . 1 1 18 18 GLU CB C 18 30.310 30.310 29.943 0.367 17919 93808 1 229 . 1 1 18 18 GLU H H 18 8.640 8.640 8.800 -0.160 17919 93809 1 229 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.315 -0.174 17919 93810 1 229 . 1 1 19 19 PRO C C 19 175.310 175.310 177.100 -1.790 17919 93811 1 229 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.201 0.269 17919 93812 1 229 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.136 -0.186 17919 93813 1 229 . 1 1 20 20 SER N N 20 103.400 103.400 109.535 -6.135 17919 93814 1 229 . 1 1 20 20 SER HA H 20 4.370 4.370 4.422 -0.052 17919 93815 1 229 . 1 1 20 20 SER C C 20 174.660 174.660 174.144 0.516 17919 93816 1 229 . 1 1 20 20 SER CA C 20 57.400 57.400 58.869 -1.469 17919 93817 1 229 . 1 1 20 20 SER CB C 20 63.370 63.370 63.408 -0.038 17919 93818 1 229 . 1 1 20 20 SER H H 20 7.040 7.040 7.868 -0.828 17919 93819 1 229 . 1 1 21 21 ASP N N 21 123.480 123.480 124.021 -0.541 17919 93820 1 229 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.529 0.166 17919 93821 1 229 . 1 1 21 21 ASP C C 21 176.360 176.360 175.879 0.481 17919 93822 1 229 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.920 -0.220 17919 93823 1 229 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.127 -0.327 17919 93824 1 229 . 1 1 21 21 ASP H H 21 8.030 8.030 7.634 0.396 17919 93825 1 229 . 1 1 22 22 THR N N 22 108.800 108.800 111.942 -3.142 17919 93826 1 229 . 1 1 22 22 THR HA H 22 4.920 4.920 5.086 -0.166 17919 93827 1 229 . 1 1 22 22 THR C C 22 176.750 176.750 176.075 0.675 17919 93828 1 229 . 1 1 22 22 THR CA C 22 59.690 59.690 60.145 -0.455 17919 93829 1 229 . 1 1 22 22 THR CB C 22 71.200 71.200 71.605 -0.405 17919 93830 1 229 . 1 1 22 22 THR H H 22 7.900 7.900 8.042 -0.142 17919 93831 1 229 . 1 1 23 23 ILE N N 23 121.190 121.190 121.823 -0.633 17919 93832 1 229 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.833 -0.176 17919 93833 1 229 . 1 1 23 23 ILE C C 23 179.040 179.040 177.866 1.174 17919 93834 1 229 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.325 -0.066 17919 93835 1 229 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.197 -1.847 17919 93836 1 229 . 1 1 23 23 ILE H H 23 8.560 8.560 8.975 -0.415 17919 93837 1 229 . 1 1 24 24 GLU N N 24 120.830 120.830 121.226 -0.396 17919 93838 1 229 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.853 0.064 17919 93839 1 229 . 1 1 24 24 GLU C C 24 178.640 178.640 178.619 0.021 17919 93840 1 229 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.319 -0.099 17919 93841 1 229 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.421 -1.141 17919 93842 1 229 . 1 1 24 24 GLU H H 24 9.760 9.760 8.828 0.932 17919 93843 1 229 . 1 1 25 25 ASN N N 25 120.570 120.570 117.838 2.732 17919 93844 1 229 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.521 0.004 17919 93845 1 229 . 1 1 25 25 ASN C C 25 178.380 178.380 178.088 0.292 17919 93846 1 229 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.917 0.143 17919 93847 1 229 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.663 -0.213 17919 93848 1 229 . 1 1 25 25 ASN H H 25 7.920 7.920 7.670 0.250 17919 93849 1 229 . 1 1 26 26 VAL N N 26 121.710 121.710 121.273 0.437 17919 93850 1 229 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.536 -0.139 17919 93851 1 229 . 1 1 26 26 VAL C C 26 177.950 177.950 177.684 0.266 17919 93852 1 229 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.719 0.941 17919 93853 1 229 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.075 -0.235 17919 93854 1 229 . 1 1 26 26 VAL H H 26 8.070 8.070 8.500 -0.430 17919 93855 1 229 . 1 1 27 27 LYS N N 27 118.860 118.860 119.678 -0.818 17919 93856 1 229 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.096 0.484 17919 93857 1 229 . 1 1 27 27 LYS C C 27 180.550 180.550 179.321 1.229 17919 93858 1 229 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.568 -0.318 17919 93859 1 229 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.178 1.552 17919 93860 1 229 . 1 1 27 27 LYS H H 27 8.560 8.560 7.917 0.643 17919 93861 1 229 . 1 1 28 28 ALA N N 28 123.440 123.440 120.605 2.835 17919 93862 1 229 . 1 1 28 28 ALA HA H 28 4.160 4.160 3.989 0.171 17919 93863 1 229 . 1 1 28 28 ALA C C 28 180.300 180.300 179.564 0.736 17919 93864 1 229 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.216 0.154 17919 93865 1 229 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.251 -0.541 17919 93866 1 229 . 1 1 28 28 ALA H H 28 8.060 8.060 8.379 -0.319 17919 93867 1 229 . 1 1 29 29 LYS N N 29 119.940 119.940 119.315 0.625 17919 93868 1 229 . 1 1 29 29 LYS HA H 29 4.207 4.207 3.978 0.229 17919 93869 1 229 . 1 1 29 29 LYS C C 29 180.320 180.320 179.249 1.071 17919 93870 1 229 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.502 0.148 17919 93871 1 229 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.254 1.036 17919 93872 1 229 . 1 1 29 29 LYS H H 29 7.850 7.850 7.652 0.198 17919 93873 1 229 . 1 1 30 30 ILE N N 30 121.080 121.080 119.508 1.572 17919 93874 1 229 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.727 -0.220 17919 93875 1 229 . 1 1 30 30 ILE C C 30 178.310 178.310 177.908 0.402 17919 93876 1 229 . 1 1 30 30 ILE CA C 30 66.150 66.150 64.564 1.585 17919 93877 1 229 . 1 1 30 30 ILE CB C 30 36.800 36.800 36.952 -0.152 17919 93878 1 229 . 1 1 30 30 ILE H H 30 8.280 8.280 8.255 0.025 17919 93879 1 229 . 1 1 31 31 GLN N N 31 123.490 123.490 120.735 2.755 17919 93880 1 229 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.155 -0.326 17919 93881 1 229 . 1 1 31 31 GLN C C 31 178.890 178.890 178.538 0.352 17919 93882 1 229 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.339 0.661 17919 93883 1 229 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.417 -0.697 17919 93884 1 229 . 1 1 31 31 GLN H H 31 8.580 8.580 8.047 0.533 17919 93885 1 229 . 1 1 32 32 ASP N N 32 119.360 119.360 120.132 -0.772 17919 93886 1 229 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.390 -0.036 17919 93887 1 229 . 1 1 32 32 ASP C C 32 177.250 177.250 178.195 -0.945 17919 93888 1 229 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.894 0.296 17919 93889 1 229 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.828 -0.248 17919 93890 1 229 . 1 1 32 32 ASP H H 32 8.010 8.010 8.390 -0.380 17919 93891 1 229 . 1 1 33 33 LYS N N 33 115.130 115.130 118.557 -3.427 17919 93892 1 229 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.248 0.089 17919 93893 1 229 . 1 1 33 33 LYS C C 33 177.870 177.870 178.306 -0.436 17919 93894 1 229 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.916 0.134 17919 93895 1 229 . 1 1 33 33 LYS CB C 33 34.170 34.170 32.995 1.175 17919 93896 1 229 . 1 1 33 33 LYS H H 33 7.430 7.430 7.744 -0.314 17919 93897 1 229 . 1 1 34 34 GLU N N 34 113.870 113.870 114.079 -0.209 17919 93898 1 229 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.559 0.066 17919 93899 1 229 . 1 1 34 34 GLU C C 34 177.840 177.840 176.549 1.291 17919 93900 1 229 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.707 -0.537 17919 93901 1 229 . 1 1 34 34 GLU CB C 34 32.660 32.660 30.949 1.711 17919 93902 1 229 . 1 1 34 34 GLU H H 34 8.740 8.740 8.087 0.653 17919 93903 1 229 . 1 1 35 35 GLY N N 35 108.650 108.650 108.585 0.065 17919 93904 1 229 . 1 1 35 35 GLY C C 35 173.960 173.960 174.628 -0.668 17919 93905 1 229 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.933 0.147 17919 93906 1 229 . 1 1 35 35 GLY H H 35 8.530 8.530 8.064 0.466 17919 93907 1 229 . 1 1 36 36 ILE N N 36 119.880 119.880 122.125 -2.245 17919 93908 1 229 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.309 0.136 17919 93909 1 229 . 1 1 36 36 ILE C C 36 173.590 173.590 173.993 -0.403 17919 93910 1 229 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.443 -0.693 17919 93911 1 229 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.507 2.073 17919 93912 1 229 . 1 1 36 36 ILE H H 36 6.150 6.150 7.361 -1.211 17919 93913 1 229 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.813 -0.179 17919 93914 1 229 . 1 1 37 37 PRO C C 37 176.940 176.940 176.075 0.865 17919 93915 1 229 . 1 1 37 37 PRO CA C 37 61.660 61.660 60.966 0.694 17919 93916 1 229 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.652 0.198 17919 93917 1 229 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.236 -0.119 17919 93918 1 229 . 1 1 38 38 PRO C C 38 178.320 178.320 177.439 0.881 17919 93919 1 229 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.520 0.740 17919 93920 1 229 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.893 0.997 17919 93921 1 229 . 1 1 39 39 ASP N N 39 113.380 113.380 113.756 -0.376 17919 93922 1 229 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.472 -0.042 17919 93923 1 229 . 1 1 39 39 ASP C C 39 177.090 177.090 177.837 -0.747 17919 93924 1 229 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.013 -0.373 17919 93925 1 229 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.347 -0.807 17919 93926 1 229 . 1 1 39 39 ASP H H 39 8.550 8.550 8.320 0.230 17919 93927 1 229 . 1 1 40 40 GLN N N 40 116.780 116.780 118.006 -1.226 17919 93928 1 229 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.207 0.257 17919 93929 1 229 . 1 1 40 40 GLN C C 40 175.380 175.380 176.752 -1.372 17919 93930 1 229 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.981 -1.341 17919 93931 1 229 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.259 0.881 17919 93932 1 229 . 1 1 40 40 GLN H H 40 7.820 7.820 8.208 -0.388 17919 93933 1 229 . 1 1 41 41 GLN N N 41 117.720 117.720 118.793 -1.073 17919 93934 1 229 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.347 -0.103 17919 93935 1 229 . 1 1 41 41 GLN C C 41 176.300 176.300 175.696 0.604 17919 93936 1 229 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.270 0.200 17919 93937 1 229 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.099 2.551 17919 93938 1 229 . 1 1 41 41 GLN H H 41 7.480 7.480 7.352 0.128 17919 93939 1 229 . 1 1 42 42 ARG N N 42 122.680 122.680 125.489 -2.809 17919 93940 1 229 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.630 -0.130 17919 93941 1 229 . 1 1 42 42 ARG C C 42 174.050 174.050 174.476 -0.426 17919 93942 1 229 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.029 0.021 17919 93943 1 229 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.634 -0.884 17919 93944 1 229 . 1 1 42 42 ARG H H 42 8.530 8.530 8.983 -0.453 17919 93945 1 229 . 1 1 43 43 LEU N N 43 124.040 124.040 124.977 -0.937 17919 93946 1 229 . 1 1 43 43 LEU C C 43 175.290 175.290 176.105 -0.815 17919 93947 1 229 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.328 -0.348 17919 93948 1 229 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.185 1.605 17919 93949 1 229 . 1 1 43 43 LEU H H 43 8.820 8.820 8.773 0.047 17919 93950 1 229 . 1 1 44 44 ILE N N 44 121.920 121.920 117.071 4.849 17919 93951 1 229 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.343 -0.351 17919 93952 1 229 . 1 1 44 44 ILE C C 44 176.060 176.060 173.874 2.186 17919 93953 1 229 . 1 1 44 44 ILE CA C 44 58.980 58.980 58.447 0.533 17919 93954 1 229 . 1 1 44 44 ILE CB C 44 41.420 41.420 42.163 -0.743 17919 93955 1 229 . 1 1 44 44 ILE H H 44 9.030 9.030 8.807 0.223 17919 93956 1 229 . 1 1 45 45 PHE N N 45 125.390 125.390 124.149 1.241 17919 93957 1 229 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.017 0.028 17919 93958 1 229 . 1 1 45 45 PHE C C 45 174.470 174.470 174.752 -0.282 17919 93959 1 229 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.235 0.785 17919 93960 1 229 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.441 1.319 17919 93961 1 229 . 1 1 45 45 PHE H H 45 8.830 8.830 8.451 0.379 17919 93962 1 229 . 1 1 46 46 ALA N N 46 132.200 132.200 130.854 1.346 17919 93963 1 229 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.688 0.002 17919 93964 1 229 . 1 1 46 46 ALA C C 46 177.290 177.290 176.499 0.791 17919 93965 1 229 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.743 -0.203 17919 93966 1 229 . 1 1 46 46 ALA CB C 46 16.570 16.570 17.242 -0.672 17919 93967 1 229 . 1 1 46 46 ALA H H 46 8.810 8.810 8.981 -0.171 17919 93968 1 229 . 1 1 47 47 GLY N N 47 102.340 102.340 103.722 -1.382 17919 93969 1 229 . 1 1 47 47 GLY C C 47 173.810 173.810 174.366 -0.556 17919 93970 1 229 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.297 0.052 17919 93971 1 229 . 1 1 47 47 GLY H H 47 8.130 8.130 8.391 -0.261 17919 93972 1 229 . 1 1 48 48 LYS N N 48 121.570 121.570 121.480 0.090 17919 93973 1 229 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.607 0.015 17919 93974 1 229 . 1 1 48 48 LYS C C 48 174.700 174.700 175.755 -1.055 17919 93975 1 229 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.909 -0.359 17919 93976 1 229 . 1 1 48 48 LYS CB C 48 34.530 34.530 33.923 0.607 17919 93977 1 229 . 1 1 48 48 LYS H H 48 7.980 7.980 7.796 0.184 17919 93978 1 229 . 1 1 49 49 GLN N N 49 122.410 122.410 123.012 -0.602 17919 93979 1 229 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.518 0.042 17919 93980 1 229 . 1 1 49 49 GLN C C 49 175.670 175.670 175.360 0.310 17919 93981 1 229 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.423 0.317 17919 93982 1 229 . 1 1 49 49 GLN CB C 49 29.000 29.000 28.423 0.577 17919 93983 1 229 . 1 1 49 49 GLN H H 49 8.600 8.600 8.499 0.101 17919 93984 1 229 . 1 1 50 50 LEU N N 50 125.520 125.520 127.722 -2.202 17919 93985 1 229 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.444 -0.354 17919 93986 1 229 . 1 1 50 50 LEU C C 50 176.660 176.660 177.447 -0.787 17919 93987 1 229 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.612 -0.372 17919 93988 1 229 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.790 -0.220 17919 93989 1 229 . 1 1 50 50 LEU H H 50 8.530 8.530 7.918 0.612 17919 93990 1 229 . 1 1 51 51 GLU N N 51 122.940 122.940 123.931 -0.991 17919 93991 1 229 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.508 -0.020 17919 93992 1 229 . 1 1 51 51 GLU C C 51 175.870 175.870 176.671 -0.801 17919 93993 1 229 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.744 0.216 17919 93994 1 229 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.200 0.370 17919 93995 1 229 . 1 1 51 51 GLU H H 51 8.400 8.400 8.895 -0.495 17919 93996 1 229 . 1 1 52 52 ASP N N 52 120.030 120.030 122.653 -2.623 17919 93997 1 229 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.630 -0.271 17919 93998 1 229 . 1 1 52 52 ASP C C 52 177.330 177.330 176.829 0.501 17919 93999 1 229 . 1 1 52 52 ASP CA C 52 56.960 56.960 55.907 1.053 17919 94000 1 229 . 1 1 52 52 ASP CB C 52 40.850 40.850 41.006 -0.156 17919 94001 1 229 . 1 1 52 52 ASP H H 52 8.160 8.160 8.765 -0.605 17919 94002 1 229 . 1 1 53 53 GLY N N 53 106.660 106.660 105.138 1.522 17919 94003 1 229 . 1 1 53 53 GLY C C 53 174.870 174.870 174.147 0.723 17919 94004 1 229 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.764 0.406 17919 94005 1 229 . 1 1 53 53 GLY H H 53 9.390 9.390 8.415 0.975 17919 94006 1 229 . 1 1 54 54 ARG N N 54 119.050 119.050 120.587 -1.537 17919 94007 1 229 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.688 0.007 17919 94008 1 229 . 1 1 54 54 ARG C C 54 175.350 175.350 175.045 0.305 17919 94009 1 229 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.638 -0.248 17919 94010 1 229 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.549 0.101 17919 94011 1 229 . 1 1 54 54 ARG H H 54 7.460 7.460 7.468 -0.008 17919 94012 1 229 . 1 1 55 55 THR N N 55 108.400 108.400 112.104 -3.704 17919 94013 1 229 . 1 1 55 55 THR HA H 55 5.240 5.240 4.865 0.375 17919 94014 1 229 . 1 1 55 55 THR C C 55 176.560 176.560 175.970 0.590 17919 94015 1 229 . 1 1 55 55 THR CA C 55 59.690 59.690 60.560 -0.870 17919 94016 1 229 . 1 1 55 55 THR CB C 55 72.260 72.260 70.551 1.709 17919 94017 1 229 . 1 1 55 55 THR H H 55 8.730 8.730 8.244 0.486 17919 94018 1 229 . 1 1 56 56 LEU N N 56 117.920 117.920 120.568 -2.648 17919 94019 1 229 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.174 -0.114 17919 94020 1 229 . 1 1 56 56 LEU C C 56 180.810 180.810 178.837 1.973 17919 94021 1 229 . 1 1 56 56 LEU CA C 56 58.710 58.710 57.953 0.757 17919 94022 1 229 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.299 -0.929 17919 94023 1 229 . 1 1 56 56 LEU H H 56 8.140 8.140 8.424 -0.284 17919 94024 1 229 . 1 1 57 57 SER N N 57 113.330 113.330 114.338 -1.008 17919 94025 1 229 . 1 1 57 57 SER HA H 57 4.370 4.370 4.068 0.302 17919 94026 1 229 . 1 1 57 57 SER C C 57 178.310 178.310 176.244 2.066 17919 94027 1 229 . 1 1 57 57 SER CA C 57 61.080 61.080 61.131 -0.051 17919 94028 1 229 . 1 1 57 57 SER CB C 57 62.530 62.530 62.648 -0.118 17919 94029 1 229 . 1 1 57 57 SER H H 57 8.470 8.470 8.187 0.283 17919 94030 1 229 . 1 1 58 58 ASP N N 58 124.190 124.190 121.436 2.754 17919 94031 1 229 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.418 -0.122 17919 94032 1 229 . 1 1 58 58 ASP C C 58 177.400 177.400 177.202 0.198 17919 94033 1 229 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.075 1.105 17919 94034 1 229 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.794 -0.694 17919 94035 1 229 . 1 1 58 58 ASP H H 58 7.930 7.930 7.665 0.265 17919 94036 1 229 . 1 1 59 59 TYR N N 59 115.510 115.510 115.992 -0.482 17919 94037 1 229 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.651 0.020 17919 94038 1 229 . 1 1 59 59 TYR C C 59 174.700 174.700 174.686 0.014 17919 94039 1 229 . 1 1 59 59 TYR CA C 59 58.250 58.250 58.138 0.112 17919 94040 1 229 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.257 1.813 17919 94041 1 229 . 1 1 59 59 TYR H H 59 7.250 7.250 7.450 -0.200 17919 94042 1 229 . 1 1 60 60 ASN N N 60 115.900 115.900 113.984 1.916 17919 94043 1 229 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.446 -0.091 17919 94044 1 229 . 1 1 60 60 ASN C C 60 174.340 174.340 174.400 -0.060 17919 94045 1 229 . 1 1 60 60 ASN CA C 60 54.120 54.120 53.989 0.131 17919 94046 1 229 . 1 1 60 60 ASN CB C 60 37.410 37.410 36.616 0.794 17919 94047 1 229 . 1 1 60 60 ASN H H 60 8.150 8.150 7.624 0.526 17919 94048 1 229 . 1 1 61 61 ILE N N 61 118.600 118.600 120.433 -1.833 17919 94049 1 229 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.792 -0.399 17919 94050 1 229 . 1 1 61 61 ILE C C 61 174.610 174.610 175.633 -1.023 17919 94051 1 229 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.126 0.294 17919 94052 1 229 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.117 -0.377 17919 94053 1 229 . 1 1 61 61 ILE H H 61 7.250 7.250 7.828 -0.578 17919 94054 1 229 . 1 1 62 62 GLN N N 62 124.740 124.740 126.667 -1.927 17919 94055 1 229 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.734 -0.228 17919 94056 1 229 . 1 1 62 62 GLN C C 62 175.970 175.970 175.865 0.105 17919 94057 1 229 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.512 0.148 17919 94058 1 229 . 1 1 62 62 GLN CB C 62 31.650 31.650 30.947 0.703 17919 94059 1 229 . 1 1 62 62 GLN H H 62 7.610 7.610 8.060 -0.450 17919 94060 1 229 . 1 1 63 63 LYS N N 63 120.300 120.300 120.906 -0.606 17919 94061 1 229 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.027 -0.026 17919 94062 1 229 . 1 1 63 63 LYS C C 63 175.810 175.810 176.581 -0.771 17919 94063 1 229 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.587 0.202 17919 94064 1 229 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.430 1.220 17919 94065 1 229 . 1 1 63 63 LYS H H 63 8.490 8.490 8.435 0.055 17919 94066 1 229 . 1 1 64 64 GLU N N 64 113.950 113.950 120.519 -6.569 17919 94067 1 229 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.324 0.141 17919 94068 1 229 . 1 1 64 64 GLU C C 64 175.250 175.250 175.696 -0.446 17919 94069 1 229 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.092 0.798 17919 94070 1 229 . 1 1 64 64 GLU CB C 64 25.900 25.900 27.971 -2.071 17919 94071 1 229 . 1 1 64 64 GLU H H 64 9.280 9.280 8.603 0.677 17919 94072 1 229 . 1 1 65 65 SER N N 65 114.730 114.730 114.852 -0.122 17919 94073 1 229 . 1 1 65 65 SER HA H 65 4.640 4.640 4.478 0.162 17919 94074 1 229 . 1 1 65 65 SER C C 65 172.160 172.160 174.027 -1.867 17919 94075 1 229 . 1 1 65 65 SER CA C 65 60.890 60.890 60.130 0.760 17919 94076 1 229 . 1 1 65 65 SER CB C 65 64.910 64.910 64.228 0.682 17919 94077 1 229 . 1 1 65 65 SER H H 65 7.670 7.670 7.432 0.238 17919 94078 1 229 . 1 1 66 66 THR N N 66 117.110 117.110 119.317 -2.207 17919 94079 1 229 . 1 1 66 66 THR HA H 66 5.270 5.270 5.152 0.118 17919 94080 1 229 . 1 1 66 66 THR C C 66 173.950 173.950 173.541 0.409 17919 94081 1 229 . 1 1 66 66 THR CA C 66 62.340 62.340 61.612 0.728 17919 94082 1 229 . 1 1 66 66 THR CB C 66 70.080 70.080 70.568 -0.488 17919 94083 1 229 . 1 1 66 66 THR H H 66 8.730 8.730 8.411 0.319 17919 94084 1 229 . 1 1 67 67 LEU N N 67 127.110 127.110 127.933 -0.823 17919 94085 1 229 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.969 0.091 17919 94086 1 229 . 1 1 67 67 LEU C C 67 175.770 175.770 175.351 0.419 17919 94087 1 229 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.936 -0.036 17919 94088 1 229 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.375 -0.115 17919 94089 1 229 . 1 1 67 67 LEU H H 67 9.410 9.410 9.120 0.290 17919 94090 1 229 . 1 1 68 68 HIS N N 68 118.380 118.380 120.778 -2.398 17919 94091 1 229 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.231 0.009 17919 94092 1 229 . 1 1 68 68 HIS C C 68 173.150 173.150 173.895 -0.745 17919 94093 1 229 . 1 1 68 68 HIS CA C 68 55.000 55.000 55.280 -0.280 17919 94094 1 229 . 1 1 68 68 HIS CB C 68 30.530 30.530 31.989 -1.460 17919 94095 1 229 . 1 1 68 68 HIS H H 68 9.230 9.230 8.758 0.472 17919 94096 1 229 . 1 1 69 69 LEU N N 69 124.460 124.460 126.872 -2.412 17919 94097 1 229 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.209 -0.019 17919 94098 1 229 . 1 1 69 69 LEU C C 69 175.270 175.270 174.511 0.759 17919 94099 1 229 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.539 0.351 17919 94100 1 229 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.721 -0.341 17919 94101 1 229 . 1 1 69 69 LEU H H 69 8.340 8.340 9.116 -0.776 17919 94102 1 229 . 1 1 70 70 VAL N N 70 126.940 126.940 125.402 1.538 17919 94103 1 229 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.487 -0.137 17919 94104 1 229 . 1 1 70 70 VAL C C 70 174.000 174.000 174.099 -0.099 17919 94105 1 229 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.089 0.711 17919 94106 1 229 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.697 -0.787 17919 94107 1 229 . 1 1 70 70 VAL H H 70 9.200 9.200 9.084 0.116 17919 94108 1 229 . 1 1 71 71 LEU N N 71 123.130 123.130 127.611 -4.481 17919 94109 1 229 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.718 0.342 17919 94110 1 229 . 1 1 71 71 LEU C C 71 177.830 177.830 177.125 0.705 17919 94111 1 229 . 1 1 71 71 LEU CA C 71 53.940 53.940 55.067 -1.127 17919 94112 1 229 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.137 0.713 17919 94113 1 229 . 1 1 71 71 LEU H H 71 8.120 8.120 8.563 -0.443 17919 94114 1 229 . 1 1 72 72 ARG N N 72 123.490 123.490 125.348 -1.858 17919 94115 1 229 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.469 -0.168 17919 94116 1 229 . 1 1 72 72 ARG C C 72 175.350 175.350 175.862 -0.512 17919 94117 1 229 . 1 1 72 72 ARG CA C 72 55.610 55.610 54.973 0.637 17919 94118 1 229 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.171 1.179 17919 94119 1 229 . 1 1 72 72 ARG H H 72 8.580 8.580 8.691 -0.111 17919 94120 1 230 . 1 1 2 2 GLN N N 2 123.220 123.220 121.270 1.950 17919 94121 1 230 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.276 -0.027 17919 94122 1 230 . 1 1 2 2 GLN C C 2 175.920 175.920 174.707 1.213 17919 94123 1 230 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.700 0.380 17919 94124 1 230 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.812 -0.052 17919 94125 1 230 . 1 1 2 2 GLN H H 2 8.900 8.900 8.361 0.539 17919 94126 1 230 . 1 1 3 3 ILE N N 3 115.340 115.340 118.507 -3.167 17919 94127 1 230 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.365 -0.152 17919 94128 1 230 . 1 1 3 3 ILE C C 3 172.450 172.450 173.192 -0.742 17919 94129 1 230 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.300 0.270 17919 94130 1 230 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.800 0.410 17919 94131 1 230 . 1 1 3 3 ILE H H 3 8.320 8.320 8.518 -0.198 17919 94132 1 230 . 1 1 4 4 PHE N N 4 118.110 118.110 120.800 -2.690 17919 94133 1 230 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.490 0.140 17919 94134 1 230 . 1 1 4 4 PHE C C 4 175.320 175.320 175.282 0.038 17919 94135 1 230 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.458 -0.248 17919 94136 1 230 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.800 -0.320 17919 94137 1 230 . 1 1 4 4 PHE H H 4 8.610 8.610 8.252 0.358 17919 94138 1 230 . 1 1 5 5 VAL N N 5 121.000 121.000 122.452 -1.452 17919 94139 1 230 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.511 0.214 17919 94140 1 230 . 1 1 5 5 VAL C C 5 174.870 174.870 174.547 0.323 17919 94141 1 230 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.516 -0.896 17919 94142 1 230 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.985 0.245 17919 94143 1 230 . 1 1 5 5 VAL H H 5 9.300 9.300 9.242 0.058 17919 94144 1 230 . 1 1 6 6 LYS N N 6 127.520 127.520 129.873 -2.353 17919 94145 1 230 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.417 -0.050 17919 94146 1 230 . 1 1 6 6 LYS C C 6 177.140 177.140 176.037 1.103 17919 94147 1 230 . 1 1 6 6 LYS CA C 6 54.520 54.520 53.643 0.877 17919 94148 1 230 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.905 0.145 17919 94149 1 230 . 1 1 6 6 LYS H H 6 8.820 8.820 9.092 -0.272 17919 94150 1 230 . 1 1 7 7 THR N N 7 115.400 115.400 117.254 -1.854 17919 94151 1 230 . 1 1 7 7 THR HA H 7 4.970 4.970 4.814 0.156 17919 94152 1 230 . 1 1 7 7 THR C C 7 176.910 176.910 176.669 0.241 17919 94153 1 230 . 1 1 7 7 THR CA C 7 60.470 60.470 60.156 0.314 17919 94154 1 230 . 1 1 7 7 THR CB C 7 70.630 70.630 70.973 -0.343 17919 94155 1 230 . 1 1 7 7 THR H H 7 8.730 8.730 9.009 -0.279 17919 94156 1 230 . 1 1 8 8 LEU N N 8 121.330 121.330 118.764 2.566 17919 94157 1 230 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.465 -0.155 17919 94158 1 230 . 1 1 8 8 LEU C C 8 178.800 178.800 177.374 1.426 17919 94159 1 230 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.495 0.085 17919 94160 1 230 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.603 0.367 17919 94161 1 230 . 1 1 8 8 LEU H H 8 9.100 9.100 8.541 0.559 17919 94162 1 230 . 1 1 9 9 THR N N 9 105.590 105.590 110.094 -4.504 17919 94163 1 230 . 1 1 9 9 THR HA H 9 4.428 4.428 4.337 0.091 17919 94164 1 230 . 1 1 9 9 THR C C 9 175.520 175.520 175.786 -0.266 17919 94165 1 230 . 1 1 9 9 THR CA C 9 61.400 61.400 61.755 -0.355 17919 94166 1 230 . 1 1 9 9 THR CB C 9 69.140 69.140 69.185 -0.045 17919 94167 1 230 . 1 1 9 9 THR H H 9 7.630 7.630 7.539 0.091 17919 94168 1 230 . 1 1 10 10 GLY N N 10 108.890 108.890 111.119 -2.229 17919 94169 1 230 . 1 1 10 10 GLY C C 10 174.070 174.070 173.721 0.349 17919 94170 1 230 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.147 0.313 17919 94171 1 230 . 1 1 10 10 GLY H H 10 7.810 7.810 8.058 -0.248 17919 94172 1 230 . 1 1 11 11 LYS N N 11 121.600 121.600 121.281 0.319 17919 94173 1 230 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.385 -0.024 17919 94174 1 230 . 1 1 11 11 LYS C C 11 175.940 175.940 175.173 0.767 17919 94175 1 230 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.449 -0.169 17919 94176 1 230 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.689 -0.489 17919 94177 1 230 . 1 1 11 11 LYS H H 11 7.280 7.280 7.761 -0.481 17919 94178 1 230 . 1 1 12 12 THR N N 12 120.440 120.440 119.901 0.539 17919 94179 1 230 . 1 1 12 12 THR HA H 12 5.046 5.046 4.941 0.105 17919 94180 1 230 . 1 1 12 12 THR C C 12 174.320 174.320 174.025 0.295 17919 94181 1 230 . 1 1 12 12 THR CA C 12 62.390 62.390 62.247 0.143 17919 94182 1 230 . 1 1 12 12 THR CB C 12 69.910 69.910 69.822 0.088 17919 94183 1 230 . 1 1 12 12 THR H H 12 8.650 8.650 8.293 0.357 17919 94184 1 230 . 1 1 13 13 ILE N N 13 127.110 127.110 128.913 -1.803 17919 94185 1 230 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.407 0.137 17919 94186 1 230 . 1 1 13 13 ILE C C 13 175.220 175.220 174.958 0.262 17919 94187 1 230 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.526 -0.546 17919 94188 1 230 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.090 -0.140 17919 94189 1 230 . 1 1 13 13 ILE H H 13 9.450 9.450 9.092 0.358 17919 94190 1 230 . 1 1 14 14 THR N N 14 121.520 121.520 123.519 -1.999 17919 94191 1 230 . 1 1 14 14 THR HA H 14 4.964 4.964 5.148 -0.184 17919 94192 1 230 . 1 1 14 14 THR C C 14 173.790 173.790 173.531 0.259 17919 94193 1 230 . 1 1 14 14 THR CA C 14 61.940 61.940 62.269 -0.329 17919 94194 1 230 . 1 1 14 14 THR CB C 14 69.650 69.650 69.830 -0.180 17919 94195 1 230 . 1 1 14 14 THR H H 14 8.710 8.710 8.725 -0.015 17919 94196 1 230 . 1 1 15 15 LEU N N 15 124.800 124.800 125.688 -0.888 17919 94197 1 230 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.844 -0.064 17919 94198 1 230 . 1 1 15 15 LEU C C 15 174.670 174.670 174.737 -0.067 17919 94199 1 230 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.852 -1.022 17919 94200 1 230 . 1 1 15 15 LEU CB C 15 47.070 47.070 46.316 0.754 17919 94201 1 230 . 1 1 15 15 LEU H H 15 8.710 8.710 8.746 -0.036 17919 94202 1 230 . 1 1 16 16 GLU N N 16 122.160 122.160 120.402 1.758 17919 94203 1 230 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.449 -0.532 17919 94204 1 230 . 1 1 16 16 GLU C C 16 175.860 175.860 176.209 -0.349 17919 94205 1 230 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.141 -0.321 17919 94206 1 230 . 1 1 16 16 GLU CB C 16 29.450 29.450 32.112 -2.662 17919 94207 1 230 . 1 1 16 16 GLU H H 16 8.140 8.140 8.470 -0.330 17919 94208 1 230 . 1 1 17 17 VAL N N 17 117.210 117.210 116.803 0.407 17919 94209 1 230 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.679 0.035 17919 94210 1 230 . 1 1 17 17 VAL C C 17 174.160 174.160 174.580 -0.420 17919 94211 1 230 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.565 -1.135 17919 94212 1 230 . 1 1 17 17 VAL CB C 17 36.400 36.400 34.818 1.582 17919 94213 1 230 . 1 1 17 17 VAL H H 17 8.900 8.900 8.380 0.520 17919 94214 1 230 . 1 1 18 18 GLU N N 18 118.990 118.990 119.364 -0.374 17919 94215 1 230 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.811 0.268 17919 94216 1 230 . 1 1 18 18 GLU C C 18 176.160 176.160 175.526 0.634 17919 94217 1 230 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.554 0.166 17919 94218 1 230 . 1 1 18 18 GLU CB C 18 30.310 30.310 29.922 0.388 17919 94219 1 230 . 1 1 18 18 GLU H H 18 8.640 8.640 8.429 0.211 17919 94220 1 230 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.333 -0.192 17919 94221 1 230 . 1 1 19 19 PRO C C 19 175.310 175.310 177.721 -2.411 17919 94222 1 230 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.326 0.144 17919 94223 1 230 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.943 0.007 17919 94224 1 230 . 1 1 20 20 SER N N 20 103.400 103.400 112.639 -9.239 17919 94225 1 230 . 1 1 20 20 SER HA H 20 4.370 4.370 4.403 -0.033 17919 94226 1 230 . 1 1 20 20 SER C C 20 174.660 174.660 174.683 -0.023 17919 94227 1 230 . 1 1 20 20 SER CA C 20 57.400 57.400 59.589 -2.189 17919 94228 1 230 . 1 1 20 20 SER CB C 20 63.370 63.370 63.183 0.187 17919 94229 1 230 . 1 1 20 20 SER H H 20 7.040 7.040 8.390 -1.350 17919 94230 1 230 . 1 1 21 21 ASP N N 21 123.480 123.480 122.274 1.206 17919 94231 1 230 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.786 -0.091 17919 94232 1 230 . 1 1 21 21 ASP C C 21 176.360 176.360 176.048 0.312 17919 94233 1 230 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.292 1.408 17919 94234 1 230 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.704 -0.904 17919 94235 1 230 . 1 1 21 21 ASP H H 21 8.030 8.030 7.626 0.404 17919 94236 1 230 . 1 1 22 22 THR N N 22 108.800 108.800 111.655 -2.855 17919 94237 1 230 . 1 1 22 22 THR HA H 22 4.920 4.920 4.952 -0.032 17919 94238 1 230 . 1 1 22 22 THR C C 22 176.750 176.750 176.238 0.512 17919 94239 1 230 . 1 1 22 22 THR CA C 22 59.690 59.690 60.361 -0.671 17919 94240 1 230 . 1 1 22 22 THR CB C 22 71.200 71.200 71.223 -0.023 17919 94241 1 230 . 1 1 22 22 THR H H 22 7.900 7.900 8.823 -0.923 17919 94242 1 230 . 1 1 23 23 ILE N N 23 121.190 121.190 122.820 -1.630 17919 94243 1 230 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.747 -0.090 17919 94244 1 230 . 1 1 23 23 ILE C C 23 179.040 179.040 177.673 1.367 17919 94245 1 230 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.383 -1.123 17919 94246 1 230 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.504 -2.154 17919 94247 1 230 . 1 1 23 23 ILE H H 23 8.560 8.560 8.445 0.115 17919 94248 1 230 . 1 1 24 24 GLU N N 24 120.830 120.830 120.870 -0.040 17919 94249 1 230 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.915 0.002 17919 94250 1 230 . 1 1 24 24 GLU C C 24 178.640 178.640 178.529 0.111 17919 94251 1 230 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.211 0.009 17919 94252 1 230 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.407 -1.127 17919 94253 1 230 . 1 1 24 24 GLU H H 24 9.760 9.760 8.216 1.544 17919 94254 1 230 . 1 1 25 25 ASN N N 25 120.570 120.570 117.807 2.763 17919 94255 1 230 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.471 0.054 17919 94256 1 230 . 1 1 25 25 ASN C C 25 178.380 178.380 178.075 0.305 17919 94257 1 230 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.976 0.084 17919 94258 1 230 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.518 -0.068 17919 94259 1 230 . 1 1 25 25 ASN H H 25 7.920 7.920 7.744 0.176 17919 94260 1 230 . 1 1 26 26 VAL N N 26 121.710 121.710 121.898 -0.188 17919 94261 1 230 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.508 -0.111 17919 94262 1 230 . 1 1 26 26 VAL C C 26 177.950 177.950 177.470 0.480 17919 94263 1 230 . 1 1 26 26 VAL CA C 26 67.660 67.660 67.109 0.551 17919 94264 1 230 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.634 -0.794 17919 94265 1 230 . 1 1 26 26 VAL H H 26 8.070 8.070 8.057 0.013 17919 94266 1 230 . 1 1 27 27 LYS N N 27 118.860 118.860 119.707 -0.847 17919 94267 1 230 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.025 0.555 17919 94268 1 230 . 1 1 27 27 LYS C C 27 180.550 180.550 179.208 1.342 17919 94269 1 230 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.488 -0.238 17919 94270 1 230 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.316 1.414 17919 94271 1 230 . 1 1 27 27 LYS H H 27 8.560 8.560 8.369 0.191 17919 94272 1 230 . 1 1 28 28 ALA N N 28 123.440 123.440 122.313 1.127 17919 94273 1 230 . 1 1 28 28 ALA HA H 28 4.160 4.160 3.968 0.192 17919 94274 1 230 . 1 1 28 28 ALA C C 28 180.300 180.300 179.266 1.034 17919 94275 1 230 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.431 -0.061 17919 94276 1 230 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.277 -0.567 17919 94277 1 230 . 1 1 28 28 ALA H H 28 8.060 8.060 8.440 -0.380 17919 94278 1 230 . 1 1 29 29 LYS N N 29 119.940 119.940 118.640 1.300 17919 94279 1 230 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.063 0.144 17919 94280 1 230 . 1 1 29 29 LYS C C 29 180.320 180.320 179.045 1.275 17919 94281 1 230 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.223 0.427 17919 94282 1 230 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.413 0.877 17919 94283 1 230 . 1 1 29 29 LYS H H 29 7.850 7.850 7.530 0.320 17919 94284 1 230 . 1 1 30 30 ILE N N 30 121.080 121.080 120.759 0.321 17919 94285 1 230 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.661 -0.154 17919 94286 1 230 . 1 1 30 30 ILE C C 30 178.310 178.310 177.619 0.691 17919 94287 1 230 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.106 1.044 17919 94288 1 230 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.703 -0.903 17919 94289 1 230 . 1 1 30 30 ILE H H 30 8.280 8.280 8.186 0.094 17919 94290 1 230 . 1 1 31 31 GLN N N 31 123.490 123.490 120.667 2.823 17919 94291 1 230 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.083 -0.254 17919 94292 1 230 . 1 1 31 31 GLN C C 31 178.890 178.890 178.491 0.399 17919 94293 1 230 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.326 0.674 17919 94294 1 230 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.537 -0.817 17919 94295 1 230 . 1 1 31 31 GLN H H 31 8.580 8.580 7.985 0.595 17919 94296 1 230 . 1 1 32 32 ASP N N 32 119.360 119.360 119.353 0.007 17919 94297 1 230 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.422 -0.068 17919 94298 1 230 . 1 1 32 32 ASP C C 32 177.250 177.250 178.086 -0.836 17919 94299 1 230 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.677 0.513 17919 94300 1 230 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.947 -0.367 17919 94301 1 230 . 1 1 32 32 ASP H H 32 8.010 8.010 7.923 0.087 17919 94302 1 230 . 1 1 33 33 LYS N N 33 115.130 115.130 117.831 -2.701 17919 94303 1 230 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.299 0.038 17919 94304 1 230 . 1 1 33 33 LYS C C 33 177.870 177.870 177.845 0.025 17919 94305 1 230 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.273 -0.223 17919 94306 1 230 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.652 0.518 17919 94307 1 230 . 1 1 33 33 LYS H H 33 7.430 7.430 7.909 -0.479 17919 94308 1 230 . 1 1 34 34 GLU N N 34 113.870 113.870 114.731 -0.861 17919 94309 1 230 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.520 0.105 17919 94310 1 230 . 1 1 34 34 GLU C C 34 177.840 177.840 176.391 1.449 17919 94311 1 230 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.611 -0.441 17919 94312 1 230 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.509 1.151 17919 94313 1 230 . 1 1 34 34 GLU H H 34 8.740 8.740 8.164 0.576 17919 94314 1 230 . 1 1 35 35 GLY N N 35 108.650 108.650 108.599 0.051 17919 94315 1 230 . 1 1 35 35 GLY C C 35 173.960 173.960 174.703 -0.743 17919 94316 1 230 . 1 1 35 35 GLY CA C 35 46.080 46.080 46.087 -0.006 17919 94317 1 230 . 1 1 35 35 GLY H H 35 8.530 8.530 7.904 0.626 17919 94318 1 230 . 1 1 36 36 ILE N N 36 119.880 119.880 122.227 -2.347 17919 94319 1 230 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.260 0.185 17919 94320 1 230 . 1 1 36 36 ILE C C 36 173.590 173.590 174.441 -0.851 17919 94321 1 230 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.524 -0.774 17919 94322 1 230 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.209 2.371 17919 94323 1 230 . 1 1 36 36 ILE H H 36 6.150 6.150 7.407 -1.257 17919 94324 1 230 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.480 0.154 17919 94325 1 230 . 1 1 37 37 PRO C C 37 176.940 176.940 175.758 1.182 17919 94326 1 230 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.435 0.225 17919 94327 1 230 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.342 0.508 17919 94328 1 230 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.213 -0.096 17919 94329 1 230 . 1 1 38 38 PRO C C 38 178.320 178.320 177.925 0.395 17919 94330 1 230 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.187 1.073 17919 94331 1 230 . 1 1 38 38 PRO CB C 38 32.890 32.890 32.120 0.770 17919 94332 1 230 . 1 1 39 39 ASP N N 39 113.380 113.380 117.673 -4.293 17919 94333 1 230 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.341 0.089 17919 94334 1 230 . 1 1 39 39 ASP C C 39 177.090 177.090 177.172 -0.082 17919 94335 1 230 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.674 -1.034 17919 94336 1 230 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.440 -0.900 17919 94337 1 230 . 1 1 39 39 ASP H H 39 8.550 8.550 8.352 0.198 17919 94338 1 230 . 1 1 40 40 GLN N N 40 116.780 116.780 116.752 0.028 17919 94339 1 230 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.356 0.108 17919 94340 1 230 . 1 1 40 40 GLN C C 40 175.380 175.380 175.691 -0.311 17919 94341 1 230 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.016 0.624 17919 94342 1 230 . 1 1 40 40 GLN CB C 40 30.140 30.140 28.296 1.844 17919 94343 1 230 . 1 1 40 40 GLN H H 40 7.820 7.820 8.266 -0.446 17919 94344 1 230 . 1 1 41 41 GLN N N 41 117.720 117.720 120.583 -2.863 17919 94345 1 230 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.559 -0.315 17919 94346 1 230 . 1 1 41 41 GLN C C 41 176.300 176.300 175.283 1.017 17919 94347 1 230 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.236 0.234 17919 94348 1 230 . 1 1 41 41 GLN CB C 41 31.650 31.650 28.925 2.725 17919 94349 1 230 . 1 1 41 41 GLN H H 41 7.480 7.480 7.308 0.172 17919 94350 1 230 . 1 1 42 42 ARG N N 42 122.680 122.680 124.179 -1.499 17919 94351 1 230 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.588 -0.088 17919 94352 1 230 . 1 1 42 42 ARG C C 42 174.050 174.050 174.652 -0.602 17919 94353 1 230 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.308 -0.258 17919 94354 1 230 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.611 -0.861 17919 94355 1 230 . 1 1 42 42 ARG H H 42 8.530 8.530 8.559 -0.029 17919 94356 1 230 . 1 1 43 43 LEU N N 43 124.040 124.040 124.517 -0.477 17919 94357 1 230 . 1 1 43 43 LEU C C 43 175.290 175.290 175.600 -0.310 17919 94358 1 230 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.652 -0.672 17919 94359 1 230 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.035 1.755 17919 94360 1 230 . 1 1 43 43 LEU H H 43 8.820 8.820 8.764 0.056 17919 94361 1 230 . 1 1 44 44 ILE N N 44 121.920 121.920 121.417 0.503 17919 94362 1 230 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.194 -0.202 17919 94363 1 230 . 1 1 44 44 ILE C C 44 176.060 176.060 174.329 1.731 17919 94364 1 230 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.259 -1.279 17919 94365 1 230 . 1 1 44 44 ILE CB C 44 41.420 41.420 42.028 -0.608 17919 94366 1 230 . 1 1 44 44 ILE H H 44 9.030 9.030 9.178 -0.148 17919 94367 1 230 . 1 1 45 45 PHE N N 45 125.390 125.390 125.496 -0.106 17919 94368 1 230 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.910 0.135 17919 94369 1 230 . 1 1 45 45 PHE C C 45 174.470 174.470 174.223 0.247 17919 94370 1 230 . 1 1 45 45 PHE CA C 45 57.020 57.020 57.374 -0.354 17919 94371 1 230 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.119 0.641 17919 94372 1 230 . 1 1 45 45 PHE H H 45 8.830 8.830 9.194 -0.364 17919 94373 1 230 . 1 1 46 46 ALA N N 46 132.200 132.200 129.903 2.297 17919 94374 1 230 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.660 0.030 17919 94375 1 230 . 1 1 46 46 ALA C C 46 177.290 177.290 177.824 -0.534 17919 94376 1 230 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.646 -0.106 17919 94377 1 230 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.465 0.105 17919 94378 1 230 . 1 1 46 46 ALA H H 46 8.810 8.810 8.852 -0.042 17919 94379 1 230 . 1 1 47 47 GLY N N 47 102.340 102.340 105.600 -3.260 17919 94380 1 230 . 1 1 47 47 GLY C C 47 173.810 173.810 174.307 -0.497 17919 94381 1 230 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.010 0.340 17919 94382 1 230 . 1 1 47 47 GLY H H 47 8.130 8.130 8.706 -0.576 17919 94383 1 230 . 1 1 48 48 LYS N N 48 121.570 121.570 121.486 0.084 17919 94384 1 230 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.494 0.128 17919 94385 1 230 . 1 1 48 48 LYS C C 48 174.700 174.700 175.564 -0.864 17919 94386 1 230 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.416 -0.866 17919 94387 1 230 . 1 1 48 48 LYS CB C 48 34.530 34.530 33.646 0.884 17919 94388 1 230 . 1 1 48 48 LYS H H 48 7.980 7.980 7.618 0.362 17919 94389 1 230 . 1 1 49 49 GLN N N 49 122.410 122.410 123.305 -0.895 17919 94390 1 230 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.549 0.011 17919 94391 1 230 . 1 1 49 49 GLN C C 49 175.670 175.670 175.645 0.025 17919 94392 1 230 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.945 -0.205 17919 94393 1 230 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.654 -0.653 17919 94394 1 230 . 1 1 49 49 GLN H H 49 8.600 8.600 8.573 0.027 17919 94395 1 230 . 1 1 50 50 LEU N N 50 125.520 125.520 127.669 -2.149 17919 94396 1 230 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.287 -0.197 17919 94397 1 230 . 1 1 50 50 LEU C C 50 176.660 176.660 175.875 0.785 17919 94398 1 230 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.635 0.605 17919 94399 1 230 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.492 -0.922 17919 94400 1 230 . 1 1 50 50 LEU H H 50 8.530 8.530 8.831 -0.301 17919 94401 1 230 . 1 1 51 51 GLU N N 51 122.940 122.940 124.457 -1.517 17919 94402 1 230 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.460 0.028 17919 94403 1 230 . 1 1 51 51 GLU C C 51 175.870 175.870 177.292 -1.422 17919 94404 1 230 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.562 0.398 17919 94405 1 230 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.522 0.048 17919 94406 1 230 . 1 1 51 51 GLU H H 51 8.400 8.400 8.372 0.028 17919 94407 1 230 . 1 1 52 52 ASP N N 52 120.030 120.030 127.919 -7.889 17919 94408 1 230 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.325 0.034 17919 94409 1 230 . 1 1 52 52 ASP C C 52 177.330 177.330 177.594 -0.264 17919 94410 1 230 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.781 -0.821 17919 94411 1 230 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.603 0.247 17919 94412 1 230 . 1 1 52 52 ASP H H 52 8.160 8.160 8.860 -0.700 17919 94413 1 230 . 1 1 53 53 GLY N N 53 106.660 106.660 105.454 1.206 17919 94414 1 230 . 1 1 53 53 GLY C C 53 174.870 174.870 174.079 0.791 17919 94415 1 230 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.024 0.146 17919 94416 1 230 . 1 1 53 53 GLY H H 53 9.390 9.390 8.622 0.768 17919 94417 1 230 . 1 1 54 54 ARG N N 54 119.050 119.050 120.031 -0.981 17919 94418 1 230 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.638 0.057 17919 94419 1 230 . 1 1 54 54 ARG C C 54 175.350 175.350 175.098 0.252 17919 94420 1 230 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.203 0.187 17919 94421 1 230 . 1 1 54 54 ARG CB C 54 32.650 32.650 34.128 -1.478 17919 94422 1 230 . 1 1 54 54 ARG H H 54 7.460 7.460 7.351 0.109 17919 94423 1 230 . 1 1 55 55 THR N N 55 108.400 108.400 113.006 -4.606 17919 94424 1 230 . 1 1 55 55 THR HA H 55 5.240 5.240 4.890 0.350 17919 94425 1 230 . 1 1 55 55 THR C C 55 176.560 176.560 176.031 0.529 17919 94426 1 230 . 1 1 55 55 THR CA C 55 59.690 59.690 60.961 -1.271 17919 94427 1 230 . 1 1 55 55 THR CB C 55 72.260 72.260 70.127 2.132 17919 94428 1 230 . 1 1 55 55 THR H H 55 8.730 8.730 9.114 -0.384 17919 94429 1 230 . 1 1 56 56 LEU N N 56 117.920 117.920 122.890 -4.970 17919 94430 1 230 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.971 0.089 17919 94431 1 230 . 1 1 56 56 LEU C C 56 180.810 180.810 178.828 1.982 17919 94432 1 230 . 1 1 56 56 LEU CA C 56 58.710 58.710 59.352 -0.642 17919 94433 1 230 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.375 -1.005 17919 94434 1 230 . 1 1 56 56 LEU H H 56 8.140 8.140 8.836 -0.696 17919 94435 1 230 . 1 1 57 57 SER N N 57 113.330 113.330 113.563 -0.233 17919 94436 1 230 . 1 1 57 57 SER HA H 57 4.370 4.370 4.126 0.244 17919 94437 1 230 . 1 1 57 57 SER C C 57 178.310 178.310 176.274 2.036 17919 94438 1 230 . 1 1 57 57 SER CA C 57 61.080 61.080 61.941 -0.861 17919 94439 1 230 . 1 1 57 57 SER CB C 57 62.530 62.530 62.677 -0.147 17919 94440 1 230 . 1 1 57 57 SER H H 57 8.470 8.470 8.086 0.384 17919 94441 1 230 . 1 1 58 58 ASP N N 58 124.190 124.190 120.818 3.372 17919 94442 1 230 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.344 -0.048 17919 94443 1 230 . 1 1 58 58 ASP C C 58 177.400 177.400 176.825 0.575 17919 94444 1 230 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.468 0.712 17919 94445 1 230 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.512 -0.412 17919 94446 1 230 . 1 1 58 58 ASP H H 58 7.930 7.930 7.591 0.339 17919 94447 1 230 . 1 1 59 59 TYR N N 59 115.510 115.510 114.620 0.890 17919 94448 1 230 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.623 0.047 17919 94449 1 230 . 1 1 59 59 TYR C C 59 174.700 174.700 175.410 -0.710 17919 94450 1 230 . 1 1 59 59 TYR CA C 59 58.250 58.250 56.822 1.428 17919 94451 1 230 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.305 1.765 17919 94452 1 230 . 1 1 59 59 TYR H H 59 7.250 7.250 7.221 0.029 17919 94453 1 230 . 1 1 60 60 ASN N N 60 115.900 115.900 117.140 -1.240 17919 94454 1 230 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.374 -0.019 17919 94455 1 230 . 1 1 60 60 ASN C C 60 174.340 174.340 174.542 -0.202 17919 94456 1 230 . 1 1 60 60 ASN CA C 60 54.120 54.120 53.946 0.174 17919 94457 1 230 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.161 0.249 17919 94458 1 230 . 1 1 60 60 ASN H H 60 8.150 8.150 7.543 0.607 17919 94459 1 230 . 1 1 61 61 ILE N N 61 118.600 118.600 120.932 -2.332 17919 94460 1 230 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.939 -0.546 17919 94461 1 230 . 1 1 61 61 ILE C C 61 174.610 174.610 174.796 -0.186 17919 94462 1 230 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.790 0.630 17919 94463 1 230 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.399 -0.659 17919 94464 1 230 . 1 1 61 61 ILE H H 61 7.250 7.250 8.216 -0.966 17919 94465 1 230 . 1 1 62 62 GLN N N 62 124.740 124.740 125.444 -0.704 17919 94466 1 230 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.695 -0.189 17919 94467 1 230 . 1 1 62 62 GLN C C 62 175.970 175.970 176.087 -0.117 17919 94468 1 230 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.811 -0.151 17919 94469 1 230 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.517 0.133 17919 94470 1 230 . 1 1 62 62 GLN H H 62 7.610 7.610 7.873 -0.263 17919 94471 1 230 . 1 1 63 63 LYS N N 63 120.300 120.300 120.435 -0.135 17919 94472 1 230 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.975 0.026 17919 94473 1 230 . 1 1 63 63 LYS C C 63 175.810 175.810 177.342 -1.532 17919 94474 1 230 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.944 -0.154 17919 94475 1 230 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.990 0.660 17919 94476 1 230 . 1 1 63 63 LYS H H 63 8.490 8.490 8.763 -0.273 17919 94477 1 230 . 1 1 64 64 GLU N N 64 113.950 113.950 120.257 -6.307 17919 94478 1 230 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.625 -0.160 17919 94479 1 230 . 1 1 64 64 GLU C C 64 175.250 175.250 175.410 -0.160 17919 94480 1 230 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.568 0.322 17919 94481 1 230 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.892 -2.992 17919 94482 1 230 . 1 1 64 64 GLU H H 64 9.280 9.280 9.092 0.188 17919 94483 1 230 . 1 1 65 65 SER N N 65 114.730 114.730 114.526 0.204 17919 94484 1 230 . 1 1 65 65 SER HA H 65 4.640 4.640 4.753 -0.113 17919 94485 1 230 . 1 1 65 65 SER C C 65 172.160 172.160 173.873 -1.713 17919 94486 1 230 . 1 1 65 65 SER CA C 65 60.890 60.890 59.306 1.584 17919 94487 1 230 . 1 1 65 65 SER CB C 65 64.910 64.910 65.025 -0.115 17919 94488 1 230 . 1 1 65 65 SER H H 65 7.670 7.670 7.310 0.360 17919 94489 1 230 . 1 1 66 66 THR N N 66 117.110 117.110 122.000 -4.890 17919 94490 1 230 . 1 1 66 66 THR HA H 66 5.270 5.270 5.396 -0.126 17919 94491 1 230 . 1 1 66 66 THR C C 66 173.950 173.950 174.612 -0.662 17919 94492 1 230 . 1 1 66 66 THR CA C 66 62.340 62.340 61.724 0.616 17919 94493 1 230 . 1 1 66 66 THR CB C 66 70.080 70.080 69.804 0.276 17919 94494 1 230 . 1 1 66 66 THR H H 66 8.730 8.730 8.593 0.137 17919 94495 1 230 . 1 1 67 67 LEU N N 67 127.110 127.110 126.535 0.575 17919 94496 1 230 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.809 0.251 17919 94497 1 230 . 1 1 67 67 LEU C C 67 175.770 175.770 175.700 0.070 17919 94498 1 230 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.968 -0.068 17919 94499 1 230 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.991 0.269 17919 94500 1 230 . 1 1 67 67 LEU H H 67 9.410 9.410 8.948 0.462 17919 94501 1 230 . 1 1 68 68 HIS N N 68 118.380 118.380 120.243 -1.863 17919 94502 1 230 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.484 -0.244 17919 94503 1 230 . 1 1 68 68 HIS C C 68 173.150 173.150 173.274 -0.124 17919 94504 1 230 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.367 0.633 17919 94505 1 230 . 1 1 68 68 HIS CB C 68 30.530 30.530 33.199 -2.668 17919 94506 1 230 . 1 1 68 68 HIS H H 68 9.230 9.230 9.135 0.095 17919 94507 1 230 . 1 1 69 69 LEU N N 69 124.460 124.460 128.433 -3.973 17919 94508 1 230 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.980 0.210 17919 94509 1 230 . 1 1 69 69 LEU C C 69 175.270 175.270 173.759 1.511 17919 94510 1 230 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.183 0.707 17919 94511 1 230 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.752 -0.372 17919 94512 1 230 . 1 1 69 69 LEU H H 69 8.340 8.340 8.767 -0.427 17919 94513 1 230 . 1 1 70 70 VAL N N 70 126.940 126.940 127.195 -0.255 17919 94514 1 230 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.405 -0.055 17919 94515 1 230 . 1 1 70 70 VAL C C 70 174.000 174.000 174.101 -0.101 17919 94516 1 230 . 1 1 70 70 VAL CA C 70 60.800 60.800 61.622 -0.822 17919 94517 1 230 . 1 1 70 70 VAL CB C 70 34.910 34.910 33.791 1.119 17919 94518 1 230 . 1 1 70 70 VAL H H 70 9.200 9.200 8.714 0.486 17919 94519 1 230 . 1 1 71 71 LEU N N 71 123.130 123.130 125.683 -2.553 17919 94520 1 230 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.313 -0.253 17919 94521 1 230 . 1 1 71 71 LEU C C 71 177.830 177.830 175.581 2.249 17919 94522 1 230 . 1 1 71 71 LEU CA C 71 53.940 53.940 52.938 1.002 17919 94523 1 230 . 1 1 71 71 LEU CB C 71 42.850 42.850 45.995 -3.145 17919 94524 1 230 . 1 1 71 71 LEU H H 71 8.120 8.120 8.246 -0.126 17919 94525 1 230 . 1 1 72 72 ARG N N 72 123.490 123.490 120.249 3.241 17919 94526 1 230 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.522 -0.221 17919 94527 1 230 . 1 1 72 72 ARG C C 72 175.350 175.350 174.352 0.998 17919 94528 1 230 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.316 0.294 17919 94529 1 230 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.830 0.520 17919 94530 1 230 . 1 1 72 72 ARG H H 72 8.580 8.580 8.051 0.529 17919 94531 1 231 . 1 1 2 2 GLN N N 2 123.220 123.220 124.728 -1.508 17919 94532 1 231 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.386 -0.137 17919 94533 1 231 . 1 1 2 2 GLN C C 2 175.920 175.920 175.103 0.817 17919 94534 1 231 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.965 0.115 17919 94535 1 231 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.419 0.341 17919 94536 1 231 . 1 1 2 2 GLN H H 2 8.900 8.900 8.440 0.460 17919 94537 1 231 . 1 1 3 3 ILE N N 3 115.340 115.340 118.919 -3.579 17919 94538 1 231 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.947 -0.734 17919 94539 1 231 . 1 1 3 3 ILE C C 3 172.450 172.450 173.869 -1.419 17919 94540 1 231 . 1 1 3 3 ILE CA C 3 59.570 59.570 58.768 0.802 17919 94541 1 231 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.908 0.302 17919 94542 1 231 . 1 1 3 3 ILE H H 3 8.320 8.320 8.691 -0.371 17919 94543 1 231 . 1 1 4 4 PHE N N 4 118.110 118.110 119.510 -1.400 17919 94544 1 231 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.440 0.190 17919 94545 1 231 . 1 1 4 4 PHE C C 4 175.320 175.320 175.195 0.125 17919 94546 1 231 . 1 1 4 4 PHE CA C 4 55.210 55.210 56.103 -0.893 17919 94547 1 231 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.233 -0.753 17919 94548 1 231 . 1 1 4 4 PHE H H 4 8.610 8.610 8.865 -0.255 17919 94549 1 231 . 1 1 5 5 VAL N N 5 121.000 121.000 122.803 -1.803 17919 94550 1 231 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.635 0.090 17919 94551 1 231 . 1 1 5 5 VAL C C 5 174.870 174.870 174.400 0.470 17919 94552 1 231 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.444 -0.824 17919 94553 1 231 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.499 0.731 17919 94554 1 231 . 1 1 5 5 VAL H H 5 9.300 9.300 9.330 -0.030 17919 94555 1 231 . 1 1 6 6 LYS N N 6 127.520 127.520 129.726 -2.206 17919 94556 1 231 . 1 1 6 6 LYS HA H 6 5.367 5.367 4.782 0.585 17919 94557 1 231 . 1 1 6 6 LYS C C 6 177.140 177.140 175.863 1.277 17919 94558 1 231 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.708 -0.188 17919 94559 1 231 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.072 0.978 17919 94560 1 231 . 1 1 6 6 LYS H H 6 8.820 8.820 9.232 -0.412 17919 94561 1 231 . 1 1 7 7 THR N N 7 115.400 115.400 122.763 -7.363 17919 94562 1 231 . 1 1 7 7 THR HA H 7 4.970 4.970 4.900 0.070 17919 94563 1 231 . 1 1 7 7 THR C C 7 176.910 176.910 174.712 2.198 17919 94564 1 231 . 1 1 7 7 THR CA C 7 60.470 60.470 62.052 -1.582 17919 94565 1 231 . 1 1 7 7 THR CB C 7 70.630 70.630 70.125 0.505 17919 94566 1 231 . 1 1 7 7 THR H H 7 8.730 8.730 9.251 -0.521 17919 94567 1 231 . 1 1 8 8 LEU N N 8 121.330 121.330 124.851 -3.521 17919 94568 1 231 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.525 -0.215 17919 94569 1 231 . 1 1 8 8 LEU C C 8 178.800 178.800 176.615 2.185 17919 94570 1 231 . 1 1 8 8 LEU CA C 8 57.580 57.580 55.602 1.978 17919 94571 1 231 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.389 -0.419 17919 94572 1 231 . 1 1 8 8 LEU H H 8 9.100 9.100 8.773 0.327 17919 94573 1 231 . 1 1 9 9 THR N N 9 105.590 105.590 109.676 -4.086 17919 94574 1 231 . 1 1 9 9 THR HA H 9 4.428 4.428 4.411 0.017 17919 94575 1 231 . 1 1 9 9 THR C C 9 175.520 175.520 175.715 -0.195 17919 94576 1 231 . 1 1 9 9 THR CA C 9 61.400 61.400 61.383 0.017 17919 94577 1 231 . 1 1 9 9 THR CB C 9 69.140 69.140 68.534 0.606 17919 94578 1 231 . 1 1 9 9 THR H H 9 7.630 7.630 7.735 -0.105 17919 94579 1 231 . 1 1 10 10 GLY N N 10 108.890 108.890 111.278 -2.388 17919 94580 1 231 . 1 1 10 10 GLY C C 10 174.070 174.070 173.683 0.387 17919 94581 1 231 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.165 0.295 17919 94582 1 231 . 1 1 10 10 GLY H H 10 7.810 7.810 7.875 -0.065 17919 94583 1 231 . 1 1 11 11 LYS N N 11 121.600 121.600 120.960 0.640 17919 94584 1 231 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.564 -0.203 17919 94585 1 231 . 1 1 11 11 LYS C C 11 175.940 175.940 175.500 0.440 17919 94586 1 231 . 1 1 11 11 LYS CA C 11 56.280 56.280 55.497 0.783 17919 94587 1 231 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.971 -0.770 17919 94588 1 231 . 1 1 11 11 LYS H H 11 7.280 7.280 7.774 -0.494 17919 94589 1 231 . 1 1 12 12 THR N N 12 120.440 120.440 117.433 3.007 17919 94590 1 231 . 1 1 12 12 THR HA H 12 5.046 5.046 5.464 -0.418 17919 94591 1 231 . 1 1 12 12 THR C C 12 174.320 174.320 173.626 0.694 17919 94592 1 231 . 1 1 12 12 THR CA C 12 62.390 62.390 61.056 1.334 17919 94593 1 231 . 1 1 12 12 THR CB C 12 69.910 69.910 70.995 -1.085 17919 94594 1 231 . 1 1 12 12 THR H H 12 8.650 8.650 8.350 0.300 17919 94595 1 231 . 1 1 13 13 ILE N N 13 127.110 127.110 124.057 3.053 17919 94596 1 231 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.670 -0.126 17919 94597 1 231 . 1 1 13 13 ILE C C 13 175.220 175.220 174.942 0.278 17919 94598 1 231 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.514 0.466 17919 94599 1 231 . 1 1 13 13 ILE CB C 13 40.950 40.950 42.332 -1.382 17919 94600 1 231 . 1 1 13 13 ILE H H 13 9.450 9.450 9.199 0.251 17919 94601 1 231 . 1 1 14 14 THR N N 14 121.520 121.520 117.393 4.127 17919 94602 1 231 . 1 1 14 14 THR HA H 14 4.964 4.964 5.016 -0.052 17919 94603 1 231 . 1 1 14 14 THR C C 14 173.790 173.790 173.918 -0.128 17919 94604 1 231 . 1 1 14 14 THR CA C 14 61.940 61.940 60.130 1.810 17919 94605 1 231 . 1 1 14 14 THR CB C 14 69.650 69.650 70.117 -0.467 17919 94606 1 231 . 1 1 14 14 THR H H 14 8.710 8.710 8.226 0.484 17919 94607 1 231 . 1 1 15 15 LEU N N 15 124.800 124.800 126.656 -1.856 17919 94608 1 231 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.659 0.121 17919 94609 1 231 . 1 1 15 15 LEU C C 15 174.670 174.670 175.015 -0.345 17919 94610 1 231 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.927 -1.097 17919 94611 1 231 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.717 1.353 17919 94612 1 231 . 1 1 15 15 LEU H H 15 8.710 8.710 8.933 -0.223 17919 94613 1 231 . 1 1 16 16 GLU N N 16 122.160 122.160 122.777 -0.617 17919 94614 1 231 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.102 -0.185 17919 94615 1 231 . 1 1 16 16 GLU C C 16 175.860 175.860 175.309 0.551 17919 94616 1 231 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.229 -0.409 17919 94617 1 231 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.875 -1.425 17919 94618 1 231 . 1 1 16 16 GLU H H 16 8.140 8.140 8.516 -0.376 17919 94619 1 231 . 1 1 17 17 VAL N N 17 117.210 117.210 120.440 -3.230 17919 94620 1 231 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.629 0.085 17919 94621 1 231 . 1 1 17 17 VAL C C 17 174.160 174.160 174.222 -0.062 17919 94622 1 231 . 1 1 17 17 VAL CA C 17 58.430 58.430 60.124 -1.694 17919 94623 1 231 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.630 0.770 17919 94624 1 231 . 1 1 17 17 VAL H H 17 8.900 8.900 8.591 0.309 17919 94625 1 231 . 1 1 18 18 GLU N N 18 118.990 118.990 120.018 -1.028 17919 94626 1 231 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.857 0.222 17919 94627 1 231 . 1 1 18 18 GLU C C 18 176.160 176.160 175.440 0.720 17919 94628 1 231 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.648 0.072 17919 94629 1 231 . 1 1 18 18 GLU CB C 18 30.310 30.310 31.240 -0.930 17919 94630 1 231 . 1 1 18 18 GLU H H 18 8.640 8.640 9.259 -0.619 17919 94631 1 231 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.306 -0.165 17919 94632 1 231 . 1 1 19 19 PRO C C 19 175.310 175.310 177.562 -2.252 17919 94633 1 231 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.199 0.271 17919 94634 1 231 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.837 0.113 17919 94635 1 231 . 1 1 20 20 SER N N 20 103.400 103.400 112.942 -9.542 17919 94636 1 231 . 1 1 20 20 SER HA H 20 4.370 4.370 4.313 0.057 17919 94637 1 231 . 1 1 20 20 SER C C 20 174.660 174.660 174.933 -0.273 17919 94638 1 231 . 1 1 20 20 SER CA C 20 57.400 57.400 58.853 -1.453 17919 94639 1 231 . 1 1 20 20 SER CB C 20 63.370 63.370 62.956 0.414 17919 94640 1 231 . 1 1 20 20 SER H H 20 7.040 7.040 8.264 -1.224 17919 94641 1 231 . 1 1 21 21 ASP N N 21 123.480 123.480 124.992 -1.512 17919 94642 1 231 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.734 -0.039 17919 94643 1 231 . 1 1 21 21 ASP C C 21 176.360 176.360 175.922 0.438 17919 94644 1 231 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.308 0.392 17919 94645 1 231 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.604 -0.804 17919 94646 1 231 . 1 1 21 21 ASP H H 21 8.030 8.030 7.956 0.074 17919 94647 1 231 . 1 1 22 22 THR N N 22 108.800 108.800 111.455 -2.655 17919 94648 1 231 . 1 1 22 22 THR HA H 22 4.920 4.920 4.955 -0.035 17919 94649 1 231 . 1 1 22 22 THR C C 22 176.750 176.750 176.280 0.470 17919 94650 1 231 . 1 1 22 22 THR CA C 22 59.690 59.690 60.876 -1.186 17919 94651 1 231 . 1 1 22 22 THR CB C 22 71.200 71.200 70.675 0.525 17919 94652 1 231 . 1 1 22 22 THR H H 22 7.900 7.900 8.233 -0.333 17919 94653 1 231 . 1 1 23 23 ILE N N 23 121.190 121.190 121.455 -0.265 17919 94654 1 231 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.803 -0.146 17919 94655 1 231 . 1 1 23 23 ILE C C 23 179.040 179.040 177.569 1.471 17919 94656 1 231 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.665 -0.405 17919 94657 1 231 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.200 -1.850 17919 94658 1 231 . 1 1 23 23 ILE H H 23 8.560 8.560 8.718 -0.158 17919 94659 1 231 . 1 1 24 24 GLU N N 24 120.830 120.830 121.782 -0.952 17919 94660 1 231 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.849 0.068 17919 94661 1 231 . 1 1 24 24 GLU C C 24 178.640 178.640 178.450 0.190 17919 94662 1 231 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.336 -0.116 17919 94663 1 231 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.426 -1.146 17919 94664 1 231 . 1 1 24 24 GLU H H 24 9.760 9.760 8.248 1.512 17919 94665 1 231 . 1 1 25 25 ASN N N 25 120.570 120.570 117.902 2.668 17919 94666 1 231 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.442 0.083 17919 94667 1 231 . 1 1 25 25 ASN C C 25 178.380 178.380 178.131 0.249 17919 94668 1 231 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.084 -0.024 17919 94669 1 231 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.470 -0.020 17919 94670 1 231 . 1 1 25 25 ASN H H 25 7.920 7.920 7.708 0.212 17919 94671 1 231 . 1 1 26 26 VAL N N 26 121.710 121.710 120.876 0.834 17919 94672 1 231 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.562 -0.165 17919 94673 1 231 . 1 1 26 26 VAL C C 26 177.950 177.950 177.438 0.512 17919 94674 1 231 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.999 0.661 17919 94675 1 231 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.785 -0.945 17919 94676 1 231 . 1 1 26 26 VAL H H 26 8.070 8.070 7.880 0.190 17919 94677 1 231 . 1 1 27 27 LYS N N 27 118.860 118.860 120.486 -1.626 17919 94678 1 231 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.020 0.560 17919 94679 1 231 . 1 1 27 27 LYS C C 27 180.550 180.550 179.160 1.390 17919 94680 1 231 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.904 -0.654 17919 94681 1 231 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.123 1.607 17919 94682 1 231 . 1 1 27 27 LYS H H 27 8.560 8.560 8.195 0.365 17919 94683 1 231 . 1 1 28 28 ALA N N 28 123.440 123.440 120.459 2.981 17919 94684 1 231 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.059 0.101 17919 94685 1 231 . 1 1 28 28 ALA C C 28 180.300 180.300 179.422 0.878 17919 94686 1 231 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.202 0.168 17919 94687 1 231 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.346 -0.636 17919 94688 1 231 . 1 1 28 28 ALA H H 28 8.060 8.060 8.457 -0.397 17919 94689 1 231 . 1 1 29 29 LYS N N 29 119.940 119.940 118.637 1.303 17919 94690 1 231 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.187 0.020 17919 94691 1 231 . 1 1 29 29 LYS C C 29 180.320 180.320 179.127 1.193 17919 94692 1 231 . 1 1 29 29 LYS CA C 29 59.650 59.650 57.743 1.907 17919 94693 1 231 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.207 1.083 17919 94694 1 231 . 1 1 29 29 LYS H H 29 7.850 7.850 7.623 0.227 17919 94695 1 231 . 1 1 30 30 ILE N N 30 121.080 121.080 121.872 -0.792 17919 94696 1 231 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.591 -0.084 17919 94697 1 231 . 1 1 30 30 ILE C C 30 178.310 178.310 177.488 0.822 17919 94698 1 231 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.564 0.586 17919 94699 1 231 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.855 -1.056 17919 94700 1 231 . 1 1 30 30 ILE H H 30 8.280 8.280 8.510 -0.230 17919 94701 1 231 . 1 1 31 31 GLN N N 31 123.490 123.490 120.700 2.790 17919 94702 1 231 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.903 -0.074 17919 94703 1 231 . 1 1 31 31 GLN C C 31 178.890 178.890 178.242 0.648 17919 94704 1 231 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.243 0.757 17919 94705 1 231 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.570 -0.850 17919 94706 1 231 . 1 1 31 31 GLN H H 31 8.580 8.580 8.437 0.143 17919 94707 1 231 . 1 1 32 32 ASP N N 32 119.360 119.360 119.933 -0.573 17919 94708 1 231 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.389 -0.035 17919 94709 1 231 . 1 1 32 32 ASP C C 32 177.250 177.250 177.929 -0.679 17919 94710 1 231 . 1 1 32 32 ASP CA C 32 57.190 57.190 57.105 0.085 17919 94711 1 231 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.734 -0.154 17919 94712 1 231 . 1 1 32 32 ASP H H 32 8.010 8.010 8.347 -0.337 17919 94713 1 231 . 1 1 33 33 LYS N N 33 115.130 115.130 117.981 -2.851 17919 94714 1 231 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.238 0.099 17919 94715 1 231 . 1 1 33 33 LYS C C 33 177.870 177.870 178.017 -0.147 17919 94716 1 231 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.103 -0.053 17919 94717 1 231 . 1 1 33 33 LYS CB C 33 34.170 34.170 32.896 1.274 17919 94718 1 231 . 1 1 33 33 LYS H H 33 7.430 7.430 7.494 -0.064 17919 94719 1 231 . 1 1 34 34 GLU N N 34 113.870 113.870 115.030 -1.160 17919 94720 1 231 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.452 0.173 17919 94721 1 231 . 1 1 34 34 GLU C C 34 177.840 177.840 177.440 0.400 17919 94722 1 231 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.327 -1.157 17919 94723 1 231 . 1 1 34 34 GLU CB C 34 32.660 32.660 32.014 0.646 17919 94724 1 231 . 1 1 34 34 GLU H H 34 8.740 8.740 8.054 0.686 17919 94725 1 231 . 1 1 35 35 GLY N N 35 108.650 108.650 109.341 -0.691 17919 94726 1 231 . 1 1 35 35 GLY C C 35 173.960 173.960 174.090 -0.130 17919 94727 1 231 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.940 0.140 17919 94728 1 231 . 1 1 35 35 GLY H H 35 8.530 8.530 8.380 0.150 17919 94729 1 231 . 1 1 36 36 ILE N N 36 119.880 119.880 121.741 -1.861 17919 94730 1 231 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.362 0.083 17919 94731 1 231 . 1 1 36 36 ILE C C 36 173.590 173.590 174.174 -0.584 17919 94732 1 231 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.561 0.189 17919 94733 1 231 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.878 1.702 17919 94734 1 231 . 1 1 36 36 ILE H H 36 6.150 6.150 7.430 -1.280 17919 94735 1 231 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.621 0.013 17919 94736 1 231 . 1 1 37 37 PRO C C 37 176.940 176.940 176.114 0.826 17919 94737 1 231 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.553 0.107 17919 94738 1 231 . 1 1 37 37 PRO CB C 37 31.850 31.850 30.861 0.989 17919 94739 1 231 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.216 -0.099 17919 94740 1 231 . 1 1 38 38 PRO C C 38 178.320 178.320 178.734 -0.414 17919 94741 1 231 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.616 0.644 17919 94742 1 231 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.812 1.078 17919 94743 1 231 . 1 1 39 39 ASP N N 39 113.380 113.380 117.610 -4.230 17919 94744 1 231 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.350 0.080 17919 94745 1 231 . 1 1 39 39 ASP C C 39 177.090 177.090 177.734 -0.644 17919 94746 1 231 . 1 1 39 39 ASP CA C 39 55.640 55.640 57.039 -1.399 17919 94747 1 231 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.589 -1.049 17919 94748 1 231 . 1 1 39 39 ASP H H 39 8.550 8.550 8.627 -0.077 17919 94749 1 231 . 1 1 40 40 GLN N N 40 116.780 116.780 115.895 0.885 17919 94750 1 231 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.144 0.320 17919 94751 1 231 . 1 1 40 40 GLN C C 40 175.380 175.380 175.976 -0.596 17919 94752 1 231 . 1 1 40 40 GLN CA C 40 55.640 55.640 57.060 -1.420 17919 94753 1 231 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.532 0.608 17919 94754 1 231 . 1 1 40 40 GLN H H 40 7.820 7.820 7.793 0.027 17919 94755 1 231 . 1 1 41 41 GLN N N 41 117.720 117.720 117.718 0.002 17919 94756 1 231 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.760 -0.516 17919 94757 1 231 . 1 1 41 41 GLN C C 41 176.300 176.300 175.553 0.747 17919 94758 1 231 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.309 1.161 17919 94759 1 231 . 1 1 41 41 GLN CB C 41 31.650 31.650 30.075 1.575 17919 94760 1 231 . 1 1 41 41 GLN H H 41 7.480 7.480 7.274 0.206 17919 94761 1 231 . 1 1 42 42 ARG N N 42 122.680 122.680 125.608 -2.928 17919 94762 1 231 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.677 -0.177 17919 94763 1 231 . 1 1 42 42 ARG C C 42 174.050 174.050 174.191 -0.141 17919 94764 1 231 . 1 1 42 42 ARG CA C 42 55.050 55.050 53.891 1.159 17919 94765 1 231 . 1 1 42 42 ARG CB C 42 31.750 31.750 31.981 -0.231 17919 94766 1 231 . 1 1 42 42 ARG H H 42 8.530 8.530 9.014 -0.484 17919 94767 1 231 . 1 1 43 43 LEU N N 43 124.040 124.040 127.339 -3.299 17919 94768 1 231 . 1 1 43 43 LEU C C 43 175.290 175.290 176.074 -0.784 17919 94769 1 231 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.770 -1.790 17919 94770 1 231 . 1 1 43 43 LEU CB C 43 45.790 45.790 42.927 2.863 17919 94771 1 231 . 1 1 43 43 LEU H H 43 8.820 8.820 8.776 0.044 17919 94772 1 231 . 1 1 44 44 ILE N N 44 121.920 121.920 122.562 -0.642 17919 94773 1 231 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.004 -0.012 17919 94774 1 231 . 1 1 44 44 ILE C C 44 176.060 176.060 174.278 1.782 17919 94775 1 231 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.419 -1.439 17919 94776 1 231 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.879 -0.459 17919 94777 1 231 . 1 1 44 44 ILE H H 44 9.030 9.030 9.193 -0.163 17919 94778 1 231 . 1 1 45 45 PHE N N 45 125.390 125.390 125.071 0.319 17919 94779 1 231 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.072 -0.027 17919 94780 1 231 . 1 1 45 45 PHE C C 45 174.470 174.470 174.367 0.103 17919 94781 1 231 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.932 0.088 17919 94782 1 231 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.162 0.598 17919 94783 1 231 . 1 1 45 45 PHE H H 45 8.830 8.830 8.941 -0.111 17919 94784 1 231 . 1 1 46 46 ALA N N 46 132.200 132.200 129.849 2.351 17919 94785 1 231 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.676 0.014 17919 94786 1 231 . 1 1 46 46 ALA C C 46 177.290 177.290 177.628 -0.338 17919 94787 1 231 . 1 1 46 46 ALA CA C 46 52.540 52.540 53.006 -0.466 17919 94788 1 231 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.649 -0.079 17919 94789 1 231 . 1 1 46 46 ALA H H 46 8.810 8.810 8.932 -0.122 17919 94790 1 231 . 1 1 47 47 GLY N N 47 102.340 102.340 103.348 -1.008 17919 94791 1 231 . 1 1 47 47 GLY C C 47 173.810 173.810 174.847 -1.037 17919 94792 1 231 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.249 0.100 17919 94793 1 231 . 1 1 47 47 GLY H H 47 8.130 8.130 8.514 -0.384 17919 94794 1 231 . 1 1 48 48 LYS N N 48 121.570 121.570 121.877 -0.307 17919 94795 1 231 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.478 0.144 17919 94796 1 231 . 1 1 48 48 LYS C C 48 174.700 174.700 175.990 -1.290 17919 94797 1 231 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.528 -0.978 17919 94798 1 231 . 1 1 48 48 LYS CB C 48 34.530 34.530 33.539 0.991 17919 94799 1 231 . 1 1 48 48 LYS H H 48 7.980 7.980 7.878 0.102 17919 94800 1 231 . 1 1 49 49 GLN N N 49 122.410 122.410 122.071 0.339 17919 94801 1 231 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.473 0.087 17919 94802 1 231 . 1 1 49 49 GLN C C 49 175.670 175.670 175.976 -0.306 17919 94803 1 231 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.212 -0.472 17919 94804 1 231 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.337 -0.337 17919 94805 1 231 . 1 1 49 49 GLN H H 49 8.600 8.600 8.550 0.050 17919 94806 1 231 . 1 1 50 50 LEU N N 50 125.520 125.520 126.350 -0.830 17919 94807 1 231 . 1 1 50 50 LEU HA H 50 4.090 4.090 3.996 0.094 17919 94808 1 231 . 1 1 50 50 LEU C C 50 176.660 176.660 175.778 0.882 17919 94809 1 231 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.940 0.300 17919 94810 1 231 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.221 -0.651 17919 94811 1 231 . 1 1 50 50 LEU H H 50 8.530 8.530 8.591 -0.062 17919 94812 1 231 . 1 1 51 51 GLU N N 51 122.940 122.940 123.742 -0.802 17919 94813 1 231 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.567 -0.079 17919 94814 1 231 . 1 1 51 51 GLU C C 51 175.870 175.870 176.622 -0.752 17919 94815 1 231 . 1 1 51 51 GLU CA C 51 55.960 55.960 54.839 1.121 17919 94816 1 231 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.724 -1.153 17919 94817 1 231 . 1 1 51 51 GLU H H 51 8.400 8.400 8.040 0.360 17919 94818 1 231 . 1 1 52 52 ASP N N 52 120.030 120.030 126.694 -6.664 17919 94819 1 231 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.406 -0.047 17919 94820 1 231 . 1 1 52 52 ASP C C 52 177.330 177.330 177.548 -0.218 17919 94821 1 231 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.564 -0.604 17919 94822 1 231 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.708 0.142 17919 94823 1 231 . 1 1 52 52 ASP H H 52 8.160 8.160 8.785 -0.625 17919 94824 1 231 . 1 1 53 53 GLY N N 53 106.660 106.660 104.803 1.857 17919 94825 1 231 . 1 1 53 53 GLY C C 53 174.870 174.870 173.984 0.886 17919 94826 1 231 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.243 -0.073 17919 94827 1 231 . 1 1 53 53 GLY H H 53 9.390 9.390 8.540 0.850 17919 94828 1 231 . 1 1 54 54 ARG N N 54 119.050 119.050 118.400 0.650 17919 94829 1 231 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.598 0.097 17919 94830 1 231 . 1 1 54 54 ARG C C 54 175.350 175.350 175.538 -0.188 17919 94831 1 231 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.335 0.055 17919 94832 1 231 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.602 -0.952 17919 94833 1 231 . 1 1 54 54 ARG H H 54 7.460 7.460 7.600 -0.140 17919 94834 1 231 . 1 1 55 55 THR N N 55 108.400 108.400 112.191 -3.791 17919 94835 1 231 . 1 1 55 55 THR HA H 55 5.240 5.240 5.099 0.141 17919 94836 1 231 . 1 1 55 55 THR C C 55 176.560 176.560 176.256 0.304 17919 94837 1 231 . 1 1 55 55 THR CA C 55 59.690 59.690 60.581 -0.891 17919 94838 1 231 . 1 1 55 55 THR CB C 55 72.260 72.260 70.424 1.836 17919 94839 1 231 . 1 1 55 55 THR H H 55 8.730 8.730 8.852 -0.122 17919 94840 1 231 . 1 1 56 56 LEU N N 56 117.920 117.920 122.353 -4.433 17919 94841 1 231 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.967 0.093 17919 94842 1 231 . 1 1 56 56 LEU C C 56 180.810 180.810 178.915 1.895 17919 94843 1 231 . 1 1 56 56 LEU CA C 56 58.710 58.710 59.024 -0.314 17919 94844 1 231 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.535 -1.165 17919 94845 1 231 . 1 1 56 56 LEU H H 56 8.140 8.140 8.591 -0.451 17919 94846 1 231 . 1 1 57 57 SER N N 57 113.330 113.330 113.948 -0.618 17919 94847 1 231 . 1 1 57 57 SER HA H 57 4.370 4.370 4.195 0.175 17919 94848 1 231 . 1 1 57 57 SER C C 57 178.310 178.310 175.602 2.708 17919 94849 1 231 . 1 1 57 57 SER CA C 57 61.080 61.080 61.817 -0.737 17919 94850 1 231 . 1 1 57 57 SER CB C 57 62.530 62.530 62.833 -0.303 17919 94851 1 231 . 1 1 57 57 SER H H 57 8.470 8.470 8.319 0.151 17919 94852 1 231 . 1 1 58 58 ASP N N 58 124.190 124.190 119.738 4.452 17919 94853 1 231 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.424 -0.128 17919 94854 1 231 . 1 1 58 58 ASP C C 58 177.400 177.400 177.331 0.069 17919 94855 1 231 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.359 0.821 17919 94856 1 231 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.968 -0.868 17919 94857 1 231 . 1 1 58 58 ASP H H 58 7.930 7.930 7.524 0.406 17919 94858 1 231 . 1 1 59 59 TYR N N 59 115.510 115.510 116.363 -0.853 17919 94859 1 231 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.608 0.062 17919 94860 1 231 . 1 1 59 59 TYR C C 59 174.700 174.700 175.407 -0.707 17919 94861 1 231 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.638 0.612 17919 94862 1 231 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.476 1.594 17919 94863 1 231 . 1 1 59 59 TYR H H 59 7.250 7.250 7.464 -0.214 17919 94864 1 231 . 1 1 60 60 ASN N N 60 115.900 115.900 117.927 -2.027 17919 94865 1 231 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.376 -0.021 17919 94866 1 231 . 1 1 60 60 ASN C C 60 174.340 174.340 174.811 -0.471 17919 94867 1 231 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.009 0.111 17919 94868 1 231 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.226 0.184 17919 94869 1 231 . 1 1 60 60 ASN H H 60 8.150 8.150 7.852 0.298 17919 94870 1 231 . 1 1 61 61 ILE N N 61 118.600 118.600 120.850 -2.250 17919 94871 1 231 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.546 -0.153 17919 94872 1 231 . 1 1 61 61 ILE C C 61 174.610 174.610 174.962 -0.352 17919 94873 1 231 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.312 0.108 17919 94874 1 231 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.768 -1.028 17919 94875 1 231 . 1 1 61 61 ILE H H 61 7.250 7.250 8.017 -0.767 17919 94876 1 231 . 1 1 62 62 GLN N N 62 124.740 124.740 123.952 0.788 17919 94877 1 231 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.713 -0.207 17919 94878 1 231 . 1 1 62 62 GLN C C 62 175.970 175.970 175.415 0.555 17919 94879 1 231 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.450 0.210 17919 94880 1 231 . 1 1 62 62 GLN CB C 62 31.650 31.650 32.753 -1.103 17919 94881 1 231 . 1 1 62 62 GLN H H 62 7.610 7.610 7.931 -0.321 17919 94882 1 231 . 1 1 63 63 LYS N N 63 120.300 120.300 122.988 -2.688 17919 94883 1 231 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.115 -0.114 17919 94884 1 231 . 1 1 63 63 LYS C C 63 175.810 175.810 177.195 -1.385 17919 94885 1 231 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.278 -0.487 17919 94886 1 231 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.297 0.353 17919 94887 1 231 . 1 1 63 63 LYS H H 63 8.490 8.490 8.781 -0.291 17919 94888 1 231 . 1 1 64 64 GLU N N 64 113.950 113.950 122.587 -8.637 17919 94889 1 231 . 1 1 64 64 GLU HA H 64 3.465 3.465 4.094 -0.629 17919 94890 1 231 . 1 1 64 64 GLU C C 64 175.250 175.250 176.275 -1.025 17919 94891 1 231 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.839 0.051 17919 94892 1 231 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.248 -2.348 17919 94893 1 231 . 1 1 64 64 GLU H H 64 9.280 9.280 8.839 0.441 17919 94894 1 231 . 1 1 65 65 SER N N 65 114.730 114.730 115.257 -0.527 17919 94895 1 231 . 1 1 65 65 SER HA H 65 4.640 4.640 4.701 -0.061 17919 94896 1 231 . 1 1 65 65 SER C C 65 172.160 172.160 174.120 -1.960 17919 94897 1 231 . 1 1 65 65 SER CA C 65 60.890 60.890 59.265 1.625 17919 94898 1 231 . 1 1 65 65 SER CB C 65 64.910 64.910 64.932 -0.022 17919 94899 1 231 . 1 1 65 65 SER H H 65 7.670 7.670 7.688 -0.018 17919 94900 1 231 . 1 1 66 66 THR N N 66 117.110 117.110 120.576 -3.466 17919 94901 1 231 . 1 1 66 66 THR HA H 66 5.270 5.270 5.259 0.011 17919 94902 1 231 . 1 1 66 66 THR C C 66 173.950 173.950 174.438 -0.488 17919 94903 1 231 . 1 1 66 66 THR CA C 66 62.340 62.340 62.320 0.020 17919 94904 1 231 . 1 1 66 66 THR CB C 66 70.080 70.080 69.959 0.121 17919 94905 1 231 . 1 1 66 66 THR H H 66 8.730 8.730 8.597 0.133 17919 94906 1 231 . 1 1 67 67 LEU N N 67 127.110 127.110 126.830 0.280 17919 94907 1 231 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.847 0.213 17919 94908 1 231 . 1 1 67 67 LEU C C 67 175.770 175.770 175.468 0.302 17919 94909 1 231 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.182 -0.282 17919 94910 1 231 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.278 -0.018 17919 94911 1 231 . 1 1 67 67 LEU H H 67 9.410 9.410 9.146 0.264 17919 94912 1 231 . 1 1 68 68 HIS N N 68 118.380 118.380 120.779 -2.399 17919 94913 1 231 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.251 -0.011 17919 94914 1 231 . 1 1 68 68 HIS C C 68 173.150 173.150 174.107 -0.957 17919 94915 1 231 . 1 1 68 68 HIS CA C 68 55.000 55.000 55.421 -0.421 17919 94916 1 231 . 1 1 68 68 HIS CB C 68 30.530 30.530 31.369 -0.839 17919 94917 1 231 . 1 1 68 68 HIS H H 68 9.230 9.230 9.294 -0.064 17919 94918 1 231 . 1 1 69 69 LEU N N 69 124.460 124.460 125.823 -1.363 17919 94919 1 231 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.155 0.035 17919 94920 1 231 . 1 1 69 69 LEU C C 69 175.270 175.270 174.574 0.696 17919 94921 1 231 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.540 0.350 17919 94922 1 231 . 1 1 69 69 LEU CB C 69 44.380 44.380 45.741 -1.361 17919 94923 1 231 . 1 1 69 69 LEU H H 69 8.340 8.340 8.136 0.204 17919 94924 1 231 . 1 1 70 70 VAL N N 70 126.940 126.940 124.689 2.251 17919 94925 1 231 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.548 -0.198 17919 94926 1 231 . 1 1 70 70 VAL C C 70 174.000 174.000 174.483 -0.483 17919 94927 1 231 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.951 -0.151 17919 94928 1 231 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.061 -0.151 17919 94929 1 231 . 1 1 70 70 VAL H H 70 9.200 9.200 9.068 0.132 17919 94930 1 231 . 1 1 71 71 LEU N N 71 123.130 123.130 123.668 -0.538 17919 94931 1 231 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.168 -0.108 17919 94932 1 231 . 1 1 71 71 LEU C C 71 177.830 177.830 176.250 1.580 17919 94933 1 231 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.297 0.643 17919 94934 1 231 . 1 1 71 71 LEU CB C 71 42.850 42.850 45.051 -2.201 17919 94935 1 231 . 1 1 71 71 LEU H H 71 8.120 8.120 8.512 -0.392 17919 94936 1 231 . 1 1 72 72 ARG N N 72 123.490 123.490 121.276 2.214 17919 94937 1 231 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.631 -0.330 17919 94938 1 231 . 1 1 72 72 ARG C C 72 175.350 175.350 174.971 0.379 17919 94939 1 231 . 1 1 72 72 ARG CA C 72 55.610 55.610 54.901 0.709 17919 94940 1 231 . 1 1 72 72 ARG CB C 72 31.350 31.350 32.564 -1.214 17919 94941 1 231 . 1 1 72 72 ARG H H 72 8.580 8.580 8.091 0.489 17919 94942 1 232 . 1 1 2 2 GLN N N 2 123.220 123.220 121.337 1.883 17919 94943 1 232 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.292 -0.043 17919 94944 1 232 . 1 1 2 2 GLN C C 2 175.920 175.920 174.813 1.107 17919 94945 1 232 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.637 0.443 17919 94946 1 232 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.296 0.465 17919 94947 1 232 . 1 1 2 2 GLN H H 2 8.900 8.900 8.248 0.652 17919 94948 1 232 . 1 1 3 3 ILE N N 3 115.340 115.340 118.035 -2.695 17919 94949 1 232 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.690 -0.477 17919 94950 1 232 . 1 1 3 3 ILE C C 3 172.450 172.450 173.401 -0.951 17919 94951 1 232 . 1 1 3 3 ILE CA C 3 59.570 59.570 58.841 0.729 17919 94952 1 232 . 1 1 3 3 ILE CB C 3 42.210 42.210 42.080 0.130 17919 94953 1 232 . 1 1 3 3 ILE H H 3 8.320 8.320 8.564 -0.244 17919 94954 1 232 . 1 1 4 4 PHE N N 4 118.110 118.110 119.548 -1.438 17919 94955 1 232 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.374 0.256 17919 94956 1 232 . 1 1 4 4 PHE C C 4 175.320 175.320 175.437 -0.117 17919 94957 1 232 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.230 -0.020 17919 94958 1 232 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.103 0.377 17919 94959 1 232 . 1 1 4 4 PHE H H 4 8.610 8.610 8.388 0.222 17919 94960 1 232 . 1 1 5 5 VAL N N 5 121.000 121.000 122.163 -1.163 17919 94961 1 232 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.601 0.124 17919 94962 1 232 . 1 1 5 5 VAL C C 5 174.870 174.870 174.478 0.392 17919 94963 1 232 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.333 -0.713 17919 94964 1 232 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.393 -0.163 17919 94965 1 232 . 1 1 5 5 VAL H H 5 9.300 9.300 9.400 -0.100 17919 94966 1 232 . 1 1 6 6 LYS N N 6 127.520 127.520 129.119 -1.599 17919 94967 1 232 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.340 0.027 17919 94968 1 232 . 1 1 6 6 LYS C C 6 177.140 177.140 176.615 0.525 17919 94969 1 232 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.479 0.041 17919 94970 1 232 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.453 -0.403 17919 94971 1 232 . 1 1 6 6 LYS H H 6 8.820 8.820 9.110 -0.290 17919 94972 1 232 . 1 1 7 7 THR N N 7 115.400 115.400 119.094 -3.694 17919 94973 1 232 . 1 1 7 7 THR HA H 7 4.970 4.970 4.388 0.582 17919 94974 1 232 . 1 1 7 7 THR C C 7 176.910 176.910 176.104 0.806 17919 94975 1 232 . 1 1 7 7 THR CA C 7 60.470 60.470 60.748 -0.278 17919 94976 1 232 . 1 1 7 7 THR CB C 7 70.630 70.630 69.927 0.703 17919 94977 1 232 . 1 1 7 7 THR H H 7 8.730 8.730 8.978 -0.248 17919 94978 1 232 . 1 1 8 8 LEU N N 8 121.330 121.330 120.830 0.500 17919 94979 1 232 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.392 -0.082 17919 94980 1 232 . 1 1 8 8 LEU C C 8 178.800 178.800 177.409 1.391 17919 94981 1 232 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.108 0.472 17919 94982 1 232 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.912 0.058 17919 94983 1 232 . 1 1 8 8 LEU H H 8 9.100 9.100 8.733 0.367 17919 94984 1 232 . 1 1 9 9 THR N N 9 105.590 105.590 108.517 -2.927 17919 94985 1 232 . 1 1 9 9 THR HA H 9 4.428 4.428 4.379 0.049 17919 94986 1 232 . 1 1 9 9 THR C C 9 175.520 175.520 176.019 -0.499 17919 94987 1 232 . 1 1 9 9 THR CA C 9 61.400 61.400 61.415 -0.015 17919 94988 1 232 . 1 1 9 9 THR CB C 9 69.140 69.140 68.655 0.485 17919 94989 1 232 . 1 1 9 9 THR H H 9 7.630 7.630 7.685 -0.055 17919 94990 1 232 . 1 1 10 10 GLY N N 10 108.890 108.890 110.731 -1.841 17919 94991 1 232 . 1 1 10 10 GLY C C 10 174.070 174.070 173.995 0.075 17919 94992 1 232 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.410 0.050 17919 94993 1 232 . 1 1 10 10 GLY H H 10 7.810 7.810 7.850 -0.040 17919 94994 1 232 . 1 1 11 11 LYS N N 11 121.600 121.600 122.100 -0.500 17919 94995 1 232 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.598 -0.237 17919 94996 1 232 . 1 1 11 11 LYS C C 11 175.940 175.940 175.626 0.314 17919 94997 1 232 . 1 1 11 11 LYS CA C 11 56.280 56.280 54.944 1.336 17919 94998 1 232 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.651 -0.451 17919 94999 1 232 . 1 1 11 11 LYS H H 11 7.280 7.280 8.086 -0.806 17919 95000 1 232 . 1 1 12 12 THR N N 12 120.440 120.440 123.651 -3.211 17919 95001 1 232 . 1 1 12 12 THR HA H 12 5.046 5.046 4.782 0.264 17919 95002 1 232 . 1 1 12 12 THR C C 12 174.320 174.320 174.817 -0.497 17919 95003 1 232 . 1 1 12 12 THR CA C 12 62.390 62.390 62.990 -0.600 17919 95004 1 232 . 1 1 12 12 THR CB C 12 69.910 69.910 68.390 1.520 17919 95005 1 232 . 1 1 12 12 THR H H 12 8.650 8.650 8.567 0.083 17919 95006 1 232 . 1 1 13 13 ILE N N 13 127.110 127.110 124.473 2.637 17919 95007 1 232 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.672 -0.128 17919 95008 1 232 . 1 1 13 13 ILE C C 13 175.220 175.220 174.963 0.257 17919 95009 1 232 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.663 0.316 17919 95010 1 232 . 1 1 13 13 ILE CB C 13 40.950 40.950 39.685 1.265 17919 95011 1 232 . 1 1 13 13 ILE H H 13 9.450 9.450 9.178 0.272 17919 95012 1 232 . 1 1 14 14 THR N N 14 121.520 121.520 120.190 1.330 17919 95013 1 232 . 1 1 14 14 THR HA H 14 4.964 4.964 5.225 -0.261 17919 95014 1 232 . 1 1 14 14 THR C C 14 173.790 173.790 173.980 -0.190 17919 95015 1 232 . 1 1 14 14 THR CA C 14 61.940 61.940 61.764 0.176 17919 95016 1 232 . 1 1 14 14 THR CB C 14 69.650 69.650 70.101 -0.451 17919 95017 1 232 . 1 1 14 14 THR H H 14 8.710 8.710 8.392 0.318 17919 95018 1 232 . 1 1 15 15 LEU N N 15 124.800 124.800 127.473 -2.673 17919 95019 1 232 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.759 0.021 17919 95020 1 232 . 1 1 15 15 LEU C C 15 174.670 174.670 175.317 -0.647 17919 95021 1 232 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.701 -0.871 17919 95022 1 232 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.583 1.487 17919 95023 1 232 . 1 1 15 15 LEU H H 15 8.710 8.710 9.006 -0.296 17919 95024 1 232 . 1 1 16 16 GLU N N 16 122.160 122.160 122.201 -0.041 17919 95025 1 232 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.414 -0.497 17919 95026 1 232 . 1 1 16 16 GLU C C 16 175.860 175.860 175.974 -0.114 17919 95027 1 232 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.485 -0.665 17919 95028 1 232 . 1 1 16 16 GLU CB C 16 29.450 29.450 31.485 -2.034 17919 95029 1 232 . 1 1 16 16 GLU H H 16 8.140 8.140 8.692 -0.552 17919 95030 1 232 . 1 1 17 17 VAL N N 17 117.210 117.210 118.833 -1.623 17919 95031 1 232 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.860 -0.146 17919 95032 1 232 . 1 1 17 17 VAL C C 17 174.160 174.160 174.591 -0.431 17919 95033 1 232 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.278 -0.848 17919 95034 1 232 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.592 0.809 17919 95035 1 232 . 1 1 17 17 VAL H H 17 8.900 8.900 8.587 0.313 17919 95036 1 232 . 1 1 18 18 GLU N N 18 118.990 118.990 123.176 -4.186 17919 95037 1 232 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.875 0.204 17919 95038 1 232 . 1 1 18 18 GLU C C 18 176.160 176.160 175.452 0.708 17919 95039 1 232 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.268 0.452 17919 95040 1 232 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.987 -0.677 17919 95041 1 232 . 1 1 18 18 GLU H H 18 8.640 8.640 8.841 -0.201 17919 95042 1 232 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.331 -0.190 17919 95043 1 232 . 1 1 19 19 PRO C C 19 175.310 175.310 177.807 -2.497 17919 95044 1 232 . 1 1 19 19 PRO CA C 19 65.470 65.470 64.922 0.548 17919 95045 1 232 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.916 0.034 17919 95046 1 232 . 1 1 20 20 SER N N 20 103.400 103.400 110.375 -6.975 17919 95047 1 232 . 1 1 20 20 SER HA H 20 4.370 4.370 4.212 0.158 17919 95048 1 232 . 1 1 20 20 SER C C 20 174.660 174.660 174.561 0.099 17919 95049 1 232 . 1 1 20 20 SER CA C 20 57.400 57.400 58.795 -1.395 17919 95050 1 232 . 1 1 20 20 SER CB C 20 63.370 63.370 62.769 0.601 17919 95051 1 232 . 1 1 20 20 SER H H 20 7.040 7.040 8.059 -1.019 17919 95052 1 232 . 1 1 21 21 ASP N N 21 123.480 123.480 124.370 -0.890 17919 95053 1 232 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.745 -0.050 17919 95054 1 232 . 1 1 21 21 ASP C C 21 176.360 176.360 175.969 0.391 17919 95055 1 232 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.342 0.358 17919 95056 1 232 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.758 -0.958 17919 95057 1 232 . 1 1 21 21 ASP H H 21 8.030 8.030 7.897 0.133 17919 95058 1 232 . 1 1 22 22 THR N N 22 108.800 108.800 111.396 -2.596 17919 95059 1 232 . 1 1 22 22 THR HA H 22 4.920 4.920 4.623 0.297 17919 95060 1 232 . 1 1 22 22 THR C C 22 176.750 176.750 176.108 0.642 17919 95061 1 232 . 1 1 22 22 THR CA C 22 59.690 59.690 61.287 -1.597 17919 95062 1 232 . 1 1 22 22 THR CB C 22 71.200 71.200 70.419 0.781 17919 95063 1 232 . 1 1 22 22 THR H H 22 7.900 7.900 8.232 -0.332 17919 95064 1 232 . 1 1 23 23 ILE N N 23 121.190 121.190 122.059 -0.869 17919 95065 1 232 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.801 -0.144 17919 95066 1 232 . 1 1 23 23 ILE C C 23 179.040 179.040 177.654 1.386 17919 95067 1 232 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.801 -0.541 17919 95068 1 232 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.432 -2.082 17919 95069 1 232 . 1 1 23 23 ILE H H 23 8.560 8.560 8.869 -0.309 17919 95070 1 232 . 1 1 24 24 GLU N N 24 120.830 120.830 120.729 0.101 17919 95071 1 232 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.913 0.004 17919 95072 1 232 . 1 1 24 24 GLU C C 24 178.640 178.640 178.425 0.215 17919 95073 1 232 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.910 0.311 17919 95074 1 232 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.471 -1.190 17919 95075 1 232 . 1 1 24 24 GLU H H 24 9.760 9.760 8.408 1.352 17919 95076 1 232 . 1 1 25 25 ASN N N 25 120.570 120.570 117.705 2.865 17919 95077 1 232 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.609 -0.084 17919 95078 1 232 . 1 1 25 25 ASN C C 25 178.380 178.380 177.897 0.483 17919 95079 1 232 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.659 0.401 17919 95080 1 232 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.790 -0.340 17919 95081 1 232 . 1 1 25 25 ASN H H 25 7.920 7.920 7.652 0.268 17919 95082 1 232 . 1 1 26 26 VAL N N 26 121.710 121.710 121.677 0.033 17919 95083 1 232 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.517 -0.120 17919 95084 1 232 . 1 1 26 26 VAL C C 26 177.950 177.950 177.678 0.272 17919 95085 1 232 . 1 1 26 26 VAL CA C 26 67.660 67.660 67.191 0.469 17919 95086 1 232 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.639 -0.799 17919 95087 1 232 . 1 1 26 26 VAL H H 26 8.070 8.070 7.818 0.252 17919 95088 1 232 . 1 1 27 27 LYS N N 27 118.860 118.860 119.805 -0.945 17919 95089 1 232 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.116 0.464 17919 95090 1 232 . 1 1 27 27 LYS C C 27 180.550 180.550 179.218 1.332 17919 95091 1 232 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.698 -0.448 17919 95092 1 232 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.247 1.483 17919 95093 1 232 . 1 1 27 27 LYS H H 27 8.560 8.560 8.387 0.173 17919 95094 1 232 . 1 1 28 28 ALA N N 28 123.440 123.440 121.425 2.015 17919 95095 1 232 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.023 0.137 17919 95096 1 232 . 1 1 28 28 ALA C C 28 180.300 180.300 178.730 1.570 17919 95097 1 232 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.294 0.076 17919 95098 1 232 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.328 -0.618 17919 95099 1 232 . 1 1 28 28 ALA H H 28 8.060 8.060 8.619 -0.559 17919 95100 1 232 . 1 1 29 29 LYS N N 29 119.940 119.940 119.734 0.206 17919 95101 1 232 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.117 0.090 17919 95102 1 232 . 1 1 29 29 LYS C C 29 180.320 180.320 178.889 1.431 17919 95103 1 232 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.117 0.533 17919 95104 1 232 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.453 0.837 17919 95105 1 232 . 1 1 29 29 LYS H H 29 7.850 7.850 7.705 0.145 17919 95106 1 232 . 1 1 30 30 ILE N N 30 121.080 121.080 120.091 0.989 17919 95107 1 232 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.655 -0.148 17919 95108 1 232 . 1 1 30 30 ILE C C 30 178.310 178.310 177.530 0.780 17919 95109 1 232 . 1 1 30 30 ILE CA C 30 66.150 66.150 64.992 1.159 17919 95110 1 232 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.903 -1.103 17919 95111 1 232 . 1 1 30 30 ILE H H 30 8.280 8.280 8.540 -0.260 17919 95112 1 232 . 1 1 31 31 GLN N N 31 123.490 123.490 120.830 2.660 17919 95113 1 232 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.977 -0.148 17919 95114 1 232 . 1 1 31 31 GLN C C 31 178.890 178.890 178.466 0.424 17919 95115 1 232 . 1 1 31 31 GLN CA C 31 60.000 60.000 58.743 1.256 17919 95116 1 232 . 1 1 31 31 GLN CB C 31 27.720 27.720 27.985 -0.265 17919 95117 1 232 . 1 1 31 31 GLN H H 31 8.580 8.580 7.963 0.617 17919 95118 1 232 . 1 1 32 32 ASP N N 32 119.360 119.360 120.014 -0.654 17919 95119 1 232 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.436 -0.082 17919 95120 1 232 . 1 1 32 32 ASP C C 32 177.250 177.250 178.053 -0.803 17919 95121 1 232 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.530 0.660 17919 95122 1 232 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.536 0.044 17919 95123 1 232 . 1 1 32 32 ASP H H 32 8.010 8.010 8.399 -0.389 17919 95124 1 232 . 1 1 33 33 LYS N N 33 115.130 115.130 119.077 -3.947 17919 95125 1 232 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.305 0.032 17919 95126 1 232 . 1 1 33 33 LYS C C 33 177.870 177.870 177.985 -0.115 17919 95127 1 232 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.774 0.276 17919 95128 1 232 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.282 0.888 17919 95129 1 232 . 1 1 33 33 LYS H H 33 7.430 7.430 7.637 -0.207 17919 95130 1 232 . 1 1 34 34 GLU N N 34 113.870 113.870 114.147 -0.277 17919 95131 1 232 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.594 0.031 17919 95132 1 232 . 1 1 34 34 GLU C C 34 177.840 177.840 176.759 1.081 17919 95133 1 232 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.451 -0.281 17919 95134 1 232 . 1 1 34 34 GLU CB C 34 32.660 32.660 30.580 2.080 17919 95135 1 232 . 1 1 34 34 GLU H H 34 8.740 8.740 7.890 0.850 17919 95136 1 232 . 1 1 35 35 GLY N N 35 108.650 108.650 108.689 -0.039 17919 95137 1 232 . 1 1 35 35 GLY C C 35 173.960 173.960 174.746 -0.786 17919 95138 1 232 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.934 0.146 17919 95139 1 232 . 1 1 35 35 GLY H H 35 8.530 8.530 7.911 0.619 17919 95140 1 232 . 1 1 36 36 ILE N N 36 119.880 119.880 122.044 -2.164 17919 95141 1 232 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.124 0.321 17919 95142 1 232 . 1 1 36 36 ILE C C 36 173.590 173.590 174.164 -0.574 17919 95143 1 232 . 1 1 36 36 ILE CA C 36 57.750 57.750 59.481 -1.731 17919 95144 1 232 . 1 1 36 36 ILE CB C 36 40.580 40.580 37.784 2.796 17919 95145 1 232 . 1 1 36 36 ILE H H 36 6.150 6.150 7.766 -1.616 17919 95146 1 232 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.974 -0.340 17919 95147 1 232 . 1 1 37 37 PRO C C 37 176.940 176.940 176.214 0.726 17919 95148 1 232 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.175 0.485 17919 95149 1 232 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.392 0.458 17919 95150 1 232 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.154 -0.037 17919 95151 1 232 . 1 1 38 38 PRO C C 38 178.320 178.320 178.632 -0.312 17919 95152 1 232 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.837 0.423 17919 95153 1 232 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.898 0.992 17919 95154 1 232 . 1 1 39 39 ASP N N 39 113.380 113.380 114.630 -1.250 17919 95155 1 232 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.441 -0.011 17919 95156 1 232 . 1 1 39 39 ASP C C 39 177.090 177.090 176.462 0.628 17919 95157 1 232 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.098 -0.458 17919 95158 1 232 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.270 -0.730 17919 95159 1 232 . 1 1 39 39 ASP H H 39 8.550 8.550 8.804 -0.254 17919 95160 1 232 . 1 1 40 40 GLN N N 40 116.780 116.780 116.097 0.683 17919 95161 1 232 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.727 -0.263 17919 95162 1 232 . 1 1 40 40 GLN C C 40 175.380 175.380 175.325 0.055 17919 95163 1 232 . 1 1 40 40 GLN CA C 40 55.640 55.640 54.566 1.074 17919 95164 1 232 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.823 0.317 17919 95165 1 232 . 1 1 40 40 GLN H H 40 7.820 7.820 7.571 0.249 17919 95166 1 232 . 1 1 41 41 GLN N N 41 117.720 117.720 119.800 -2.080 17919 95167 1 232 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.478 -0.234 17919 95168 1 232 . 1 1 41 41 GLN C C 41 176.300 176.300 174.920 1.380 17919 95169 1 232 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.178 0.292 17919 95170 1 232 . 1 1 41 41 GLN CB C 41 31.650 31.650 30.134 1.516 17919 95171 1 232 . 1 1 41 41 GLN H H 41 7.480 7.480 7.878 -0.398 17919 95172 1 232 . 1 1 42 42 ARG N N 42 122.680 122.680 122.585 0.095 17919 95173 1 232 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.697 -0.197 17919 95174 1 232 . 1 1 42 42 ARG C C 42 174.050 174.050 173.899 0.151 17919 95175 1 232 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.240 0.810 17919 95176 1 232 . 1 1 42 42 ARG CB C 42 31.750 31.750 34.094 -2.344 17919 95177 1 232 . 1 1 42 42 ARG H H 42 8.530 8.530 8.887 -0.357 17919 95178 1 232 . 1 1 43 43 LEU N N 43 124.040 124.040 120.542 3.498 17919 95179 1 232 . 1 1 43 43 LEU C C 43 175.290 175.290 175.002 0.288 17919 95180 1 232 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.577 -0.597 17919 95181 1 232 . 1 1 43 43 LEU CB C 43 45.790 45.790 46.288 -0.498 17919 95182 1 232 . 1 1 43 43 LEU H H 43 8.820 8.820 8.541 0.279 17919 95183 1 232 . 1 1 44 44 ILE N N 44 121.920 121.920 117.869 4.051 17919 95184 1 232 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.163 -0.171 17919 95185 1 232 . 1 1 44 44 ILE C C 44 176.060 176.060 173.674 2.386 17919 95186 1 232 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.658 -0.678 17919 95187 1 232 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.428 -0.008 17919 95188 1 232 . 1 1 44 44 ILE H H 44 9.030 9.030 8.588 0.442 17919 95189 1 232 . 1 1 45 45 PHE N N 45 125.390 125.390 128.262 -2.872 17919 95190 1 232 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.033 0.012 17919 95191 1 232 . 1 1 45 45 PHE C C 45 174.470 174.470 175.115 -0.645 17919 95192 1 232 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.901 0.119 17919 95193 1 232 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.009 0.751 17919 95194 1 232 . 1 1 45 45 PHE H H 45 8.830 8.830 8.643 0.187 17919 95195 1 232 . 1 1 46 46 ALA N N 46 132.200 132.200 130.133 2.067 17919 95196 1 232 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.727 -0.037 17919 95197 1 232 . 1 1 46 46 ALA C C 46 177.290 177.290 177.715 -0.425 17919 95198 1 232 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.358 0.182 17919 95199 1 232 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.661 -0.091 17919 95200 1 232 . 1 1 46 46 ALA H H 46 8.810 8.810 8.637 0.173 17919 95201 1 232 . 1 1 47 47 GLY N N 47 102.340 102.340 104.525 -2.185 17919 95202 1 232 . 1 1 47 47 GLY C C 47 173.810 173.810 174.222 -0.412 17919 95203 1 232 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.840 0.510 17919 95204 1 232 . 1 1 47 47 GLY H H 47 8.130 8.130 8.495 -0.365 17919 95205 1 232 . 1 1 48 48 LYS N N 48 121.570 121.570 121.825 -0.255 17919 95206 1 232 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.599 0.023 17919 95207 1 232 . 1 1 48 48 LYS C C 48 174.700 174.700 175.531 -0.831 17919 95208 1 232 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.041 -0.491 17919 95209 1 232 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.231 0.299 17919 95210 1 232 . 1 1 48 48 LYS H H 48 7.980 7.980 7.666 0.314 17919 95211 1 232 . 1 1 49 49 GLN N N 49 122.410 122.410 122.991 -0.581 17919 95212 1 232 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.210 0.350 17919 95213 1 232 . 1 1 49 49 GLN C C 49 175.670 175.670 175.825 -0.155 17919 95214 1 232 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.789 -1.049 17919 95215 1 232 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.050 -0.050 17919 95216 1 232 . 1 1 49 49 GLN H H 49 8.600 8.600 8.572 0.028 17919 95217 1 232 . 1 1 50 50 LEU N N 50 125.520 125.520 127.406 -1.886 17919 95218 1 232 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.048 0.042 17919 95219 1 232 . 1 1 50 50 LEU C C 50 176.660 176.660 175.735 0.925 17919 95220 1 232 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.486 0.754 17919 95221 1 232 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.996 -0.426 17919 95222 1 232 . 1 1 50 50 LEU H H 50 8.530 8.530 8.709 -0.179 17919 95223 1 232 . 1 1 51 51 GLU N N 51 122.940 122.940 123.718 -0.778 17919 95224 1 232 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.543 -0.055 17919 95225 1 232 . 1 1 51 51 GLU C C 51 175.870 175.870 177.139 -1.269 17919 95226 1 232 . 1 1 51 51 GLU CA C 51 55.960 55.960 54.938 1.022 17919 95227 1 232 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.552 -0.982 17919 95228 1 232 . 1 1 51 51 GLU H H 51 8.400 8.400 7.939 0.461 17919 95229 1 232 . 1 1 52 52 ASP N N 52 120.030 120.030 126.314 -6.284 17919 95230 1 232 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.411 -0.052 17919 95231 1 232 . 1 1 52 52 ASP C C 52 177.330 177.330 177.757 -0.427 17919 95232 1 232 . 1 1 52 52 ASP CA C 52 56.960 56.960 58.289 -1.329 17919 95233 1 232 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.672 0.178 17919 95234 1 232 . 1 1 52 52 ASP H H 52 8.160 8.160 8.820 -0.660 17919 95235 1 232 . 1 1 53 53 GLY N N 53 106.660 106.660 103.931 2.729 17919 95236 1 232 . 1 1 53 53 GLY C C 53 174.870 174.870 174.634 0.236 17919 95237 1 232 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.029 0.141 17919 95238 1 232 . 1 1 53 53 GLY H H 53 9.390 9.390 8.660 0.730 17919 95239 1 232 . 1 1 54 54 ARG N N 54 119.050 119.050 118.464 0.586 17919 95240 1 232 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.723 -0.028 17919 95241 1 232 . 1 1 54 54 ARG C C 54 175.350 175.350 175.095 0.255 17919 95242 1 232 . 1 1 54 54 ARG CA C 54 54.390 54.390 53.991 0.399 17919 95243 1 232 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.317 -0.667 17919 95244 1 232 . 1 1 54 54 ARG H H 54 7.460 7.460 7.280 0.180 17919 95245 1 232 . 1 1 55 55 THR N N 55 108.400 108.400 111.047 -2.647 17919 95246 1 232 . 1 1 55 55 THR HA H 55 5.240 5.240 5.189 0.051 17919 95247 1 232 . 1 1 55 55 THR C C 55 176.560 176.560 176.216 0.344 17919 95248 1 232 . 1 1 55 55 THR CA C 55 59.690 59.690 59.574 0.116 17919 95249 1 232 . 1 1 55 55 THR CB C 55 72.260 72.260 71.729 0.531 17919 95250 1 232 . 1 1 55 55 THR H H 55 8.730 8.730 9.155 -0.425 17919 95251 1 232 . 1 1 56 56 LEU N N 56 117.920 117.920 121.369 -3.449 17919 95252 1 232 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.035 0.025 17919 95253 1 232 . 1 1 56 56 LEU C C 56 180.810 180.810 178.734 2.076 17919 95254 1 232 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.460 0.250 17919 95255 1 232 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.545 -1.175 17919 95256 1 232 . 1 1 56 56 LEU H H 56 8.140 8.140 8.788 -0.648 17919 95257 1 232 . 1 1 57 57 SER N N 57 113.330 113.330 115.178 -1.848 17919 95258 1 232 . 1 1 57 57 SER HA H 57 4.370 4.370 4.216 0.154 17919 95259 1 232 . 1 1 57 57 SER C C 57 178.310 178.310 176.796 1.514 17919 95260 1 232 . 1 1 57 57 SER CA C 57 61.080 61.080 62.362 -1.282 17919 95261 1 232 . 1 1 57 57 SER CB C 57 62.530 62.530 62.865 -0.335 17919 95262 1 232 . 1 1 57 57 SER H H 57 8.470 8.470 8.324 0.146 17919 95263 1 232 . 1 1 58 58 ASP N N 58 124.190 124.190 122.509 1.681 17919 95264 1 232 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.321 -0.025 17919 95265 1 232 . 1 1 58 58 ASP C C 58 177.400 177.400 177.448 -0.048 17919 95266 1 232 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.737 0.443 17919 95267 1 232 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.300 -0.200 17919 95268 1 232 . 1 1 58 58 ASP H H 58 7.930 7.930 7.759 0.171 17919 95269 1 232 . 1 1 59 59 TYR N N 59 115.510 115.510 115.916 -0.406 17919 95270 1 232 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.597 0.073 17919 95271 1 232 . 1 1 59 59 TYR C C 59 174.700 174.700 174.840 -0.140 17919 95272 1 232 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.344 0.906 17919 95273 1 232 . 1 1 59 59 TYR CB C 59 40.070 40.070 37.936 2.134 17919 95274 1 232 . 1 1 59 59 TYR H H 59 7.250 7.250 7.398 -0.148 17919 95275 1 232 . 1 1 60 60 ASN N N 60 115.900 115.900 117.856 -1.956 17919 95276 1 232 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.354 0.001 17919 95277 1 232 . 1 1 60 60 ASN C C 60 174.340 174.340 174.457 -0.117 17919 95278 1 232 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.069 0.051 17919 95279 1 232 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.124 0.286 17919 95280 1 232 . 1 1 60 60 ASN H H 60 8.150 8.150 7.750 0.400 17919 95281 1 232 . 1 1 61 61 ILE N N 61 118.600 118.600 119.194 -0.594 17919 95282 1 232 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.925 -0.532 17919 95283 1 232 . 1 1 61 61 ILE C C 61 174.610 174.610 174.903 -0.293 17919 95284 1 232 . 1 1 61 61 ILE CA C 61 62.420 62.420 60.911 1.509 17919 95285 1 232 . 1 1 61 61 ILE CB C 61 36.740 36.740 38.549 -1.809 17919 95286 1 232 . 1 1 61 61 ILE H H 61 7.250 7.250 8.067 -0.817 17919 95287 1 232 . 1 1 62 62 GLN N N 62 124.740 124.740 124.743 -0.003 17919 95288 1 232 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.763 -0.257 17919 95289 1 232 . 1 1 62 62 GLN C C 62 175.970 175.970 175.374 0.596 17919 95290 1 232 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.426 0.234 17919 95291 1 232 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.589 0.061 17919 95292 1 232 . 1 1 62 62 GLN H H 62 7.610 7.610 7.903 -0.293 17919 95293 1 232 . 1 1 63 63 LYS N N 63 120.300 120.300 120.962 -0.662 17919 95294 1 232 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.210 -0.209 17919 95295 1 232 . 1 1 63 63 LYS C C 63 175.810 175.810 176.919 -1.109 17919 95296 1 232 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.141 0.649 17919 95297 1 232 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.308 0.342 17919 95298 1 232 . 1 1 63 63 LYS H H 63 8.490 8.490 8.373 0.117 17919 95299 1 232 . 1 1 64 64 GLU N N 64 113.950 113.950 118.552 -4.602 17919 95300 1 232 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.565 -0.100 17919 95301 1 232 . 1 1 64 64 GLU C C 64 175.250 175.250 175.924 -0.674 17919 95302 1 232 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.811 0.079 17919 95303 1 232 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.825 -2.925 17919 95304 1 232 . 1 1 64 64 GLU H H 64 9.280 9.280 8.561 0.719 17919 95305 1 232 . 1 1 65 65 SER N N 65 114.730 114.730 115.834 -1.104 17919 95306 1 232 . 1 1 65 65 SER HA H 65 4.640 4.640 4.577 0.063 17919 95307 1 232 . 1 1 65 65 SER C C 65 172.160 172.160 173.730 -1.570 17919 95308 1 232 . 1 1 65 65 SER CA C 65 60.890 60.890 59.952 0.938 17919 95309 1 232 . 1 1 65 65 SER CB C 65 64.910 64.910 64.373 0.537 17919 95310 1 232 . 1 1 65 65 SER H H 65 7.670 7.670 7.256 0.414 17919 95311 1 232 . 1 1 66 66 THR N N 66 117.110 117.110 120.046 -2.936 17919 95312 1 232 . 1 1 66 66 THR HA H 66 5.270 5.270 5.034 0.236 17919 95313 1 232 . 1 1 66 66 THR C C 66 173.950 173.950 174.090 -0.140 17919 95314 1 232 . 1 1 66 66 THR CA C 66 62.340 62.340 61.715 0.625 17919 95315 1 232 . 1 1 66 66 THR CB C 66 70.080 70.080 70.770 -0.690 17919 95316 1 232 . 1 1 66 66 THR H H 66 8.730 8.730 8.576 0.154 17919 95317 1 232 . 1 1 67 67 LEU N N 67 127.110 127.110 127.156 -0.046 17919 95318 1 232 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.813 0.247 17919 95319 1 232 . 1 1 67 67 LEU C C 67 175.770 175.770 175.260 0.510 17919 95320 1 232 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.840 0.060 17919 95321 1 232 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.717 -0.457 17919 95322 1 232 . 1 1 67 67 LEU H H 67 9.410 9.410 8.873 0.537 17919 95323 1 232 . 1 1 68 68 HIS N N 68 118.380 118.380 120.936 -2.556 17919 95324 1 232 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.328 -0.088 17919 95325 1 232 . 1 1 68 68 HIS C C 68 173.150 173.150 174.444 -1.294 17919 95326 1 232 . 1 1 68 68 HIS CA C 68 55.000 55.000 53.995 1.004 17919 95327 1 232 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.631 -2.101 17919 95328 1 232 . 1 1 68 68 HIS H H 68 9.230 9.230 8.329 0.901 17919 95329 1 232 . 1 1 69 69 LEU N N 69 124.460 124.460 129.554 -5.094 17919 95330 1 232 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.396 0.794 17919 95331 1 232 . 1 1 69 69 LEU C C 69 175.270 175.270 175.226 0.044 17919 95332 1 232 . 1 1 69 69 LEU CA C 69 53.890 53.890 55.490 -1.600 17919 95333 1 232 . 1 1 69 69 LEU CB C 69 44.380 44.380 42.735 1.645 17919 95334 1 232 . 1 1 69 69 LEU H H 69 8.340 8.340 7.494 0.846 17919 95335 1 232 . 1 1 70 70 VAL N N 70 126.940 126.940 126.532 0.408 17919 95336 1 232 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.340 0.010 17919 95337 1 232 . 1 1 70 70 VAL C C 70 174.000 174.000 174.511 -0.511 17919 95338 1 232 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.783 0.017 17919 95339 1 232 . 1 1 70 70 VAL CB C 70 34.910 34.910 34.722 0.188 17919 95340 1 232 . 1 1 70 70 VAL H H 70 9.200 9.200 8.355 0.845 17919 95341 1 232 . 1 1 71 71 LEU N N 71 123.130 123.130 126.363 -3.233 17919 95342 1 232 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.395 -0.335 17919 95343 1 232 . 1 1 71 71 LEU C C 71 177.830 177.830 177.010 0.820 17919 95344 1 232 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.718 0.222 17919 95345 1 232 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.795 -0.945 17919 95346 1 232 . 1 1 71 71 LEU H H 71 8.120 8.120 8.438 -0.318 17919 95347 1 232 . 1 1 72 72 ARG N N 72 123.490 123.490 121.077 2.413 17919 95348 1 232 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.615 -0.314 17919 95349 1 232 . 1 1 72 72 ARG C C 72 175.350 175.350 176.677 -1.327 17919 95350 1 232 . 1 1 72 72 ARG CA C 72 55.610 55.610 53.972 1.638 17919 95351 1 232 . 1 1 72 72 ARG CB C 72 31.350 31.350 32.443 -1.093 17919 95352 1 232 . 1 1 72 72 ARG H H 72 8.580 8.580 8.139 0.441 17919 95353 1 233 . 1 1 2 2 GLN N N 2 123.220 123.220 119.335 3.885 17919 95354 1 233 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.050 0.199 17919 95355 1 233 . 1 1 2 2 GLN C C 2 175.920 175.920 175.426 0.494 17919 95356 1 233 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.557 0.523 17919 95357 1 233 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.747 0.013 17919 95358 1 233 . 1 1 2 2 GLN H H 2 8.900 8.900 8.318 0.582 17919 95359 1 233 . 1 1 3 3 ILE N N 3 115.340 115.340 115.208 0.132 17919 95360 1 233 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.538 -0.325 17919 95361 1 233 . 1 1 3 3 ILE C C 3 172.450 172.450 173.450 -1.000 17919 95362 1 233 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.194 0.376 17919 95363 1 233 . 1 1 3 3 ILE CB C 3 42.210 42.210 42.083 0.127 17919 95364 1 233 . 1 1 3 3 ILE H H 3 8.320 8.320 7.688 0.632 17919 95365 1 233 . 1 1 4 4 PHE N N 4 118.110 118.110 119.421 -1.311 17919 95366 1 233 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.616 0.014 17919 95367 1 233 . 1 1 4 4 PHE C C 4 175.320 175.320 175.059 0.261 17919 95368 1 233 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.726 -0.516 17919 95369 1 233 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.466 -0.986 17919 95370 1 233 . 1 1 4 4 PHE H H 4 8.610 8.610 8.631 -0.021 17919 95371 1 233 . 1 1 5 5 VAL N N 5 121.000 121.000 122.156 -1.156 17919 95372 1 233 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.712 0.013 17919 95373 1 233 . 1 1 5 5 VAL C C 5 174.870 174.870 174.381 0.489 17919 95374 1 233 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.373 -0.754 17919 95375 1 233 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.446 -0.216 17919 95376 1 233 . 1 1 5 5 VAL H H 5 9.300 9.300 9.402 -0.102 17919 95377 1 233 . 1 1 6 6 LYS N N 6 127.520 127.520 128.426 -0.906 17919 95378 1 233 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.447 -0.080 17919 95379 1 233 . 1 1 6 6 LYS C C 6 177.140 177.140 175.996 1.144 17919 95380 1 233 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.229 0.291 17919 95381 1 233 . 1 1 6 6 LYS CB C 6 35.050 35.050 36.370 -1.320 17919 95382 1 233 . 1 1 6 6 LYS H H 6 8.820 8.820 9.385 -0.565 17919 95383 1 233 . 1 1 7 7 THR N N 7 115.400 115.400 116.977 -1.577 17919 95384 1 233 . 1 1 7 7 THR HA H 7 4.970 4.970 4.671 0.299 17919 95385 1 233 . 1 1 7 7 THR C C 7 176.910 176.910 176.015 0.895 17919 95386 1 233 . 1 1 7 7 THR CA C 7 60.470 60.470 60.664 -0.194 17919 95387 1 233 . 1 1 7 7 THR CB C 7 70.630 70.630 70.674 -0.044 17919 95388 1 233 . 1 1 7 7 THR H H 7 8.730 8.730 8.847 -0.117 17919 95389 1 233 . 1 1 8 8 LEU N N 8 121.330 121.330 124.691 -3.361 17919 95390 1 233 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.296 0.014 17919 95391 1 233 . 1 1 8 8 LEU C C 8 178.800 178.800 176.989 1.811 17919 95392 1 233 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.302 0.278 17919 95393 1 233 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.075 -0.105 17919 95394 1 233 . 1 1 8 8 LEU H H 8 9.100 9.100 8.710 0.390 17919 95395 1 233 . 1 1 9 9 THR N N 9 105.590 105.590 106.917 -1.327 17919 95396 1 233 . 1 1 9 9 THR HA H 9 4.428 4.428 4.324 0.104 17919 95397 1 233 . 1 1 9 9 THR C C 9 175.520 175.520 175.585 -0.065 17919 95398 1 233 . 1 1 9 9 THR CA C 9 61.400 61.400 61.413 -0.014 17919 95399 1 233 . 1 1 9 9 THR CB C 9 69.140 69.140 68.707 0.433 17919 95400 1 233 . 1 1 9 9 THR H H 9 7.630 7.630 7.505 0.125 17919 95401 1 233 . 1 1 10 10 GLY N N 10 108.890 108.890 111.026 -2.136 17919 95402 1 233 . 1 1 10 10 GLY C C 10 174.070 174.070 173.942 0.128 17919 95403 1 233 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.170 0.290 17919 95404 1 233 . 1 1 10 10 GLY H H 10 7.810 7.810 8.364 -0.554 17919 95405 1 233 . 1 1 11 11 LYS N N 11 121.600 121.600 120.555 1.045 17919 95406 1 233 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.621 -0.260 17919 95407 1 233 . 1 1 11 11 LYS C C 11 175.940 175.940 175.289 0.651 17919 95408 1 233 . 1 1 11 11 LYS CA C 11 56.280 56.280 55.162 1.118 17919 95409 1 233 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.557 -0.357 17919 95410 1 233 . 1 1 11 11 LYS H H 11 7.280 7.280 7.711 -0.431 17919 95411 1 233 . 1 1 12 12 THR N N 12 120.440 120.440 119.094 1.346 17919 95412 1 233 . 1 1 12 12 THR HA H 12 5.046 5.046 5.149 -0.103 17919 95413 1 233 . 1 1 12 12 THR C C 12 174.320 174.320 174.649 -0.329 17919 95414 1 233 . 1 1 12 12 THR CA C 12 62.390 62.390 61.537 0.853 17919 95415 1 233 . 1 1 12 12 THR CB C 12 69.910 69.910 70.016 -0.106 17919 95416 1 233 . 1 1 12 12 THR H H 12 8.650 8.650 8.301 0.349 17919 95417 1 233 . 1 1 13 13 ILE N N 13 127.110 127.110 121.737 5.373 17919 95418 1 233 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.799 -0.255 17919 95419 1 233 . 1 1 13 13 ILE C C 13 175.220 175.220 174.853 0.367 17919 95420 1 233 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.291 0.689 17919 95421 1 233 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.037 -0.087 17919 95422 1 233 . 1 1 13 13 ILE H H 13 9.450 9.450 9.183 0.267 17919 95423 1 233 . 1 1 14 14 THR N N 14 121.520 121.520 121.054 0.466 17919 95424 1 233 . 1 1 14 14 THR HA H 14 4.964 4.964 4.925 0.039 17919 95425 1 233 . 1 1 14 14 THR C C 14 173.790 173.790 173.802 -0.012 17919 95426 1 233 . 1 1 14 14 THR CA C 14 61.940 61.940 62.350 -0.410 17919 95427 1 233 . 1 1 14 14 THR CB C 14 69.650 69.650 69.693 -0.043 17919 95428 1 233 . 1 1 14 14 THR H H 14 8.710 8.710 8.444 0.266 17919 95429 1 233 . 1 1 15 15 LEU N N 15 124.800 124.800 124.137 0.663 17919 95430 1 233 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.791 -0.011 17919 95431 1 233 . 1 1 15 15 LEU C C 15 174.670 174.670 176.126 -1.456 17919 95432 1 233 . 1 1 15 15 LEU CA C 15 52.830 52.830 52.515 0.315 17919 95433 1 233 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.051 2.019 17919 95434 1 233 . 1 1 15 15 LEU H H 15 8.710 8.710 8.651 0.059 17919 95435 1 233 . 1 1 16 16 GLU N N 16 122.160 122.160 120.534 1.626 17919 95436 1 233 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.208 -0.291 17919 95437 1 233 . 1 1 16 16 GLU C C 16 175.860 175.860 175.243 0.617 17919 95438 1 233 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.230 -0.410 17919 95439 1 233 . 1 1 16 16 GLU CB C 16 29.450 29.450 31.336 -1.886 17919 95440 1 233 . 1 1 16 16 GLU H H 16 8.140 8.140 8.450 -0.310 17919 95441 1 233 . 1 1 17 17 VAL N N 17 117.210 117.210 117.351 -0.141 17919 95442 1 233 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.916 -0.202 17919 95443 1 233 . 1 1 17 17 VAL C C 17 174.160 174.160 174.250 -0.090 17919 95444 1 233 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.043 -0.613 17919 95445 1 233 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.578 0.822 17919 95446 1 233 . 1 1 17 17 VAL H H 17 8.900 8.900 8.730 0.170 17919 95447 1 233 . 1 1 18 18 GLU N N 18 118.990 118.990 121.631 -2.641 17919 95448 1 233 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.834 0.245 17919 95449 1 233 . 1 1 18 18 GLU C C 18 176.160 176.160 175.380 0.780 17919 95450 1 233 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.013 0.707 17919 95451 1 233 . 1 1 18 18 GLU CB C 18 30.310 30.310 31.898 -1.588 17919 95452 1 233 . 1 1 18 18 GLU H H 18 8.640 8.640 8.771 -0.131 17919 95453 1 233 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.244 -0.103 17919 95454 1 233 . 1 1 19 19 PRO C C 19 175.310 175.310 177.486 -2.176 17919 95455 1 233 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.374 0.096 17919 95456 1 233 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.952 -0.002 17919 95457 1 233 . 1 1 20 20 SER N N 20 103.400 103.400 110.233 -6.833 17919 95458 1 233 . 1 1 20 20 SER HA H 20 4.370 4.370 4.374 -0.004 17919 95459 1 233 . 1 1 20 20 SER C C 20 174.660 174.660 174.526 0.134 17919 95460 1 233 . 1 1 20 20 SER CA C 20 57.400 57.400 58.340 -0.940 17919 95461 1 233 . 1 1 20 20 SER CB C 20 63.370 63.370 63.102 0.268 17919 95462 1 233 . 1 1 20 20 SER H H 20 7.040 7.040 8.014 -0.974 17919 95463 1 233 . 1 1 21 21 ASP N N 21 123.480 123.480 123.327 0.153 17919 95464 1 233 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.677 0.018 17919 95465 1 233 . 1 1 21 21 ASP C C 21 176.360 176.360 175.795 0.565 17919 95466 1 233 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.706 0.994 17919 95467 1 233 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.774 -0.974 17919 95468 1 233 . 1 1 21 21 ASP H H 21 8.030 8.030 7.758 0.272 17919 95469 1 233 . 1 1 22 22 THR N N 22 108.800 108.800 112.683 -3.883 17919 95470 1 233 . 1 1 22 22 THR HA H 22 4.920 4.920 4.926 -0.006 17919 95471 1 233 . 1 1 22 22 THR C C 22 176.750 176.750 175.955 0.795 17919 95472 1 233 . 1 1 22 22 THR CA C 22 59.690 59.690 60.879 -1.189 17919 95473 1 233 . 1 1 22 22 THR CB C 22 71.200 71.200 70.531 0.669 17919 95474 1 233 . 1 1 22 22 THR H H 22 7.900 7.900 8.250 -0.350 17919 95475 1 233 . 1 1 23 23 ILE N N 23 121.190 121.190 122.385 -1.195 17919 95476 1 233 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.803 -0.146 17919 95477 1 233 . 1 1 23 23 ILE C C 23 179.040 179.040 177.519 1.521 17919 95478 1 233 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.639 -0.379 17919 95479 1 233 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.665 -2.315 17919 95480 1 233 . 1 1 23 23 ILE H H 23 8.560 8.560 8.592 -0.032 17919 95481 1 233 . 1 1 24 24 GLU N N 24 120.830 120.830 121.493 -0.663 17919 95482 1 233 . 1 1 24 24 GLU HA H 24 3.917 3.917 4.092 -0.175 17919 95483 1 233 . 1 1 24 24 GLU C C 24 178.640 178.640 179.023 -0.383 17919 95484 1 233 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.017 0.203 17919 95485 1 233 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.406 -1.126 17919 95486 1 233 . 1 1 24 24 GLU H H 24 9.760 9.760 8.166 1.594 17919 95487 1 233 . 1 1 25 25 ASN N N 25 120.570 120.570 116.578 3.992 17919 95488 1 233 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.627 -0.102 17919 95489 1 233 . 1 1 25 25 ASN C C 25 178.380 178.380 177.765 0.615 17919 95490 1 233 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.610 0.450 17919 95491 1 233 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.429 0.021 17919 95492 1 233 . 1 1 25 25 ASN H H 25 7.920 7.920 7.867 0.053 17919 95493 1 233 . 1 1 26 26 VAL N N 26 121.710 121.710 121.112 0.598 17919 95494 1 233 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.659 -0.262 17919 95495 1 233 . 1 1 26 26 VAL C C 26 177.950 177.950 177.574 0.376 17919 95496 1 233 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.269 1.391 17919 95497 1 233 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.144 -0.304 17919 95498 1 233 . 1 1 26 26 VAL H H 26 8.070 8.070 7.325 0.745 17919 95499 1 233 . 1 1 27 27 LYS N N 27 118.860 118.860 119.493 -0.633 17919 95500 1 233 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.212 0.368 17919 95501 1 233 . 1 1 27 27 LYS C C 27 180.550 180.550 179.075 1.475 17919 95502 1 233 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.425 -0.175 17919 95503 1 233 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.125 1.605 17919 95504 1 233 . 1 1 27 27 LYS H H 27 8.560 8.560 8.018 0.542 17919 95505 1 233 . 1 1 28 28 ALA N N 28 123.440 123.440 122.507 0.933 17919 95506 1 233 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.064 0.096 17919 95507 1 233 . 1 1 28 28 ALA C C 28 180.300 180.300 179.189 1.111 17919 95508 1 233 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.154 0.216 17919 95509 1 233 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.342 -0.632 17919 95510 1 233 . 1 1 28 28 ALA H H 28 8.060 8.060 8.265 -0.205 17919 95511 1 233 . 1 1 29 29 LYS N N 29 119.940 119.940 118.763 1.177 17919 95512 1 233 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.044 0.163 17919 95513 1 233 . 1 1 29 29 LYS C C 29 180.320 180.320 179.033 1.287 17919 95514 1 233 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.141 0.509 17919 95515 1 233 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.406 0.884 17919 95516 1 233 . 1 1 29 29 LYS H H 29 7.850 7.850 7.544 0.306 17919 95517 1 233 . 1 1 30 30 ILE N N 30 121.080 121.080 120.611 0.469 17919 95518 1 233 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.618 -0.111 17919 95519 1 233 . 1 1 30 30 ILE C C 30 178.310 178.310 177.195 1.115 17919 95520 1 233 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.591 0.559 17919 95521 1 233 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.861 -1.061 17919 95522 1 233 . 1 1 30 30 ILE H H 30 8.280 8.280 8.073 0.207 17919 95523 1 233 . 1 1 31 31 GLN N N 31 123.490 123.490 121.251 2.239 17919 95524 1 233 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.018 -0.189 17919 95525 1 233 . 1 1 31 31 GLN C C 31 178.890 178.890 177.993 0.897 17919 95526 1 233 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.186 0.814 17919 95527 1 233 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.556 -0.836 17919 95528 1 233 . 1 1 31 31 GLN H H 31 8.580 8.580 8.052 0.528 17919 95529 1 233 . 1 1 32 32 ASP N N 32 119.360 119.360 117.990 1.370 17919 95530 1 233 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.416 -0.062 17919 95531 1 233 . 1 1 32 32 ASP C C 32 177.250 177.250 178.028 -0.778 17919 95532 1 233 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.620 0.570 17919 95533 1 233 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.822 -0.242 17919 95534 1 233 . 1 1 32 32 ASP H H 32 8.010 8.010 7.811 0.199 17919 95535 1 233 . 1 1 33 33 LYS N N 33 115.130 115.130 117.454 -2.324 17919 95536 1 233 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.295 0.042 17919 95537 1 233 . 1 1 33 33 LYS C C 33 177.870 177.870 177.530 0.340 17919 95538 1 233 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.595 0.455 17919 95539 1 233 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.596 0.574 17919 95540 1 233 . 1 1 33 33 LYS H H 33 7.430 7.430 7.435 -0.005 17919 95541 1 233 . 1 1 34 34 GLU N N 34 113.870 113.870 117.382 -3.512 17919 95542 1 233 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.417 0.208 17919 95543 1 233 . 1 1 34 34 GLU C C 34 177.840 177.840 177.023 0.817 17919 95544 1 233 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.108 -0.938 17919 95545 1 233 . 1 1 34 34 GLU CB C 34 32.660 32.660 30.999 1.661 17919 95546 1 233 . 1 1 34 34 GLU H H 34 8.740 8.740 8.263 0.477 17919 95547 1 233 . 1 1 35 35 GLY N N 35 108.650 108.650 107.965 0.685 17919 95548 1 233 . 1 1 35 35 GLY C C 35 173.960 173.960 174.174 -0.214 17919 95549 1 233 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.317 0.763 17919 95550 1 233 . 1 1 35 35 GLY H H 35 8.530 8.530 7.986 0.544 17919 95551 1 233 . 1 1 36 36 ILE N N 36 119.880 119.880 117.582 2.298 17919 95552 1 233 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.565 -0.120 17919 95553 1 233 . 1 1 36 36 ILE C C 36 173.590 173.590 173.665 -0.075 17919 95554 1 233 . 1 1 36 36 ILE CA C 36 57.750 57.750 56.693 1.057 17919 95555 1 233 . 1 1 36 36 ILE CB C 36 40.580 40.580 37.884 2.696 17919 95556 1 233 . 1 1 36 36 ILE H H 36 6.150 6.150 7.466 -1.316 17919 95557 1 233 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.550 0.084 17919 95558 1 233 . 1 1 37 37 PRO C C 37 176.940 176.940 176.424 0.516 17919 95559 1 233 . 1 1 37 37 PRO CA C 37 61.660 61.660 62.148 -0.488 17919 95560 1 233 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.096 0.754 17919 95561 1 233 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.225 -0.108 17919 95562 1 233 . 1 1 38 38 PRO C C 38 178.320 178.320 178.470 -0.150 17919 95563 1 233 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.571 0.689 17919 95564 1 233 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.924 0.966 17919 95565 1 233 . 1 1 39 39 ASP N N 39 113.380 113.380 118.005 -4.625 17919 95566 1 233 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.422 0.008 17919 95567 1 233 . 1 1 39 39 ASP C C 39 177.090 177.090 177.411 -0.321 17919 95568 1 233 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.496 -0.856 17919 95569 1 233 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.688 -1.148 17919 95570 1 233 . 1 1 39 39 ASP H H 39 8.550 8.550 8.444 0.106 17919 95571 1 233 . 1 1 40 40 GLN N N 40 116.780 116.780 117.174 -0.394 17919 95572 1 233 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.241 0.223 17919 95573 1 233 . 1 1 40 40 GLN C C 40 175.380 175.380 176.001 -0.621 17919 95574 1 233 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.701 -1.061 17919 95575 1 233 . 1 1 40 40 GLN CB C 40 30.140 30.140 28.781 1.359 17919 95576 1 233 . 1 1 40 40 GLN H H 40 7.820 7.820 7.517 0.303 17919 95577 1 233 . 1 1 41 41 GLN N N 41 117.720 117.720 119.391 -1.671 17919 95578 1 233 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.471 -0.227 17919 95579 1 233 . 1 1 41 41 GLN C C 41 176.300 176.300 174.500 1.800 17919 95580 1 233 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.359 1.111 17919 95581 1 233 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.548 2.102 17919 95582 1 233 . 1 1 41 41 GLN H H 41 7.480 7.480 7.511 -0.031 17919 95583 1 233 . 1 1 42 42 ARG N N 42 122.680 122.680 126.235 -3.555 17919 95584 1 233 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.604 -0.104 17919 95585 1 233 . 1 1 42 42 ARG C C 42 174.050 174.050 173.758 0.292 17919 95586 1 233 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.837 0.213 17919 95587 1 233 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.066 -0.317 17919 95588 1 233 . 1 1 42 42 ARG H H 42 8.530 8.530 8.845 -0.315 17919 95589 1 233 . 1 1 43 43 LEU N N 43 124.040 124.040 126.966 -2.926 17919 95590 1 233 . 1 1 43 43 LEU C C 43 175.290 175.290 174.233 1.057 17919 95591 1 233 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.435 -1.455 17919 95592 1 233 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.852 0.938 17919 95593 1 233 . 1 1 43 43 LEU H H 43 8.820 8.820 8.746 0.074 17919 95594 1 233 . 1 1 44 44 ILE N N 44 121.920 121.920 125.821 -3.901 17919 95595 1 233 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.921 0.071 17919 95596 1 233 . 1 1 44 44 ILE C C 44 176.060 176.060 174.104 1.956 17919 95597 1 233 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.332 -1.352 17919 95598 1 233 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.306 0.114 17919 95599 1 233 . 1 1 44 44 ILE H H 44 9.030 9.030 8.153 0.877 17919 95600 1 233 . 1 1 45 45 PHE N N 45 125.390 125.390 127.662 -2.272 17919 95601 1 233 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.030 0.015 17919 95602 1 233 . 1 1 45 45 PHE C C 45 174.470 174.470 174.724 -0.254 17919 95603 1 233 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.247 0.773 17919 95604 1 233 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.973 0.787 17919 95605 1 233 . 1 1 45 45 PHE H H 45 8.830 8.830 8.652 0.178 17919 95606 1 233 . 1 1 46 46 ALA N N 46 132.200 132.200 130.912 1.288 17919 95607 1 233 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.726 -0.036 17919 95608 1 233 . 1 1 46 46 ALA C C 46 177.290 177.290 177.416 -0.126 17919 95609 1 233 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.575 -0.035 17919 95610 1 233 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.417 0.153 17919 95611 1 233 . 1 1 46 46 ALA H H 46 8.810 8.810 8.652 0.158 17919 95612 1 233 . 1 1 47 47 GLY N N 47 102.340 102.340 104.685 -2.345 17919 95613 1 233 . 1 1 47 47 GLY C C 47 173.810 173.810 174.501 -0.691 17919 95614 1 233 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.275 0.075 17919 95615 1 233 . 1 1 47 47 GLY H H 47 8.130 8.130 8.461 -0.331 17919 95616 1 233 . 1 1 48 48 LYS N N 48 121.570 121.570 121.859 -0.289 17919 95617 1 233 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.682 -0.060 17919 95618 1 233 . 1 1 48 48 LYS C C 48 174.700 174.700 175.379 -0.679 17919 95619 1 233 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.313 0.237 17919 95620 1 233 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.319 0.211 17919 95621 1 233 . 1 1 48 48 LYS H H 48 7.980 7.980 7.853 0.127 17919 95622 1 233 . 1 1 49 49 GLN N N 49 122.410 122.410 121.451 0.959 17919 95623 1 233 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.516 0.044 17919 95624 1 233 . 1 1 49 49 GLN C C 49 175.670 175.670 175.788 -0.118 17919 95625 1 233 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.987 -0.247 17919 95626 1 233 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.482 -0.482 17919 95627 1 233 . 1 1 49 49 GLN H H 49 8.600 8.600 8.453 0.147 17919 95628 1 233 . 1 1 50 50 LEU N N 50 125.520 125.520 126.892 -1.372 17919 95629 1 233 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.107 -0.017 17919 95630 1 233 . 1 1 50 50 LEU C C 50 176.660 176.660 175.590 1.070 17919 95631 1 233 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.579 0.661 17919 95632 1 233 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.247 -0.677 17919 95633 1 233 . 1 1 50 50 LEU H H 50 8.530 8.530 8.438 0.092 17919 95634 1 233 . 1 1 51 51 GLU N N 51 122.940 122.940 123.787 -0.847 17919 95635 1 233 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.491 -0.003 17919 95636 1 233 . 1 1 51 51 GLU C C 51 175.870 175.870 177.186 -1.316 17919 95637 1 233 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.094 0.866 17919 95638 1 233 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.482 -0.912 17919 95639 1 233 . 1 1 51 51 GLU H H 51 8.400 8.400 8.286 0.114 17919 95640 1 233 . 1 1 52 52 ASP N N 52 120.030 120.030 125.866 -5.836 17919 95641 1 233 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.474 -0.115 17919 95642 1 233 . 1 1 52 52 ASP C C 52 177.330 177.330 177.545 -0.215 17919 95643 1 233 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.572 -0.612 17919 95644 1 233 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.682 0.168 17919 95645 1 233 . 1 1 52 52 ASP H H 52 8.160 8.160 8.740 -0.580 17919 95646 1 233 . 1 1 53 53 GLY N N 53 106.660 106.660 105.026 1.634 17919 95647 1 233 . 1 1 53 53 GLY C C 53 174.870 174.870 174.230 0.640 17919 95648 1 233 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.934 0.236 17919 95649 1 233 . 1 1 53 53 GLY H H 53 9.390 9.390 8.574 0.816 17919 95650 1 233 . 1 1 54 54 ARG N N 54 119.050 119.050 121.027 -1.977 17919 95651 1 233 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.700 -0.005 17919 95652 1 233 . 1 1 54 54 ARG C C 54 175.350 175.350 175.264 0.086 17919 95653 1 233 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.539 -0.149 17919 95654 1 233 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.435 -0.785 17919 95655 1 233 . 1 1 54 54 ARG H H 54 7.460 7.460 7.550 -0.090 17919 95656 1 233 . 1 1 55 55 THR N N 55 108.400 108.400 111.162 -2.762 17919 95657 1 233 . 1 1 55 55 THR HA H 55 5.240 5.240 5.208 0.032 17919 95658 1 233 . 1 1 55 55 THR C C 55 176.560 176.560 176.147 0.413 17919 95659 1 233 . 1 1 55 55 THR CA C 55 59.690 59.690 59.910 -0.220 17919 95660 1 233 . 1 1 55 55 THR CB C 55 72.260 72.260 71.518 0.742 17919 95661 1 233 . 1 1 55 55 THR H H 55 8.730 8.730 8.926 -0.196 17919 95662 1 233 . 1 1 56 56 LEU N N 56 117.920 117.920 121.236 -3.316 17919 95663 1 233 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.008 0.052 17919 95664 1 233 . 1 1 56 56 LEU C C 56 180.810 180.810 178.954 1.856 17919 95665 1 233 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.232 0.478 17919 95666 1 233 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.679 -1.309 17919 95667 1 233 . 1 1 56 56 LEU H H 56 8.140 8.140 8.824 -0.684 17919 95668 1 233 . 1 1 57 57 SER N N 57 113.330 113.330 114.762 -1.432 17919 95669 1 233 . 1 1 57 57 SER HA H 57 4.370 4.370 4.220 0.150 17919 95670 1 233 . 1 1 57 57 SER C C 57 178.310 178.310 176.882 1.428 17919 95671 1 233 . 1 1 57 57 SER CA C 57 61.080 61.080 62.116 -1.036 17919 95672 1 233 . 1 1 57 57 SER CB C 57 62.530 62.530 62.946 -0.416 17919 95673 1 233 . 1 1 57 57 SER H H 57 8.470 8.470 8.497 -0.027 17919 95674 1 233 . 1 1 58 58 ASP N N 58 124.190 124.190 122.210 1.980 17919 95675 1 233 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.357 -0.061 17919 95676 1 233 . 1 1 58 58 ASP C C 58 177.400 177.400 177.291 0.109 17919 95677 1 233 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.887 0.293 17919 95678 1 233 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.511 -0.411 17919 95679 1 233 . 1 1 58 58 ASP H H 58 7.930 7.930 7.594 0.336 17919 95680 1 233 . 1 1 59 59 TYR N N 59 115.510 115.510 115.562 -0.052 17919 95681 1 233 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.672 -0.002 17919 95682 1 233 . 1 1 59 59 TYR C C 59 174.700 174.700 174.577 0.123 17919 95683 1 233 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.455 0.795 17919 95684 1 233 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.105 1.966 17919 95685 1 233 . 1 1 59 59 TYR H H 59 7.250 7.250 7.432 -0.182 17919 95686 1 233 . 1 1 60 60 ASN N N 60 115.900 115.900 115.158 0.742 17919 95687 1 233 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.395 -0.040 17919 95688 1 233 . 1 1 60 60 ASN C C 60 174.340 174.340 174.633 -0.293 17919 95689 1 233 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.047 0.073 17919 95690 1 233 . 1 1 60 60 ASN CB C 60 37.410 37.410 36.907 0.503 17919 95691 1 233 . 1 1 60 60 ASN H H 60 8.150 8.150 7.801 0.349 17919 95692 1 233 . 1 1 61 61 ILE N N 61 118.600 118.600 120.683 -2.083 17919 95693 1 233 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.537 -0.144 17919 95694 1 233 . 1 1 61 61 ILE C C 61 174.610 174.610 175.546 -0.936 17919 95695 1 233 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.858 -0.438 17919 95696 1 233 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.122 -0.382 17919 95697 1 233 . 1 1 61 61 ILE H H 61 7.250 7.250 7.907 -0.657 17919 95698 1 233 . 1 1 62 62 GLN N N 62 124.740 124.740 125.804 -1.064 17919 95699 1 233 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.585 -0.079 17919 95700 1 233 . 1 1 62 62 GLN C C 62 175.970 175.970 176.140 -0.170 17919 95701 1 233 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.794 -0.134 17919 95702 1 233 . 1 1 62 62 GLN CB C 62 31.650 31.650 30.727 0.923 17919 95703 1 233 . 1 1 62 62 GLN H H 62 7.610 7.610 8.308 -0.698 17919 95704 1 233 . 1 1 63 63 LYS N N 63 120.300 120.300 120.059 0.241 17919 95705 1 233 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.220 -0.219 17919 95706 1 233 . 1 1 63 63 LYS C C 63 175.810 175.810 177.827 -2.017 17919 95707 1 233 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.657 0.133 17919 95708 1 233 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.603 0.047 17919 95709 1 233 . 1 1 63 63 LYS H H 63 8.490 8.490 8.503 -0.013 17919 95710 1 233 . 1 1 64 64 GLU N N 64 113.950 113.950 115.800 -1.850 17919 95711 1 233 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.774 -0.309 17919 95712 1 233 . 1 1 64 64 GLU C C 64 175.250 175.250 176.862 -1.612 17919 95713 1 233 . 1 1 64 64 GLU CA C 64 57.890 57.890 58.103 -0.213 17919 95714 1 233 . 1 1 64 64 GLU CB C 64 25.900 25.900 27.846 -1.946 17919 95715 1 233 . 1 1 64 64 GLU H H 64 9.280 9.280 8.703 0.577 17919 95716 1 233 . 1 1 65 65 SER N N 65 114.730 114.730 118.074 -3.344 17919 95717 1 233 . 1 1 65 65 SER HA H 65 4.640 4.640 4.443 0.197 17919 95718 1 233 . 1 1 65 65 SER C C 65 172.160 172.160 173.997 -1.837 17919 95719 1 233 . 1 1 65 65 SER CA C 65 60.890 60.890 60.510 0.380 17919 95720 1 233 . 1 1 65 65 SER CB C 65 64.910 64.910 63.991 0.919 17919 95721 1 233 . 1 1 65 65 SER H H 65 7.670 7.670 7.369 0.301 17919 95722 1 233 . 1 1 66 66 THR N N 66 117.110 117.110 119.687 -2.577 17919 95723 1 233 . 1 1 66 66 THR HA H 66 5.270 5.270 5.248 0.022 17919 95724 1 233 . 1 1 66 66 THR C C 66 173.950 173.950 174.001 -0.051 17919 95725 1 233 . 1 1 66 66 THR CA C 66 62.340 62.340 61.663 0.676 17919 95726 1 233 . 1 1 66 66 THR CB C 66 70.080 70.080 70.883 -0.803 17919 95727 1 233 . 1 1 66 66 THR H H 66 8.730 8.730 8.551 0.179 17919 95728 1 233 . 1 1 67 67 LEU N N 67 127.110 127.110 126.281 0.829 17919 95729 1 233 . 1 1 67 67 LEU HA H 67 5.060 5.060 5.091 -0.031 17919 95730 1 233 . 1 1 67 67 LEU C C 67 175.770 175.770 175.085 0.685 17919 95731 1 233 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.957 -0.057 17919 95732 1 233 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.918 -0.658 17919 95733 1 233 . 1 1 67 67 LEU H H 67 9.410 9.410 9.130 0.280 17919 95734 1 233 . 1 1 68 68 HIS N N 68 118.380 118.380 121.897 -3.517 17919 95735 1 233 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.370 -0.130 17919 95736 1 233 . 1 1 68 68 HIS C C 68 173.150 173.150 174.169 -1.019 17919 95737 1 233 . 1 1 68 68 HIS CA C 68 55.000 55.000 53.940 1.060 17919 95738 1 233 . 1 1 68 68 HIS CB C 68 30.530 30.530 31.115 -0.585 17919 95739 1 233 . 1 1 68 68 HIS H H 68 9.230 9.230 9.210 0.020 17919 95740 1 233 . 1 1 69 69 LEU N N 69 124.460 124.460 130.759 -6.299 17919 95741 1 233 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.863 0.327 17919 95742 1 233 . 1 1 69 69 LEU C C 69 175.270 175.270 174.278 0.992 17919 95743 1 233 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.812 0.078 17919 95744 1 233 . 1 1 69 69 LEU CB C 69 44.380 44.380 43.944 0.436 17919 95745 1 233 . 1 1 69 69 LEU H H 69 8.340 8.340 8.381 -0.041 17919 95746 1 233 . 1 1 70 70 VAL N N 70 126.940 126.940 125.560 1.380 17919 95747 1 233 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.306 0.044 17919 95748 1 233 . 1 1 70 70 VAL C C 70 174.000 174.000 174.549 -0.549 17919 95749 1 233 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.505 0.295 17919 95750 1 233 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.023 -0.113 17919 95751 1 233 . 1 1 70 70 VAL H H 70 9.200 9.200 8.960 0.240 17919 95752 1 233 . 1 1 71 71 LEU N N 71 123.130 123.130 125.180 -2.050 17919 95753 1 233 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.328 -0.268 17919 95754 1 233 . 1 1 71 71 LEU C C 71 177.830 177.830 177.106 0.724 17919 95755 1 233 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.030 0.910 17919 95756 1 233 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.910 -0.060 17919 95757 1 233 . 1 1 71 71 LEU H H 71 8.120 8.120 8.377 -0.257 17919 95758 1 233 . 1 1 72 72 ARG N N 72 123.490 123.490 124.313 -0.823 17919 95759 1 233 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.425 -0.124 17919 95760 1 233 . 1 1 72 72 ARG C C 72 175.350 175.350 175.952 -0.602 17919 95761 1 233 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.946 -0.336 17919 95762 1 233 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.436 0.914 17919 95763 1 233 . 1 1 72 72 ARG H H 72 8.580 8.580 8.228 0.352 17919 95764 1 234 . 1 1 2 2 GLN N N 2 123.220 123.220 121.351 1.869 17919 95765 1 234 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.359 -0.110 17919 95766 1 234 . 1 1 2 2 GLN C C 2 175.920 175.920 174.787 1.133 17919 95767 1 234 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.674 0.406 17919 95768 1 234 . 1 1 2 2 GLN CB C 2 30.760 30.760 31.012 -0.252 17919 95769 1 234 . 1 1 2 2 GLN H H 2 8.900 8.900 8.407 0.493 17919 95770 1 234 . 1 1 3 3 ILE N N 3 115.340 115.340 118.228 -2.888 17919 95771 1 234 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.285 -0.072 17919 95772 1 234 . 1 1 3 3 ILE C C 3 172.450 172.450 173.217 -0.767 17919 95773 1 234 . 1 1 3 3 ILE CA C 3 59.570 59.570 58.766 0.805 17919 95774 1 234 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.840 0.370 17919 95775 1 234 . 1 1 3 3 ILE H H 3 8.320 8.320 8.719 -0.399 17919 95776 1 234 . 1 1 4 4 PHE N N 4 118.110 118.110 118.031 0.079 17919 95777 1 234 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.758 -0.128 17919 95778 1 234 . 1 1 4 4 PHE C C 4 175.320 175.320 175.647 -0.327 17919 95779 1 234 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.358 -0.148 17919 95780 1 234 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.249 -0.769 17919 95781 1 234 . 1 1 4 4 PHE H H 4 8.610 8.610 8.269 0.341 17919 95782 1 234 . 1 1 5 5 VAL N N 5 121.000 121.000 116.263 4.737 17919 95783 1 234 . 1 1 5 5 VAL HA H 5 4.725 4.725 5.212 -0.487 17919 95784 1 234 . 1 1 5 5 VAL C C 5 174.870 174.870 174.190 0.680 17919 95785 1 234 . 1 1 5 5 VAL CA C 5 60.620 60.620 60.202 0.418 17919 95786 1 234 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.600 -0.370 17919 95787 1 234 . 1 1 5 5 VAL H H 5 9.300 9.300 8.987 0.313 17919 95788 1 234 . 1 1 6 6 LYS N N 6 127.520 127.520 128.817 -1.297 17919 95789 1 234 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.528 -0.161 17919 95790 1 234 . 1 1 6 6 LYS C C 6 177.140 177.140 176.339 0.801 17919 95791 1 234 . 1 1 6 6 LYS CA C 6 54.520 54.520 53.945 0.575 17919 95792 1 234 . 1 1 6 6 LYS CB C 6 35.050 35.050 36.312 -1.262 17919 95793 1 234 . 1 1 6 6 LYS H H 6 8.820 8.820 9.269 -0.449 17919 95794 1 234 . 1 1 7 7 THR N N 7 115.400 115.400 118.245 -2.845 17919 95795 1 234 . 1 1 7 7 THR HA H 7 4.970 4.970 4.948 0.022 17919 95796 1 234 . 1 1 7 7 THR C C 7 176.910 176.910 176.131 0.779 17919 95797 1 234 . 1 1 7 7 THR CA C 7 60.470 60.470 60.668 -0.198 17919 95798 1 234 . 1 1 7 7 THR CB C 7 70.630 70.630 70.658 -0.028 17919 95799 1 234 . 1 1 7 7 THR H H 7 8.730 8.730 9.006 -0.276 17919 95800 1 234 . 1 1 8 8 LEU N N 8 121.330 121.330 122.961 -1.631 17919 95801 1 234 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.136 0.174 17919 95802 1 234 . 1 1 8 8 LEU C C 8 178.800 178.800 176.820 1.980 17919 95803 1 234 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.838 -0.258 17919 95804 1 234 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.238 -0.268 17919 95805 1 234 . 1 1 8 8 LEU H H 8 9.100 9.100 8.740 0.360 17919 95806 1 234 . 1 1 9 9 THR N N 9 105.590 105.590 106.176 -0.586 17919 95807 1 234 . 1 1 9 9 THR HA H 9 4.428 4.428 4.273 0.155 17919 95808 1 234 . 1 1 9 9 THR C C 9 175.520 175.520 175.453 0.067 17919 95809 1 234 . 1 1 9 9 THR CA C 9 61.400 61.400 62.241 -0.841 17919 95810 1 234 . 1 1 9 9 THR CB C 9 69.140 69.140 68.295 0.845 17919 95811 1 234 . 1 1 9 9 THR H H 9 7.630 7.630 7.694 -0.064 17919 95812 1 234 . 1 1 10 10 GLY N N 10 108.890 108.890 110.085 -1.195 17919 95813 1 234 . 1 1 10 10 GLY C C 10 174.070 174.070 174.060 0.010 17919 95814 1 234 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.064 0.396 17919 95815 1 234 . 1 1 10 10 GLY H H 10 7.810 7.810 8.004 -0.194 17919 95816 1 234 . 1 1 11 11 LYS N N 11 121.600 121.600 121.500 0.100 17919 95817 1 234 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.532 -0.171 17919 95818 1 234 . 1 1 11 11 LYS C C 11 175.940 175.940 175.603 0.337 17919 95819 1 234 . 1 1 11 11 LYS CA C 11 56.280 56.280 55.367 0.913 17919 95820 1 234 . 1 1 11 11 LYS CB C 11 33.200 33.200 34.041 -0.841 17919 95821 1 234 . 1 1 11 11 LYS H H 11 7.280 7.280 7.843 -0.563 17919 95822 1 234 . 1 1 12 12 THR N N 12 120.440 120.440 119.712 0.728 17919 95823 1 234 . 1 1 12 12 THR HA H 12 5.046 5.046 4.952 0.094 17919 95824 1 234 . 1 1 12 12 THR C C 12 174.320 174.320 173.892 0.428 17919 95825 1 234 . 1 1 12 12 THR CA C 12 62.390 62.390 61.542 0.848 17919 95826 1 234 . 1 1 12 12 THR CB C 12 69.910 69.910 70.009 -0.099 17919 95827 1 234 . 1 1 12 12 THR H H 12 8.650 8.650 8.463 0.187 17919 95828 1 234 . 1 1 13 13 ILE N N 13 127.110 127.110 128.311 -1.201 17919 95829 1 234 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.479 0.065 17919 95830 1 234 . 1 1 13 13 ILE C C 13 175.220 175.220 175.667 -0.447 17919 95831 1 234 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.957 0.023 17919 95832 1 234 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.039 -0.089 17919 95833 1 234 . 1 1 13 13 ILE H H 13 9.450 9.450 9.218 0.232 17919 95834 1 234 . 1 1 14 14 THR N N 14 121.520 121.520 119.597 1.923 17919 95835 1 234 . 1 1 14 14 THR HA H 14 4.964 4.964 4.812 0.152 17919 95836 1 234 . 1 1 14 14 THR C C 14 173.790 173.790 174.032 -0.242 17919 95837 1 234 . 1 1 14 14 THR CA C 14 61.940 61.940 61.886 0.054 17919 95838 1 234 . 1 1 14 14 THR CB C 14 69.650 69.650 69.338 0.312 17919 95839 1 234 . 1 1 14 14 THR H H 14 8.710 8.710 8.627 0.083 17919 95840 1 234 . 1 1 15 15 LEU N N 15 124.800 124.800 125.532 -0.732 17919 95841 1 234 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.762 0.018 17919 95842 1 234 . 1 1 15 15 LEU C C 15 174.670 174.670 175.005 -0.335 17919 95843 1 234 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.846 -1.016 17919 95844 1 234 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.114 1.956 17919 95845 1 234 . 1 1 15 15 LEU H H 15 8.710 8.710 8.988 -0.278 17919 95846 1 234 . 1 1 16 16 GLU N N 16 122.160 122.160 124.103 -1.943 17919 95847 1 234 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.159 -0.242 17919 95848 1 234 . 1 1 16 16 GLU C C 16 175.860 175.860 176.120 -0.260 17919 95849 1 234 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.239 -0.419 17919 95850 1 234 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.714 -1.264 17919 95851 1 234 . 1 1 16 16 GLU H H 16 8.140 8.140 8.674 -0.534 17919 95852 1 234 . 1 1 17 17 VAL N N 17 117.210 117.210 122.380 -5.170 17919 95853 1 234 . 1 1 17 17 VAL HA H 17 4.714 4.714 5.155 -0.441 17919 95854 1 234 . 1 1 17 17 VAL C C 17 174.160 174.160 174.780 -0.620 17919 95855 1 234 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.036 -0.606 17919 95856 1 234 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.459 0.942 17919 95857 1 234 . 1 1 17 17 VAL H H 17 8.900 8.900 8.751 0.149 17919 95858 1 234 . 1 1 18 18 GLU N N 18 118.990 118.990 120.862 -1.872 17919 95859 1 234 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.869 0.210 17919 95860 1 234 . 1 1 18 18 GLU C C 18 176.160 176.160 176.020 0.140 17919 95861 1 234 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.849 -0.129 17919 95862 1 234 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.433 -0.123 17919 95863 1 234 . 1 1 18 18 GLU H H 18 8.640 8.640 9.424 -0.784 17919 95864 1 234 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.250 -0.108 17919 95865 1 234 . 1 1 19 19 PRO C C 19 175.310 175.310 177.418 -2.108 17919 95866 1 234 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.645 -0.175 17919 95867 1 234 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.889 0.061 17919 95868 1 234 . 1 1 20 20 SER N N 20 103.400 103.400 109.578 -6.178 17919 95869 1 234 . 1 1 20 20 SER HA H 20 4.370 4.370 4.328 0.042 17919 95870 1 234 . 1 1 20 20 SER C C 20 174.660 174.660 174.626 0.034 17919 95871 1 234 . 1 1 20 20 SER CA C 20 57.400 57.400 58.323 -0.923 17919 95872 1 234 . 1 1 20 20 SER CB C 20 63.370 63.370 62.597 0.773 17919 95873 1 234 . 1 1 20 20 SER H H 20 7.040 7.040 8.346 -1.306 17919 95874 1 234 . 1 1 21 21 ASP N N 21 123.480 123.480 125.079 -1.599 17919 95875 1 234 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.624 0.071 17919 95876 1 234 . 1 1 21 21 ASP C C 21 176.360 176.360 176.108 0.252 17919 95877 1 234 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.648 0.052 17919 95878 1 234 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.265 -0.465 17919 95879 1 234 . 1 1 21 21 ASP H H 21 8.030 8.030 8.139 -0.109 17919 95880 1 234 . 1 1 22 22 THR N N 22 108.800 108.800 112.303 -3.503 17919 95881 1 234 . 1 1 22 22 THR HA H 22 4.920 4.920 5.035 -0.115 17919 95882 1 234 . 1 1 22 22 THR C C 22 176.750 176.750 176.601 0.149 17919 95883 1 234 . 1 1 22 22 THR CA C 22 59.690 59.690 60.608 -0.918 17919 95884 1 234 . 1 1 22 22 THR CB C 22 71.200 71.200 70.993 0.207 17919 95885 1 234 . 1 1 22 22 THR H H 22 7.900 7.900 8.024 -0.124 17919 95886 1 234 . 1 1 23 23 ILE N N 23 121.190 121.190 123.893 -2.703 17919 95887 1 234 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.596 0.061 17919 95888 1 234 . 1 1 23 23 ILE C C 23 179.040 179.040 177.728 1.312 17919 95889 1 234 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.975 -1.715 17919 95890 1 234 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.060 -1.710 17919 95891 1 234 . 1 1 23 23 ILE H H 23 8.560 8.560 9.091 -0.531 17919 95892 1 234 . 1 1 24 24 GLU N N 24 120.830 120.830 120.144 0.686 17919 95893 1 234 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.835 0.082 17919 95894 1 234 . 1 1 24 24 GLU C C 24 178.640 178.640 178.583 0.057 17919 95895 1 234 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.017 0.204 17919 95896 1 234 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.430 -1.150 17919 95897 1 234 . 1 1 24 24 GLU H H 24 9.760 9.760 8.164 1.596 17919 95898 1 234 . 1 1 25 25 ASN N N 25 120.570 120.570 117.878 2.692 17919 95899 1 234 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.482 0.043 17919 95900 1 234 . 1 1 25 25 ASN C C 25 178.380 178.380 177.908 0.472 17919 95901 1 234 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.064 -0.004 17919 95902 1 234 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.578 -0.128 17919 95903 1 234 . 1 1 25 25 ASN H H 25 7.920 7.920 7.854 0.066 17919 95904 1 234 . 1 1 26 26 VAL N N 26 121.710 121.710 120.498 1.212 17919 95905 1 234 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.641 -0.244 17919 95906 1 234 . 1 1 26 26 VAL C C 26 177.950 177.950 178.084 -0.134 17919 95907 1 234 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.412 1.248 17919 95908 1 234 . 1 1 26 26 VAL CB C 26 30.840 30.840 30.918 -0.078 17919 95909 1 234 . 1 1 26 26 VAL H H 26 8.070 8.070 8.498 -0.428 17919 95910 1 234 . 1 1 27 27 LYS N N 27 118.860 118.860 119.842 -0.982 17919 95911 1 234 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.011 0.569 17919 95912 1 234 . 1 1 27 27 LYS C C 27 180.550 180.550 179.127 1.423 17919 95913 1 234 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.718 -0.468 17919 95914 1 234 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.172 1.558 17919 95915 1 234 . 1 1 27 27 LYS H H 27 8.560 8.560 8.605 -0.045 17919 95916 1 234 . 1 1 28 28 ALA N N 28 123.440 123.440 122.160 1.280 17919 95917 1 234 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.130 0.030 17919 95918 1 234 . 1 1 28 28 ALA C C 28 180.300 180.300 179.108 1.192 17919 95919 1 234 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.951 0.419 17919 95920 1 234 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.381 -0.671 17919 95921 1 234 . 1 1 28 28 ALA H H 28 8.060 8.060 8.520 -0.460 17919 95922 1 234 . 1 1 29 29 LYS N N 29 119.940 119.940 119.536 0.404 17919 95923 1 234 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.021 0.186 17919 95924 1 234 . 1 1 29 29 LYS C C 29 180.320 180.320 179.034 1.286 17919 95925 1 234 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.468 0.182 17919 95926 1 234 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.374 0.916 17919 95927 1 234 . 1 1 29 29 LYS H H 29 7.850 7.850 8.017 -0.167 17919 95928 1 234 . 1 1 30 30 ILE N N 30 121.080 121.080 120.986 0.094 17919 95929 1 234 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.596 -0.089 17919 95930 1 234 . 1 1 30 30 ILE C C 30 178.310 178.310 177.519 0.791 17919 95931 1 234 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.953 0.197 17919 95932 1 234 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.798 -0.998 17919 95933 1 234 . 1 1 30 30 ILE H H 30 8.280 8.280 8.306 -0.026 17919 95934 1 234 . 1 1 31 31 GLN N N 31 123.490 123.490 120.058 3.432 17919 95935 1 234 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.005 -0.176 17919 95936 1 234 . 1 1 31 31 GLN C C 31 178.890 178.890 178.741 0.149 17919 95937 1 234 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.358 0.642 17919 95938 1 234 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.430 -0.710 17919 95939 1 234 . 1 1 31 31 GLN H H 31 8.580 8.580 8.011 0.569 17919 95940 1 234 . 1 1 32 32 ASP N N 32 119.360 119.360 119.329 0.031 17919 95941 1 234 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.457 -0.103 17919 95942 1 234 . 1 1 32 32 ASP C C 32 177.250 177.250 177.933 -0.683 17919 95943 1 234 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.539 0.651 17919 95944 1 234 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.945 -0.365 17919 95945 1 234 . 1 1 32 32 ASP H H 32 8.010 8.010 8.180 -0.170 17919 95946 1 234 . 1 1 33 33 LYS N N 33 115.130 115.130 118.882 -3.752 17919 95947 1 234 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.234 0.103 17919 95948 1 234 . 1 1 33 33 LYS C C 33 177.870 177.870 178.326 -0.456 17919 95949 1 234 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.317 -0.267 17919 95950 1 234 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.412 0.758 17919 95951 1 234 . 1 1 33 33 LYS H H 33 7.430 7.430 7.848 -0.418 17919 95952 1 234 . 1 1 34 34 GLU N N 34 113.870 113.870 114.303 -0.433 17919 95953 1 234 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.535 0.090 17919 95954 1 234 . 1 1 34 34 GLU C C 34 177.840 177.840 176.097 1.743 17919 95955 1 234 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.789 -0.619 17919 95956 1 234 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.259 1.401 17919 95957 1 234 . 1 1 34 34 GLU H H 34 8.740 8.740 8.152 0.588 17919 95958 1 234 . 1 1 35 35 GLY N N 35 108.650 108.650 108.466 0.184 17919 95959 1 234 . 1 1 35 35 GLY C C 35 173.960 173.960 174.756 -0.796 17919 95960 1 234 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.624 0.456 17919 95961 1 234 . 1 1 35 35 GLY H H 35 8.530 8.530 7.917 0.613 17919 95962 1 234 . 1 1 36 36 ILE N N 36 119.880 119.880 121.603 -1.723 17919 95963 1 234 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.176 0.269 17919 95964 1 234 . 1 1 36 36 ILE C C 36 173.590 173.590 174.028 -0.438 17919 95965 1 234 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.081 -0.331 17919 95966 1 234 . 1 1 36 36 ILE CB C 36 40.580 40.580 36.560 4.020 17919 95967 1 234 . 1 1 36 36 ILE H H 36 6.150 6.150 7.479 -1.329 17919 95968 1 234 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.775 -0.141 17919 95969 1 234 . 1 1 37 37 PRO C C 37 176.940 176.940 175.964 0.976 17919 95970 1 234 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.405 0.255 17919 95971 1 234 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.522 0.328 17919 95972 1 234 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.118 -0.001 17919 95973 1 234 . 1 1 38 38 PRO C C 38 178.320 178.320 178.692 -0.372 17919 95974 1 234 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.932 0.328 17919 95975 1 234 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.904 0.986 17919 95976 1 234 . 1 1 39 39 ASP N N 39 113.380 113.380 115.576 -2.196 17919 95977 1 234 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.390 0.040 17919 95978 1 234 . 1 1 39 39 ASP C C 39 177.090 177.090 177.597 -0.507 17919 95979 1 234 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.938 -1.298 17919 95980 1 234 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.389 -0.849 17919 95981 1 234 . 1 1 39 39 ASP H H 39 8.550 8.550 8.871 -0.321 17919 95982 1 234 . 1 1 40 40 GLN N N 40 116.780 116.780 116.514 0.266 17919 95983 1 234 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.292 0.172 17919 95984 1 234 . 1 1 40 40 GLN C C 40 175.380 175.380 175.025 0.355 17919 95985 1 234 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.934 -0.294 17919 95986 1 234 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.370 0.770 17919 95987 1 234 . 1 1 40 40 GLN H H 40 7.820 7.820 7.588 0.232 17919 95988 1 234 . 1 1 41 41 GLN N N 41 117.720 117.720 116.926 0.794 17919 95989 1 234 . 1 1 41 41 GLN HA H 41 4.244 4.244 5.129 -0.885 17919 95990 1 234 . 1 1 41 41 GLN C C 41 176.300 176.300 174.698 1.602 17919 95991 1 234 . 1 1 41 41 GLN CA C 41 56.470 56.470 53.959 2.511 17919 95992 1 234 . 1 1 41 41 GLN CB C 41 31.650 31.650 32.102 -0.452 17919 95993 1 234 . 1 1 41 41 GLN H H 41 7.480 7.480 7.464 0.016 17919 95994 1 234 . 1 1 42 42 ARG N N 42 122.680 122.680 120.283 2.397 17919 95995 1 234 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.756 -0.256 17919 95996 1 234 . 1 1 42 42 ARG C C 42 174.050 174.050 174.373 -0.323 17919 95997 1 234 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.409 0.641 17919 95998 1 234 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.563 -1.813 17919 95999 1 234 . 1 1 42 42 ARG H H 42 8.530 8.530 8.406 0.124 17919 96000 1 234 . 1 1 43 43 LEU N N 43 124.040 124.040 121.885 2.155 17919 96001 1 234 . 1 1 43 43 LEU C C 43 175.290 175.290 175.629 -0.339 17919 96002 1 234 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.627 -0.647 17919 96003 1 234 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.796 0.994 17919 96004 1 234 . 1 1 43 43 LEU H H 43 8.820 8.820 8.680 0.140 17919 96005 1 234 . 1 1 44 44 ILE N N 44 121.920 121.920 120.797 1.123 17919 96006 1 234 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.177 -0.185 17919 96007 1 234 . 1 1 44 44 ILE C C 44 176.060 176.060 174.271 1.789 17919 96008 1 234 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.437 -1.457 17919 96009 1 234 . 1 1 44 44 ILE CB C 44 41.420 41.420 42.265 -0.845 17919 96010 1 234 . 1 1 44 44 ILE H H 44 9.030 9.030 8.501 0.529 17919 96011 1 234 . 1 1 45 45 PHE N N 45 125.390 125.390 125.953 -0.563 17919 96012 1 234 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.004 0.041 17919 96013 1 234 . 1 1 45 45 PHE C C 45 174.470 174.470 174.313 0.157 17919 96014 1 234 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.803 0.217 17919 96015 1 234 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.067 0.693 17919 96016 1 234 . 1 1 45 45 PHE H H 45 8.830 8.830 8.828 0.002 17919 96017 1 234 . 1 1 46 46 ALA N N 46 132.200 132.200 129.306 2.894 17919 96018 1 234 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.541 0.149 17919 96019 1 234 . 1 1 46 46 ALA C C 46 177.290 177.290 177.333 -0.043 17919 96020 1 234 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.919 -0.379 17919 96021 1 234 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.820 -0.250 17919 96022 1 234 . 1 1 46 46 ALA H H 46 8.810 8.810 8.465 0.345 17919 96023 1 234 . 1 1 47 47 GLY N N 47 102.340 102.340 103.638 -1.298 17919 96024 1 234 . 1 1 47 47 GLY C C 47 173.810 173.810 174.442 -0.632 17919 96025 1 234 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.305 0.045 17919 96026 1 234 . 1 1 47 47 GLY H H 47 8.130 8.130 8.306 -0.176 17919 96027 1 234 . 1 1 48 48 LYS N N 48 121.570 121.570 121.816 -0.246 17919 96028 1 234 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.640 -0.018 17919 96029 1 234 . 1 1 48 48 LYS C C 48 174.700 174.700 175.313 -0.613 17919 96030 1 234 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.909 -0.359 17919 96031 1 234 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.394 0.136 17919 96032 1 234 . 1 1 48 48 LYS H H 48 7.980 7.980 7.933 0.047 17919 96033 1 234 . 1 1 49 49 GLN N N 49 122.410 122.410 123.419 -1.009 17919 96034 1 234 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.570 -0.010 17919 96035 1 234 . 1 1 49 49 GLN C C 49 175.670 175.670 175.362 0.308 17919 96036 1 234 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.647 0.093 17919 96037 1 234 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.478 -0.478 17919 96038 1 234 . 1 1 49 49 GLN H H 49 8.600 8.600 8.526 0.074 17919 96039 1 234 . 1 1 50 50 LEU N N 50 125.520 125.520 124.995 0.525 17919 96040 1 234 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.406 -0.316 17919 96041 1 234 . 1 1 50 50 LEU C C 50 176.660 176.660 176.163 0.497 17919 96042 1 234 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.945 0.295 17919 96043 1 234 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.329 -0.759 17919 96044 1 234 . 1 1 50 50 LEU H H 50 8.530 8.530 8.684 -0.154 17919 96045 1 234 . 1 1 51 51 GLU N N 51 122.940 122.940 123.106 -0.166 17919 96046 1 234 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.560 -0.072 17919 96047 1 234 . 1 1 51 51 GLU C C 51 175.870 175.870 176.579 -0.709 17919 96048 1 234 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.394 0.566 17919 96049 1 234 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.957 -0.387 17919 96050 1 234 . 1 1 51 51 GLU H H 51 8.400 8.400 8.516 -0.116 17919 96051 1 234 . 1 1 52 52 ASP N N 52 120.030 120.030 125.024 -4.994 17919 96052 1 234 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.445 -0.086 17919 96053 1 234 . 1 1 52 52 ASP C C 52 177.330 177.330 178.071 -0.741 17919 96054 1 234 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.616 -0.656 17919 96055 1 234 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.703 0.147 17919 96056 1 234 . 1 1 52 52 ASP H H 52 8.160 8.160 8.828 -0.668 17919 96057 1 234 . 1 1 53 53 GLY N N 53 106.660 106.660 105.744 0.916 17919 96058 1 234 . 1 1 53 53 GLY C C 53 174.870 174.870 174.747 0.123 17919 96059 1 234 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.966 0.204 17919 96060 1 234 . 1 1 53 53 GLY H H 53 9.390 9.390 8.515 0.875 17919 96061 1 234 . 1 1 54 54 ARG N N 54 119.050 119.050 119.983 -0.933 17919 96062 1 234 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.634 0.061 17919 96063 1 234 . 1 1 54 54 ARG C C 54 175.350 175.350 174.997 0.353 17919 96064 1 234 . 1 1 54 54 ARG CA C 54 54.390 54.390 55.145 -0.755 17919 96065 1 234 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.222 -0.572 17919 96066 1 234 . 1 1 54 54 ARG H H 54 7.460 7.460 7.580 -0.120 17919 96067 1 234 . 1 1 55 55 THR N N 55 108.400 108.400 112.352 -3.952 17919 96068 1 234 . 1 1 55 55 THR HA H 55 5.240 5.240 5.250 -0.010 17919 96069 1 234 . 1 1 55 55 THR C C 55 176.560 176.560 176.203 0.357 17919 96070 1 234 . 1 1 55 55 THR CA C 55 59.690 59.690 60.041 -0.351 17919 96071 1 234 . 1 1 55 55 THR CB C 55 72.260 72.260 70.916 1.344 17919 96072 1 234 . 1 1 55 55 THR H H 55 8.730 8.730 9.374 -0.644 17919 96073 1 234 . 1 1 56 56 LEU N N 56 117.920 117.920 122.294 -4.374 17919 96074 1 234 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.960 0.100 17919 96075 1 234 . 1 1 56 56 LEU C C 56 180.810 180.810 178.824 1.986 17919 96076 1 234 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.529 0.181 17919 96077 1 234 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.252 -0.882 17919 96078 1 234 . 1 1 56 56 LEU H H 56 8.140 8.140 8.420 -0.280 17919 96079 1 234 . 1 1 57 57 SER N N 57 113.330 113.330 115.069 -1.739 17919 96080 1 234 . 1 1 57 57 SER HA H 57 4.370 4.370 4.106 0.264 17919 96081 1 234 . 1 1 57 57 SER C C 57 178.310 178.310 176.737 1.573 17919 96082 1 234 . 1 1 57 57 SER CA C 57 61.080 61.080 62.174 -1.094 17919 96083 1 234 . 1 1 57 57 SER CB C 57 62.530 62.530 62.412 0.118 17919 96084 1 234 . 1 1 57 57 SER H H 57 8.470 8.470 8.060 0.410 17919 96085 1 234 . 1 1 58 58 ASP N N 58 124.190 124.190 121.793 2.397 17919 96086 1 234 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.308 -0.012 17919 96087 1 234 . 1 1 58 58 ASP C C 58 177.400 177.400 177.048 0.352 17919 96088 1 234 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.707 0.473 17919 96089 1 234 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.384 -0.284 17919 96090 1 234 . 1 1 58 58 ASP H H 58 7.930 7.930 7.872 0.058 17919 96091 1 234 . 1 1 59 59 TYR N N 59 115.510 115.510 115.663 -0.153 17919 96092 1 234 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.612 0.058 17919 96093 1 234 . 1 1 59 59 TYR C C 59 174.700 174.700 174.743 -0.043 17919 96094 1 234 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.414 0.836 17919 96095 1 234 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.193 1.877 17919 96096 1 234 . 1 1 59 59 TYR H H 59 7.250 7.250 7.169 0.081 17919 96097 1 234 . 1 1 60 60 ASN N N 60 115.900 115.900 116.240 -0.340 17919 96098 1 234 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.318 0.037 17919 96099 1 234 . 1 1 60 60 ASN C C 60 174.340 174.340 174.451 -0.111 17919 96100 1 234 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.418 -0.298 17919 96101 1 234 . 1 1 60 60 ASN CB C 60 37.410 37.410 36.589 0.821 17919 96102 1 234 . 1 1 60 60 ASN H H 60 8.150 8.150 8.420 -0.270 17919 96103 1 234 . 1 1 61 61 ILE N N 61 118.600 118.600 119.222 -0.622 17919 96104 1 234 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.880 -0.487 17919 96105 1 234 . 1 1 61 61 ILE C C 61 174.610 174.610 175.168 -0.558 17919 96106 1 234 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.285 1.135 17919 96107 1 234 . 1 1 61 61 ILE CB C 61 36.740 36.740 38.437 -1.697 17919 96108 1 234 . 1 1 61 61 ILE H H 61 7.250 7.250 7.614 -0.364 17919 96109 1 234 . 1 1 62 62 GLN N N 62 124.740 124.740 125.460 -0.720 17919 96110 1 234 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.845 -0.339 17919 96111 1 234 . 1 1 62 62 GLN C C 62 175.970 175.970 175.549 0.421 17919 96112 1 234 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.245 0.415 17919 96113 1 234 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.689 -0.039 17919 96114 1 234 . 1 1 62 62 GLN H H 62 7.610 7.610 8.042 -0.432 17919 96115 1 234 . 1 1 63 63 LYS N N 63 120.300 120.300 121.105 -0.805 17919 96116 1 234 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.988 0.013 17919 96117 1 234 . 1 1 63 63 LYS C C 63 175.810 175.810 176.941 -1.131 17919 96118 1 234 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.993 -0.203 17919 96119 1 234 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.852 0.798 17919 96120 1 234 . 1 1 63 63 LYS H H 63 8.490 8.490 8.578 -0.088 17919 96121 1 234 . 1 1 64 64 GLU N N 64 113.950 113.950 119.216 -5.266 17919 96122 1 234 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.645 -0.180 17919 96123 1 234 . 1 1 64 64 GLU C C 64 175.250 175.250 175.996 -0.746 17919 96124 1 234 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.457 0.433 17919 96125 1 234 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.559 -2.659 17919 96126 1 234 . 1 1 64 64 GLU H H 64 9.280 9.280 8.809 0.471 17919 96127 1 234 . 1 1 65 65 SER N N 65 114.730 114.730 115.089 -0.359 17919 96128 1 234 . 1 1 65 65 SER HA H 65 4.640 4.640 4.428 0.212 17919 96129 1 234 . 1 1 65 65 SER C C 65 172.160 172.160 173.836 -1.676 17919 96130 1 234 . 1 1 65 65 SER CA C 65 60.890 60.890 60.621 0.269 17919 96131 1 234 . 1 1 65 65 SER CB C 65 64.910 64.910 64.209 0.701 17919 96132 1 234 . 1 1 65 65 SER H H 65 7.670 7.670 7.256 0.414 17919 96133 1 234 . 1 1 66 66 THR N N 66 117.110 117.110 120.046 -2.936 17919 96134 1 234 . 1 1 66 66 THR HA H 66 5.270 5.270 5.013 0.257 17919 96135 1 234 . 1 1 66 66 THR C C 66 173.950 173.950 174.017 -0.067 17919 96136 1 234 . 1 1 66 66 THR CA C 66 62.340 62.340 61.370 0.970 17919 96137 1 234 . 1 1 66 66 THR CB C 66 70.080 70.080 70.555 -0.474 17919 96138 1 234 . 1 1 66 66 THR H H 66 8.730 8.730 8.568 0.162 17919 96139 1 234 . 1 1 67 67 LEU N N 67 127.110 127.110 127.979 -0.869 17919 96140 1 234 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.976 0.084 17919 96141 1 234 . 1 1 67 67 LEU C C 67 175.770 175.770 175.573 0.197 17919 96142 1 234 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.115 -0.215 17919 96143 1 234 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.796 0.464 17919 96144 1 234 . 1 1 67 67 LEU H H 67 9.410 9.410 8.782 0.628 17919 96145 1 234 . 1 1 68 68 HIS N N 68 118.380 118.380 121.721 -3.341 17919 96146 1 234 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.306 -0.066 17919 96147 1 234 . 1 1 68 68 HIS C C 68 173.150 173.150 173.672 -0.522 17919 96148 1 234 . 1 1 68 68 HIS CA C 68 55.000 55.000 53.841 1.159 17919 96149 1 234 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.074 -1.544 17919 96150 1 234 . 1 1 68 68 HIS H H 68 9.230 9.230 8.451 0.779 17919 96151 1 234 . 1 1 69 69 LEU N N 69 124.460 124.460 130.970 -6.510 17919 96152 1 234 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.233 -0.043 17919 96153 1 234 . 1 1 69 69 LEU C C 69 175.270 175.270 174.488 0.782 17919 96154 1 234 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.648 0.242 17919 96155 1 234 . 1 1 69 69 LEU CB C 69 44.380 44.380 43.848 0.532 17919 96156 1 234 . 1 1 69 69 LEU H H 69 8.340 8.340 8.927 -0.587 17919 96157 1 234 . 1 1 70 70 VAL N N 70 126.940 126.940 127.960 -1.020 17919 96158 1 234 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.416 -0.066 17919 96159 1 234 . 1 1 70 70 VAL C C 70 174.000 174.000 174.488 -0.488 17919 96160 1 234 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.824 -0.024 17919 96161 1 234 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.114 -0.204 17919 96162 1 234 . 1 1 70 70 VAL H H 70 9.200 9.200 8.267 0.933 17919 96163 1 234 . 1 1 71 71 LEU N N 71 123.130 123.130 124.533 -1.403 17919 96164 1 234 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.156 -0.096 17919 96165 1 234 . 1 1 71 71 LEU C C 71 177.830 177.830 177.166 0.664 17919 96166 1 234 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.743 0.197 17919 96167 1 234 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.585 -0.735 17919 96168 1 234 . 1 1 71 71 LEU H H 71 8.120 8.120 8.473 -0.353 17919 96169 1 234 . 1 1 72 72 ARG N N 72 123.490 123.490 122.475 1.015 17919 96170 1 234 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.424 -0.123 17919 96171 1 234 . 1 1 72 72 ARG C C 72 175.350 175.350 176.819 -1.469 17919 96172 1 234 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.330 0.280 17919 96173 1 234 . 1 1 72 72 ARG CB C 72 31.350 31.350 28.720 2.630 17919 96174 1 234 . 1 1 72 72 ARG H H 72 8.580 8.580 8.600 -0.020 17919 96175 1 235 . 1 1 2 2 GLN N N 2 123.220 123.220 121.883 1.337 17919 96176 1 235 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.047 0.202 17919 96177 1 235 . 1 1 2 2 GLN C C 2 175.920 175.920 175.139 0.781 17919 96178 1 235 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.870 0.210 17919 96179 1 235 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.355 0.405 17919 96180 1 235 . 1 1 2 2 GLN H H 2 8.900 8.900 8.482 0.418 17919 96181 1 235 . 1 1 3 3 ILE N N 3 115.340 115.340 116.256 -0.916 17919 96182 1 235 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.844 -0.631 17919 96183 1 235 . 1 1 3 3 ILE C C 3 172.450 172.450 173.296 -0.846 17919 96184 1 235 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.453 0.117 17919 96185 1 235 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.958 0.252 17919 96186 1 235 . 1 1 3 3 ILE H H 3 8.320 8.320 8.225 0.095 17919 96187 1 235 . 1 1 4 4 PHE N N 4 118.110 118.110 120.568 -2.458 17919 96188 1 235 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.628 0.002 17919 96189 1 235 . 1 1 4 4 PHE C C 4 175.320 175.320 175.079 0.241 17919 96190 1 235 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.703 -0.493 17919 96191 1 235 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.727 -1.247 17919 96192 1 235 . 1 1 4 4 PHE H H 4 8.610 8.610 8.234 0.376 17919 96193 1 235 . 1 1 5 5 VAL N N 5 121.000 121.000 120.438 0.562 17919 96194 1 235 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.879 -0.154 17919 96195 1 235 . 1 1 5 5 VAL C C 5 174.870 174.870 174.804 0.066 17919 96196 1 235 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.442 -0.822 17919 96197 1 235 . 1 1 5 5 VAL CB C 5 34.230 34.230 35.116 -0.886 17919 96198 1 235 . 1 1 5 5 VAL H H 5 9.300 9.300 9.218 0.082 17919 96199 1 235 . 1 1 6 6 LYS N N 6 127.520 127.520 128.160 -0.640 17919 96200 1 235 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.459 -0.092 17919 96201 1 235 . 1 1 6 6 LYS C C 6 177.140 177.140 176.794 0.346 17919 96202 1 235 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.859 -0.339 17919 96203 1 235 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.742 0.308 17919 96204 1 235 . 1 1 6 6 LYS H H 6 8.820 8.820 9.361 -0.541 17919 96205 1 235 . 1 1 7 7 THR N N 7 115.400 115.400 116.815 -1.415 17919 96206 1 235 . 1 1 7 7 THR HA H 7 4.970 4.970 4.487 0.483 17919 96207 1 235 . 1 1 7 7 THR C C 7 176.910 176.910 176.074 0.836 17919 96208 1 235 . 1 1 7 7 THR CA C 7 60.470 60.470 61.225 -0.755 17919 96209 1 235 . 1 1 7 7 THR CB C 7 70.630 70.630 70.124 0.506 17919 96210 1 235 . 1 1 7 7 THR H H 7 8.730 8.730 8.959 -0.229 17919 96211 1 235 . 1 1 8 8 LEU N N 8 121.330 121.330 121.639 -0.309 17919 96212 1 235 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.546 -0.236 17919 96213 1 235 . 1 1 8 8 LEU C C 8 178.800 178.800 177.296 1.504 17919 96214 1 235 . 1 1 8 8 LEU CA C 8 57.580 57.580 56.332 1.248 17919 96215 1 235 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.277 -0.307 17919 96216 1 235 . 1 1 8 8 LEU H H 8 9.100 9.100 8.762 0.338 17919 96217 1 235 . 1 1 9 9 THR N N 9 105.590 105.590 110.116 -4.526 17919 96218 1 235 . 1 1 9 9 THR HA H 9 4.428 4.428 4.350 0.078 17919 96219 1 235 . 1 1 9 9 THR C C 9 175.520 175.520 175.599 -0.079 17919 96220 1 235 . 1 1 9 9 THR CA C 9 61.400 61.400 61.646 -0.246 17919 96221 1 235 . 1 1 9 9 THR CB C 9 69.140 69.140 69.444 -0.304 17919 96222 1 235 . 1 1 9 9 THR H H 9 7.630 7.630 7.578 0.052 17919 96223 1 235 . 1 1 10 10 GLY N N 10 108.890 108.890 111.631 -2.741 17919 96224 1 235 . 1 1 10 10 GLY C C 10 174.070 174.070 173.619 0.451 17919 96225 1 235 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.265 0.195 17919 96226 1 235 . 1 1 10 10 GLY H H 10 7.810 7.810 7.891 -0.081 17919 96227 1 235 . 1 1 11 11 LYS N N 11 121.600 121.600 120.741 0.859 17919 96228 1 235 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.615 -0.254 17919 96229 1 235 . 1 1 11 11 LYS C C 11 175.940 175.940 175.303 0.637 17919 96230 1 235 . 1 1 11 11 LYS CA C 11 56.280 56.280 55.279 1.001 17919 96231 1 235 . 1 1 11 11 LYS CB C 11 33.200 33.200 34.468 -1.268 17919 96232 1 235 . 1 1 11 11 LYS H H 11 7.280 7.280 7.688 -0.408 17919 96233 1 235 . 1 1 12 12 THR N N 12 120.440 120.440 118.174 2.266 17919 96234 1 235 . 1 1 12 12 THR HA H 12 5.046 5.046 5.391 -0.345 17919 96235 1 235 . 1 1 12 12 THR C C 12 174.320 174.320 174.027 0.293 17919 96236 1 235 . 1 1 12 12 THR CA C 12 62.390 62.390 61.021 1.369 17919 96237 1 235 . 1 1 12 12 THR CB C 12 69.910 69.910 70.790 -0.880 17919 96238 1 235 . 1 1 12 12 THR H H 12 8.650 8.650 8.291 0.359 17919 96239 1 235 . 1 1 13 13 ILE N N 13 127.110 127.110 121.618 5.492 17919 96240 1 235 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.746 -0.202 17919 96241 1 235 . 1 1 13 13 ILE C C 13 175.220 175.220 174.434 0.786 17919 96242 1 235 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.161 0.819 17919 96243 1 235 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.515 -0.565 17919 96244 1 235 . 1 1 13 13 ILE H H 13 9.450 9.450 9.273 0.177 17919 96245 1 235 . 1 1 14 14 THR N N 14 121.520 121.520 121.130 0.390 17919 96246 1 235 . 1 1 14 14 THR HA H 14 4.964 4.964 4.744 0.220 17919 96247 1 235 . 1 1 14 14 THR C C 14 173.790 173.790 173.866 -0.076 17919 96248 1 235 . 1 1 14 14 THR CA C 14 61.940 61.940 62.389 -0.449 17919 96249 1 235 . 1 1 14 14 THR CB C 14 69.650 69.650 69.544 0.106 17919 96250 1 235 . 1 1 14 14 THR H H 14 8.710 8.710 8.587 0.123 17919 96251 1 235 . 1 1 15 15 LEU N N 15 124.800 124.800 125.291 -0.491 17919 96252 1 235 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.743 0.037 17919 96253 1 235 . 1 1 15 15 LEU C C 15 174.670 174.670 175.160 -0.490 17919 96254 1 235 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.670 -0.840 17919 96255 1 235 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.266 1.804 17919 96256 1 235 . 1 1 15 15 LEU H H 15 8.710 8.710 8.958 -0.248 17919 96257 1 235 . 1 1 16 16 GLU N N 16 122.160 122.160 122.099 0.061 17919 96258 1 235 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.384 -0.467 17919 96259 1 235 . 1 1 16 16 GLU C C 16 175.860 175.860 175.908 -0.048 17919 96260 1 235 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.186 -0.366 17919 96261 1 235 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.937 -1.487 17919 96262 1 235 . 1 1 16 16 GLU H H 16 8.140 8.140 8.642 -0.502 17919 96263 1 235 . 1 1 17 17 VAL N N 17 117.210 117.210 117.914 -0.704 17919 96264 1 235 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.908 -0.194 17919 96265 1 235 . 1 1 17 17 VAL C C 17 174.160 174.160 174.633 -0.473 17919 96266 1 235 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.224 -0.794 17919 96267 1 235 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.794 0.607 17919 96268 1 235 . 1 1 17 17 VAL H H 17 8.900 8.900 8.862 0.038 17919 96269 1 235 . 1 1 18 18 GLU N N 18 118.990 118.990 121.920 -2.930 17919 96270 1 235 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.774 0.305 17919 96271 1 235 . 1 1 18 18 GLU C C 18 176.160 176.160 175.086 1.074 17919 96272 1 235 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.893 -0.173 17919 96273 1 235 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.467 -0.157 17919 96274 1 235 . 1 1 18 18 GLU H H 18 8.640 8.640 8.711 -0.071 17919 96275 1 235 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.271 -0.130 17919 96276 1 235 . 1 1 19 19 PRO C C 19 175.310 175.310 178.072 -2.762 17919 96277 1 235 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.326 0.144 17919 96278 1 235 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.886 0.064 17919 96279 1 235 . 1 1 20 20 SER N N 20 103.400 103.400 109.724 -6.324 17919 96280 1 235 . 1 1 20 20 SER HA H 20 4.370 4.370 4.264 0.106 17919 96281 1 235 . 1 1 20 20 SER C C 20 174.660 174.660 174.321 0.339 17919 96282 1 235 . 1 1 20 20 SER CA C 20 57.400 57.400 58.733 -1.333 17919 96283 1 235 . 1 1 20 20 SER CB C 20 63.370 63.370 62.676 0.694 17919 96284 1 235 . 1 1 20 20 SER H H 20 7.040 7.040 8.104 -1.064 17919 96285 1 235 . 1 1 21 21 ASP N N 21 123.480 123.480 124.156 -0.676 17919 96286 1 235 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.769 -0.074 17919 96287 1 235 . 1 1 21 21 ASP C C 21 176.360 176.360 176.116 0.244 17919 96288 1 235 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.700 1.000 17919 96289 1 235 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.670 -0.870 17919 96290 1 235 . 1 1 21 21 ASP H H 21 8.030 8.030 7.647 0.383 17919 96291 1 235 . 1 1 22 22 THR N N 22 108.800 108.800 113.562 -4.762 17919 96292 1 235 . 1 1 22 22 THR HA H 22 4.920 4.920 4.699 0.221 17919 96293 1 235 . 1 1 22 22 THR C C 22 176.750 176.750 176.125 0.625 17919 96294 1 235 . 1 1 22 22 THR CA C 22 59.690 59.690 62.163 -2.473 17919 96295 1 235 . 1 1 22 22 THR CB C 22 71.200 71.200 70.483 0.717 17919 96296 1 235 . 1 1 22 22 THR H H 22 7.900 7.900 8.312 -0.412 17919 96297 1 235 . 1 1 23 23 ILE N N 23 121.190 121.190 123.394 -2.204 17919 96298 1 235 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.769 -0.112 17919 96299 1 235 . 1 1 23 23 ILE C C 23 179.040 179.040 177.797 1.243 17919 96300 1 235 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.251 -0.991 17919 96301 1 235 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.472 -2.122 17919 96302 1 235 . 1 1 23 23 ILE H H 23 8.560 8.560 9.029 -0.469 17919 96303 1 235 . 1 1 24 24 GLU N N 24 120.830 120.830 120.875 -0.045 17919 96304 1 235 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.843 0.074 17919 96305 1 235 . 1 1 24 24 GLU C C 24 178.640 178.640 178.715 -0.075 17919 96306 1 235 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.363 -0.143 17919 96307 1 235 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.321 -1.041 17919 96308 1 235 . 1 1 24 24 GLU H H 24 9.760 9.760 8.422 1.338 17919 96309 1 235 . 1 1 25 25 ASN N N 25 120.570 120.570 117.198 3.372 17919 96310 1 235 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.523 0.002 17919 96311 1 235 . 1 1 25 25 ASN C C 25 178.380 178.380 178.083 0.297 17919 96312 1 235 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.996 0.064 17919 96313 1 235 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.560 -0.110 17919 96314 1 235 . 1 1 25 25 ASN H H 25 7.920 7.920 7.574 0.346 17919 96315 1 235 . 1 1 26 26 VAL N N 26 121.710 121.710 120.634 1.076 17919 96316 1 235 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.617 -0.220 17919 96317 1 235 . 1 1 26 26 VAL C C 26 177.950 177.950 177.540 0.410 17919 96318 1 235 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.882 0.778 17919 96319 1 235 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.256 -0.416 17919 96320 1 235 . 1 1 26 26 VAL H H 26 8.070 8.070 8.047 0.023 17919 96321 1 235 . 1 1 27 27 LYS N N 27 118.860 118.860 120.063 -1.203 17919 96322 1 235 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.185 0.395 17919 96323 1 235 . 1 1 27 27 LYS C C 27 180.550 180.550 178.958 1.592 17919 96324 1 235 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.274 -0.024 17919 96325 1 235 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.296 1.434 17919 96326 1 235 . 1 1 27 27 LYS H H 27 8.560 8.560 8.057 0.503 17919 96327 1 235 . 1 1 28 28 ALA N N 28 123.440 123.440 122.950 0.490 17919 96328 1 235 . 1 1 28 28 ALA HA H 28 4.160 4.160 3.984 0.176 17919 96329 1 235 . 1 1 28 28 ALA C C 28 180.300 180.300 178.928 1.372 17919 96330 1 235 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.513 -0.143 17919 96331 1 235 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.360 -0.650 17919 96332 1 235 . 1 1 28 28 ALA H H 28 8.060 8.060 8.583 -0.523 17919 96333 1 235 . 1 1 29 29 LYS N N 29 119.940 119.940 118.031 1.909 17919 96334 1 235 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.059 0.148 17919 96335 1 235 . 1 1 29 29 LYS C C 29 180.320 180.320 178.982 1.338 17919 96336 1 235 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.228 0.422 17919 96337 1 235 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.419 0.871 17919 96338 1 235 . 1 1 29 29 LYS H H 29 7.850 7.850 7.565 0.285 17919 96339 1 235 . 1 1 30 30 ILE N N 30 121.080 121.080 121.190 -0.110 17919 96340 1 235 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.617 -0.110 17919 96341 1 235 . 1 1 30 30 ILE C C 30 178.310 178.310 177.479 0.831 17919 96342 1 235 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.345 0.805 17919 96343 1 235 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.649 -0.849 17919 96344 1 235 . 1 1 30 30 ILE H H 30 8.280 8.280 8.116 0.164 17919 96345 1 235 . 1 1 31 31 GLN N N 31 123.490 123.490 120.925 2.565 17919 96346 1 235 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.915 -0.086 17919 96347 1 235 . 1 1 31 31 GLN C C 31 178.890 178.890 178.637 0.253 17919 96348 1 235 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.333 0.667 17919 96349 1 235 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.085 -0.365 17919 96350 1 235 . 1 1 31 31 GLN H H 31 8.580 8.580 8.046 0.534 17919 96351 1 235 . 1 1 32 32 ASP N N 32 119.360 119.360 118.958 0.402 17919 96352 1 235 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.383 -0.029 17919 96353 1 235 . 1 1 32 32 ASP C C 32 177.250 177.250 178.027 -0.777 17919 96354 1 235 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.916 0.274 17919 96355 1 235 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.841 -0.261 17919 96356 1 235 . 1 1 32 32 ASP H H 32 8.010 8.010 8.190 -0.180 17919 96357 1 235 . 1 1 33 33 LYS N N 33 115.130 115.130 116.569 -1.439 17919 96358 1 235 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.342 -0.005 17919 96359 1 235 . 1 1 33 33 LYS C C 33 177.870 177.870 177.685 0.185 17919 96360 1 235 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.045 0.005 17919 96361 1 235 . 1 1 33 33 LYS CB C 33 34.170 34.170 34.009 0.161 17919 96362 1 235 . 1 1 33 33 LYS H H 33 7.430 7.430 7.436 -0.006 17919 96363 1 235 . 1 1 34 34 GLU N N 34 113.870 113.870 113.856 0.014 17919 96364 1 235 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.522 0.103 17919 96365 1 235 . 1 1 34 34 GLU C C 34 177.840 177.840 176.680 1.160 17919 96366 1 235 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.530 -0.360 17919 96367 1 235 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.864 0.796 17919 96368 1 235 . 1 1 34 34 GLU H H 34 8.740 8.740 8.268 0.472 17919 96369 1 235 . 1 1 35 35 GLY N N 35 108.650 108.650 109.078 -0.428 17919 96370 1 235 . 1 1 35 35 GLY C C 35 173.960 173.960 174.259 -0.299 17919 96371 1 235 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.796 0.284 17919 96372 1 235 . 1 1 35 35 GLY H H 35 8.530 8.530 8.263 0.267 17919 96373 1 235 . 1 1 36 36 ILE N N 36 119.880 119.880 121.260 -1.380 17919 96374 1 235 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.300 0.145 17919 96375 1 235 . 1 1 36 36 ILE C C 36 173.590 173.590 174.093 -0.503 17919 96376 1 235 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.184 -0.434 17919 96377 1 235 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.642 1.938 17919 96378 1 235 . 1 1 36 36 ILE H H 36 6.150 6.150 7.677 -1.527 17919 96379 1 235 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.675 -0.041 17919 96380 1 235 . 1 1 37 37 PRO C C 37 176.940 176.940 176.144 0.796 17919 96381 1 235 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.896 -0.236 17919 96382 1 235 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.297 0.553 17919 96383 1 235 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.139 -0.022 17919 96384 1 235 . 1 1 38 38 PRO C C 38 178.320 178.320 178.594 -0.274 17919 96385 1 235 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.918 0.342 17919 96386 1 235 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.990 0.900 17919 96387 1 235 . 1 1 39 39 ASP N N 39 113.380 113.380 116.661 -3.281 17919 96388 1 235 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.422 0.008 17919 96389 1 235 . 1 1 39 39 ASP C C 39 177.090 177.090 178.035 -0.945 17919 96390 1 235 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.856 -1.216 17919 96391 1 235 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.368 -0.828 17919 96392 1 235 . 1 1 39 39 ASP H H 39 8.550 8.550 8.740 -0.190 17919 96393 1 235 . 1 1 40 40 GLN N N 40 116.780 116.780 116.568 0.212 17919 96394 1 235 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.416 0.048 17919 96395 1 235 . 1 1 40 40 GLN C C 40 175.380 175.380 175.782 -0.402 17919 96396 1 235 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.103 0.537 17919 96397 1 235 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.212 0.927 17919 96398 1 235 . 1 1 40 40 GLN H H 40 7.820 7.820 7.826 -0.006 17919 96399 1 235 . 1 1 41 41 GLN N N 41 117.720 117.720 120.206 -2.486 17919 96400 1 235 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.315 -0.071 17919 96401 1 235 . 1 1 41 41 GLN C C 41 176.300 176.300 174.716 1.584 17919 96402 1 235 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.354 0.116 17919 96403 1 235 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.466 2.184 17919 96404 1 235 . 1 1 41 41 GLN H H 41 7.480 7.480 7.638 -0.158 17919 96405 1 235 . 1 1 42 42 ARG N N 42 122.680 122.680 125.474 -2.794 17919 96406 1 235 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.641 -0.141 17919 96407 1 235 . 1 1 42 42 ARG C C 42 174.050 174.050 174.046 0.004 17919 96408 1 235 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.540 0.510 17919 96409 1 235 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.891 -1.141 17919 96410 1 235 . 1 1 42 42 ARG H H 42 8.530 8.530 8.743 -0.213 17919 96411 1 235 . 1 1 43 43 LEU N N 43 124.040 124.040 127.454 -3.414 17919 96412 1 235 . 1 1 43 43 LEU C C 43 175.290 175.290 175.581 -0.291 17919 96413 1 235 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.039 -1.059 17919 96414 1 235 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.895 1.895 17919 96415 1 235 . 1 1 43 43 LEU H H 43 8.820 8.820 8.854 -0.034 17919 96416 1 235 . 1 1 44 44 ILE N N 44 121.920 121.920 122.517 -0.597 17919 96417 1 235 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.002 -0.010 17919 96418 1 235 . 1 1 44 44 ILE C C 44 176.060 176.060 174.425 1.635 17919 96419 1 235 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.294 -1.314 17919 96420 1 235 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.508 -0.088 17919 96421 1 235 . 1 1 44 44 ILE H H 44 9.030 9.030 9.046 -0.016 17919 96422 1 235 . 1 1 45 45 PHE N N 45 125.390 125.390 129.159 -3.769 17919 96423 1 235 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.985 0.060 17919 96424 1 235 . 1 1 45 45 PHE C C 45 174.470 174.470 174.903 -0.433 17919 96425 1 235 . 1 1 45 45 PHE CA C 45 57.020 57.020 54.973 2.047 17919 96426 1 235 . 1 1 45 45 PHE CB C 45 43.760 43.760 40.805 2.955 17919 96427 1 235 . 1 1 45 45 PHE H H 45 8.830 8.830 8.752 0.078 17919 96428 1 235 . 1 1 46 46 ALA N N 46 132.200 132.200 131.382 0.818 17919 96429 1 235 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.915 -0.225 17919 96430 1 235 . 1 1 46 46 ALA C C 46 177.290 177.290 177.404 -0.114 17919 96431 1 235 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.525 0.015 17919 96432 1 235 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.629 -0.059 17919 96433 1 235 . 1 1 46 46 ALA H H 46 8.810 8.810 8.848 -0.038 17919 96434 1 235 . 1 1 47 47 GLY N N 47 102.340 102.340 105.614 -3.274 17919 96435 1 235 . 1 1 47 47 GLY C C 47 173.810 173.810 174.514 -0.704 17919 96436 1 235 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.567 -0.217 17919 96437 1 235 . 1 1 47 47 GLY H H 47 8.130 8.130 8.569 -0.439 17919 96438 1 235 . 1 1 48 48 LYS N N 48 121.570 121.570 120.324 1.246 17919 96439 1 235 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.553 0.069 17919 96440 1 235 . 1 1 48 48 LYS C C 48 174.700 174.700 175.062 -0.362 17919 96441 1 235 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.796 -0.246 17919 96442 1 235 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.557 -0.027 17919 96443 1 235 . 1 1 48 48 LYS H H 48 7.980 7.980 7.478 0.502 17919 96444 1 235 . 1 1 49 49 GLN N N 49 122.410 122.410 124.685 -2.275 17919 96445 1 235 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.331 0.229 17919 96446 1 235 . 1 1 49 49 GLN C C 49 175.670 175.670 175.699 -0.029 17919 96447 1 235 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.882 -0.142 17919 96448 1 235 . 1 1 49 49 GLN CB C 49 29.000 29.000 28.986 0.014 17919 96449 1 235 . 1 1 49 49 GLN H H 49 8.600 8.600 8.608 -0.008 17919 96450 1 235 . 1 1 50 50 LEU N N 50 125.520 125.520 129.602 -4.082 17919 96451 1 235 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.070 0.020 17919 96452 1 235 . 1 1 50 50 LEU C C 50 176.660 176.660 175.968 0.692 17919 96453 1 235 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.093 0.148 17919 96454 1 235 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.562 0.008 17919 96455 1 235 . 1 1 50 50 LEU H H 50 8.530 8.530 8.202 0.328 17919 96456 1 235 . 1 1 51 51 GLU N N 51 122.940 122.940 124.617 -1.677 17919 96457 1 235 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.355 0.133 17919 96458 1 235 . 1 1 51 51 GLU C C 51 175.870 175.870 176.970 -1.100 17919 96459 1 235 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.674 0.286 17919 96460 1 235 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.812 -0.242 17919 96461 1 235 . 1 1 51 51 GLU H H 51 8.400 8.400 8.411 -0.011 17919 96462 1 235 . 1 1 52 52 ASP N N 52 120.030 120.030 126.519 -6.489 17919 96463 1 235 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.498 -0.139 17919 96464 1 235 . 1 1 52 52 ASP C C 52 177.330 177.330 177.787 -0.457 17919 96465 1 235 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.118 -0.158 17919 96466 1 235 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.608 0.242 17919 96467 1 235 . 1 1 52 52 ASP H H 52 8.160 8.160 8.800 -0.640 17919 96468 1 235 . 1 1 53 53 GLY N N 53 106.660 106.660 106.087 0.573 17919 96469 1 235 . 1 1 53 53 GLY C C 53 174.870 174.870 174.112 0.758 17919 96470 1 235 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.766 0.404 17919 96471 1 235 . 1 1 53 53 GLY H H 53 9.390 9.390 8.508 0.882 17919 96472 1 235 . 1 1 54 54 ARG N N 54 119.050 119.050 120.062 -1.012 17919 96473 1 235 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.701 -0.006 17919 96474 1 235 . 1 1 54 54 ARG C C 54 175.350 175.350 175.497 -0.147 17919 96475 1 235 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.436 -0.046 17919 96476 1 235 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.887 -0.237 17919 96477 1 235 . 1 1 54 54 ARG H H 54 7.460 7.460 7.450 0.010 17919 96478 1 235 . 1 1 55 55 THR N N 55 108.400 108.400 110.958 -2.558 17919 96479 1 235 . 1 1 55 55 THR HA H 55 5.240 5.240 5.212 0.028 17919 96480 1 235 . 1 1 55 55 THR C C 55 176.560 176.560 176.227 0.333 17919 96481 1 235 . 1 1 55 55 THR CA C 55 59.690 59.690 59.587 0.103 17919 96482 1 235 . 1 1 55 55 THR CB C 55 72.260 72.260 71.355 0.905 17919 96483 1 235 . 1 1 55 55 THR H H 55 8.730 8.730 8.867 -0.137 17919 96484 1 235 . 1 1 56 56 LEU N N 56 117.920 117.920 120.619 -2.699 17919 96485 1 235 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.988 0.072 17919 96486 1 235 . 1 1 56 56 LEU C C 56 180.810 180.810 178.933 1.877 17919 96487 1 235 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.300 0.410 17919 96488 1 235 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.426 -1.056 17919 96489 1 235 . 1 1 56 56 LEU H H 56 8.140 8.140 8.659 -0.519 17919 96490 1 235 . 1 1 57 57 SER N N 57 113.330 113.330 115.363 -2.033 17919 96491 1 235 . 1 1 57 57 SER HA H 57 4.370 4.370 4.202 0.168 17919 96492 1 235 . 1 1 57 57 SER C C 57 178.310 178.310 176.775 1.535 17919 96493 1 235 . 1 1 57 57 SER CA C 57 61.080 61.080 62.339 -1.259 17919 96494 1 235 . 1 1 57 57 SER CB C 57 62.530 62.530 62.820 -0.290 17919 96495 1 235 . 1 1 57 57 SER H H 57 8.470 8.470 8.098 0.372 17919 96496 1 235 . 1 1 58 58 ASP N N 58 124.190 124.190 121.517 2.673 17919 96497 1 235 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.373 -0.077 17919 96498 1 235 . 1 1 58 58 ASP C C 58 177.400 177.400 176.858 0.542 17919 96499 1 235 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.279 0.901 17919 96500 1 235 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.409 -0.309 17919 96501 1 235 . 1 1 58 58 ASP H H 58 7.930 7.930 7.818 0.112 17919 96502 1 235 . 1 1 59 59 TYR N N 59 115.510 115.510 116.410 -0.900 17919 96503 1 235 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.623 0.047 17919 96504 1 235 . 1 1 59 59 TYR C C 59 174.700 174.700 175.036 -0.336 17919 96505 1 235 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.464 0.786 17919 96506 1 235 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.230 1.839 17919 96507 1 235 . 1 1 59 59 TYR H H 59 7.250 7.250 7.431 -0.181 17919 96508 1 235 . 1 1 60 60 ASN N N 60 115.900 115.900 117.268 -1.368 17919 96509 1 235 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.378 -0.023 17919 96510 1 235 . 1 1 60 60 ASN C C 60 174.340 174.340 174.593 -0.253 17919 96511 1 235 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.310 -0.190 17919 96512 1 235 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.435 -0.025 17919 96513 1 235 . 1 1 60 60 ASN H H 60 8.150 8.150 7.904 0.246 17919 96514 1 235 . 1 1 61 61 ILE N N 61 118.600 118.600 120.017 -1.417 17919 96515 1 235 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.621 -0.228 17919 96516 1 235 . 1 1 61 61 ILE C C 61 174.610 174.610 175.271 -0.661 17919 96517 1 235 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.255 0.165 17919 96518 1 235 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.667 -0.927 17919 96519 1 235 . 1 1 61 61 ILE H H 61 7.250 7.250 8.007 -0.757 17919 96520 1 235 . 1 1 62 62 GLN N N 62 124.740 124.740 125.318 -0.578 17919 96521 1 235 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.721 -0.215 17919 96522 1 235 . 1 1 62 62 GLN C C 62 175.970 175.970 175.737 0.233 17919 96523 1 235 . 1 1 62 62 GLN CA C 62 53.660 53.660 52.951 0.709 17919 96524 1 235 . 1 1 62 62 GLN CB C 62 31.650 31.650 32.026 -0.376 17919 96525 1 235 . 1 1 62 62 GLN H H 62 7.610 7.610 7.979 -0.369 17919 96526 1 235 . 1 1 63 63 LYS N N 63 120.300 120.300 121.599 -1.299 17919 96527 1 235 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.868 0.133 17919 96528 1 235 . 1 1 63 63 LYS C C 63 175.810 175.810 177.793 -1.983 17919 96529 1 235 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.443 -0.653 17919 96530 1 235 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.627 0.023 17919 96531 1 235 . 1 1 63 63 LYS H H 63 8.490 8.490 8.772 -0.282 17919 96532 1 235 . 1 1 64 64 GLU N N 64 113.950 113.950 122.355 -8.405 17919 96533 1 235 . 1 1 64 64 GLU HA H 64 3.465 3.465 4.051 -0.586 17919 96534 1 235 . 1 1 64 64 GLU C C 64 175.250 175.250 176.108 -0.858 17919 96535 1 235 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.547 0.343 17919 96536 1 235 . 1 1 64 64 GLU CB C 64 25.900 25.900 29.005 -3.105 17919 96537 1 235 . 1 1 64 64 GLU H H 64 9.280 9.280 8.689 0.591 17919 96538 1 235 . 1 1 65 65 SER N N 65 114.730 114.730 116.058 -1.328 17919 96539 1 235 . 1 1 65 65 SER HA H 65 4.640 4.640 4.628 0.012 17919 96540 1 235 . 1 1 65 65 SER C C 65 172.160 172.160 173.587 -1.427 17919 96541 1 235 . 1 1 65 65 SER CA C 65 60.890 60.890 60.933 -0.043 17919 96542 1 235 . 1 1 65 65 SER CB C 65 64.910 64.910 64.137 0.773 17919 96543 1 235 . 1 1 65 65 SER H H 65 7.670 7.670 7.722 -0.052 17919 96544 1 235 . 1 1 66 66 THR N N 66 117.110 117.110 119.349 -2.239 17919 96545 1 235 . 1 1 66 66 THR HA H 66 5.270 5.270 5.072 0.198 17919 96546 1 235 . 1 1 66 66 THR C C 66 173.950 173.950 173.971 -0.021 17919 96547 1 235 . 1 1 66 66 THR CA C 66 62.340 62.340 61.488 0.852 17919 96548 1 235 . 1 1 66 66 THR CB C 66 70.080 70.080 70.254 -0.174 17919 96549 1 235 . 1 1 66 66 THR H H 66 8.730 8.730 8.231 0.499 17919 96550 1 235 . 1 1 67 67 LEU N N 67 127.110 127.110 126.447 0.663 17919 96551 1 235 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.819 0.241 17919 96552 1 235 . 1 1 67 67 LEU C C 67 175.770 175.770 175.744 0.026 17919 96553 1 235 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.156 -0.256 17919 96554 1 235 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.609 0.651 17919 96555 1 235 . 1 1 67 67 LEU H H 67 9.410 9.410 9.102 0.308 17919 96556 1 235 . 1 1 68 68 HIS N N 68 118.380 118.380 122.274 -3.894 17919 96557 1 235 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.346 -0.106 17919 96558 1 235 . 1 1 68 68 HIS C C 68 173.150 173.150 173.817 -0.667 17919 96559 1 235 . 1 1 68 68 HIS CA C 68 55.000 55.000 53.953 1.046 17919 96560 1 235 . 1 1 68 68 HIS CB C 68 30.530 30.530 31.796 -1.266 17919 96561 1 235 . 1 1 68 68 HIS H H 68 9.230 9.230 8.953 0.277 17919 96562 1 235 . 1 1 69 69 LEU N N 69 124.460 124.460 130.049 -5.589 17919 96563 1 235 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.028 0.162 17919 96564 1 235 . 1 1 69 69 LEU C C 69 175.270 175.270 174.182 1.088 17919 96565 1 235 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.712 0.178 17919 96566 1 235 . 1 1 69 69 LEU CB C 69 44.380 44.380 43.991 0.389 17919 96567 1 235 . 1 1 69 69 LEU H H 69 8.340 8.340 8.365 -0.025 17919 96568 1 235 . 1 1 70 70 VAL N N 70 126.940 126.940 125.242 1.698 17919 96569 1 235 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.244 0.106 17919 96570 1 235 . 1 1 70 70 VAL C C 70 174.000 174.000 174.239 -0.239 17919 96571 1 235 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.535 0.265 17919 96572 1 235 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.800 -0.889 17919 96573 1 235 . 1 1 70 70 VAL H H 70 9.200 9.200 8.947 0.253 17919 96574 1 235 . 1 1 71 71 LEU N N 71 123.130 123.130 123.287 -0.157 17919 96575 1 235 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.184 -0.124 17919 96576 1 235 . 1 1 71 71 LEU C C 71 177.830 177.830 177.638 0.192 17919 96577 1 235 . 1 1 71 71 LEU CA C 71 53.940 53.940 52.793 1.147 17919 96578 1 235 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.947 -0.097 17919 96579 1 235 . 1 1 71 71 LEU H H 71 8.120 8.120 8.234 -0.114 17919 96580 1 235 . 1 1 72 72 ARG N N 72 123.490 123.490 122.250 1.240 17919 96581 1 235 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.334 -0.033 17919 96582 1 235 . 1 1 72 72 ARG C C 72 175.350 175.350 176.160 -0.810 17919 96583 1 235 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.490 -0.880 17919 96584 1 235 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.709 0.641 17919 96585 1 235 . 1 1 72 72 ARG H H 72 8.580 8.580 8.343 0.237 17919 96586 1 236 . 1 1 2 2 GLN N N 2 123.220 123.220 119.005 4.215 17919 96587 1 236 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.332 -0.083 17919 96588 1 236 . 1 1 2 2 GLN C C 2 175.920 175.920 176.007 -0.087 17919 96589 1 236 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.821 0.259 17919 96590 1 236 . 1 1 2 2 GLN CB C 2 30.760 30.760 29.930 0.831 17919 96591 1 236 . 1 1 2 2 GLN H H 2 8.900 8.900 8.274 0.626 17919 96592 1 236 . 1 1 3 3 ILE N N 3 115.340 115.340 115.383 -0.043 17919 96593 1 236 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.343 -0.130 17919 96594 1 236 . 1 1 3 3 ILE C C 3 172.450 172.450 173.900 -1.450 17919 96595 1 236 . 1 1 3 3 ILE CA C 3 59.570 59.570 58.729 0.841 17919 96596 1 236 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.651 0.559 17919 96597 1 236 . 1 1 3 3 ILE H H 3 8.320 8.320 8.646 -0.326 17919 96598 1 236 . 1 1 4 4 PHE N N 4 118.110 118.110 119.402 -1.292 17919 96599 1 236 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.539 0.091 17919 96600 1 236 . 1 1 4 4 PHE C C 4 175.320 175.320 174.973 0.347 17919 96601 1 236 . 1 1 4 4 PHE CA C 4 55.210 55.210 54.790 0.420 17919 96602 1 236 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.388 0.092 17919 96603 1 236 . 1 1 4 4 PHE H H 4 8.610 8.610 8.184 0.426 17919 96604 1 236 . 1 1 5 5 VAL N N 5 121.000 121.000 124.220 -3.220 17919 96605 1 236 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.606 0.119 17919 96606 1 236 . 1 1 5 5 VAL C C 5 174.870 174.870 175.366 -0.496 17919 96607 1 236 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.428 -0.808 17919 96608 1 236 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.480 0.750 17919 96609 1 236 . 1 1 5 5 VAL H H 5 9.300 9.300 9.310 -0.010 17919 96610 1 236 . 1 1 6 6 LYS N N 6 127.520 127.520 128.328 -0.808 17919 96611 1 236 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.394 -0.027 17919 96612 1 236 . 1 1 6 6 LYS C C 6 177.140 177.140 177.174 -0.034 17919 96613 1 236 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.889 -0.369 17919 96614 1 236 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.336 0.714 17919 96615 1 236 . 1 1 6 6 LYS H H 6 8.820 8.820 9.158 -0.338 17919 96616 1 236 . 1 1 7 7 THR N N 7 115.400 115.400 115.753 -0.353 17919 96617 1 236 . 1 1 7 7 THR HA H 7 4.970 4.970 4.389 0.581 17919 96618 1 236 . 1 1 7 7 THR C C 7 176.910 176.910 176.575 0.335 17919 96619 1 236 . 1 1 7 7 THR CA C 7 60.470 60.470 61.374 -0.904 17919 96620 1 236 . 1 1 7 7 THR CB C 7 70.630 70.630 69.546 1.083 17919 96621 1 236 . 1 1 7 7 THR H H 7 8.730 8.730 8.381 0.349 17919 96622 1 236 . 1 1 8 8 LEU N N 8 121.330 121.330 120.407 0.923 17919 96623 1 236 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.244 0.066 17919 96624 1 236 . 1 1 8 8 LEU C C 8 178.800 178.800 177.676 1.124 17919 96625 1 236 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.376 0.204 17919 96626 1 236 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.324 0.646 17919 96627 1 236 . 1 1 8 8 LEU H H 8 9.100 9.100 8.598 0.502 17919 96628 1 236 . 1 1 9 9 THR N N 9 105.590 105.590 108.824 -3.234 17919 96629 1 236 . 1 1 9 9 THR HA H 9 4.428 4.428 4.321 0.107 17919 96630 1 236 . 1 1 9 9 THR C C 9 175.520 175.520 174.831 0.689 17919 96631 1 236 . 1 1 9 9 THR CA C 9 61.400 61.400 62.050 -0.650 17919 96632 1 236 . 1 1 9 9 THR CB C 9 69.140 69.140 68.860 0.280 17919 96633 1 236 . 1 1 9 9 THR H H 9 7.630 7.630 7.939 -0.309 17919 96634 1 236 . 1 1 10 10 GLY N N 10 108.890 108.890 110.346 -1.456 17919 96635 1 236 . 1 1 10 10 GLY C C 10 174.070 174.070 173.660 0.410 17919 96636 1 236 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.128 0.332 17919 96637 1 236 . 1 1 10 10 GLY H H 10 7.810 7.810 7.719 0.091 17919 96638 1 236 . 1 1 11 11 LYS N N 11 121.600 121.600 120.499 1.101 17919 96639 1 236 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.643 -0.282 17919 96640 1 236 . 1 1 11 11 LYS C C 11 175.940 175.940 175.253 0.687 17919 96641 1 236 . 1 1 11 11 LYS CA C 11 56.280 56.280 54.980 1.300 17919 96642 1 236 . 1 1 11 11 LYS CB C 11 33.200 33.200 34.050 -0.850 17919 96643 1 236 . 1 1 11 11 LYS H H 11 7.280 7.280 8.099 -0.819 17919 96644 1 236 . 1 1 12 12 THR N N 12 120.440 120.440 121.032 -0.592 17919 96645 1 236 . 1 1 12 12 THR HA H 12 5.046 5.046 4.694 0.352 17919 96646 1 236 . 1 1 12 12 THR C C 12 174.320 174.320 174.517 -0.197 17919 96647 1 236 . 1 1 12 12 THR CA C 12 62.390 62.390 62.428 -0.038 17919 96648 1 236 . 1 1 12 12 THR CB C 12 69.910 69.910 69.552 0.358 17919 96649 1 236 . 1 1 12 12 THR H H 12 8.650 8.650 8.476 0.174 17919 96650 1 236 . 1 1 13 13 ILE N N 13 127.110 127.110 126.995 0.115 17919 96651 1 236 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.472 0.072 17919 96652 1 236 . 1 1 13 13 ILE C C 13 175.220 175.220 175.555 -0.335 17919 96653 1 236 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.200 -0.220 17919 96654 1 236 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.444 0.506 17919 96655 1 236 . 1 1 13 13 ILE H H 13 9.450 9.450 8.468 0.982 17919 96656 1 236 . 1 1 14 14 THR N N 14 121.520 121.520 123.420 -1.900 17919 96657 1 236 . 1 1 14 14 THR HA H 14 4.964 4.964 5.359 -0.395 17919 96658 1 236 . 1 1 14 14 THR C C 14 173.790 173.790 174.073 -0.283 17919 96659 1 236 . 1 1 14 14 THR CA C 14 61.940 61.940 61.631 0.309 17919 96660 1 236 . 1 1 14 14 THR CB C 14 69.650 69.650 69.724 -0.074 17919 96661 1 236 . 1 1 14 14 THR H H 14 8.710 8.710 8.418 0.292 17919 96662 1 236 . 1 1 15 15 LEU N N 15 124.800 124.800 127.284 -2.484 17919 96663 1 236 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.687 0.093 17919 96664 1 236 . 1 1 15 15 LEU C C 15 174.670 174.670 175.049 -0.379 17919 96665 1 236 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.563 -0.733 17919 96666 1 236 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.417 1.653 17919 96667 1 236 . 1 1 15 15 LEU H H 15 8.710 8.710 8.683 0.027 17919 96668 1 236 . 1 1 16 16 GLU N N 16 122.160 122.160 124.202 -2.042 17919 96669 1 236 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.977 -0.060 17919 96670 1 236 . 1 1 16 16 GLU C C 16 175.860 175.860 176.107 -0.247 17919 96671 1 236 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.368 -0.548 17919 96672 1 236 . 1 1 16 16 GLU CB C 16 29.450 29.450 29.749 -0.299 17919 96673 1 236 . 1 1 16 16 GLU H H 16 8.140 8.140 8.748 -0.608 17919 96674 1 236 . 1 1 17 17 VAL N N 17 117.210 117.210 120.665 -3.455 17919 96675 1 236 . 1 1 17 17 VAL HA H 17 4.714 4.714 5.007 -0.293 17919 96676 1 236 . 1 1 17 17 VAL C C 17 174.160 174.160 174.620 -0.460 17919 96677 1 236 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.899 -0.469 17919 96678 1 236 . 1 1 17 17 VAL CB C 17 36.400 36.400 36.127 0.273 17919 96679 1 236 . 1 1 17 17 VAL H H 17 8.900 8.900 8.714 0.186 17919 96680 1 236 . 1 1 18 18 GLU N N 18 118.990 118.990 120.549 -1.559 17919 96681 1 236 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.918 0.161 17919 96682 1 236 . 1 1 18 18 GLU C C 18 176.160 176.160 175.426 0.734 17919 96683 1 236 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.405 0.315 17919 96684 1 236 . 1 1 18 18 GLU CB C 18 30.310 30.310 32.238 -1.928 17919 96685 1 236 . 1 1 18 18 GLU H H 18 8.640 8.640 9.113 -0.473 17919 96686 1 236 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.398 -0.257 17919 96687 1 236 . 1 1 19 19 PRO C C 19 175.310 175.310 177.544 -2.234 17919 96688 1 236 . 1 1 19 19 PRO CA C 19 65.470 65.470 64.825 0.645 17919 96689 1 236 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.933 0.017 17919 96690 1 236 . 1 1 20 20 SER N N 20 103.400 103.400 113.172 -9.772 17919 96691 1 236 . 1 1 20 20 SER HA H 20 4.370 4.370 4.417 -0.047 17919 96692 1 236 . 1 1 20 20 SER C C 20 174.660 174.660 174.088 0.572 17919 96693 1 236 . 1 1 20 20 SER CA C 20 57.400 57.400 59.316 -1.917 17919 96694 1 236 . 1 1 20 20 SER CB C 20 63.370 63.370 63.214 0.156 17919 96695 1 236 . 1 1 20 20 SER H H 20 7.040 7.040 8.252 -1.212 17919 96696 1 236 . 1 1 21 21 ASP N N 21 123.480 123.480 122.572 0.908 17919 96697 1 236 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.708 -0.013 17919 96698 1 236 . 1 1 21 21 ASP C C 21 176.360 176.360 175.282 1.078 17919 96699 1 236 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.993 0.707 17919 96700 1 236 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.361 -0.561 17919 96701 1 236 . 1 1 21 21 ASP H H 21 8.030 8.030 7.605 0.425 17919 96702 1 236 . 1 1 22 22 THR N N 22 108.800 108.800 113.268 -4.468 17919 96703 1 236 . 1 1 22 22 THR HA H 22 4.920 4.920 4.791 0.129 17919 96704 1 236 . 1 1 22 22 THR C C 22 176.750 176.750 176.103 0.647 17919 96705 1 236 . 1 1 22 22 THR CA C 22 59.690 59.690 61.527 -1.837 17919 96706 1 236 . 1 1 22 22 THR CB C 22 71.200 71.200 70.144 1.056 17919 96707 1 236 . 1 1 22 22 THR H H 22 7.900 7.900 8.223 -0.323 17919 96708 1 236 . 1 1 23 23 ILE N N 23 121.190 121.190 121.805 -0.615 17919 96709 1 236 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.795 -0.138 17919 96710 1 236 . 1 1 23 23 ILE C C 23 179.040 179.040 177.564 1.476 17919 96711 1 236 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.249 0.011 17919 96712 1 236 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.049 -1.699 17919 96713 1 236 . 1 1 23 23 ILE H H 23 8.560 8.560 8.827 -0.267 17919 96714 1 236 . 1 1 24 24 GLU N N 24 120.830 120.830 121.274 -0.444 17919 96715 1 236 . 1 1 24 24 GLU HA H 24 3.917 3.917 4.024 -0.107 17919 96716 1 236 . 1 1 24 24 GLU C C 24 178.640 178.640 178.641 -0.001 17919 96717 1 236 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.065 0.155 17919 96718 1 236 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.367 -1.087 17919 96719 1 236 . 1 1 24 24 GLU H H 24 9.760 9.760 7.924 1.836 17919 96720 1 236 . 1 1 25 25 ASN N N 25 120.570 120.570 117.744 2.826 17919 96721 1 236 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.536 -0.011 17919 96722 1 236 . 1 1 25 25 ASN C C 25 178.380 178.380 178.039 0.341 17919 96723 1 236 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.997 0.063 17919 96724 1 236 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.557 -0.107 17919 96725 1 236 . 1 1 25 25 ASN H H 25 7.920 7.920 7.532 0.388 17919 96726 1 236 . 1 1 26 26 VAL N N 26 121.710 121.710 120.515 1.195 17919 96727 1 236 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.688 -0.291 17919 96728 1 236 . 1 1 26 26 VAL C C 26 177.950 177.950 177.803 0.147 17919 96729 1 236 . 1 1 26 26 VAL CA C 26 67.660 67.660 65.804 1.856 17919 96730 1 236 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.069 -0.229 17919 96731 1 236 . 1 1 26 26 VAL H H 26 8.070 8.070 7.628 0.442 17919 96732 1 236 . 1 1 27 27 LYS N N 27 118.860 118.860 120.476 -1.616 17919 96733 1 236 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.164 0.416 17919 96734 1 236 . 1 1 27 27 LYS C C 27 180.550 180.550 179.209 1.341 17919 96735 1 236 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.825 -0.575 17919 96736 1 236 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.174 1.556 17919 96737 1 236 . 1 1 27 27 LYS H H 27 8.560 8.560 8.403 0.157 17919 96738 1 236 . 1 1 28 28 ALA N N 28 123.440 123.440 120.563 2.877 17919 96739 1 236 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.103 0.057 17919 96740 1 236 . 1 1 28 28 ALA C C 28 180.300 180.300 178.763 1.537 17919 96741 1 236 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.662 0.708 17919 96742 1 236 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.416 -0.706 17919 96743 1 236 . 1 1 28 28 ALA H H 28 8.060 8.060 8.455 -0.395 17919 96744 1 236 . 1 1 29 29 LYS N N 29 119.940 119.940 118.834 1.106 17919 96745 1 236 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.040 0.167 17919 96746 1 236 . 1 1 29 29 LYS C C 29 180.320 180.320 178.540 1.780 17919 96747 1 236 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.340 0.311 17919 96748 1 236 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.435 0.855 17919 96749 1 236 . 1 1 29 29 LYS H H 29 7.850 7.850 7.388 0.462 17919 96750 1 236 . 1 1 30 30 ILE N N 30 121.080 121.080 118.690 2.390 17919 96751 1 236 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.710 -0.203 17919 96752 1 236 . 1 1 30 30 ILE C C 30 178.310 178.310 177.769 0.541 17919 96753 1 236 . 1 1 30 30 ILE CA C 30 66.150 66.150 64.402 1.748 17919 96754 1 236 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.851 -1.051 17919 96755 1 236 . 1 1 30 30 ILE H H 30 8.280 8.280 7.813 0.467 17919 96756 1 236 . 1 1 31 31 GLN N N 31 123.490 123.490 121.187 2.303 17919 96757 1 236 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.091 -0.262 17919 96758 1 236 . 1 1 31 31 GLN C C 31 178.890 178.890 178.356 0.534 17919 96759 1 236 . 1 1 31 31 GLN CA C 31 60.000 60.000 58.577 1.423 17919 96760 1 236 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.042 -0.322 17919 96761 1 236 . 1 1 31 31 GLN H H 31 8.580 8.580 8.051 0.529 17919 96762 1 236 . 1 1 32 32 ASP N N 32 119.360 119.360 118.537 0.823 17919 96763 1 236 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.520 -0.166 17919 96764 1 236 . 1 1 32 32 ASP C C 32 177.250 177.250 177.305 -0.055 17919 96765 1 236 . 1 1 32 32 ASP CA C 32 57.190 57.190 55.869 1.321 17919 96766 1 236 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.671 -0.091 17919 96767 1 236 . 1 1 32 32 ASP H H 32 8.010 8.010 7.776 0.234 17919 96768 1 236 . 1 1 33 33 LYS N N 33 115.130 115.130 118.013 -2.883 17919 96769 1 236 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.403 -0.066 17919 96770 1 236 . 1 1 33 33 LYS C C 33 177.870 177.870 177.527 0.343 17919 96771 1 236 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.473 0.577 17919 96772 1 236 . 1 1 33 33 LYS CB C 33 34.170 34.170 34.883 -0.713 17919 96773 1 236 . 1 1 33 33 LYS H H 33 7.430 7.430 7.553 -0.123 17919 96774 1 236 . 1 1 34 34 GLU N N 34 113.870 113.870 116.154 -2.284 17919 96775 1 236 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.492 0.133 17919 96776 1 236 . 1 1 34 34 GLU C C 34 177.840 177.840 176.921 0.919 17919 96777 1 236 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.264 -1.094 17919 96778 1 236 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.359 1.301 17919 96779 1 236 . 1 1 34 34 GLU H H 34 8.740 8.740 7.913 0.827 17919 96780 1 236 . 1 1 35 35 GLY N N 35 108.650 108.650 109.658 -1.008 17919 96781 1 236 . 1 1 35 35 GLY C C 35 173.960 173.960 174.360 -0.400 17919 96782 1 236 . 1 1 35 35 GLY CA C 35 46.080 46.080 46.151 -0.071 17919 96783 1 236 . 1 1 35 35 GLY H H 35 8.530 8.530 8.144 0.386 17919 96784 1 236 . 1 1 36 36 ILE N N 36 119.880 119.880 121.199 -1.319 17919 96785 1 236 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.341 0.104 17919 96786 1 236 . 1 1 36 36 ILE C C 36 173.590 173.590 174.138 -0.548 17919 96787 1 236 . 1 1 36 36 ILE CA C 36 57.750 57.750 56.399 1.351 17919 96788 1 236 . 1 1 36 36 ILE CB C 36 40.580 40.580 36.967 3.613 17919 96789 1 236 . 1 1 36 36 ILE H H 36 6.150 6.150 7.479 -1.329 17919 96790 1 236 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.746 -0.112 17919 96791 1 236 . 1 1 37 37 PRO C C 37 176.940 176.940 176.185 0.755 17919 96792 1 236 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.631 0.029 17919 96793 1 236 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.756 0.094 17919 96794 1 236 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.092 0.025 17919 96795 1 236 . 1 1 38 38 PRO C C 38 178.320 178.320 178.318 0.002 17919 96796 1 236 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.886 0.374 17919 96797 1 236 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.894 0.996 17919 96798 1 236 . 1 1 39 39 ASP N N 39 113.380 113.380 114.815 -1.435 17919 96799 1 236 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.456 -0.026 17919 96800 1 236 . 1 1 39 39 ASP C C 39 177.090 177.090 177.690 -0.600 17919 96801 1 236 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.553 -0.913 17919 96802 1 236 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.572 -1.032 17919 96803 1 236 . 1 1 39 39 ASP H H 39 8.550 8.550 8.688 -0.138 17919 96804 1 236 . 1 1 40 40 GLN N N 40 116.780 116.780 117.538 -0.758 17919 96805 1 236 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.388 0.076 17919 96806 1 236 . 1 1 40 40 GLN C C 40 175.380 175.380 176.256 -0.876 17919 96807 1 236 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.489 0.151 17919 96808 1 236 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.830 0.310 17919 96809 1 236 . 1 1 40 40 GLN H H 40 7.820 7.820 8.144 -0.324 17919 96810 1 236 . 1 1 41 41 GLN N N 41 117.720 117.720 119.700 -1.980 17919 96811 1 236 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.353 -0.109 17919 96812 1 236 . 1 1 41 41 GLN C C 41 176.300 176.300 175.524 0.776 17919 96813 1 236 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.152 0.318 17919 96814 1 236 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.401 2.249 17919 96815 1 236 . 1 1 41 41 GLN H H 41 7.480 7.480 7.430 0.050 17919 96816 1 236 . 1 1 42 42 ARG N N 42 122.680 122.680 125.113 -2.433 17919 96817 1 236 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.514 -0.014 17919 96818 1 236 . 1 1 42 42 ARG C C 42 174.050 174.050 174.355 -0.305 17919 96819 1 236 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.220 -0.170 17919 96820 1 236 . 1 1 42 42 ARG CB C 42 31.750 31.750 31.573 0.177 17919 96821 1 236 . 1 1 42 42 ARG H H 42 8.530 8.530 9.010 -0.480 17919 96822 1 236 . 1 1 43 43 LEU N N 43 124.040 124.040 127.693 -3.653 17919 96823 1 236 . 1 1 43 43 LEU C C 43 175.290 175.290 174.625 0.665 17919 96824 1 236 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.945 -0.965 17919 96825 1 236 . 1 1 43 43 LEU CB C 43 45.790 45.790 45.384 0.406 17919 96826 1 236 . 1 1 43 43 LEU H H 43 8.820 8.820 8.825 -0.005 17919 96827 1 236 . 1 1 44 44 ILE N N 44 121.920 121.920 126.906 -4.986 17919 96828 1 236 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.129 -0.137 17919 96829 1 236 . 1 1 44 44 ILE C C 44 176.060 176.060 174.196 1.864 17919 96830 1 236 . 1 1 44 44 ILE CA C 44 58.980 58.980 58.734 0.246 17919 96831 1 236 . 1 1 44 44 ILE CB C 44 41.420 41.420 39.933 1.487 17919 96832 1 236 . 1 1 44 44 ILE H H 44 9.030 9.030 8.644 0.386 17919 96833 1 236 . 1 1 45 45 PHE N N 45 125.390 125.390 127.205 -1.815 17919 96834 1 236 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.947 0.098 17919 96835 1 236 . 1 1 45 45 PHE C C 45 174.470 174.470 174.626 -0.156 17919 96836 1 236 . 1 1 45 45 PHE CA C 45 57.020 57.020 55.359 1.661 17919 96837 1 236 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.093 0.667 17919 96838 1 236 . 1 1 45 45 PHE H H 45 8.830 8.830 8.887 -0.057 17919 96839 1 236 . 1 1 46 46 ALA N N 46 132.200 132.200 129.452 2.748 17919 96840 1 236 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.602 0.088 17919 96841 1 236 . 1 1 46 46 ALA C C 46 177.290 177.290 177.706 -0.416 17919 96842 1 236 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.821 -0.281 17919 96843 1 236 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.463 0.107 17919 96844 1 236 . 1 1 46 46 ALA H H 46 8.810 8.810 9.165 -0.355 17919 96845 1 236 . 1 1 47 47 GLY N N 47 102.340 102.340 103.877 -1.537 17919 96846 1 236 . 1 1 47 47 GLY C C 47 173.810 173.810 174.717 -0.907 17919 96847 1 236 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.549 -0.199 17919 96848 1 236 . 1 1 47 47 GLY H H 47 8.130 8.130 8.711 -0.581 17919 96849 1 236 . 1 1 48 48 LYS N N 48 121.570 121.570 120.801 0.769 17919 96850 1 236 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.534 0.088 17919 96851 1 236 . 1 1 48 48 LYS C C 48 174.700 174.700 175.490 -0.790 17919 96852 1 236 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.076 -0.526 17919 96853 1 236 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.199 0.331 17919 96854 1 236 . 1 1 48 48 LYS H H 48 7.980 7.980 8.104 -0.124 17919 96855 1 236 . 1 1 49 49 GLN N N 49 122.410 122.410 123.128 -0.718 17919 96856 1 236 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.567 -0.007 17919 96857 1 236 . 1 1 49 49 GLN C C 49 175.670 175.670 175.478 0.192 17919 96858 1 236 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.860 -0.120 17919 96859 1 236 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.756 -0.756 17919 96860 1 236 . 1 1 49 49 GLN H H 49 8.600 8.600 8.665 -0.065 17919 96861 1 236 . 1 1 50 50 LEU N N 50 125.520 125.520 127.767 -2.247 17919 96862 1 236 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.146 -0.056 17919 96863 1 236 . 1 1 50 50 LEU C C 50 176.660 176.660 176.181 0.479 17919 96864 1 236 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.254 -0.014 17919 96865 1 236 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.923 -0.353 17919 96866 1 236 . 1 1 50 50 LEU H H 50 8.530 8.530 8.740 -0.210 17919 96867 1 236 . 1 1 51 51 GLU N N 51 122.940 122.940 123.409 -0.469 17919 96868 1 236 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.648 -0.160 17919 96869 1 236 . 1 1 51 51 GLU C C 51 175.870 175.870 176.498 -0.628 17919 96870 1 236 . 1 1 51 51 GLU CA C 51 55.960 55.960 54.976 0.984 17919 96871 1 236 . 1 1 51 51 GLU CB C 51 31.570 31.570 33.105 -1.535 17919 96872 1 236 . 1 1 51 51 GLU H H 51 8.400 8.400 8.110 0.290 17919 96873 1 236 . 1 1 52 52 ASP N N 52 120.030 120.030 124.537 -4.507 17919 96874 1 236 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.486 -0.127 17919 96875 1 236 . 1 1 52 52 ASP C C 52 177.330 177.330 177.972 -0.642 17919 96876 1 236 . 1 1 52 52 ASP CA C 52 56.960 56.960 58.099 -1.139 17919 96877 1 236 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.922 -0.072 17919 96878 1 236 . 1 1 52 52 ASP H H 52 8.160 8.160 8.954 -0.794 17919 96879 1 236 . 1 1 53 53 GLY N N 53 106.660 106.660 106.796 -0.136 17919 96880 1 236 . 1 1 53 53 GLY C C 53 174.870 174.870 174.640 0.230 17919 96881 1 236 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.133 0.037 17919 96882 1 236 . 1 1 53 53 GLY H H 53 9.390 9.390 8.264 1.126 17919 96883 1 236 . 1 1 54 54 ARG N N 54 119.050 119.050 120.638 -1.588 17919 96884 1 236 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.594 0.101 17919 96885 1 236 . 1 1 54 54 ARG C C 54 175.350 175.350 176.171 -0.821 17919 96886 1 236 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.257 0.133 17919 96887 1 236 . 1 1 54 54 ARG CB C 54 32.650 32.650 31.177 1.473 17919 96888 1 236 . 1 1 54 54 ARG H H 54 7.460 7.460 7.771 -0.311 17919 96889 1 236 . 1 1 55 55 THR N N 55 108.400 108.400 112.889 -4.489 17919 96890 1 236 . 1 1 55 55 THR HA H 55 5.240 5.240 5.003 0.237 17919 96891 1 236 . 1 1 55 55 THR C C 55 176.560 176.560 176.911 -0.351 17919 96892 1 236 . 1 1 55 55 THR CA C 55 59.690 59.690 60.857 -1.167 17919 96893 1 236 . 1 1 55 55 THR CB C 55 72.260 72.260 70.641 1.619 17919 96894 1 236 . 1 1 55 55 THR H H 55 8.730 8.730 9.033 -0.303 17919 96895 1 236 . 1 1 56 56 LEU N N 56 117.920 117.920 123.982 -6.062 17919 96896 1 236 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.881 0.179 17919 96897 1 236 . 1 1 56 56 LEU C C 56 180.810 180.810 179.002 1.808 17919 96898 1 236 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.450 0.260 17919 96899 1 236 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.449 -1.079 17919 96900 1 236 . 1 1 56 56 LEU H H 56 8.140 8.140 8.530 -0.390 17919 96901 1 236 . 1 1 57 57 SER N N 57 113.330 113.330 115.120 -1.790 17919 96902 1 236 . 1 1 57 57 SER HA H 57 4.370 4.370 4.115 0.255 17919 96903 1 236 . 1 1 57 57 SER C C 57 178.310 178.310 176.554 1.756 17919 96904 1 236 . 1 1 57 57 SER CA C 57 61.080 61.080 62.507 -1.427 17919 96905 1 236 . 1 1 57 57 SER CB C 57 62.530 62.530 62.810 -0.280 17919 96906 1 236 . 1 1 57 57 SER H H 57 8.470 8.470 8.098 0.372 17919 96907 1 236 . 1 1 58 58 ASP N N 58 124.190 124.190 121.550 2.640 17919 96908 1 236 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.323 -0.027 17919 96909 1 236 . 1 1 58 58 ASP C C 58 177.400 177.400 177.527 -0.127 17919 96910 1 236 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.891 0.289 17919 96911 1 236 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.556 -0.456 17919 96912 1 236 . 1 1 58 58 ASP H H 58 7.930 7.930 7.671 0.259 17919 96913 1 236 . 1 1 59 59 TYR N N 59 115.510 115.510 116.122 -0.612 17919 96914 1 236 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.671 -0.001 17919 96915 1 236 . 1 1 59 59 TYR C C 59 174.700 174.700 175.232 -0.532 17919 96916 1 236 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.810 0.440 17919 96917 1 236 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.731 1.339 17919 96918 1 236 . 1 1 59 59 TYR H H 59 7.250 7.250 7.573 -0.323 17919 96919 1 236 . 1 1 60 60 ASN N N 60 115.900 115.900 118.872 -2.972 17919 96920 1 236 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.437 -0.082 17919 96921 1 236 . 1 1 60 60 ASN C C 60 174.340 174.340 174.425 -0.085 17919 96922 1 236 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.218 -0.098 17919 96923 1 236 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.346 0.064 17919 96924 1 236 . 1 1 60 60 ASN H H 60 8.150 8.150 8.057 0.093 17919 96925 1 236 . 1 1 61 61 ILE N N 61 118.600 118.600 119.653 -1.053 17919 96926 1 236 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.896 -0.503 17919 96927 1 236 . 1 1 61 61 ILE C C 61 174.610 174.610 175.322 -0.712 17919 96928 1 236 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.563 0.857 17919 96929 1 236 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.838 -1.098 17919 96930 1 236 . 1 1 61 61 ILE H H 61 7.250 7.250 7.800 -0.550 17919 96931 1 236 . 1 1 62 62 GLN N N 62 124.740 124.740 126.929 -2.189 17919 96932 1 236 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.680 -0.174 17919 96933 1 236 . 1 1 62 62 GLN C C 62 175.970 175.970 174.627 1.343 17919 96934 1 236 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.412 0.248 17919 96935 1 236 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.437 0.213 17919 96936 1 236 . 1 1 62 62 GLN H H 62 7.610 7.610 8.040 -0.430 17919 96937 1 236 . 1 1 63 63 LYS N N 63 120.300 120.300 119.628 0.672 17919 96938 1 236 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.939 0.062 17919 96939 1 236 . 1 1 63 63 LYS C C 63 175.810 175.810 176.857 -1.047 17919 96940 1 236 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.270 -0.480 17919 96941 1 236 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.815 0.835 17919 96942 1 236 . 1 1 63 63 LYS H H 63 8.490 8.490 8.500 -0.010 17919 96943 1 236 . 1 1 64 64 GLU N N 64 113.950 113.950 119.253 -5.303 17919 96944 1 236 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.346 0.119 17919 96945 1 236 . 1 1 64 64 GLU C C 64 175.250 175.250 176.164 -0.914 17919 96946 1 236 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.731 0.159 17919 96947 1 236 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.810 -2.910 17919 96948 1 236 . 1 1 64 64 GLU H H 64 9.280 9.280 8.985 0.295 17919 96949 1 236 . 1 1 65 65 SER N N 65 114.730 114.730 116.448 -1.718 17919 96950 1 236 . 1 1 65 65 SER HA H 65 4.640 4.640 4.335 0.305 17919 96951 1 236 . 1 1 65 65 SER C C 65 172.160 172.160 173.777 -1.617 17919 96952 1 236 . 1 1 65 65 SER CA C 65 60.890 60.890 60.866 0.024 17919 96953 1 236 . 1 1 65 65 SER CB C 65 64.910 64.910 63.445 1.465 17919 96954 1 236 . 1 1 65 65 SER H H 65 7.670 7.670 7.502 0.168 17919 96955 1 236 . 1 1 66 66 THR N N 66 117.110 117.110 119.436 -2.326 17919 96956 1 236 . 1 1 66 66 THR HA H 66 5.270 5.270 5.094 0.176 17919 96957 1 236 . 1 1 66 66 THR C C 66 173.950 173.950 173.970 -0.020 17919 96958 1 236 . 1 1 66 66 THR CA C 66 62.340 62.340 62.377 -0.037 17919 96959 1 236 . 1 1 66 66 THR CB C 66 70.080 70.080 69.653 0.427 17919 96960 1 236 . 1 1 66 66 THR H H 66 8.730 8.730 8.280 0.450 17919 96961 1 236 . 1 1 67 67 LEU N N 67 127.110 127.110 127.958 -0.848 17919 96962 1 236 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.943 0.117 17919 96963 1 236 . 1 1 67 67 LEU C C 67 175.770 175.770 175.483 0.287 17919 96964 1 236 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.705 0.195 17919 96965 1 236 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.663 -0.403 17919 96966 1 236 . 1 1 67 67 LEU H H 67 9.410 9.410 9.110 0.300 17919 96967 1 236 . 1 1 68 68 HIS N N 68 118.380 118.380 119.986 -1.606 17919 96968 1 236 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.102 0.138 17919 96969 1 236 . 1 1 68 68 HIS C C 68 173.150 173.150 174.274 -1.124 17919 96970 1 236 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.630 0.370 17919 96971 1 236 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.045 -1.515 17919 96972 1 236 . 1 1 68 68 HIS H H 68 9.230 9.230 9.172 0.058 17919 96973 1 236 . 1 1 69 69 LEU N N 69 124.460 124.460 127.706 -3.246 17919 96974 1 236 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.905 0.285 17919 96975 1 236 . 1 1 69 69 LEU C C 69 175.270 175.270 175.604 -0.334 17919 96976 1 236 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.146 -0.256 17919 96977 1 236 . 1 1 69 69 LEU CB C 69 44.380 44.380 42.876 1.504 17919 96978 1 236 . 1 1 69 69 LEU H H 69 8.340 8.340 8.080 0.260 17919 96979 1 236 . 1 1 70 70 VAL N N 70 126.940 126.940 124.913 2.027 17919 96980 1 236 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.487 -0.137 17919 96981 1 236 . 1 1 70 70 VAL C C 70 174.000 174.000 174.361 -0.361 17919 96982 1 236 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.940 0.860 17919 96983 1 236 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.451 -0.541 17919 96984 1 236 . 1 1 70 70 VAL H H 70 9.200 9.200 9.103 0.097 17919 96985 1 236 . 1 1 71 71 LEU N N 71 123.130 123.130 122.591 0.539 17919 96986 1 236 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.040 0.020 17919 96987 1 236 . 1 1 71 71 LEU C C 71 177.830 177.830 176.952 0.878 17919 96988 1 236 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.803 0.137 17919 96989 1 236 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.975 -0.125 17919 96990 1 236 . 1 1 71 71 LEU H H 71 8.120 8.120 8.324 -0.204 17919 96991 1 236 . 1 1 72 72 ARG N N 72 123.490 123.490 125.610 -2.120 17919 96992 1 236 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.338 -0.037 17919 96993 1 236 . 1 1 72 72 ARG C C 72 175.350 175.350 174.881 0.469 17919 96994 1 236 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.283 -0.673 17919 96995 1 236 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.996 0.354 17919 96996 1 236 . 1 1 72 72 ARG H H 72 8.580 8.580 8.464 0.116 17919 96997 1 237 . 1 1 2 2 GLN N N 2 123.220 123.220 120.933 2.287 17919 96998 1 237 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.349 -0.100 17919 96999 1 237 . 1 1 2 2 GLN C C 2 175.920 175.920 175.128 0.792 17919 97000 1 237 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.644 0.436 17919 97001 1 237 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.217 0.543 17919 97002 1 237 . 1 1 2 2 GLN H H 2 8.900 8.900 8.457 0.443 17919 97003 1 237 . 1 1 3 3 ILE N N 3 115.340 115.340 115.354 -0.014 17919 97004 1 237 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.370 -0.157 17919 97005 1 237 . 1 1 3 3 ILE C C 3 172.450 172.450 173.395 -0.945 17919 97006 1 237 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.380 0.190 17919 97007 1 237 . 1 1 3 3 ILE CB C 3 42.210 42.210 42.217 -0.007 17919 97008 1 237 . 1 1 3 3 ILE H H 3 8.320 8.320 8.981 -0.661 17919 97009 1 237 . 1 1 4 4 PHE N N 4 118.110 118.110 119.170 -1.060 17919 97010 1 237 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.466 0.164 17919 97011 1 237 . 1 1 4 4 PHE C C 4 175.320 175.320 175.657 -0.337 17919 97012 1 237 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.445 -0.235 17919 97013 1 237 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.106 0.374 17919 97014 1 237 . 1 1 4 4 PHE H H 4 8.610 8.610 8.537 0.073 17919 97015 1 237 . 1 1 5 5 VAL N N 5 121.000 121.000 122.886 -1.886 17919 97016 1 237 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.799 -0.074 17919 97017 1 237 . 1 1 5 5 VAL C C 5 174.870 174.870 174.545 0.325 17919 97018 1 237 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.472 -0.852 17919 97019 1 237 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.620 0.610 17919 97020 1 237 . 1 1 5 5 VAL H H 5 9.300 9.300 9.277 0.023 17919 97021 1 237 . 1 1 6 6 LYS N N 6 127.520 127.520 128.683 -1.163 17919 97022 1 237 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.233 0.134 17919 97023 1 237 . 1 1 6 6 LYS C C 6 177.140 177.140 175.471 1.669 17919 97024 1 237 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.061 0.459 17919 97025 1 237 . 1 1 6 6 LYS CB C 6 35.050 35.050 36.460 -1.410 17919 97026 1 237 . 1 1 6 6 LYS H H 6 8.820 8.820 9.306 -0.486 17919 97027 1 237 . 1 1 7 7 THR N N 7 115.400 115.400 116.586 -1.186 17919 97028 1 237 . 1 1 7 7 THR HA H 7 4.970 4.970 4.500 0.470 17919 97029 1 237 . 1 1 7 7 THR C C 7 176.910 176.910 176.437 0.473 17919 97030 1 237 . 1 1 7 7 THR CA C 7 60.470 60.470 59.777 0.693 17919 97031 1 237 . 1 1 7 7 THR CB C 7 70.630 70.630 70.821 -0.191 17919 97032 1 237 . 1 1 7 7 THR H H 7 8.730 8.730 8.495 0.235 17919 97033 1 237 . 1 1 8 8 LEU N N 8 121.330 121.330 120.880 0.450 17919 97034 1 237 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.319 -0.009 17919 97035 1 237 . 1 1 8 8 LEU C C 8 178.800 178.800 177.805 0.995 17919 97036 1 237 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.923 -0.343 17919 97037 1 237 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.628 0.342 17919 97038 1 237 . 1 1 8 8 LEU H H 8 9.100 9.100 8.813 0.287 17919 97039 1 237 . 1 1 9 9 THR N N 9 105.590 105.590 106.012 -0.422 17919 97040 1 237 . 1 1 9 9 THR HA H 9 4.428 4.428 4.312 0.116 17919 97041 1 237 . 1 1 9 9 THR C C 9 175.520 175.520 175.671 -0.151 17919 97042 1 237 . 1 1 9 9 THR CA C 9 61.400 61.400 61.941 -0.541 17919 97043 1 237 . 1 1 9 9 THR CB C 9 69.140 69.140 68.991 0.149 17919 97044 1 237 . 1 1 9 9 THR H H 9 7.630 7.630 7.642 -0.012 17919 97045 1 237 . 1 1 10 10 GLY N N 10 108.890 108.890 110.748 -1.858 17919 97046 1 237 . 1 1 10 10 GLY C C 10 174.070 174.070 173.692 0.378 17919 97047 1 237 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.964 0.496 17919 97048 1 237 . 1 1 10 10 GLY H H 10 7.810 7.810 7.634 0.176 17919 97049 1 237 . 1 1 11 11 LYS N N 11 121.600 121.600 120.746 0.854 17919 97050 1 237 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.645 -0.284 17919 97051 1 237 . 1 1 11 11 LYS C C 11 175.940 175.940 175.367 0.573 17919 97052 1 237 . 1 1 11 11 LYS CA C 11 56.280 56.280 54.954 1.326 17919 97053 1 237 . 1 1 11 11 LYS CB C 11 33.200 33.200 34.805 -1.605 17919 97054 1 237 . 1 1 11 11 LYS H H 11 7.280 7.280 7.841 -0.561 17919 97055 1 237 . 1 1 12 12 THR N N 12 120.440 120.440 118.445 1.995 17919 97056 1 237 . 1 1 12 12 THR HA H 12 5.046 5.046 5.123 -0.077 17919 97057 1 237 . 1 1 12 12 THR C C 12 174.320 174.320 174.090 0.230 17919 97058 1 237 . 1 1 12 12 THR CA C 12 62.390 62.390 61.353 1.036 17919 97059 1 237 . 1 1 12 12 THR CB C 12 69.910 69.910 70.478 -0.567 17919 97060 1 237 . 1 1 12 12 THR H H 12 8.650 8.650 8.298 0.352 17919 97061 1 237 . 1 1 13 13 ILE N N 13 127.110 127.110 125.803 1.307 17919 97062 1 237 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.536 0.008 17919 97063 1 237 . 1 1 13 13 ILE C C 13 175.220 175.220 175.371 -0.151 17919 97064 1 237 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.998 -0.018 17919 97065 1 237 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.925 -0.975 17919 97066 1 237 . 1 1 13 13 ILE H H 13 9.450 9.450 9.080 0.370 17919 97067 1 237 . 1 1 14 14 THR N N 14 121.520 121.520 122.326 -0.806 17919 97068 1 237 . 1 1 14 14 THR HA H 14 4.964 4.964 5.280 -0.316 17919 97069 1 237 . 1 1 14 14 THR C C 14 173.790 173.790 173.979 -0.189 17919 97070 1 237 . 1 1 14 14 THR CA C 14 61.940 61.940 61.779 0.161 17919 97071 1 237 . 1 1 14 14 THR CB C 14 69.650 69.650 69.932 -0.282 17919 97072 1 237 . 1 1 14 14 THR H H 14 8.710 8.710 8.323 0.387 17919 97073 1 237 . 1 1 15 15 LEU N N 15 124.800 124.800 126.884 -2.084 17919 97074 1 237 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.679 0.101 17919 97075 1 237 . 1 1 15 15 LEU C C 15 174.670 174.670 174.398 0.272 17919 97076 1 237 . 1 1 15 15 LEU CA C 15 52.830 52.830 54.390 -1.560 17919 97077 1 237 . 1 1 15 15 LEU CB C 15 47.070 47.070 46.737 0.333 17919 97078 1 237 . 1 1 15 15 LEU H H 15 8.710 8.710 9.143 -0.433 17919 97079 1 237 . 1 1 16 16 GLU N N 16 122.160 122.160 123.622 -1.462 17919 97080 1 237 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.019 -0.102 17919 97081 1 237 . 1 1 16 16 GLU C C 16 175.860 175.860 175.778 0.082 17919 97082 1 237 . 1 1 16 16 GLU CA C 16 54.820 54.820 54.998 -0.178 17919 97083 1 237 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.440 -0.990 17919 97084 1 237 . 1 1 16 16 GLU H H 16 8.140 8.140 8.644 -0.504 17919 97085 1 237 . 1 1 17 17 VAL N N 17 117.210 117.210 119.485 -2.275 17919 97086 1 237 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.995 -0.281 17919 97087 1 237 . 1 1 17 17 VAL C C 17 174.160 174.160 174.875 -0.715 17919 97088 1 237 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.825 -0.396 17919 97089 1 237 . 1 1 17 17 VAL CB C 17 36.400 36.400 36.011 0.389 17919 97090 1 237 . 1 1 17 17 VAL H H 17 8.900 8.900 8.979 -0.079 17919 97091 1 237 . 1 1 18 18 GLU N N 18 118.990 118.990 120.245 -1.255 17919 97092 1 237 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.956 0.123 17919 97093 1 237 . 1 1 18 18 GLU C C 18 176.160 176.160 175.602 0.558 17919 97094 1 237 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.926 -0.206 17919 97095 1 237 . 1 1 18 18 GLU CB C 18 30.310 30.310 31.596 -1.286 17919 97096 1 237 . 1 1 18 18 GLU H H 18 8.640 8.640 8.845 -0.205 17919 97097 1 237 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.430 -0.289 17919 97098 1 237 . 1 1 19 19 PRO C C 19 175.310 175.310 177.233 -1.923 17919 97099 1 237 . 1 1 19 19 PRO CA C 19 65.470 65.470 64.995 0.475 17919 97100 1 237 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.842 0.108 17919 97101 1 237 . 1 1 20 20 SER N N 20 103.400 103.400 109.910 -6.510 17919 97102 1 237 . 1 1 20 20 SER HA H 20 4.370 4.370 4.279 0.091 17919 97103 1 237 . 1 1 20 20 SER C C 20 174.660 174.660 174.109 0.551 17919 97104 1 237 . 1 1 20 20 SER CA C 20 57.400 57.400 58.943 -1.543 17919 97105 1 237 . 1 1 20 20 SER CB C 20 63.370 63.370 62.627 0.743 17919 97106 1 237 . 1 1 20 20 SER H H 20 7.040 7.040 8.019 -0.979 17919 97107 1 237 . 1 1 21 21 ASP N N 21 123.480 123.480 123.731 -0.251 17919 97108 1 237 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.736 -0.041 17919 97109 1 237 . 1 1 21 21 ASP C C 21 176.360 176.360 176.679 -0.319 17919 97110 1 237 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.388 1.312 17919 97111 1 237 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.585 -0.785 17919 97112 1 237 . 1 1 21 21 ASP H H 21 8.030 8.030 7.754 0.276 17919 97113 1 237 . 1 1 22 22 THR N N 22 108.800 108.800 113.321 -4.521 17919 97114 1 237 . 1 1 22 22 THR HA H 22 4.920 4.920 4.860 0.060 17919 97115 1 237 . 1 1 22 22 THR C C 22 176.750 176.750 176.391 0.359 17919 97116 1 237 . 1 1 22 22 THR CA C 22 59.690 59.690 61.094 -1.404 17919 97117 1 237 . 1 1 22 22 THR CB C 22 71.200 71.200 70.570 0.630 17919 97118 1 237 . 1 1 22 22 THR H H 22 7.900 7.900 8.052 -0.152 17919 97119 1 237 . 1 1 23 23 ILE N N 23 121.190 121.190 121.815 -0.625 17919 97120 1 237 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.797 -0.140 17919 97121 1 237 . 1 1 23 23 ILE C C 23 179.040 179.040 178.149 0.891 17919 97122 1 237 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.100 -0.840 17919 97123 1 237 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.252 -1.902 17919 97124 1 237 . 1 1 23 23 ILE H H 23 8.560 8.560 8.780 -0.220 17919 97125 1 237 . 1 1 24 24 GLU N N 24 120.830 120.830 120.136 0.694 17919 97126 1 237 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.943 -0.026 17919 97127 1 237 . 1 1 24 24 GLU C C 24 178.640 178.640 178.631 0.009 17919 97128 1 237 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.995 0.225 17919 97129 1 237 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.146 -0.866 17919 97130 1 237 . 1 1 24 24 GLU H H 24 9.760 9.760 8.468 1.292 17919 97131 1 237 . 1 1 25 25 ASN N N 25 120.570 120.570 118.198 2.372 17919 97132 1 237 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.482 0.043 17919 97133 1 237 . 1 1 25 25 ASN C C 25 178.380 178.380 177.966 0.414 17919 97134 1 237 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.161 -0.101 17919 97135 1 237 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.527 -0.077 17919 97136 1 237 . 1 1 25 25 ASN H H 25 7.920 7.920 7.693 0.227 17919 97137 1 237 . 1 1 26 26 VAL N N 26 121.710 121.710 120.542 1.168 17919 97138 1 237 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.634 -0.237 17919 97139 1 237 . 1 1 26 26 VAL C C 26 177.950 177.950 177.461 0.489 17919 97140 1 237 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.539 1.121 17919 97141 1 237 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.438 -0.598 17919 97142 1 237 . 1 1 26 26 VAL H H 26 8.070 8.070 7.665 0.405 17919 97143 1 237 . 1 1 27 27 LYS N N 27 118.860 118.860 120.382 -1.522 17919 97144 1 237 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.428 0.152 17919 97145 1 237 . 1 1 27 27 LYS C C 27 180.550 180.550 178.682 1.868 17919 97146 1 237 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.268 -0.018 17919 97147 1 237 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.451 1.279 17919 97148 1 237 . 1 1 27 27 LYS H H 27 8.560 8.560 8.342 0.218 17919 97149 1 237 . 1 1 28 28 ALA N N 28 123.440 123.440 122.846 0.594 17919 97150 1 237 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.162 -0.002 17919 97151 1 237 . 1 1 28 28 ALA C C 28 180.300 180.300 179.142 1.158 17919 97152 1 237 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.967 0.403 17919 97153 1 237 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.384 -0.673 17919 97154 1 237 . 1 1 28 28 ALA H H 28 8.060 8.060 8.339 -0.279 17919 97155 1 237 . 1 1 29 29 LYS N N 29 119.940 119.940 119.372 0.568 17919 97156 1 237 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.033 0.174 17919 97157 1 237 . 1 1 29 29 LYS C C 29 180.320 180.320 179.010 1.310 17919 97158 1 237 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.513 0.137 17919 97159 1 237 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.410 0.880 17919 97160 1 237 . 1 1 29 29 LYS H H 29 7.850 7.850 7.816 0.034 17919 97161 1 237 . 1 1 30 30 ILE N N 30 121.080 121.080 120.252 0.828 17919 97162 1 237 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.676 -0.169 17919 97163 1 237 . 1 1 30 30 ILE C C 30 178.310 178.310 177.563 0.747 17919 97164 1 237 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.280 0.870 17919 97165 1 237 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.701 -0.901 17919 97166 1 237 . 1 1 30 30 ILE H H 30 8.280 8.280 7.807 0.473 17919 97167 1 237 . 1 1 31 31 GLN N N 31 123.490 123.490 121.468 2.022 17919 97168 1 237 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.020 -0.191 17919 97169 1 237 . 1 1 31 31 GLN C C 31 178.890 178.890 178.486 0.404 17919 97170 1 237 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.343 0.657 17919 97171 1 237 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.522 -0.802 17919 97172 1 237 . 1 1 31 31 GLN H H 31 8.580 8.580 8.325 0.255 17919 97173 1 237 . 1 1 32 32 ASP N N 32 119.360 119.360 118.587 0.773 17919 97174 1 237 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.437 -0.083 17919 97175 1 237 . 1 1 32 32 ASP C C 32 177.250 177.250 178.189 -0.939 17919 97176 1 237 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.527 0.663 17919 97177 1 237 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.901 -0.321 17919 97178 1 237 . 1 1 32 32 ASP H H 32 8.010 8.010 7.786 0.224 17919 97179 1 237 . 1 1 33 33 LYS N N 33 115.130 115.130 118.707 -3.577 17919 97180 1 237 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.213 0.124 17919 97181 1 237 . 1 1 33 33 LYS C C 33 177.870 177.870 177.985 -0.115 17919 97182 1 237 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.232 -0.182 17919 97183 1 237 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.110 1.060 17919 97184 1 237 . 1 1 33 33 LYS H H 33 7.430 7.430 7.732 -0.302 17919 97185 1 237 . 1 1 34 34 GLU N N 34 113.870 113.870 115.047 -1.177 17919 97186 1 237 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.426 0.199 17919 97187 1 237 . 1 1 34 34 GLU C C 34 177.840 177.840 177.099 0.741 17919 97188 1 237 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.655 -0.485 17919 97189 1 237 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.280 1.380 17919 97190 1 237 . 1 1 34 34 GLU H H 34 8.740 8.740 8.232 0.508 17919 97191 1 237 . 1 1 35 35 GLY N N 35 108.650 108.650 107.926 0.724 17919 97192 1 237 . 1 1 35 35 GLY C C 35 173.960 173.960 174.823 -0.863 17919 97193 1 237 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.542 0.538 17919 97194 1 237 . 1 1 35 35 GLY H H 35 8.530 8.530 7.880 0.650 17919 97195 1 237 . 1 1 36 36 ILE N N 36 119.880 119.880 122.871 -2.991 17919 97196 1 237 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.487 -0.042 17919 97197 1 237 . 1 1 36 36 ILE C C 36 173.590 173.590 174.184 -0.594 17919 97198 1 237 . 1 1 36 36 ILE CA C 36 57.750 57.750 56.499 1.251 17919 97199 1 237 . 1 1 36 36 ILE CB C 36 40.580 40.580 37.234 3.346 17919 97200 1 237 . 1 1 36 36 ILE H H 36 6.150 6.150 7.672 -1.522 17919 97201 1 237 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.559 0.075 17919 97202 1 237 . 1 1 37 37 PRO C C 37 176.940 176.940 176.127 0.813 17919 97203 1 237 . 1 1 37 37 PRO CA C 37 61.660 61.660 62.325 -0.665 17919 97204 1 237 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.326 0.524 17919 97205 1 237 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.230 -0.113 17919 97206 1 237 . 1 1 38 38 PRO C C 38 178.320 178.320 178.009 0.311 17919 97207 1 237 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.229 1.031 17919 97208 1 237 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.792 1.098 17919 97209 1 237 . 1 1 39 39 ASP N N 39 113.380 113.380 116.356 -2.976 17919 97210 1 237 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.355 0.075 17919 97211 1 237 . 1 1 39 39 ASP C C 39 177.090 177.090 177.414 -0.324 17919 97212 1 237 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.806 -1.166 17919 97213 1 237 . 1 1 39 39 ASP CB C 39 39.540 39.540 39.407 0.133 17919 97214 1 237 . 1 1 39 39 ASP H H 39 8.550 8.550 8.978 -0.428 17919 97215 1 237 . 1 1 40 40 GLN N N 40 116.780 116.780 117.853 -1.073 17919 97216 1 237 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.241 0.223 17919 97217 1 237 . 1 1 40 40 GLN C C 40 175.380 175.380 176.105 -0.725 17919 97218 1 237 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.962 -1.322 17919 97219 1 237 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.689 0.451 17919 97220 1 237 . 1 1 40 40 GLN H H 40 7.820 7.820 7.919 -0.099 17919 97221 1 237 . 1 1 41 41 GLN N N 41 117.720 117.720 118.131 -0.411 17919 97222 1 237 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.456 -0.212 17919 97223 1 237 . 1 1 41 41 GLN C C 41 176.300 176.300 175.305 0.995 17919 97224 1 237 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.711 0.759 17919 97225 1 237 . 1 1 41 41 GLN CB C 41 31.650 31.650 30.605 1.045 17919 97226 1 237 . 1 1 41 41 GLN H H 41 7.480 7.480 7.491 -0.011 17919 97227 1 237 . 1 1 42 42 ARG N N 42 122.680 122.680 123.353 -0.673 17919 97228 1 237 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.652 -0.152 17919 97229 1 237 . 1 1 42 42 ARG C C 42 174.050 174.050 173.848 0.202 17919 97230 1 237 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.166 0.884 17919 97231 1 237 . 1 1 42 42 ARG CB C 42 31.750 31.750 34.054 -2.304 17919 97232 1 237 . 1 1 42 42 ARG H H 42 8.530 8.530 8.685 -0.155 17919 97233 1 237 . 1 1 43 43 LEU N N 43 124.040 124.040 124.761 -0.721 17919 97234 1 237 . 1 1 43 43 LEU C C 43 175.290 175.290 175.883 -0.593 17919 97235 1 237 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.398 -0.418 17919 97236 1 237 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.947 0.843 17919 97237 1 237 . 1 1 43 43 LEU H H 43 8.820 8.820 8.751 0.069 17919 97238 1 237 . 1 1 44 44 ILE N N 44 121.920 121.920 117.353 4.567 17919 97239 1 237 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.083 -0.091 17919 97240 1 237 . 1 1 44 44 ILE C C 44 176.060 176.060 173.562 2.498 17919 97241 1 237 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.377 -0.397 17919 97242 1 237 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.880 -0.460 17919 97243 1 237 . 1 1 44 44 ILE H H 44 9.030 9.030 9.160 -0.130 17919 97244 1 237 . 1 1 45 45 PHE N N 45 125.390 125.390 128.210 -2.820 17919 97245 1 237 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.036 0.009 17919 97246 1 237 . 1 1 45 45 PHE C C 45 174.470 174.470 174.756 -0.286 17919 97247 1 237 . 1 1 45 45 PHE CA C 45 57.020 57.020 55.855 1.165 17919 97248 1 237 . 1 1 45 45 PHE CB C 45 43.760 43.760 41.863 1.897 17919 97249 1 237 . 1 1 45 45 PHE H H 45 8.830 8.830 8.404 0.426 17919 97250 1 237 . 1 1 46 46 ALA N N 46 132.200 132.200 130.729 1.471 17919 97251 1 237 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.731 -0.041 17919 97252 1 237 . 1 1 46 46 ALA C C 46 177.290 177.290 177.287 0.003 17919 97253 1 237 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.398 0.142 17919 97254 1 237 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.317 0.253 17919 97255 1 237 . 1 1 46 46 ALA H H 46 8.810 8.810 8.677 0.133 17919 97256 1 237 . 1 1 47 47 GLY N N 47 102.340 102.340 105.160 -2.820 17919 97257 1 237 . 1 1 47 47 GLY C C 47 173.810 173.810 174.213 -0.403 17919 97258 1 237 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.248 0.101 17919 97259 1 237 . 1 1 47 47 GLY H H 47 8.130 8.130 8.357 -0.227 17919 97260 1 237 . 1 1 48 48 LYS N N 48 121.570 121.570 121.746 -0.176 17919 97261 1 237 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.572 0.050 17919 97262 1 237 . 1 1 48 48 LYS C C 48 174.700 174.700 174.900 -0.200 17919 97263 1 237 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.964 -0.414 17919 97264 1 237 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.785 -0.255 17919 97265 1 237 . 1 1 48 48 LYS H H 48 7.980 7.980 7.700 0.280 17919 97266 1 237 . 1 1 49 49 GLN N N 49 122.410 122.410 126.087 -3.677 17919 97267 1 237 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.171 0.389 17919 97268 1 237 . 1 1 49 49 GLN C C 49 175.670 175.670 175.280 0.390 17919 97269 1 237 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.283 -0.543 17919 97270 1 237 . 1 1 49 49 GLN CB C 49 29.000 29.000 28.699 0.301 17919 97271 1 237 . 1 1 49 49 GLN H H 49 8.600 8.600 8.538 0.062 17919 97272 1 237 . 1 1 50 50 LEU N N 50 125.520 125.520 128.253 -2.733 17919 97273 1 237 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.019 0.071 17919 97274 1 237 . 1 1 50 50 LEU C C 50 176.660 176.660 176.112 0.548 17919 97275 1 237 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.420 -0.180 17919 97276 1 237 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.161 -0.591 17919 97277 1 237 . 1 1 50 50 LEU H H 50 8.530 8.530 8.130 0.400 17919 97278 1 237 . 1 1 51 51 GLU N N 51 122.940 122.940 123.444 -0.504 17919 97279 1 237 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.561 -0.073 17919 97280 1 237 . 1 1 51 51 GLU C C 51 175.870 175.870 176.751 -0.881 17919 97281 1 237 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.055 0.905 17919 97282 1 237 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.122 -0.552 17919 97283 1 237 . 1 1 51 51 GLU H H 51 8.400 8.400 8.662 -0.262 17919 97284 1 237 . 1 1 52 52 ASP N N 52 120.030 120.030 127.486 -7.456 17919 97285 1 237 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.519 -0.160 17919 97286 1 237 . 1 1 52 52 ASP C C 52 177.330 177.330 177.135 0.195 17919 97287 1 237 . 1 1 52 52 ASP CA C 52 56.960 56.960 56.511 0.449 17919 97288 1 237 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.896 -0.046 17919 97289 1 237 . 1 1 52 52 ASP H H 52 8.160 8.160 8.889 -0.729 17919 97290 1 237 . 1 1 53 53 GLY N N 53 106.660 106.660 105.586 1.074 17919 97291 1 237 . 1 1 53 53 GLY C C 53 174.870 174.870 174.422 0.448 17919 97292 1 237 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.451 0.719 17919 97293 1 237 . 1 1 53 53 GLY H H 53 9.390 9.390 8.436 0.954 17919 97294 1 237 . 1 1 54 54 ARG N N 54 119.050 119.050 119.822 -0.772 17919 97295 1 237 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.666 0.029 17919 97296 1 237 . 1 1 54 54 ARG C C 54 175.350 175.350 175.424 -0.074 17919 97297 1 237 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.830 -0.439 17919 97298 1 237 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.585 0.065 17919 97299 1 237 . 1 1 54 54 ARG H H 54 7.460 7.460 7.581 -0.121 17919 97300 1 237 . 1 1 55 55 THR N N 55 108.400 108.400 111.576 -3.176 17919 97301 1 237 . 1 1 55 55 THR HA H 55 5.240 5.240 5.313 -0.073 17919 97302 1 237 . 1 1 55 55 THR C C 55 176.560 176.560 176.195 0.365 17919 97303 1 237 . 1 1 55 55 THR CA C 55 59.690 59.690 59.911 -0.221 17919 97304 1 237 . 1 1 55 55 THR CB C 55 72.260 72.260 71.598 0.662 17919 97305 1 237 . 1 1 55 55 THR H H 55 8.730 8.730 8.881 -0.151 17919 97306 1 237 . 1 1 56 56 LEU N N 56 117.920 117.920 122.240 -4.320 17919 97307 1 237 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.025 0.035 17919 97308 1 237 . 1 1 56 56 LEU C C 56 180.810 180.810 179.261 1.549 17919 97309 1 237 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.513 0.197 17919 97310 1 237 . 1 1 56 56 LEU CB C 56 40.370 40.370 40.369 0.001 17919 97311 1 237 . 1 1 56 56 LEU H H 56 8.140 8.140 8.333 -0.193 17919 97312 1 237 . 1 1 57 57 SER N N 57 113.330 113.330 115.310 -1.980 17919 97313 1 237 . 1 1 57 57 SER HA H 57 4.370 4.370 4.089 0.281 17919 97314 1 237 . 1 1 57 57 SER C C 57 178.310 178.310 177.003 1.307 17919 97315 1 237 . 1 1 57 57 SER CA C 57 61.080 61.080 61.705 -0.625 17919 97316 1 237 . 1 1 57 57 SER CB C 57 62.530 62.530 62.462 0.068 17919 97317 1 237 . 1 1 57 57 SER H H 57 8.470 8.470 8.097 0.373 17919 97318 1 237 . 1 1 58 58 ASP N N 58 124.190 124.190 123.209 0.981 17919 97319 1 237 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.349 -0.053 17919 97320 1 237 . 1 1 58 58 ASP C C 58 177.400 177.400 177.614 -0.214 17919 97321 1 237 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.653 0.527 17919 97322 1 237 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.476 -0.376 17919 97323 1 237 . 1 1 58 58 ASP H H 58 7.930 7.930 7.872 0.058 17919 97324 1 237 . 1 1 59 59 TYR N N 59 115.510 115.510 117.058 -1.548 17919 97325 1 237 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.531 0.139 17919 97326 1 237 . 1 1 59 59 TYR C C 59 174.700 174.700 175.059 -0.359 17919 97327 1 237 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.056 1.194 17919 97328 1 237 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.022 2.048 17919 97329 1 237 . 1 1 59 59 TYR H H 59 7.250 7.250 7.502 -0.252 17919 97330 1 237 . 1 1 60 60 ASN N N 60 115.900 115.900 116.835 -0.935 17919 97331 1 237 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.434 -0.079 17919 97332 1 237 . 1 1 60 60 ASN C C 60 174.340 174.340 174.417 -0.077 17919 97333 1 237 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.252 -0.132 17919 97334 1 237 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.566 -0.156 17919 97335 1 237 . 1 1 60 60 ASN H H 60 8.150 8.150 7.981 0.169 17919 97336 1 237 . 1 1 61 61 ILE N N 61 118.600 118.600 119.074 -0.474 17919 97337 1 237 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.747 -0.354 17919 97338 1 237 . 1 1 61 61 ILE C C 61 174.610 174.610 175.503 -0.893 17919 97339 1 237 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.173 1.247 17919 97340 1 237 . 1 1 61 61 ILE CB C 61 36.740 36.740 36.948 -0.208 17919 97341 1 237 . 1 1 61 61 ILE H H 61 7.250 7.250 8.025 -0.775 17919 97342 1 237 . 1 1 62 62 GLN N N 62 124.740 124.740 125.000 -0.260 17919 97343 1 237 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.636 -0.130 17919 97344 1 237 . 1 1 62 62 GLN C C 62 175.970 175.970 175.217 0.753 17919 97345 1 237 . 1 1 62 62 GLN CA C 62 53.660 53.660 52.741 0.919 17919 97346 1 237 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.614 0.036 17919 97347 1 237 . 1 1 62 62 GLN H H 62 7.610 7.610 7.983 -0.373 17919 97348 1 237 . 1 1 63 63 LYS N N 63 120.300 120.300 119.974 0.326 17919 97349 1 237 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.291 -0.290 17919 97350 1 237 . 1 1 63 63 LYS C C 63 175.810 175.810 177.211 -1.401 17919 97351 1 237 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.184 0.607 17919 97352 1 237 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.221 0.430 17919 97353 1 237 . 1 1 63 63 LYS H H 63 8.490 8.490 8.554 -0.064 17919 97354 1 237 . 1 1 64 64 GLU N N 64 113.950 113.950 118.155 -4.205 17919 97355 1 237 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.208 0.257 17919 97356 1 237 . 1 1 64 64 GLU C C 64 175.250 175.250 176.287 -1.037 17919 97357 1 237 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.527 0.363 17919 97358 1 237 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.315 -2.415 17919 97359 1 237 . 1 1 64 64 GLU H H 64 9.280 9.280 8.582 0.698 17919 97360 1 237 . 1 1 65 65 SER N N 65 114.730 114.730 116.153 -1.423 17919 97361 1 237 . 1 1 65 65 SER HA H 65 4.640 4.640 4.406 0.234 17919 97362 1 237 . 1 1 65 65 SER C C 65 172.160 172.160 173.967 -1.807 17919 97363 1 237 . 1 1 65 65 SER CA C 65 60.890 60.890 60.388 0.502 17919 97364 1 237 . 1 1 65 65 SER CB C 65 64.910 64.910 63.869 1.041 17919 97365 1 237 . 1 1 65 65 SER H H 65 7.670 7.670 7.578 0.092 17919 97366 1 237 . 1 1 66 66 THR N N 66 117.110 117.110 120.421 -3.311 17919 97367 1 237 . 1 1 66 66 THR HA H 66 5.270 5.270 4.953 0.317 17919 97368 1 237 . 1 1 66 66 THR C C 66 173.950 173.950 174.243 -0.293 17919 97369 1 237 . 1 1 66 66 THR CA C 66 62.340 62.340 62.575 -0.235 17919 97370 1 237 . 1 1 66 66 THR CB C 66 70.080 70.080 69.944 0.136 17919 97371 1 237 . 1 1 66 66 THR H H 66 8.730 8.730 8.721 0.009 17919 97372 1 237 . 1 1 67 67 LEU N N 67 127.110 127.110 127.350 -0.240 17919 97373 1 237 . 1 1 67 67 LEU HA H 67 5.060 5.060 5.185 -0.125 17919 97374 1 237 . 1 1 67 67 LEU C C 67 175.770 175.770 175.770 0.000 17919 97375 1 237 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.681 0.219 17919 97376 1 237 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.119 0.141 17919 97377 1 237 . 1 1 67 67 LEU H H 67 9.410 9.410 9.309 0.101 17919 97378 1 237 . 1 1 68 68 HIS N N 68 118.380 118.380 122.200 -3.820 17919 97379 1 237 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.501 -0.261 17919 97380 1 237 . 1 1 68 68 HIS C C 68 173.150 173.150 173.908 -0.758 17919 97381 1 237 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.390 0.610 17919 97382 1 237 . 1 1 68 68 HIS CB C 68 30.530 30.530 33.501 -2.971 17919 97383 1 237 . 1 1 68 68 HIS H H 68 9.230 9.230 9.349 -0.119 17919 97384 1 237 . 1 1 69 69 LEU N N 69 124.460 124.460 127.929 -3.469 17919 97385 1 237 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.256 -0.066 17919 97386 1 237 . 1 1 69 69 LEU C C 69 175.270 175.270 174.609 0.661 17919 97387 1 237 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.102 -0.212 17919 97388 1 237 . 1 1 69 69 LEU CB C 69 44.380 44.380 43.795 0.585 17919 97389 1 237 . 1 1 69 69 LEU H H 69 8.340 8.340 8.395 -0.055 17919 97390 1 237 . 1 1 70 70 VAL N N 70 126.940 126.940 127.123 -0.183 17919 97391 1 237 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.421 -0.071 17919 97392 1 237 . 1 1 70 70 VAL C C 70 174.000 174.000 174.963 -0.963 17919 97393 1 237 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.788 0.012 17919 97394 1 237 . 1 1 70 70 VAL CB C 70 34.910 34.910 33.849 1.061 17919 97395 1 237 . 1 1 70 70 VAL H H 70 9.200 9.200 9.169 0.031 17919 97396 1 237 . 1 1 71 71 LEU N N 71 123.130 123.130 127.459 -4.329 17919 97397 1 237 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.650 0.410 17919 97398 1 237 . 1 1 71 71 LEU C C 71 177.830 177.830 177.591 0.239 17919 97399 1 237 . 1 1 71 71 LEU CA C 71 53.940 53.940 54.559 -0.619 17919 97400 1 237 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.300 0.550 17919 97401 1 237 . 1 1 71 71 LEU H H 71 8.120 8.120 8.681 -0.561 17919 97402 1 237 . 1 1 72 72 ARG N N 72 123.490 123.490 126.868 -3.378 17919 97403 1 237 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.337 -0.036 17919 97404 1 237 . 1 1 72 72 ARG C C 72 175.350 175.350 175.107 0.243 17919 97405 1 237 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.822 -0.212 17919 97406 1 237 . 1 1 72 72 ARG CB C 72 31.350 31.350 28.939 2.411 17919 97407 1 237 . 1 1 72 72 ARG H H 72 8.580 8.580 8.659 -0.079 17919 97408 1 238 . 1 1 2 2 GLN N N 2 123.220 123.220 119.911 3.309 17919 97409 1 238 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.412 -0.163 17919 97410 1 238 . 1 1 2 2 GLN C C 2 175.920 175.920 175.889 0.031 17919 97411 1 238 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.733 0.347 17919 97412 1 238 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.002 0.758 17919 97413 1 238 . 1 1 2 2 GLN H H 2 8.900 8.900 8.354 0.546 17919 97414 1 238 . 1 1 3 3 ILE N N 3 115.340 115.340 116.163 -0.823 17919 97415 1 238 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.584 -0.371 17919 97416 1 238 . 1 1 3 3 ILE C C 3 172.450 172.450 173.353 -0.903 17919 97417 1 238 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.227 0.343 17919 97418 1 238 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.995 0.215 17919 97419 1 238 . 1 1 3 3 ILE H H 3 8.320 8.320 8.727 -0.407 17919 97420 1 238 . 1 1 4 4 PHE N N 4 118.110 118.110 119.586 -1.476 17919 97421 1 238 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.666 -0.036 17919 97422 1 238 . 1 1 4 4 PHE C C 4 175.320 175.320 175.428 -0.108 17919 97423 1 238 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.684 -0.474 17919 97424 1 238 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.455 -0.975 17919 97425 1 238 . 1 1 4 4 PHE H H 4 8.610 8.610 8.211 0.399 17919 97426 1 238 . 1 1 5 5 VAL N N 5 121.000 121.000 121.513 -0.513 17919 97427 1 238 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.560 0.165 17919 97428 1 238 . 1 1 5 5 VAL C C 5 174.870 174.870 174.865 0.005 17919 97429 1 238 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.240 -0.620 17919 97430 1 238 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.681 -0.451 17919 97431 1 238 . 1 1 5 5 VAL H H 5 9.300 9.300 8.810 0.490 17919 97432 1 238 . 1 1 6 6 LYS N N 6 127.520 127.520 128.168 -0.648 17919 97433 1 238 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.047 0.320 17919 97434 1 238 . 1 1 6 6 LYS C C 6 177.140 177.140 176.806 0.334 17919 97435 1 238 . 1 1 6 6 LYS CA C 6 54.520 54.520 55.043 -0.523 17919 97436 1 238 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.188 0.862 17919 97437 1 238 . 1 1 6 6 LYS H H 6 8.820 8.820 8.839 -0.019 17919 97438 1 238 . 1 1 7 7 THR N N 7 115.400 115.400 117.063 -1.663 17919 97439 1 238 . 1 1 7 7 THR HA H 7 4.970 4.970 4.588 0.382 17919 97440 1 238 . 1 1 7 7 THR C C 7 176.910 176.910 176.591 0.319 17919 97441 1 238 . 1 1 7 7 THR CA C 7 60.470 60.470 60.539 -0.069 17919 97442 1 238 . 1 1 7 7 THR CB C 7 70.630 70.630 70.014 0.616 17919 97443 1 238 . 1 1 7 7 THR H H 7 8.730 8.730 8.473 0.257 17919 97444 1 238 . 1 1 8 8 LEU N N 8 121.330 121.330 120.008 1.322 17919 97445 1 238 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.415 -0.105 17919 97446 1 238 . 1 1 8 8 LEU C C 8 178.800 178.800 177.762 1.038 17919 97447 1 238 . 1 1 8 8 LEU CA C 8 57.580 57.580 56.901 0.680 17919 97448 1 238 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.519 0.451 17919 97449 1 238 . 1 1 8 8 LEU H H 8 9.100 9.100 8.630 0.470 17919 97450 1 238 . 1 1 9 9 THR N N 9 105.590 105.590 110.131 -4.541 17919 97451 1 238 . 1 1 9 9 THR HA H 9 4.428 4.428 4.387 0.041 17919 97452 1 238 . 1 1 9 9 THR C C 9 175.520 175.520 175.996 -0.476 17919 97453 1 238 . 1 1 9 9 THR CA C 9 61.400 61.400 61.402 -0.002 17919 97454 1 238 . 1 1 9 9 THR CB C 9 69.140 69.140 69.029 0.111 17919 97455 1 238 . 1 1 9 9 THR H H 9 7.630 7.630 7.594 0.036 17919 97456 1 238 . 1 1 10 10 GLY N N 10 108.890 108.890 110.857 -1.967 17919 97457 1 238 . 1 1 10 10 GLY C C 10 174.070 174.070 174.113 -0.043 17919 97458 1 238 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.445 0.015 17919 97459 1 238 . 1 1 10 10 GLY H H 10 7.810 7.810 7.884 -0.074 17919 97460 1 238 . 1 1 11 11 LYS N N 11 121.600 121.600 121.882 -0.282 17919 97461 1 238 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.448 -0.087 17919 97462 1 238 . 1 1 11 11 LYS C C 11 175.940 175.940 175.922 0.018 17919 97463 1 238 . 1 1 11 11 LYS CA C 11 56.280 56.280 55.515 0.765 17919 97464 1 238 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.097 0.103 17919 97465 1 238 . 1 1 11 11 LYS H H 11 7.280 7.280 7.460 -0.180 17919 97466 1 238 . 1 1 12 12 THR N N 12 120.440 120.440 123.677 -3.237 17919 97467 1 238 . 1 1 12 12 THR HA H 12 5.046 5.046 4.468 0.578 17919 97468 1 238 . 1 1 12 12 THR C C 12 174.320 174.320 174.688 -0.368 17919 97469 1 238 . 1 1 12 12 THR CA C 12 62.390 62.390 63.229 -0.839 17919 97470 1 238 . 1 1 12 12 THR CB C 12 69.910 69.910 68.843 1.067 17919 97471 1 238 . 1 1 12 12 THR H H 12 8.650 8.650 8.436 0.214 17919 97472 1 238 . 1 1 13 13 ILE N N 13 127.110 127.110 127.885 -0.775 17919 97473 1 238 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.318 0.226 17919 97474 1 238 . 1 1 13 13 ILE C C 13 175.220 175.220 175.947 -0.727 17919 97475 1 238 . 1 1 13 13 ILE CA C 13 59.980 59.980 58.797 1.183 17919 97476 1 238 . 1 1 13 13 ILE CB C 13 40.950 40.950 38.510 2.440 17919 97477 1 238 . 1 1 13 13 ILE H H 13 9.450 9.450 8.934 0.516 17919 97478 1 238 . 1 1 14 14 THR N N 14 121.520 121.520 121.961 -0.441 17919 97479 1 238 . 1 1 14 14 THR HA H 14 4.964 4.964 4.413 0.551 17919 97480 1 238 . 1 1 14 14 THR C C 14 173.790 173.790 173.620 0.170 17919 97481 1 238 . 1 1 14 14 THR CA C 14 61.940 61.940 62.753 -0.813 17919 97482 1 238 . 1 1 14 14 THR CB C 14 69.650 69.650 69.346 0.304 17919 97483 1 238 . 1 1 14 14 THR H H 14 8.710 8.710 8.582 0.128 17919 97484 1 238 . 1 1 15 15 LEU N N 15 124.800 124.800 128.979 -4.179 17919 97485 1 238 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.658 0.122 17919 97486 1 238 . 1 1 15 15 LEU C C 15 174.670 174.670 175.282 -0.612 17919 97487 1 238 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.832 -1.002 17919 97488 1 238 . 1 1 15 15 LEU CB C 15 47.070 47.070 44.895 2.175 17919 97489 1 238 . 1 1 15 15 LEU H H 15 8.710 8.710 8.870 -0.160 17919 97490 1 238 . 1 1 16 16 GLU N N 16 122.160 122.160 123.894 -1.734 17919 97491 1 238 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.346 -0.429 17919 97492 1 238 . 1 1 16 16 GLU C C 16 175.860 175.860 176.270 -0.410 17919 97493 1 238 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.377 -0.557 17919 97494 1 238 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.683 -1.233 17919 97495 1 238 . 1 1 16 16 GLU H H 16 8.140 8.140 8.738 -0.598 17919 97496 1 238 . 1 1 17 17 VAL N N 17 117.210 117.210 118.650 -1.440 17919 97497 1 238 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.806 -0.092 17919 97498 1 238 . 1 1 17 17 VAL C C 17 174.160 174.160 174.954 -0.794 17919 97499 1 238 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.572 -0.142 17919 97500 1 238 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.569 0.831 17919 97501 1 238 . 1 1 17 17 VAL H H 17 8.900 8.900 9.035 -0.135 17919 97502 1 238 . 1 1 18 18 GLU N N 18 118.990 118.990 120.376 -1.386 17919 97503 1 238 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.774 0.305 17919 97504 1 238 . 1 1 18 18 GLU C C 18 176.160 176.160 175.552 0.608 17919 97505 1 238 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.480 0.240 17919 97506 1 238 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.070 0.240 17919 97507 1 238 . 1 1 18 18 GLU H H 18 8.640 8.640 8.397 0.243 17919 97508 1 238 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.370 -0.229 17919 97509 1 238 . 1 1 19 19 PRO C C 19 175.310 175.310 177.181 -1.871 17919 97510 1 238 . 1 1 19 19 PRO CA C 19 65.470 65.470 64.849 0.621 17919 97511 1 238 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.140 -0.190 17919 97512 1 238 . 1 1 20 20 SER N N 20 103.400 103.400 110.760 -7.360 17919 97513 1 238 . 1 1 20 20 SER HA H 20 4.370 4.370 4.327 0.043 17919 97514 1 238 . 1 1 20 20 SER C C 20 174.660 174.660 174.612 0.048 17919 97515 1 238 . 1 1 20 20 SER CA C 20 57.400 57.400 58.358 -0.958 17919 97516 1 238 . 1 1 20 20 SER CB C 20 63.370 63.370 63.226 0.144 17919 97517 1 238 . 1 1 20 20 SER H H 20 7.040 7.040 7.923 -0.882 17919 97518 1 238 . 1 1 21 21 ASP N N 21 123.480 123.480 125.294 -1.814 17919 97519 1 238 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.760 -0.065 17919 97520 1 238 . 1 1 21 21 ASP C C 21 176.360 176.360 175.866 0.494 17919 97521 1 238 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.200 0.499 17919 97522 1 238 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.585 -0.785 17919 97523 1 238 . 1 1 21 21 ASP H H 21 8.030 8.030 7.630 0.400 17919 97524 1 238 . 1 1 22 22 THR N N 22 108.800 108.800 111.892 -3.092 17919 97525 1 238 . 1 1 22 22 THR HA H 22 4.920 4.920 4.858 0.062 17919 97526 1 238 . 1 1 22 22 THR C C 22 176.750 176.750 176.281 0.469 17919 97527 1 238 . 1 1 22 22 THR CA C 22 59.690 59.690 61.458 -1.768 17919 97528 1 238 . 1 1 22 22 THR CB C 22 71.200 71.200 70.195 1.005 17919 97529 1 238 . 1 1 22 22 THR H H 22 7.900 7.900 8.226 -0.326 17919 97530 1 238 . 1 1 23 23 ILE N N 23 121.190 121.190 122.102 -0.912 17919 97531 1 238 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.817 -0.160 17919 97532 1 238 . 1 1 23 23 ILE C C 23 179.040 179.040 177.674 1.366 17919 97533 1 238 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.610 -0.350 17919 97534 1 238 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.284 -1.934 17919 97535 1 238 . 1 1 23 23 ILE H H 23 8.560 8.560 8.562 -0.002 17919 97536 1 238 . 1 1 24 24 GLU N N 24 120.830 120.830 121.577 -0.747 17919 97537 1 238 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.900 0.017 17919 97538 1 238 . 1 1 24 24 GLU C C 24 178.640 178.640 178.685 -0.045 17919 97539 1 238 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.017 0.203 17919 97540 1 238 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.516 -1.236 17919 97541 1 238 . 1 1 24 24 GLU H H 24 9.760 9.760 8.665 1.095 17919 97542 1 238 . 1 1 25 25 ASN N N 25 120.570 120.570 117.998 2.572 17919 97543 1 238 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.506 0.019 17919 97544 1 238 . 1 1 25 25 ASN C C 25 178.380 178.380 177.922 0.458 17919 97545 1 238 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.190 -0.130 17919 97546 1 238 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.642 -0.192 17919 97547 1 238 . 1 1 25 25 ASN H H 25 7.920 7.920 7.568 0.352 17919 97548 1 238 . 1 1 26 26 VAL N N 26 121.710 121.710 120.322 1.388 17919 97549 1 238 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.609 -0.212 17919 97550 1 238 . 1 1 26 26 VAL C C 26 177.950 177.950 177.750 0.200 17919 97551 1 238 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.508 1.152 17919 97552 1 238 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.394 -0.554 17919 97553 1 238 . 1 1 26 26 VAL H H 26 8.070 8.070 8.043 0.027 17919 97554 1 238 . 1 1 27 27 LYS N N 27 118.860 118.860 119.864 -1.004 17919 97555 1 238 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.216 0.364 17919 97556 1 238 . 1 1 27 27 LYS C C 27 180.550 180.550 179.001 1.549 17919 97557 1 238 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.447 -0.197 17919 97558 1 238 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.291 1.439 17919 97559 1 238 . 1 1 27 27 LYS H H 27 8.560 8.560 8.347 0.213 17919 97560 1 238 . 1 1 28 28 ALA N N 28 123.440 123.440 122.464 0.976 17919 97561 1 238 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.033 0.127 17919 97562 1 238 . 1 1 28 28 ALA C C 28 180.300 180.300 179.208 1.092 17919 97563 1 238 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.236 0.134 17919 97564 1 238 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.376 -0.666 17919 97565 1 238 . 1 1 28 28 ALA H H 28 8.060 8.060 8.369 -0.309 17919 97566 1 238 . 1 1 29 29 LYS N N 29 119.940 119.940 118.944 0.996 17919 97567 1 238 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.078 0.129 17919 97568 1 238 . 1 1 29 29 LYS C C 29 180.320 180.320 179.047 1.273 17919 97569 1 238 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.282 0.367 17919 97570 1 238 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.353 0.937 17919 97571 1 238 . 1 1 29 29 LYS H H 29 7.850 7.850 7.594 0.256 17919 97572 1 238 . 1 1 30 30 ILE N N 30 121.080 121.080 120.312 0.768 17919 97573 1 238 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.792 -0.285 17919 97574 1 238 . 1 1 30 30 ILE C C 30 178.310 178.310 177.588 0.722 17919 97575 1 238 . 1 1 30 30 ILE CA C 30 66.150 66.150 64.143 2.007 17919 97576 1 238 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.192 -0.392 17919 97577 1 238 . 1 1 30 30 ILE H H 30 8.280 8.280 7.864 0.416 17919 97578 1 238 . 1 1 31 31 GLN N N 31 123.490 123.490 121.641 1.849 17919 97579 1 238 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.156 -0.327 17919 97580 1 238 . 1 1 31 31 GLN C C 31 178.890 178.890 178.043 0.847 17919 97581 1 238 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.336 0.664 17919 97582 1 238 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.509 -0.789 17919 97583 1 238 . 1 1 31 31 GLN H H 31 8.580 8.580 8.100 0.480 17919 97584 1 238 . 1 1 32 32 ASP N N 32 119.360 119.360 118.179 1.181 17919 97585 1 238 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.409 -0.055 17919 97586 1 238 . 1 1 32 32 ASP C C 32 177.250 177.250 178.416 -1.166 17919 97587 1 238 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.732 0.458 17919 97588 1 238 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.860 -0.280 17919 97589 1 238 . 1 1 32 32 ASP H H 32 8.010 8.010 7.969 0.041 17919 97590 1 238 . 1 1 33 33 LYS N N 33 115.130 115.130 118.167 -3.037 17919 97591 1 238 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.336 0.001 17919 97592 1 238 . 1 1 33 33 LYS C C 33 177.870 177.870 178.296 -0.426 17919 97593 1 238 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.002 0.048 17919 97594 1 238 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.177 0.993 17919 97595 1 238 . 1 1 33 33 LYS H H 33 7.430 7.430 7.592 -0.162 17919 97596 1 238 . 1 1 34 34 GLU N N 34 113.870 113.870 114.236 -0.366 17919 97597 1 238 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.533 0.092 17919 97598 1 238 . 1 1 34 34 GLU C C 34 177.840 177.840 176.890 0.950 17919 97599 1 238 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.494 -0.324 17919 97600 1 238 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.517 1.143 17919 97601 1 238 . 1 1 34 34 GLU H H 34 8.740 8.740 8.270 0.470 17919 97602 1 238 . 1 1 35 35 GLY N N 35 108.650 108.650 108.214 0.436 17919 97603 1 238 . 1 1 35 35 GLY C C 35 173.960 173.960 174.674 -0.714 17919 97604 1 238 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.510 0.570 17919 97605 1 238 . 1 1 35 35 GLY H H 35 8.530 8.530 7.887 0.643 17919 97606 1 238 . 1 1 36 36 ILE N N 36 119.880 119.880 122.491 -2.611 17919 97607 1 238 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.277 0.168 17919 97608 1 238 . 1 1 36 36 ILE C C 36 173.590 173.590 173.985 -0.395 17919 97609 1 238 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.543 -0.793 17919 97610 1 238 . 1 1 36 36 ILE CB C 36 40.580 40.580 37.934 2.646 17919 97611 1 238 . 1 1 36 36 ILE H H 36 6.150 6.150 7.565 -1.415 17919 97612 1 238 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.985 -0.351 17919 97613 1 238 . 1 1 37 37 PRO C C 37 176.940 176.940 176.336 0.604 17919 97614 1 238 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.385 0.276 17919 97615 1 238 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.226 0.624 17919 97616 1 238 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.174 -0.057 17919 97617 1 238 . 1 1 38 38 PRO C C 38 178.320 178.320 178.141 0.179 17919 97618 1 238 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.876 0.384 17919 97619 1 238 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.866 1.024 17919 97620 1 238 . 1 1 39 39 ASP N N 39 113.380 113.380 115.524 -2.144 17919 97621 1 238 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.305 0.125 17919 97622 1 238 . 1 1 39 39 ASP C C 39 177.090 177.090 177.874 -0.784 17919 97623 1 238 . 1 1 39 39 ASP CA C 39 55.640 55.640 57.076 -1.436 17919 97624 1 238 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.478 -0.938 17919 97625 1 238 . 1 1 39 39 ASP H H 39 8.550 8.550 8.766 -0.216 17919 97626 1 238 . 1 1 40 40 GLN N N 40 116.780 116.780 115.752 1.028 17919 97627 1 238 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.371 0.093 17919 97628 1 238 . 1 1 40 40 GLN C C 40 175.380 175.380 176.506 -1.126 17919 97629 1 238 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.201 -0.561 17919 97630 1 238 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.311 0.829 17919 97631 1 238 . 1 1 40 40 GLN H H 40 7.820 7.820 7.955 -0.135 17919 97632 1 238 . 1 1 41 41 GLN N N 41 117.720 117.720 119.622 -1.902 17919 97633 1 238 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.127 0.117 17919 97634 1 238 . 1 1 41 41 GLN C C 41 176.300 176.300 175.713 0.587 17919 97635 1 238 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.904 -0.434 17919 97636 1 238 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.074 2.576 17919 97637 1 238 . 1 1 41 41 GLN H H 41 7.480 7.480 7.346 0.134 17919 97638 1 238 . 1 1 42 42 ARG N N 42 122.680 122.680 125.658 -2.978 17919 97639 1 238 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.561 -0.061 17919 97640 1 238 . 1 1 42 42 ARG C C 42 174.050 174.050 174.164 -0.114 17919 97641 1 238 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.699 0.351 17919 97642 1 238 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.374 -1.624 17919 97643 1 238 . 1 1 42 42 ARG H H 42 8.530 8.530 8.389 0.141 17919 97644 1 238 . 1 1 43 43 LEU N N 43 124.040 124.040 126.685 -2.645 17919 97645 1 238 . 1 1 43 43 LEU C C 43 175.290 175.290 175.499 -0.209 17919 97646 1 238 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.675 -0.695 17919 97647 1 238 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.647 1.143 17919 97648 1 238 . 1 1 43 43 LEU H H 43 8.820 8.820 8.863 -0.043 17919 97649 1 238 . 1 1 44 44 ILE N N 44 121.920 121.920 117.018 4.902 17919 97650 1 238 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.154 -0.162 17919 97651 1 238 . 1 1 44 44 ILE C C 44 176.060 176.060 173.843 2.217 17919 97652 1 238 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.416 -0.436 17919 97653 1 238 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.368 0.052 17919 97654 1 238 . 1 1 44 44 ILE H H 44 9.030 9.030 9.195 -0.165 17919 97655 1 238 . 1 1 45 45 PHE N N 45 125.390 125.390 127.285 -1.895 17919 97656 1 238 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.075 -0.030 17919 97657 1 238 . 1 1 45 45 PHE C C 45 174.470 174.470 174.871 -0.401 17919 97658 1 238 . 1 1 45 45 PHE CA C 45 57.020 57.020 57.729 -0.709 17919 97659 1 238 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.018 0.742 17919 97660 1 238 . 1 1 45 45 PHE H H 45 8.830 8.830 8.540 0.290 17919 97661 1 238 . 1 1 46 46 ALA N N 46 132.200 132.200 129.823 2.377 17919 97662 1 238 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.648 0.042 17919 97663 1 238 . 1 1 46 46 ALA C C 46 177.290 177.290 177.614 -0.324 17919 97664 1 238 . 1 1 46 46 ALA CA C 46 52.540 52.540 53.176 -0.636 17919 97665 1 238 . 1 1 46 46 ALA CB C 46 16.570 16.570 17.369 -0.799 17919 97666 1 238 . 1 1 46 46 ALA H H 46 8.810 8.810 8.237 0.573 17919 97667 1 238 . 1 1 47 47 GLY N N 47 102.340 102.340 104.388 -2.048 17919 97668 1 238 . 1 1 47 47 GLY C C 47 173.810 173.810 174.047 -0.237 17919 97669 1 238 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.846 0.504 17919 97670 1 238 . 1 1 47 47 GLY H H 47 8.130 8.130 8.327 -0.197 17919 97671 1 238 . 1 1 48 48 LYS N N 48 121.570 121.570 122.219 -0.649 17919 97672 1 238 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.635 -0.013 17919 97673 1 238 . 1 1 48 48 LYS C C 48 174.700 174.700 176.000 -1.300 17919 97674 1 238 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.913 -0.364 17919 97675 1 238 . 1 1 48 48 LYS CB C 48 34.530 34.530 33.699 0.831 17919 97676 1 238 . 1 1 48 48 LYS H H 48 7.980 7.980 8.197 -0.217 17919 97677 1 238 . 1 1 49 49 GLN N N 49 122.410 122.410 123.496 -1.086 17919 97678 1 238 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.610 -0.050 17919 97679 1 238 . 1 1 49 49 GLN C C 49 175.670 175.670 175.549 0.121 17919 97680 1 238 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.781 -0.040 17919 97681 1 238 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.430 -0.430 17919 97682 1 238 . 1 1 49 49 GLN H H 49 8.600 8.600 8.598 0.002 17919 97683 1 238 . 1 1 50 50 LEU N N 50 125.520 125.520 125.769 -0.249 17919 97684 1 238 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.173 -0.083 17919 97685 1 238 . 1 1 50 50 LEU C C 50 176.660 176.660 176.080 0.580 17919 97686 1 238 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.839 0.401 17919 97687 1 238 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.325 -0.755 17919 97688 1 238 . 1 1 50 50 LEU H H 50 8.530 8.530 8.314 0.216 17919 97689 1 238 . 1 1 51 51 GLU N N 51 122.940 122.940 122.943 -0.003 17919 97690 1 238 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.513 -0.025 17919 97691 1 238 . 1 1 51 51 GLU C C 51 175.870 175.870 176.596 -0.726 17919 97692 1 238 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.372 0.588 17919 97693 1 238 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.766 -0.196 17919 97694 1 238 . 1 1 51 51 GLU H H 51 8.400 8.400 8.077 0.323 17919 97695 1 238 . 1 1 52 52 ASP N N 52 120.030 120.030 122.538 -2.508 17919 97696 1 238 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.385 -0.026 17919 97697 1 238 . 1 1 52 52 ASP C C 52 177.330 177.330 177.604 -0.274 17919 97698 1 238 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.987 -1.027 17919 97699 1 238 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.742 0.108 17919 97700 1 238 . 1 1 52 52 ASP H H 52 8.160 8.160 8.807 -0.647 17919 97701 1 238 . 1 1 53 53 GLY N N 53 106.660 106.660 103.850 2.810 17919 97702 1 238 . 1 1 53 53 GLY C C 53 174.870 174.870 173.980 0.890 17919 97703 1 238 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.580 0.590 17919 97704 1 238 . 1 1 53 53 GLY H H 53 9.390 9.390 8.387 1.003 17919 97705 1 238 . 1 1 54 54 ARG N N 54 119.050 119.050 119.702 -0.652 17919 97706 1 238 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.684 0.011 17919 97707 1 238 . 1 1 54 54 ARG C C 54 175.350 175.350 175.265 0.085 17919 97708 1 238 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.124 0.266 17919 97709 1 238 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.747 -1.097 17919 97710 1 238 . 1 1 54 54 ARG H H 54 7.460 7.460 7.427 0.033 17919 97711 1 238 . 1 1 55 55 THR N N 55 108.400 108.400 112.531 -4.131 17919 97712 1 238 . 1 1 55 55 THR HA H 55 5.240 5.240 5.025 0.215 17919 97713 1 238 . 1 1 55 55 THR C C 55 176.560 176.560 176.231 0.329 17919 97714 1 238 . 1 1 55 55 THR CA C 55 59.690 59.690 60.435 -0.745 17919 97715 1 238 . 1 1 55 55 THR CB C 55 72.260 72.260 70.511 1.749 17919 97716 1 238 . 1 1 55 55 THR H H 55 8.730 8.730 8.306 0.424 17919 97717 1 238 . 1 1 56 56 LEU N N 56 117.920 117.920 120.366 -2.446 17919 97718 1 238 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.277 -0.217 17919 97719 1 238 . 1 1 56 56 LEU C C 56 180.810 180.810 178.324 2.486 17919 97720 1 238 . 1 1 56 56 LEU CA C 56 58.710 58.710 57.473 1.237 17919 97721 1 238 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.309 -0.939 17919 97722 1 238 . 1 1 56 56 LEU H H 56 8.140 8.140 8.319 -0.179 17919 97723 1 238 . 1 1 57 57 SER N N 57 113.330 113.330 114.297 -0.967 17919 97724 1 238 . 1 1 57 57 SER HA H 57 4.370 4.370 4.256 0.114 17919 97725 1 238 . 1 1 57 57 SER C C 57 178.310 178.310 176.194 2.116 17919 97726 1 238 . 1 1 57 57 SER CA C 57 61.080 61.080 61.178 -0.098 17919 97727 1 238 . 1 1 57 57 SER CB C 57 62.530 62.530 62.731 -0.202 17919 97728 1 238 . 1 1 57 57 SER H H 57 8.470 8.470 7.828 0.642 17919 97729 1 238 . 1 1 58 58 ASP N N 58 124.190 124.190 123.279 0.911 17919 97730 1 238 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.328 -0.032 17919 97731 1 238 . 1 1 58 58 ASP C C 58 177.400 177.400 177.565 -0.165 17919 97732 1 238 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.218 0.962 17919 97733 1 238 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.551 -0.451 17919 97734 1 238 . 1 1 58 58 ASP H H 58 7.930 7.930 7.725 0.205 17919 97735 1 238 . 1 1 59 59 TYR N N 59 115.510 115.510 115.950 -0.440 17919 97736 1 238 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.437 0.233 17919 97737 1 238 . 1 1 59 59 TYR C C 59 174.700 174.700 174.639 0.061 17919 97738 1 238 . 1 1 59 59 TYR CA C 59 58.250 58.250 58.719 -0.469 17919 97739 1 238 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.497 1.573 17919 97740 1 238 . 1 1 59 59 TYR H H 59 7.250 7.250 7.201 0.049 17919 97741 1 238 . 1 1 60 60 ASN N N 60 115.900 115.900 116.279 -0.379 17919 97742 1 238 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.344 0.011 17919 97743 1 238 . 1 1 60 60 ASN C C 60 174.340 174.340 173.890 0.450 17919 97744 1 238 . 1 1 60 60 ASN CA C 60 54.120 54.120 53.919 0.201 17919 97745 1 238 . 1 1 60 60 ASN CB C 60 37.410 37.410 36.997 0.413 17919 97746 1 238 . 1 1 60 60 ASN H H 60 8.150 8.150 7.647 0.503 17919 97747 1 238 . 1 1 61 61 ILE N N 61 118.600 118.600 121.169 -2.569 17919 97748 1 238 . 1 1 61 61 ILE HA H 61 3.393 3.393 4.135 -0.742 17919 97749 1 238 . 1 1 61 61 ILE C C 61 174.610 174.610 174.613 -0.003 17919 97750 1 238 . 1 1 61 61 ILE CA C 61 62.420 62.420 60.314 2.106 17919 97751 1 238 . 1 1 61 61 ILE CB C 61 36.740 36.740 39.974 -3.234 17919 97752 1 238 . 1 1 61 61 ILE H H 61 7.250 7.250 7.992 -0.742 17919 97753 1 238 . 1 1 62 62 GLN N N 62 124.740 124.740 126.165 -1.425 17919 97754 1 238 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.677 -0.171 17919 97755 1 238 . 1 1 62 62 GLN C C 62 175.970 175.970 174.712 1.258 17919 97756 1 238 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.693 -0.033 17919 97757 1 238 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.002 0.648 17919 97758 1 238 . 1 1 62 62 GLN H H 62 7.610 7.610 8.291 -0.681 17919 97759 1 238 . 1 1 63 63 LYS N N 63 120.300 120.300 119.420 0.880 17919 97760 1 238 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.180 -0.179 17919 97761 1 238 . 1 1 63 63 LYS C C 63 175.810 175.810 177.025 -1.215 17919 97762 1 238 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.372 0.418 17919 97763 1 238 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.543 0.107 17919 97764 1 238 . 1 1 63 63 LYS H H 63 8.490 8.490 8.354 0.136 17919 97765 1 238 . 1 1 64 64 GLU N N 64 113.950 113.950 119.338 -5.388 17919 97766 1 238 . 1 1 64 64 GLU HA H 64 3.465 3.465 4.081 -0.616 17919 97767 1 238 . 1 1 64 64 GLU C C 64 175.250 175.250 175.571 -0.321 17919 97768 1 238 . 1 1 64 64 GLU CA C 64 57.890 57.890 58.223 -0.333 17919 97769 1 238 . 1 1 64 64 GLU CB C 64 25.900 25.900 29.536 -3.636 17919 97770 1 238 . 1 1 64 64 GLU H H 64 9.280 9.280 8.965 0.315 17919 97771 1 238 . 1 1 65 65 SER N N 65 114.730 114.730 115.411 -0.681 17919 97772 1 238 . 1 1 65 65 SER HA H 65 4.640 4.640 4.554 0.086 17919 97773 1 238 . 1 1 65 65 SER C C 65 172.160 172.160 174.141 -1.981 17919 97774 1 238 . 1 1 65 65 SER CA C 65 60.890 60.890 60.414 0.476 17919 97775 1 238 . 1 1 65 65 SER CB C 65 64.910 64.910 63.893 1.017 17919 97776 1 238 . 1 1 65 65 SER H H 65 7.670 7.670 7.641 0.029 17919 97777 1 238 . 1 1 66 66 THR N N 66 117.110 117.110 118.302 -1.192 17919 97778 1 238 . 1 1 66 66 THR HA H 66 5.270 5.270 4.965 0.305 17919 97779 1 238 . 1 1 66 66 THR C C 66 173.950 173.950 174.150 -0.200 17919 97780 1 238 . 1 1 66 66 THR CA C 66 62.340 62.340 61.703 0.637 17919 97781 1 238 . 1 1 66 66 THR CB C 66 70.080 70.080 70.130 -0.050 17919 97782 1 238 . 1 1 66 66 THR H H 66 8.730 8.730 8.366 0.364 17919 97783 1 238 . 1 1 67 67 LEU N N 67 127.110 127.110 126.371 0.739 17919 97784 1 238 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.891 0.169 17919 97785 1 238 . 1 1 67 67 LEU C C 67 175.770 175.770 175.773 -0.003 17919 97786 1 238 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.240 -0.340 17919 97787 1 238 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.869 0.391 17919 97788 1 238 . 1 1 67 67 LEU H H 67 9.410 9.410 8.788 0.622 17919 97789 1 238 . 1 1 68 68 HIS N N 68 118.380 118.380 119.082 -0.702 17919 97790 1 238 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.309 -0.069 17919 97791 1 238 . 1 1 68 68 HIS C C 68 173.150 173.150 173.780 -0.630 17919 97792 1 238 . 1 1 68 68 HIS CA C 68 55.000 55.000 55.261 -0.261 17919 97793 1 238 . 1 1 68 68 HIS CB C 68 30.530 30.530 33.053 -2.523 17919 97794 1 238 . 1 1 68 68 HIS H H 68 9.230 9.230 8.865 0.365 17919 97795 1 238 . 1 1 69 69 LEU N N 69 124.460 124.460 126.039 -1.579 17919 97796 1 238 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.388 -0.198 17919 97797 1 238 . 1 1 69 69 LEU C C 69 175.270 175.270 175.009 0.261 17919 97798 1 238 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.523 0.367 17919 97799 1 238 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.972 -0.592 17919 97800 1 238 . 1 1 69 69 LEU H H 69 8.340 8.340 9.037 -0.697 17919 97801 1 238 . 1 1 70 70 VAL N N 70 126.940 126.940 124.813 2.127 17919 97802 1 238 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.519 -0.169 17919 97803 1 238 . 1 1 70 70 VAL C C 70 174.000 174.000 173.811 0.189 17919 97804 1 238 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.930 0.870 17919 97805 1 238 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.886 -0.976 17919 97806 1 238 . 1 1 70 70 VAL H H 70 9.200 9.200 8.758 0.442 17919 97807 1 238 . 1 1 71 71 LEU N N 71 123.130 123.130 126.795 -3.665 17919 97808 1 238 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.106 -0.046 17919 97809 1 238 . 1 1 71 71 LEU C C 71 177.830 177.830 177.183 0.647 17919 97810 1 238 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.551 0.389 17919 97811 1 238 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.039 -0.190 17919 97812 1 238 . 1 1 71 71 LEU H H 71 8.120 8.120 8.423 -0.303 17919 97813 1 238 . 1 1 72 72 ARG N N 72 123.490 123.490 123.504 -0.014 17919 97814 1 238 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.393 -0.092 17919 97815 1 238 . 1 1 72 72 ARG C C 72 175.350 175.350 175.959 -0.609 17919 97816 1 238 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.299 0.311 17919 97817 1 238 . 1 1 72 72 ARG CB C 72 31.350 31.350 29.631 1.720 17919 97818 1 238 . 1 1 72 72 ARG H H 72 8.580 8.580 8.518 0.062 17919 97819 1 239 . 1 1 2 2 GLN N N 2 123.220 123.220 121.250 1.970 17919 97820 1 239 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.142 0.107 17919 97821 1 239 . 1 1 2 2 GLN C C 2 175.920 175.920 174.728 1.192 17919 97822 1 239 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.236 0.844 17919 97823 1 239 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.713 0.047 17919 97824 1 239 . 1 1 2 2 GLN H H 2 8.900 8.900 8.370 0.530 17919 97825 1 239 . 1 1 3 3 ILE N N 3 115.340 115.340 118.195 -2.855 17919 97826 1 239 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.847 -0.634 17919 97827 1 239 . 1 1 3 3 ILE C C 3 172.450 172.450 173.710 -1.260 17919 97828 1 239 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.079 0.491 17919 97829 1 239 . 1 1 3 3 ILE CB C 3 42.210 42.210 42.019 0.191 17919 97830 1 239 . 1 1 3 3 ILE H H 3 8.320 8.320 8.279 0.041 17919 97831 1 239 . 1 1 4 4 PHE N N 4 118.110 118.110 118.435 -0.325 17919 97832 1 239 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.536 0.094 17919 97833 1 239 . 1 1 4 4 PHE C C 4 175.320 175.320 175.097 0.223 17919 97834 1 239 . 1 1 4 4 PHE CA C 4 55.210 55.210 56.128 -0.918 17919 97835 1 239 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.178 -0.698 17919 97836 1 239 . 1 1 4 4 PHE H H 4 8.610 8.610 9.117 -0.507 17919 97837 1 239 . 1 1 5 5 VAL N N 5 121.000 121.000 121.912 -0.912 17919 97838 1 239 . 1 1 5 5 VAL HA H 5 4.725 4.725 5.198 -0.473 17919 97839 1 239 . 1 1 5 5 VAL C C 5 174.870 174.870 175.136 -0.266 17919 97840 1 239 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.005 -0.385 17919 97841 1 239 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.361 -0.131 17919 97842 1 239 . 1 1 5 5 VAL H H 5 9.300 9.300 9.363 -0.063 17919 97843 1 239 . 1 1 6 6 LYS N N 6 127.520 127.520 128.092 -0.572 17919 97844 1 239 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.262 0.105 17919 97845 1 239 . 1 1 6 6 LYS C C 6 177.140 177.140 176.269 0.871 17919 97846 1 239 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.862 -0.342 17919 97847 1 239 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.252 -0.202 17919 97848 1 239 . 1 1 6 6 LYS H H 6 8.820 8.820 9.352 -0.532 17919 97849 1 239 . 1 1 7 7 THR N N 7 115.400 115.400 115.207 0.193 17919 97850 1 239 . 1 1 7 7 THR HA H 7 4.970 4.970 4.891 0.079 17919 97851 1 239 . 1 1 7 7 THR C C 7 176.910 176.910 176.900 0.010 17919 97852 1 239 . 1 1 7 7 THR CA C 7 60.470 60.470 59.713 0.757 17919 97853 1 239 . 1 1 7 7 THR CB C 7 70.630 70.630 71.144 -0.514 17919 97854 1 239 . 1 1 7 7 THR H H 7 8.730 8.730 8.798 -0.068 17919 97855 1 239 . 1 1 8 8 LEU N N 8 121.330 121.330 122.234 -0.904 17919 97856 1 239 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.194 0.116 17919 97857 1 239 . 1 1 8 8 LEU C C 8 178.800 178.800 178.149 0.651 17919 97858 1 239 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.660 -0.080 17919 97859 1 239 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.355 0.615 17919 97860 1 239 . 1 1 8 8 LEU H H 8 9.100 9.100 8.581 0.519 17919 97861 1 239 . 1 1 9 9 THR N N 9 105.590 105.590 106.028 -0.438 17919 97862 1 239 . 1 1 9 9 THR HA H 9 4.428 4.428 4.333 0.095 17919 97863 1 239 . 1 1 9 9 THR C C 9 175.520 175.520 175.643 -0.123 17919 97864 1 239 . 1 1 9 9 THR CA C 9 61.400 61.400 61.595 -0.195 17919 97865 1 239 . 1 1 9 9 THR CB C 9 69.140 69.140 68.882 0.258 17919 97866 1 239 . 1 1 9 9 THR H H 9 7.630 7.630 7.524 0.105 17919 97867 1 239 . 1 1 10 10 GLY N N 10 108.890 108.890 111.294 -2.404 17919 97868 1 239 . 1 1 10 10 GLY C C 10 174.070 174.070 173.434 0.636 17919 97869 1 239 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.180 0.280 17919 97870 1 239 . 1 1 10 10 GLY H H 10 7.810 7.810 7.947 -0.137 17919 97871 1 239 . 1 1 11 11 LYS N N 11 121.600 121.600 118.814 2.786 17919 97872 1 239 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.815 -0.454 17919 97873 1 239 . 1 1 11 11 LYS C C 11 175.940 175.940 175.162 0.778 17919 97874 1 239 . 1 1 11 11 LYS CA C 11 56.280 56.280 54.450 1.830 17919 97875 1 239 . 1 1 11 11 LYS CB C 11 33.200 33.200 35.210 -2.010 17919 97876 1 239 . 1 1 11 11 LYS H H 11 7.280 7.280 7.716 -0.436 17919 97877 1 239 . 1 1 12 12 THR N N 12 120.440 120.440 117.035 3.405 17919 97878 1 239 . 1 1 12 12 THR HA H 12 5.046 5.046 5.510 -0.464 17919 97879 1 239 . 1 1 12 12 THR C C 12 174.320 174.320 174.416 -0.096 17919 97880 1 239 . 1 1 12 12 THR CA C 12 62.390 62.390 61.525 0.865 17919 97881 1 239 . 1 1 12 12 THR CB C 12 69.910 69.910 70.771 -0.861 17919 97882 1 239 . 1 1 12 12 THR H H 12 8.650 8.650 8.330 0.320 17919 97883 1 239 . 1 1 13 13 ILE N N 13 127.110 127.110 121.345 5.765 17919 97884 1 239 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.772 -0.228 17919 97885 1 239 . 1 1 13 13 ILE C C 13 175.220 175.220 174.741 0.479 17919 97886 1 239 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.280 0.700 17919 97887 1 239 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.084 -0.134 17919 97888 1 239 . 1 1 13 13 ILE H H 13 9.450 9.450 9.294 0.156 17919 97889 1 239 . 1 1 14 14 THR N N 14 121.520 121.520 117.171 4.349 17919 97890 1 239 . 1 1 14 14 THR HA H 14 4.964 4.964 4.955 0.009 17919 97891 1 239 . 1 1 14 14 THR C C 14 173.790 173.790 174.456 -0.666 17919 97892 1 239 . 1 1 14 14 THR CA C 14 61.940 61.940 61.143 0.797 17919 97893 1 239 . 1 1 14 14 THR CB C 14 69.650 69.650 69.501 0.149 17919 97894 1 239 . 1 1 14 14 THR H H 14 8.710 8.710 8.319 0.391 17919 97895 1 239 . 1 1 15 15 LEU N N 15 124.800 124.800 125.424 -0.624 17919 97896 1 239 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.688 0.092 17919 97897 1 239 . 1 1 15 15 LEU C C 15 174.670 174.670 175.274 -0.604 17919 97898 1 239 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.850 -1.020 17919 97899 1 239 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.651 1.419 17919 97900 1 239 . 1 1 15 15 LEU H H 15 8.710 8.710 8.474 0.236 17919 97901 1 239 . 1 1 16 16 GLU N N 16 122.160 122.160 124.289 -2.129 17919 97902 1 239 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.257 -0.340 17919 97903 1 239 . 1 1 16 16 GLU C C 16 175.860 175.860 176.164 -0.304 17919 97904 1 239 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.728 -0.908 17919 97905 1 239 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.404 -0.953 17919 97906 1 239 . 1 1 16 16 GLU H H 16 8.140 8.140 8.543 -0.403 17919 97907 1 239 . 1 1 17 17 VAL N N 17 117.210 117.210 120.682 -3.472 17919 97908 1 239 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.712 0.002 17919 97909 1 239 . 1 1 17 17 VAL C C 17 174.160 174.160 174.388 -0.228 17919 97910 1 239 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.958 -0.528 17919 97911 1 239 . 1 1 17 17 VAL CB C 17 36.400 36.400 34.753 1.647 17919 97912 1 239 . 1 1 17 17 VAL H H 17 8.900 8.900 8.687 0.213 17919 97913 1 239 . 1 1 18 18 GLU N N 18 118.990 118.990 120.375 -1.385 17919 97914 1 239 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.868 0.211 17919 97915 1 239 . 1 1 18 18 GLU C C 18 176.160 176.160 175.907 0.253 17919 97916 1 239 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.912 -0.192 17919 97917 1 239 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.149 0.161 17919 97918 1 239 . 1 1 18 18 GLU H H 18 8.640 8.640 9.215 -0.575 17919 97919 1 239 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.279 -0.138 17919 97920 1 239 . 1 1 19 19 PRO C C 19 175.310 175.310 177.847 -2.537 17919 97921 1 239 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.638 -0.168 17919 97922 1 239 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.094 -0.144 17919 97923 1 239 . 1 1 20 20 SER N N 20 103.400 103.400 109.700 -6.300 17919 97924 1 239 . 1 1 20 20 SER HA H 20 4.370 4.370 4.331 0.039 17919 97925 1 239 . 1 1 20 20 SER C C 20 174.660 174.660 173.701 0.959 17919 97926 1 239 . 1 1 20 20 SER CA C 20 57.400 57.400 58.445 -1.045 17919 97927 1 239 . 1 1 20 20 SER CB C 20 63.370 63.370 63.124 0.246 17919 97928 1 239 . 1 1 20 20 SER H H 20 7.040 7.040 7.972 -0.932 17919 97929 1 239 . 1 1 21 21 ASP N N 21 123.480 123.480 123.097 0.383 17919 97930 1 239 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.733 -0.038 17919 97931 1 239 . 1 1 21 21 ASP C C 21 176.360 176.360 175.815 0.545 17919 97932 1 239 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.209 0.491 17919 97933 1 239 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.417 -0.617 17919 97934 1 239 . 1 1 21 21 ASP H H 21 8.030 8.030 7.673 0.356 17919 97935 1 239 . 1 1 22 22 THR N N 22 108.800 108.800 112.605 -3.805 17919 97936 1 239 . 1 1 22 22 THR HA H 22 4.920 4.920 4.607 0.313 17919 97937 1 239 . 1 1 22 22 THR C C 22 176.750 176.750 176.058 0.692 17919 97938 1 239 . 1 1 22 22 THR CA C 22 59.690 59.690 61.241 -1.551 17919 97939 1 239 . 1 1 22 22 THR CB C 22 71.200 71.200 70.496 0.704 17919 97940 1 239 . 1 1 22 22 THR H H 22 7.900 7.900 8.254 -0.354 17919 97941 1 239 . 1 1 23 23 ILE N N 23 121.190 121.190 121.775 -0.585 17919 97942 1 239 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.796 -0.139 17919 97943 1 239 . 1 1 23 23 ILE C C 23 179.040 179.040 177.682 1.358 17919 97944 1 239 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.867 -0.607 17919 97945 1 239 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.580 -2.230 17919 97946 1 239 . 1 1 23 23 ILE H H 23 8.560 8.560 8.390 0.170 17919 97947 1 239 . 1 1 24 24 GLU N N 24 120.830 120.830 120.813 0.017 17919 97948 1 239 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.842 0.075 17919 97949 1 239 . 1 1 24 24 GLU C C 24 178.640 178.640 178.489 0.151 17919 97950 1 239 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.186 0.034 17919 97951 1 239 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.427 -1.147 17919 97952 1 239 . 1 1 24 24 GLU H H 24 9.760 9.760 8.292 1.468 17919 97953 1 239 . 1 1 25 25 ASN N N 25 120.570 120.570 117.370 3.200 17919 97954 1 239 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.515 0.010 17919 97955 1 239 . 1 1 25 25 ASN C C 25 178.380 178.380 178.104 0.276 17919 97956 1 239 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.042 0.018 17919 97957 1 239 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.681 -0.231 17919 97958 1 239 . 1 1 25 25 ASN H H 25 7.920 7.920 7.647 0.273 17919 97959 1 239 . 1 1 26 26 VAL N N 26 121.710 121.710 120.351 1.359 17919 97960 1 239 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.644 -0.247 17919 97961 1 239 . 1 1 26 26 VAL C C 26 177.950 177.950 177.577 0.373 17919 97962 1 239 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.544 1.116 17919 97963 1 239 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.548 -0.708 17919 97964 1 239 . 1 1 26 26 VAL H H 26 8.070 8.070 7.776 0.294 17919 97965 1 239 . 1 1 27 27 LYS N N 27 118.860 118.860 120.473 -1.613 17919 97966 1 239 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.249 0.331 17919 97967 1 239 . 1 1 27 27 LYS C C 27 180.550 180.550 178.838 1.712 17919 97968 1 239 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.483 -0.233 17919 97969 1 239 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.262 1.468 17919 97970 1 239 . 1 1 27 27 LYS H H 27 8.560 8.560 8.291 0.269 17919 97971 1 239 . 1 1 28 28 ALA N N 28 123.440 123.440 122.089 1.351 17919 97972 1 239 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.173 -0.013 17919 97973 1 239 . 1 1 28 28 ALA C C 28 180.300 180.300 179.111 1.189 17919 97974 1 239 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.938 0.432 17919 97975 1 239 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.365 -0.655 17919 97976 1 239 . 1 1 28 28 ALA H H 28 8.060 8.060 7.911 0.149 17919 97977 1 239 . 1 1 29 29 LYS N N 29 119.940 119.940 118.371 1.569 17919 97978 1 239 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.199 0.008 17919 97979 1 239 . 1 1 29 29 LYS C C 29 180.320 180.320 178.843 1.477 17919 97980 1 239 . 1 1 29 29 LYS CA C 29 59.650 59.650 58.101 1.549 17919 97981 1 239 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.213 1.077 17919 97982 1 239 . 1 1 29 29 LYS H H 29 7.850 7.850 7.532 0.318 17919 97983 1 239 . 1 1 30 30 ILE N N 30 121.080 121.080 121.655 -0.575 17919 97984 1 239 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.643 -0.136 17919 97985 1 239 . 1 1 30 30 ILE C C 30 178.310 178.310 177.508 0.802 17919 97986 1 239 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.686 0.464 17919 97987 1 239 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.811 -1.011 17919 97988 1 239 . 1 1 30 30 ILE H H 30 8.280 8.280 8.081 0.199 17919 97989 1 239 . 1 1 31 31 GLN N N 31 123.490 123.490 120.884 2.606 17919 97990 1 239 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.873 -0.044 17919 97991 1 239 . 1 1 31 31 GLN C C 31 178.890 178.890 178.422 0.468 17919 97992 1 239 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.431 0.569 17919 97993 1 239 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.423 -0.703 17919 97994 1 239 . 1 1 31 31 GLN H H 31 8.580 8.580 8.251 0.329 17919 97995 1 239 . 1 1 32 32 ASP N N 32 119.360 119.360 119.778 -0.418 17919 97996 1 239 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.363 -0.009 17919 97997 1 239 . 1 1 32 32 ASP C C 32 177.250 177.250 178.201 -0.951 17919 97998 1 239 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.930 0.260 17919 97999 1 239 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.858 -0.278 17919 98000 1 239 . 1 1 32 32 ASP H H 32 8.010 8.010 8.333 -0.323 17919 98001 1 239 . 1 1 33 33 LYS N N 33 115.130 115.130 118.256 -3.126 17919 98002 1 239 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.291 0.046 17919 98003 1 239 . 1 1 33 33 LYS C C 33 177.870 177.870 178.204 -0.334 17919 98004 1 239 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.958 0.092 17919 98005 1 239 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.328 0.842 17919 98006 1 239 . 1 1 33 33 LYS H H 33 7.430 7.430 7.785 -0.355 17919 98007 1 239 . 1 1 34 34 GLU N N 34 113.870 113.870 114.776 -0.906 17919 98008 1 239 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.537 0.088 17919 98009 1 239 . 1 1 34 34 GLU C C 34 177.840 177.840 177.121 0.719 17919 98010 1 239 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.786 -0.616 17919 98011 1 239 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.799 0.861 17919 98012 1 239 . 1 1 34 34 GLU H H 34 8.740 8.740 8.289 0.451 17919 98013 1 239 . 1 1 35 35 GLY N N 35 108.650 108.650 108.147 0.503 17919 98014 1 239 . 1 1 35 35 GLY C C 35 173.960 173.960 174.500 -0.540 17919 98015 1 239 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.533 0.547 17919 98016 1 239 . 1 1 35 35 GLY H H 35 8.530 8.530 8.243 0.287 17919 98017 1 239 . 1 1 36 36 ILE N N 36 119.880 119.880 121.652 -1.772 17919 98018 1 239 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.435 0.010 17919 98019 1 239 . 1 1 36 36 ILE C C 36 173.590 173.590 174.353 -0.763 17919 98020 1 239 . 1 1 36 36 ILE CA C 36 57.750 57.750 56.518 1.232 17919 98021 1 239 . 1 1 36 36 ILE CB C 36 40.580 40.580 37.058 3.522 17919 98022 1 239 . 1 1 36 36 ILE H H 36 6.150 6.150 7.805 -1.655 17919 98023 1 239 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.547 0.087 17919 98024 1 239 . 1 1 37 37 PRO C C 37 176.940 176.940 176.185 0.755 17919 98025 1 239 . 1 1 37 37 PRO CA C 37 61.660 61.660 62.332 -0.672 17919 98026 1 239 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.532 0.318 17919 98027 1 239 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.152 -0.035 17919 98028 1 239 . 1 1 38 38 PRO C C 38 178.320 178.320 178.606 -0.286 17919 98029 1 239 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.771 0.489 17919 98030 1 239 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.932 0.958 17919 98031 1 239 . 1 1 39 39 ASP N N 39 113.380 113.380 116.329 -2.949 17919 98032 1 239 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.346 0.084 17919 98033 1 239 . 1 1 39 39 ASP C C 39 177.090 177.090 177.982 -0.892 17919 98034 1 239 . 1 1 39 39 ASP CA C 39 55.640 55.640 57.109 -1.469 17919 98035 1 239 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.446 -0.906 17919 98036 1 239 . 1 1 39 39 ASP H H 39 8.550 8.550 8.717 -0.167 17919 98037 1 239 . 1 1 40 40 GLN N N 40 116.780 116.780 117.579 -0.799 17919 98038 1 239 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.220 0.244 17919 98039 1 239 . 1 1 40 40 GLN C C 40 175.380 175.380 175.860 -0.480 17919 98040 1 239 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.598 -0.958 17919 98041 1 239 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.511 0.629 17919 98042 1 239 . 1 1 40 40 GLN H H 40 7.820 7.820 7.976 -0.156 17919 98043 1 239 . 1 1 41 41 GLN N N 41 117.720 117.720 119.961 -2.241 17919 98044 1 239 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.237 0.007 17919 98045 1 239 . 1 1 41 41 GLN C C 41 176.300 176.300 175.214 1.086 17919 98046 1 239 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.788 -0.318 17919 98047 1 239 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.215 2.436 17919 98048 1 239 . 1 1 41 41 GLN H H 41 7.480 7.480 7.428 0.052 17919 98049 1 239 . 1 1 42 42 ARG N N 42 122.680 122.680 123.415 -0.735 17919 98050 1 239 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.691 -0.191 17919 98051 1 239 . 1 1 42 42 ARG C C 42 174.050 174.050 174.625 -0.575 17919 98052 1 239 . 1 1 42 42 ARG CA C 42 55.050 55.050 53.416 1.634 17919 98053 1 239 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.254 -0.504 17919 98054 1 239 . 1 1 42 42 ARG H H 42 8.530 8.530 8.660 -0.130 17919 98055 1 239 . 1 1 43 43 LEU N N 43 124.040 124.040 125.748 -1.708 17919 98056 1 239 . 1 1 43 43 LEU C C 43 175.290 175.290 176.210 -0.920 17919 98057 1 239 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.924 -0.944 17919 98058 1 239 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.618 2.172 17919 98059 1 239 . 1 1 43 43 LEU H H 43 8.820 8.820 8.760 0.060 17919 98060 1 239 . 1 1 44 44 ILE N N 44 121.920 121.920 121.714 0.206 17919 98061 1 239 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.953 0.039 17919 98062 1 239 . 1 1 44 44 ILE C C 44 176.060 176.060 174.338 1.722 17919 98063 1 239 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.099 -1.119 17919 98064 1 239 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.541 -0.121 17919 98065 1 239 . 1 1 44 44 ILE H H 44 9.030 9.030 8.942 0.088 17919 98066 1 239 . 1 1 45 45 PHE N N 45 125.390 125.390 126.809 -1.419 17919 98067 1 239 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.986 0.059 17919 98068 1 239 . 1 1 45 45 PHE C C 45 174.470 174.470 174.366 0.104 17919 98069 1 239 . 1 1 45 45 PHE CA C 45 57.020 57.020 57.164 -0.144 17919 98070 1 239 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.643 1.117 17919 98071 1 239 . 1 1 45 45 PHE H H 45 8.830 8.830 8.766 0.064 17919 98072 1 239 . 1 1 46 46 ALA N N 46 132.200 132.200 130.870 1.330 17919 98073 1 239 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.699 -0.009 17919 98074 1 239 . 1 1 46 46 ALA C C 46 177.290 177.290 177.923 -0.633 17919 98075 1 239 . 1 1 46 46 ALA CA C 46 52.540 52.540 51.944 0.596 17919 98076 1 239 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.531 0.039 17919 98077 1 239 . 1 1 46 46 ALA H H 46 8.810 8.810 8.752 0.058 17919 98078 1 239 . 1 1 47 47 GLY N N 47 102.340 102.340 106.343 -4.003 17919 98079 1 239 . 1 1 47 47 GLY C C 47 173.810 173.810 174.297 -0.487 17919 98080 1 239 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.102 0.248 17919 98081 1 239 . 1 1 47 47 GLY H H 47 8.130 8.130 8.652 -0.522 17919 98082 1 239 . 1 1 48 48 LYS N N 48 121.570 121.570 122.052 -0.482 17919 98083 1 239 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.584 0.038 17919 98084 1 239 . 1 1 48 48 LYS C C 48 174.700 174.700 174.887 -0.187 17919 98085 1 239 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.344 -0.794 17919 98086 1 239 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.563 -0.033 17919 98087 1 239 . 1 1 48 48 LYS H H 48 7.980 7.980 7.559 0.421 17919 98088 1 239 . 1 1 49 49 GLN N N 49 122.410 122.410 124.259 -1.849 17919 98089 1 239 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.701 -0.141 17919 98090 1 239 . 1 1 49 49 GLN C C 49 175.670 175.670 175.493 0.177 17919 98091 1 239 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.174 0.566 17919 98092 1 239 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.896 -0.896 17919 98093 1 239 . 1 1 49 49 GLN H H 49 8.600 8.600 8.489 0.111 17919 98094 1 239 . 1 1 50 50 LEU N N 50 125.520 125.520 128.803 -3.283 17919 98095 1 239 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.167 -0.077 17919 98096 1 239 . 1 1 50 50 LEU C C 50 176.660 176.660 176.718 -0.058 17919 98097 1 239 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.616 -0.376 17919 98098 1 239 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.458 -0.888 17919 98099 1 239 . 1 1 50 50 LEU H H 50 8.530 8.530 8.156 0.374 17919 98100 1 239 . 1 1 51 51 GLU N N 51 122.940 122.940 122.289 0.651 17919 98101 1 239 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.563 -0.075 17919 98102 1 239 . 1 1 51 51 GLU C C 51 175.870 175.870 176.565 -0.695 17919 98103 1 239 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.611 0.349 17919 98104 1 239 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.456 0.114 17919 98105 1 239 . 1 1 51 51 GLU H H 51 8.400 8.400 8.615 -0.215 17919 98106 1 239 . 1 1 52 52 ASP N N 52 120.030 120.030 123.722 -3.692 17919 98107 1 239 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.507 -0.148 17919 98108 1 239 . 1 1 52 52 ASP C C 52 177.330 177.330 177.787 -0.457 17919 98109 1 239 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.231 -0.271 17919 98110 1 239 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.851 -0.001 17919 98111 1 239 . 1 1 52 52 ASP H H 52 8.160 8.160 8.795 -0.635 17919 98112 1 239 . 1 1 53 53 GLY N N 53 106.660 106.660 106.176 0.484 17919 98113 1 239 . 1 1 53 53 GLY C C 53 174.870 174.870 173.832 1.038 17919 98114 1 239 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.713 0.457 17919 98115 1 239 . 1 1 53 53 GLY H H 53 9.390 9.390 8.366 1.024 17919 98116 1 239 . 1 1 54 54 ARG N N 54 119.050 119.050 120.312 -1.262 17919 98117 1 239 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.780 -0.085 17919 98118 1 239 . 1 1 54 54 ARG C C 54 175.350 175.350 174.818 0.532 17919 98119 1 239 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.125 0.265 17919 98120 1 239 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.339 -0.689 17919 98121 1 239 . 1 1 54 54 ARG H H 54 7.460 7.460 7.478 -0.018 17919 98122 1 239 . 1 1 55 55 THR N N 55 108.400 108.400 114.076 -5.676 17919 98123 1 239 . 1 1 55 55 THR HA H 55 5.240 5.240 5.021 0.219 17919 98124 1 239 . 1 1 55 55 THR C C 55 176.560 176.560 175.951 0.609 17919 98125 1 239 . 1 1 55 55 THR CA C 55 59.690 59.690 60.596 -0.906 17919 98126 1 239 . 1 1 55 55 THR CB C 55 72.260 72.260 70.628 1.632 17919 98127 1 239 . 1 1 55 55 THR H H 55 8.730 8.730 8.213 0.517 17919 98128 1 239 . 1 1 56 56 LEU N N 56 117.920 117.920 122.256 -4.336 17919 98129 1 239 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.020 0.040 17919 98130 1 239 . 1 1 56 56 LEU C C 56 180.810 180.810 178.972 1.838 17919 98131 1 239 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.329 0.381 17919 98132 1 239 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.347 -0.977 17919 98133 1 239 . 1 1 56 56 LEU H H 56 8.140 8.140 8.383 -0.243 17919 98134 1 239 . 1 1 57 57 SER N N 57 113.330 113.330 114.044 -0.714 17919 98135 1 239 . 1 1 57 57 SER HA H 57 4.370 4.370 4.096 0.274 17919 98136 1 239 . 1 1 57 57 SER C C 57 178.310 178.310 176.823 1.487 17919 98137 1 239 . 1 1 57 57 SER CA C 57 61.080 61.080 61.386 -0.306 17919 98138 1 239 . 1 1 57 57 SER CB C 57 62.530 62.530 62.615 -0.085 17919 98139 1 239 . 1 1 57 57 SER H H 57 8.470 8.470 8.573 -0.103 17919 98140 1 239 . 1 1 58 58 ASP N N 58 124.190 124.190 122.333 1.857 17919 98141 1 239 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.377 -0.081 17919 98142 1 239 . 1 1 58 58 ASP C C 58 177.400 177.400 176.779 0.621 17919 98143 1 239 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.255 0.925 17919 98144 1 239 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.764 -0.664 17919 98145 1 239 . 1 1 58 58 ASP H H 58 7.930 7.930 7.729 0.201 17919 98146 1 239 . 1 1 59 59 TYR N N 59 115.510 115.510 115.617 -0.107 17919 98147 1 239 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.596 0.074 17919 98148 1 239 . 1 1 59 59 TYR C C 59 174.700 174.700 175.192 -0.492 17919 98149 1 239 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.560 0.690 17919 98150 1 239 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.072 1.998 17919 98151 1 239 . 1 1 59 59 TYR H H 59 7.250 7.250 7.351 -0.101 17919 98152 1 239 . 1 1 60 60 ASN N N 60 115.900 115.900 117.837 -1.937 17919 98153 1 239 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.433 -0.078 17919 98154 1 239 . 1 1 60 60 ASN C C 60 174.340 174.340 174.694 -0.354 17919 98155 1 239 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.100 0.020 17919 98156 1 239 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.210 0.200 17919 98157 1 239 . 1 1 60 60 ASN H H 60 8.150 8.150 7.978 0.172 17919 98158 1 239 . 1 1 61 61 ILE N N 61 118.600 118.600 120.302 -1.702 17919 98159 1 239 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.735 -0.342 17919 98160 1 239 . 1 1 61 61 ILE C C 61 174.610 174.610 175.487 -0.877 17919 98161 1 239 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.867 0.553 17919 98162 1 239 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.079 -0.339 17919 98163 1 239 . 1 1 61 61 ILE H H 61 7.250 7.250 8.147 -0.897 17919 98164 1 239 . 1 1 62 62 GLN N N 62 124.740 124.740 126.140 -1.400 17919 98165 1 239 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.675 -0.169 17919 98166 1 239 . 1 1 62 62 GLN C C 62 175.970 175.970 176.061 -0.091 17919 98167 1 239 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.843 -0.183 17919 98168 1 239 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.323 0.327 17919 98169 1 239 . 1 1 62 62 GLN H H 62 7.610 7.610 8.021 -0.411 17919 98170 1 239 . 1 1 63 63 LYS N N 63 120.300 120.300 121.025 -0.725 17919 98171 1 239 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.118 -0.117 17919 98172 1 239 . 1 1 63 63 LYS C C 63 175.810 175.810 176.725 -0.915 17919 98173 1 239 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.478 0.312 17919 98174 1 239 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.085 0.565 17919 98175 1 239 . 1 1 63 63 LYS H H 63 8.490 8.490 8.520 -0.030 17919 98176 1 239 . 1 1 64 64 GLU N N 64 113.950 113.950 118.034 -4.084 17919 98177 1 239 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.796 -0.331 17919 98178 1 239 . 1 1 64 64 GLU C C 64 175.250 175.250 175.744 -0.494 17919 98179 1 239 . 1 1 64 64 GLU CA C 64 57.890 57.890 58.131 -0.241 17919 98180 1 239 . 1 1 64 64 GLU CB C 64 25.900 25.900 29.171 -3.271 17919 98181 1 239 . 1 1 64 64 GLU H H 64 9.280 9.280 9.174 0.106 17919 98182 1 239 . 1 1 65 65 SER N N 65 114.730 114.730 115.827 -1.097 17919 98183 1 239 . 1 1 65 65 SER HA H 65 4.640 4.640 4.465 0.175 17919 98184 1 239 . 1 1 65 65 SER C C 65 172.160 172.160 173.831 -1.671 17919 98185 1 239 . 1 1 65 65 SER CA C 65 60.890 60.890 61.202 -0.312 17919 98186 1 239 . 1 1 65 65 SER CB C 65 64.910 64.910 63.835 1.075 17919 98187 1 239 . 1 1 65 65 SER H H 65 7.670 7.670 7.913 -0.243 17919 98188 1 239 . 1 1 66 66 THR N N 66 117.110 117.110 119.566 -2.456 17919 98189 1 239 . 1 1 66 66 THR HA H 66 5.270 5.270 5.351 -0.081 17919 98190 1 239 . 1 1 66 66 THR C C 66 173.950 173.950 174.281 -0.331 17919 98191 1 239 . 1 1 66 66 THR CA C 66 62.340 62.340 61.951 0.389 17919 98192 1 239 . 1 1 66 66 THR CB C 66 70.080 70.080 70.074 0.006 17919 98193 1 239 . 1 1 66 66 THR H H 66 8.730 8.730 8.436 0.294 17919 98194 1 239 . 1 1 67 67 LEU N N 67 127.110 127.110 128.376 -1.266 17919 98195 1 239 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.926 0.134 17919 98196 1 239 . 1 1 67 67 LEU C C 67 175.770 175.770 175.815 -0.045 17919 98197 1 239 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.070 -0.170 17919 98198 1 239 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.216 0.044 17919 98199 1 239 . 1 1 67 67 LEU H H 67 9.410 9.410 9.336 0.074 17919 98200 1 239 . 1 1 68 68 HIS N N 68 118.380 118.380 121.209 -2.829 17919 98201 1 239 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.365 -0.125 17919 98202 1 239 . 1 1 68 68 HIS C C 68 173.150 173.150 174.056 -0.906 17919 98203 1 239 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.605 0.395 17919 98204 1 239 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.179 -1.649 17919 98205 1 239 . 1 1 68 68 HIS H H 68 9.230 9.230 8.936 0.294 17919 98206 1 239 . 1 1 69 69 LEU N N 69 124.460 124.460 129.237 -4.777 17919 98207 1 239 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.582 0.608 17919 98208 1 239 . 1 1 69 69 LEU C C 69 175.270 175.270 173.883 1.387 17919 98209 1 239 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.060 -0.170 17919 98210 1 239 . 1 1 69 69 LEU CB C 69 44.380 44.380 43.378 1.002 17919 98211 1 239 . 1 1 69 69 LEU H H 69 8.340 8.340 8.780 -0.440 17919 98212 1 239 . 1 1 70 70 VAL N N 70 126.940 126.940 126.813 0.127 17919 98213 1 239 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.287 0.063 17919 98214 1 239 . 1 1 70 70 VAL C C 70 174.000 174.000 174.751 -0.751 17919 98215 1 239 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.729 0.071 17919 98216 1 239 . 1 1 70 70 VAL CB C 70 34.910 34.910 34.923 -0.014 17919 98217 1 239 . 1 1 70 70 VAL H H 70 9.200 9.200 8.765 0.435 17919 98218 1 239 . 1 1 71 71 LEU N N 71 123.130 123.130 125.132 -2.002 17919 98219 1 239 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.922 0.138 17919 98220 1 239 . 1 1 71 71 LEU C C 71 177.830 177.830 177.021 0.809 17919 98221 1 239 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.429 0.511 17919 98222 1 239 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.247 -0.397 17919 98223 1 239 . 1 1 71 71 LEU H H 71 8.120 8.120 8.387 -0.267 17919 98224 1 239 . 1 1 72 72 ARG N N 72 123.490 123.490 122.143 1.347 17919 98225 1 239 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.184 0.117 17919 98226 1 239 . 1 1 72 72 ARG C C 72 175.350 175.350 175.529 -0.179 17919 98227 1 239 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.589 -0.979 17919 98228 1 239 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.088 1.262 17919 98229 1 239 . 1 1 72 72 ARG H H 72 8.580 8.580 8.357 0.223 17919 98230 1 240 . 1 1 2 2 GLN N N 2 123.220 123.220 121.519 1.701 17919 98231 1 240 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.294 -0.045 17919 98232 1 240 . 1 1 2 2 GLN C C 2 175.920 175.920 174.628 1.292 17919 98233 1 240 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.657 0.423 17919 98234 1 240 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.875 -0.115 17919 98235 1 240 . 1 1 2 2 GLN H H 2 8.900 8.900 8.396 0.504 17919 98236 1 240 . 1 1 3 3 ILE N N 3 115.340 115.340 119.310 -3.970 17919 98237 1 240 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.537 -0.324 17919 98238 1 240 . 1 1 3 3 ILE C C 3 172.450 172.450 173.089 -0.639 17919 98239 1 240 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.224 0.346 17919 98240 1 240 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.829 0.381 17919 98241 1 240 . 1 1 3 3 ILE H H 3 8.320 8.320 8.833 -0.513 17919 98242 1 240 . 1 1 4 4 PHE N N 4 118.110 118.110 120.979 -2.869 17919 98243 1 240 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.505 0.125 17919 98244 1 240 . 1 1 4 4 PHE C C 4 175.320 175.320 175.294 0.026 17919 98245 1 240 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.760 -0.550 17919 98246 1 240 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.480 -1.000 17919 98247 1 240 . 1 1 4 4 PHE H H 4 8.610 8.610 8.390 0.220 17919 98248 1 240 . 1 1 5 5 VAL N N 5 121.000 121.000 120.978 0.022 17919 98249 1 240 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.937 -0.212 17919 98250 1 240 . 1 1 5 5 VAL C C 5 174.870 174.870 174.814 0.056 17919 98251 1 240 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.154 -0.534 17919 98252 1 240 . 1 1 5 5 VAL CB C 5 34.230 34.230 35.133 -0.903 17919 98253 1 240 . 1 1 5 5 VAL H H 5 9.300 9.300 9.242 0.058 17919 98254 1 240 . 1 1 6 6 LYS N N 6 127.520 127.520 128.104 -0.584 17919 98255 1 240 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.465 -0.098 17919 98256 1 240 . 1 1 6 6 LYS C C 6 177.140 177.140 176.206 0.934 17919 98257 1 240 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.787 -0.267 17919 98258 1 240 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.932 -0.882 17919 98259 1 240 . 1 1 6 6 LYS H H 6 8.820 8.820 9.238 -0.418 17919 98260 1 240 . 1 1 7 7 THR N N 7 115.400 115.400 114.720 0.680 17919 98261 1 240 . 1 1 7 7 THR HA H 7 4.970 4.970 4.984 -0.014 17919 98262 1 240 . 1 1 7 7 THR C C 7 176.910 176.910 176.505 0.405 17919 98263 1 240 . 1 1 7 7 THR CA C 7 60.470 60.470 59.761 0.709 17919 98264 1 240 . 1 1 7 7 THR CB C 7 70.630 70.630 71.231 -0.601 17919 98265 1 240 . 1 1 7 7 THR H H 7 8.730 8.730 8.271 0.459 17919 98266 1 240 . 1 1 8 8 LEU N N 8 121.330 121.330 122.173 -0.843 17919 98267 1 240 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.112 0.198 17919 98268 1 240 . 1 1 8 8 LEU C C 8 178.800 178.800 177.910 0.890 17919 98269 1 240 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.925 -0.345 17919 98270 1 240 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.506 0.464 17919 98271 1 240 . 1 1 8 8 LEU H H 8 9.100 9.100 9.006 0.094 17919 98272 1 240 . 1 1 9 9 THR N N 9 105.590 105.590 107.153 -1.563 17919 98273 1 240 . 1 1 9 9 THR HA H 9 4.428 4.428 4.314 0.114 17919 98274 1 240 . 1 1 9 9 THR C C 9 175.520 175.520 175.283 0.237 17919 98275 1 240 . 1 1 9 9 THR CA C 9 61.400 61.400 61.837 -0.438 17919 98276 1 240 . 1 1 9 9 THR CB C 9 69.140 69.140 68.643 0.497 17919 98277 1 240 . 1 1 9 9 THR H H 9 7.630 7.630 7.654 -0.024 17919 98278 1 240 . 1 1 10 10 GLY N N 10 108.890 108.890 110.261 -1.371 17919 98279 1 240 . 1 1 10 10 GLY C C 10 174.070 174.070 173.452 0.618 17919 98280 1 240 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.987 0.473 17919 98281 1 240 . 1 1 10 10 GLY H H 10 7.810 7.810 7.776 0.034 17919 98282 1 240 . 1 1 11 11 LYS N N 11 121.600 121.600 119.262 2.338 17919 98283 1 240 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.807 -0.446 17919 98284 1 240 . 1 1 11 11 LYS C C 11 175.940 175.940 175.147 0.793 17919 98285 1 240 . 1 1 11 11 LYS CA C 11 56.280 56.280 54.616 1.664 17919 98286 1 240 . 1 1 11 11 LYS CB C 11 33.200 33.200 35.296 -2.096 17919 98287 1 240 . 1 1 11 11 LYS H H 11 7.280 7.280 7.942 -0.662 17919 98288 1 240 . 1 1 12 12 THR N N 12 120.440 120.440 115.368 5.072 17919 98289 1 240 . 1 1 12 12 THR HA H 12 5.046 5.046 5.408 -0.362 17919 98290 1 240 . 1 1 12 12 THR C C 12 174.320 174.320 174.145 0.175 17919 98291 1 240 . 1 1 12 12 THR CA C 12 62.390 62.390 61.042 1.348 17919 98292 1 240 . 1 1 12 12 THR CB C 12 69.910 69.910 71.030 -1.120 17919 98293 1 240 . 1 1 12 12 THR H H 12 8.650 8.650 8.265 0.385 17919 98294 1 240 . 1 1 13 13 ILE N N 13 127.110 127.110 122.479 4.631 17919 98295 1 240 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.761 -0.217 17919 98296 1 240 . 1 1 13 13 ILE C C 13 175.220 175.220 174.532 0.688 17919 98297 1 240 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.498 0.481 17919 98298 1 240 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.310 -0.360 17919 98299 1 240 . 1 1 13 13 ILE H H 13 9.450 9.450 9.041 0.409 17919 98300 1 240 . 1 1 14 14 THR N N 14 121.520 121.520 121.308 0.212 17919 98301 1 240 . 1 1 14 14 THR HA H 14 4.964 4.964 5.047 -0.083 17919 98302 1 240 . 1 1 14 14 THR C C 14 173.790 173.790 174.109 -0.319 17919 98303 1 240 . 1 1 14 14 THR CA C 14 61.940 61.940 61.903 0.037 17919 98304 1 240 . 1 1 14 14 THR CB C 14 69.650 69.650 69.812 -0.162 17919 98305 1 240 . 1 1 14 14 THR H H 14 8.710 8.710 8.425 0.285 17919 98306 1 240 . 1 1 15 15 LEU N N 15 124.800 124.800 126.957 -2.157 17919 98307 1 240 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.728 0.052 17919 98308 1 240 . 1 1 15 15 LEU C C 15 174.670 174.670 175.077 -0.407 17919 98309 1 240 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.483 -0.653 17919 98310 1 240 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.607 1.463 17919 98311 1 240 . 1 1 15 15 LEU H H 15 8.710 8.710 9.095 -0.385 17919 98312 1 240 . 1 1 16 16 GLU N N 16 122.160 122.160 122.673 -0.513 17919 98313 1 240 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.283 -0.366 17919 98314 1 240 . 1 1 16 16 GLU C C 16 175.860 175.860 175.671 0.189 17919 98315 1 240 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.145 -0.326 17919 98316 1 240 . 1 1 16 16 GLU CB C 16 29.450 29.450 31.255 -1.805 17919 98317 1 240 . 1 1 16 16 GLU H H 16 8.140 8.140 8.661 -0.521 17919 98318 1 240 . 1 1 17 17 VAL N N 17 117.210 117.210 120.272 -3.062 17919 98319 1 240 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.535 0.179 17919 98320 1 240 . 1 1 17 17 VAL C C 17 174.160 174.160 174.118 0.042 17919 98321 1 240 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.525 -1.095 17919 98322 1 240 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.611 0.789 17919 98323 1 240 . 1 1 17 17 VAL H H 17 8.900 8.900 8.693 0.207 17919 98324 1 240 . 1 1 18 18 GLU N N 18 118.990 118.990 121.309 -2.319 17919 98325 1 240 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.823 0.256 17919 98326 1 240 . 1 1 18 18 GLU C C 18 176.160 176.160 175.392 0.768 17919 98327 1 240 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.591 0.129 17919 98328 1 240 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.322 -0.012 17919 98329 1 240 . 1 1 18 18 GLU H H 18 8.640 8.640 8.382 0.258 17919 98330 1 240 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.270 -0.129 17919 98331 1 240 . 1 1 19 19 PRO C C 19 175.310 175.310 176.749 -1.439 17919 98332 1 240 . 1 1 19 19 PRO CA C 19 65.470 65.470 64.857 0.613 17919 98333 1 240 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.793 0.157 17919 98334 1 240 . 1 1 20 20 SER N N 20 103.400 103.400 108.155 -4.755 17919 98335 1 240 . 1 1 20 20 SER HA H 20 4.370 4.370 4.403 -0.033 17919 98336 1 240 . 1 1 20 20 SER C C 20 174.660 174.660 174.068 0.592 17919 98337 1 240 . 1 1 20 20 SER CA C 20 57.400 57.400 57.638 -0.238 17919 98338 1 240 . 1 1 20 20 SER CB C 20 63.370 63.370 62.831 0.539 17919 98339 1 240 . 1 1 20 20 SER H H 20 7.040 7.040 8.226 -1.186 17919 98340 1 240 . 1 1 21 21 ASP N N 21 123.480 123.480 123.502 -0.022 17919 98341 1 240 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.931 -0.236 17919 98342 1 240 . 1 1 21 21 ASP C C 21 176.360 176.360 175.092 1.268 17919 98343 1 240 . 1 1 21 21 ASP CA C 21 55.700 55.700 52.618 3.082 17919 98344 1 240 . 1 1 21 21 ASP CB C 21 40.800 40.800 42.903 -2.103 17919 98345 1 240 . 1 1 21 21 ASP H H 21 8.030 8.030 7.881 0.149 17919 98346 1 240 . 1 1 22 22 THR N N 22 108.800 108.800 113.098 -4.298 17919 98347 1 240 . 1 1 22 22 THR HA H 22 4.920 4.920 4.790 0.130 17919 98348 1 240 . 1 1 22 22 THR C C 22 176.750 176.750 176.172 0.578 17919 98349 1 240 . 1 1 22 22 THR CA C 22 59.690 59.690 61.513 -1.823 17919 98350 1 240 . 1 1 22 22 THR CB C 22 71.200 71.200 70.891 0.309 17919 98351 1 240 . 1 1 22 22 THR H H 22 7.900 7.900 8.225 -0.325 17919 98352 1 240 . 1 1 23 23 ILE N N 23 121.190 121.190 122.251 -1.061 17919 98353 1 240 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.913 -0.256 17919 98354 1 240 . 1 1 23 23 ILE C C 23 179.040 179.040 177.692 1.348 17919 98355 1 240 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.173 0.087 17919 98356 1 240 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.332 -1.982 17919 98357 1 240 . 1 1 23 23 ILE H H 23 8.560 8.560 8.583 -0.023 17919 98358 1 240 . 1 1 24 24 GLU N N 24 120.830 120.830 122.086 -1.256 17919 98359 1 240 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.837 0.080 17919 98360 1 240 . 1 1 24 24 GLU C C 24 178.640 178.640 178.351 0.289 17919 98361 1 240 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.382 -0.162 17919 98362 1 240 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.413 -1.133 17919 98363 1 240 . 1 1 24 24 GLU H H 24 9.760 9.760 8.338 1.422 17919 98364 1 240 . 1 1 25 25 ASN N N 25 120.570 120.570 117.155 3.415 17919 98365 1 240 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.558 -0.033 17919 98366 1 240 . 1 1 25 25 ASN C C 25 178.380 178.380 177.995 0.385 17919 98367 1 240 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.606 0.454 17919 98368 1 240 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.268 0.182 17919 98369 1 240 . 1 1 25 25 ASN H H 25 7.920 7.920 7.608 0.312 17919 98370 1 240 . 1 1 26 26 VAL N N 26 121.710 121.710 120.681 1.029 17919 98371 1 240 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.575 -0.178 17919 98372 1 240 . 1 1 26 26 VAL C C 26 177.950 177.950 177.610 0.340 17919 98373 1 240 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.689 0.971 17919 98374 1 240 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.485 -0.645 17919 98375 1 240 . 1 1 26 26 VAL H H 26 8.070 8.070 7.958 0.112 17919 98376 1 240 . 1 1 27 27 LYS N N 27 118.860 118.860 120.846 -1.986 17919 98377 1 240 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.215 0.365 17919 98378 1 240 . 1 1 27 27 LYS C C 27 180.550 180.550 179.127 1.423 17919 98379 1 240 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.792 -0.542 17919 98380 1 240 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.303 1.427 17919 98381 1 240 . 1 1 27 27 LYS H H 27 8.560 8.560 8.304 0.256 17919 98382 1 240 . 1 1 28 28 ALA N N 28 123.440 123.440 121.285 2.155 17919 98383 1 240 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.209 -0.049 17919 98384 1 240 . 1 1 28 28 ALA C C 28 180.300 180.300 179.066 1.234 17919 98385 1 240 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.647 0.723 17919 98386 1 240 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.451 -0.741 17919 98387 1 240 . 1 1 28 28 ALA H H 28 8.060 8.060 8.314 -0.254 17919 98388 1 240 . 1 1 29 29 LYS N N 29 119.940 119.940 119.429 0.511 17919 98389 1 240 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.057 0.150 17919 98390 1 240 . 1 1 29 29 LYS C C 29 180.320 180.320 178.611 1.709 17919 98391 1 240 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.201 0.449 17919 98392 1 240 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.431 0.859 17919 98393 1 240 . 1 1 29 29 LYS H H 29 7.850 7.850 7.659 0.191 17919 98394 1 240 . 1 1 30 30 ILE N N 30 121.080 121.080 119.580 1.500 17919 98395 1 240 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.642 -0.135 17919 98396 1 240 . 1 1 30 30 ILE C C 30 178.310 178.310 177.167 1.143 17919 98397 1 240 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.069 1.081 17919 98398 1 240 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.901 -1.101 17919 98399 1 240 . 1 1 30 30 ILE H H 30 8.280 8.280 7.934 0.346 17919 98400 1 240 . 1 1 31 31 GLN N N 31 123.490 123.490 120.928 2.562 17919 98401 1 240 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.844 -0.015 17919 98402 1 240 . 1 1 31 31 GLN C C 31 178.890 178.890 178.118 0.772 17919 98403 1 240 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.254 0.746 17919 98404 1 240 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.480 -0.760 17919 98405 1 240 . 1 1 31 31 GLN H H 31 8.580 8.580 8.228 0.352 17919 98406 1 240 . 1 1 32 32 ASP N N 32 119.360 119.360 116.997 2.363 17919 98407 1 240 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.445 -0.091 17919 98408 1 240 . 1 1 32 32 ASP C C 32 177.250 177.250 177.332 -0.082 17919 98409 1 240 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.198 0.992 17919 98410 1 240 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.608 -0.028 17919 98411 1 240 . 1 1 32 32 ASP H H 32 8.010 8.010 8.024 -0.014 17919 98412 1 240 . 1 1 33 33 LYS N N 33 115.130 115.130 117.392 -2.262 17919 98413 1 240 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.504 -0.167 17919 98414 1 240 . 1 1 33 33 LYS C C 33 177.870 177.870 177.935 -0.065 17919 98415 1 240 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.075 0.975 17919 98416 1 240 . 1 1 33 33 LYS CB C 33 34.170 34.170 34.072 0.098 17919 98417 1 240 . 1 1 33 33 LYS H H 33 7.430 7.430 7.582 -0.152 17919 98418 1 240 . 1 1 34 34 GLU N N 34 113.870 113.870 116.093 -2.223 17919 98419 1 240 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.463 0.162 17919 98420 1 240 . 1 1 34 34 GLU C C 34 177.840 177.840 177.678 0.162 17919 98421 1 240 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.179 -1.009 17919 98422 1 240 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.825 0.835 17919 98423 1 240 . 1 1 34 34 GLU H H 34 8.740 8.740 7.935 0.805 17919 98424 1 240 . 1 1 35 35 GLY N N 35 108.650 108.650 108.291 0.359 17919 98425 1 240 . 1 1 35 35 GLY C C 35 173.960 173.960 174.314 -0.354 17919 98426 1 240 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.612 0.468 17919 98427 1 240 . 1 1 35 35 GLY H H 35 8.530 8.530 8.482 0.048 17919 98428 1 240 . 1 1 36 36 ILE N N 36 119.880 119.880 122.328 -2.448 17919 98429 1 240 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.404 0.041 17919 98430 1 240 . 1 1 36 36 ILE C C 36 173.590 173.590 174.665 -1.075 17919 98431 1 240 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.028 0.723 17919 98432 1 240 . 1 1 36 36 ILE CB C 36 40.580 40.580 37.763 2.817 17919 98433 1 240 . 1 1 36 36 ILE H H 36 6.150 6.150 7.714 -1.564 17919 98434 1 240 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.532 0.102 17919 98435 1 240 . 1 1 37 37 PRO C C 37 176.940 176.940 176.094 0.846 17919 98436 1 240 . 1 1 37 37 PRO CA C 37 61.660 61.660 62.531 -0.871 17919 98437 1 240 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.254 0.596 17919 98438 1 240 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.197 -0.080 17919 98439 1 240 . 1 1 38 38 PRO C C 38 178.320 178.320 178.861 -0.541 17919 98440 1 240 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.718 0.542 17919 98441 1 240 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.883 1.007 17919 98442 1 240 . 1 1 39 39 ASP N N 39 113.380 113.380 116.308 -2.928 17919 98443 1 240 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.320 0.110 17919 98444 1 240 . 1 1 39 39 ASP C C 39 177.090 177.090 177.562 -0.472 17919 98445 1 240 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.809 -1.169 17919 98446 1 240 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.426 -0.886 17919 98447 1 240 . 1 1 39 39 ASP H H 39 8.550 8.550 8.625 -0.075 17919 98448 1 240 . 1 1 40 40 GLN N N 40 116.780 116.780 115.268 1.512 17919 98449 1 240 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.364 0.100 17919 98450 1 240 . 1 1 40 40 GLN C C 40 175.380 175.380 175.649 -0.269 17919 98451 1 240 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.727 -0.087 17919 98452 1 240 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.326 0.814 17919 98453 1 240 . 1 1 40 40 GLN H H 40 7.820 7.820 8.324 -0.504 17919 98454 1 240 . 1 1 41 41 GLN N N 41 117.720 117.720 119.621 -1.901 17919 98455 1 240 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.824 -0.580 17919 98456 1 240 . 1 1 41 41 GLN C C 41 176.300 176.300 175.318 0.982 17919 98457 1 240 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.528 0.942 17919 98458 1 240 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.553 2.097 17919 98459 1 240 . 1 1 41 41 GLN H H 41 7.480 7.480 7.385 0.095 17919 98460 1 240 . 1 1 42 42 ARG N N 42 122.680 122.680 123.696 -1.016 17919 98461 1 240 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.638 -0.138 17919 98462 1 240 . 1 1 42 42 ARG C C 42 174.050 174.050 174.596 -0.546 17919 98463 1 240 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.806 0.244 17919 98464 1 240 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.155 -1.405 17919 98465 1 240 . 1 1 42 42 ARG H H 42 8.530 8.530 8.544 -0.014 17919 98466 1 240 . 1 1 43 43 LEU N N 43 124.040 124.040 124.639 -0.599 17919 98467 1 240 . 1 1 43 43 LEU C C 43 175.290 175.290 175.533 -0.243 17919 98468 1 240 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.823 -0.843 17919 98469 1 240 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.112 1.678 17919 98470 1 240 . 1 1 43 43 LEU H H 43 8.820 8.820 8.769 0.051 17919 98471 1 240 . 1 1 44 44 ILE N N 44 121.920 121.920 123.049 -1.129 17919 98472 1 240 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.089 -0.097 17919 98473 1 240 . 1 1 44 44 ILE C C 44 176.060 176.060 174.319 1.741 17919 98474 1 240 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.165 -1.185 17919 98475 1 240 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.494 -0.074 17919 98476 1 240 . 1 1 44 44 ILE H H 44 9.030 9.030 8.779 0.251 17919 98477 1 240 . 1 1 45 45 PHE N N 45 125.390 125.390 126.552 -1.162 17919 98478 1 240 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.000 0.045 17919 98479 1 240 . 1 1 45 45 PHE C C 45 174.470 174.470 174.573 -0.103 17919 98480 1 240 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.603 0.417 17919 98481 1 240 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.117 0.643 17919 98482 1 240 . 1 1 45 45 PHE H H 45 8.830 8.830 8.505 0.325 17919 98483 1 240 . 1 1 46 46 ALA N N 46 132.200 132.200 128.214 3.986 17919 98484 1 240 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.548 0.142 17919 98485 1 240 . 1 1 46 46 ALA C C 46 177.290 177.290 177.703 -0.413 17919 98486 1 240 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.516 0.024 17919 98487 1 240 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.617 -0.047 17919 98488 1 240 . 1 1 46 46 ALA H H 46 8.810 8.810 8.614 0.196 17919 98489 1 240 . 1 1 47 47 GLY N N 47 102.340 102.340 103.585 -1.245 17919 98490 1 240 . 1 1 47 47 GLY C C 47 173.810 173.810 174.446 -0.636 17919 98491 1 240 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.832 0.518 17919 98492 1 240 . 1 1 47 47 GLY H H 47 8.130 8.130 8.289 -0.159 17919 98493 1 240 . 1 1 48 48 LYS N N 48 121.570 121.570 122.533 -0.963 17919 98494 1 240 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.565 0.057 17919 98495 1 240 . 1 1 48 48 LYS C C 48 174.700 174.700 175.102 -0.402 17919 98496 1 240 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.628 -0.078 17919 98497 1 240 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.293 0.237 17919 98498 1 240 . 1 1 48 48 LYS H H 48 7.980 7.980 7.768 0.212 17919 98499 1 240 . 1 1 49 49 GLN N N 49 122.410 122.410 123.938 -1.528 17919 98500 1 240 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.742 -0.182 17919 98501 1 240 . 1 1 49 49 GLN C C 49 175.670 175.670 175.643 0.027 17919 98502 1 240 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.168 0.572 17919 98503 1 240 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.900 -0.900 17919 98504 1 240 . 1 1 49 49 GLN H H 49 8.600 8.600 8.481 0.119 17919 98505 1 240 . 1 1 50 50 LEU N N 50 125.520 125.520 126.801 -1.281 17919 98506 1 240 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.149 -0.059 17919 98507 1 240 . 1 1 50 50 LEU C C 50 176.660 176.660 176.693 -0.033 17919 98508 1 240 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.667 -0.427 17919 98509 1 240 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.105 -0.535 17919 98510 1 240 . 1 1 50 50 LEU H H 50 8.530 8.530 8.298 0.232 17919 98511 1 240 . 1 1 51 51 GLU N N 51 122.940 122.940 122.803 0.137 17919 98512 1 240 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.566 -0.078 17919 98513 1 240 . 1 1 51 51 GLU C C 51 175.870 175.870 176.831 -0.961 17919 98514 1 240 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.111 0.849 17919 98515 1 240 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.078 -0.508 17919 98516 1 240 . 1 1 51 51 GLU H H 51 8.400 8.400 8.721 -0.321 17919 98517 1 240 . 1 1 52 52 ASP N N 52 120.030 120.030 127.181 -7.151 17919 98518 1 240 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.390 -0.031 17919 98519 1 240 . 1 1 52 52 ASP C C 52 177.330 177.330 177.740 -0.410 17919 98520 1 240 . 1 1 52 52 ASP CA C 52 56.960 56.960 58.243 -1.283 17919 98521 1 240 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.612 0.238 17919 98522 1 240 . 1 1 52 52 ASP H H 52 8.160 8.160 8.860 -0.700 17919 98523 1 240 . 1 1 53 53 GLY N N 53 106.660 106.660 103.588 3.072 17919 98524 1 240 . 1 1 53 53 GLY C C 53 174.870 174.870 174.173 0.697 17919 98525 1 240 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.616 0.554 17919 98526 1 240 . 1 1 53 53 GLY H H 53 9.390 9.390 8.224 1.166 17919 98527 1 240 . 1 1 54 54 ARG N N 54 119.050 119.050 121.111 -2.061 17919 98528 1 240 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.564 0.131 17919 98529 1 240 . 1 1 54 54 ARG C C 54 175.350 175.350 175.751 -0.401 17919 98530 1 240 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.721 -0.331 17919 98531 1 240 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.465 0.185 17919 98532 1 240 . 1 1 54 54 ARG H H 54 7.460 7.460 7.460 0.000 17919 98533 1 240 . 1 1 55 55 THR N N 55 108.400 108.400 114.311 -5.911 17919 98534 1 240 . 1 1 55 55 THR HA H 55 5.240 5.240 4.698 0.542 17919 98535 1 240 . 1 1 55 55 THR C C 55 176.560 176.560 175.638 0.922 17919 98536 1 240 . 1 1 55 55 THR CA C 55 59.690 59.690 61.153 -1.463 17919 98537 1 240 . 1 1 55 55 THR CB C 55 72.260 72.260 70.159 2.101 17919 98538 1 240 . 1 1 55 55 THR H H 55 8.730 8.730 8.221 0.509 17919 98539 1 240 . 1 1 56 56 LEU N N 56 117.920 117.920 121.155 -3.235 17919 98540 1 240 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.036 0.024 17919 98541 1 240 . 1 1 56 56 LEU C C 56 180.810 180.810 178.906 1.904 17919 98542 1 240 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.106 0.604 17919 98543 1 240 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.644 -1.274 17919 98544 1 240 . 1 1 56 56 LEU H H 56 8.140 8.140 8.449 -0.309 17919 98545 1 240 . 1 1 57 57 SER N N 57 113.330 113.330 114.609 -1.279 17919 98546 1 240 . 1 1 57 57 SER HA H 57 4.370 4.370 4.092 0.278 17919 98547 1 240 . 1 1 57 57 SER C C 57 178.310 178.310 176.627 1.683 17919 98548 1 240 . 1 1 57 57 SER CA C 57 61.080 61.080 61.358 -0.278 17919 98549 1 240 . 1 1 57 57 SER CB C 57 62.530 62.530 62.742 -0.213 17919 98550 1 240 . 1 1 57 57 SER H H 57 8.470 8.470 8.518 -0.048 17919 98551 1 240 . 1 1 58 58 ASP N N 58 124.190 124.190 121.335 2.855 17919 98552 1 240 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.357 -0.061 17919 98553 1 240 . 1 1 58 58 ASP C C 58 177.400 177.400 177.385 0.015 17919 98554 1 240 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.297 0.883 17919 98555 1 240 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.472 -0.372 17919 98556 1 240 . 1 1 58 58 ASP H H 58 7.930 7.930 7.725 0.205 17919 98557 1 240 . 1 1 59 59 TYR N N 59 115.510 115.510 115.625 -0.115 17919 98558 1 240 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.644 0.026 17919 98559 1 240 . 1 1 59 59 TYR C C 59 174.700 174.700 175.114 -0.414 17919 98560 1 240 . 1 1 59 59 TYR CA C 59 58.250 58.250 58.377 -0.127 17919 98561 1 240 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.639 1.431 17919 98562 1 240 . 1 1 59 59 TYR H H 59 7.250 7.250 7.217 0.033 17919 98563 1 240 . 1 1 60 60 ASN N N 60 115.900 115.900 114.842 1.058 17919 98564 1 240 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.416 -0.061 17919 98565 1 240 . 1 1 60 60 ASN C C 60 174.340 174.340 174.445 -0.105 17919 98566 1 240 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.683 -0.563 17919 98567 1 240 . 1 1 60 60 ASN CB C 60 37.410 37.410 36.591 0.819 17919 98568 1 240 . 1 1 60 60 ASN H H 60 8.150 8.150 8.308 -0.158 17919 98569 1 240 . 1 1 61 61 ILE N N 61 118.600 118.600 119.792 -1.192 17919 98570 1 240 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.613 -0.220 17919 98571 1 240 . 1 1 61 61 ILE C C 61 174.610 174.610 175.336 -0.726 17919 98572 1 240 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.654 -0.234 17919 98573 1 240 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.313 -0.573 17919 98574 1 240 . 1 1 61 61 ILE H H 61 7.250 7.250 7.547 -0.297 17919 98575 1 240 . 1 1 62 62 GLN N N 62 124.740 124.740 125.741 -1.001 17919 98576 1 240 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.730 -0.224 17919 98577 1 240 . 1 1 62 62 GLN C C 62 175.970 175.970 174.966 1.004 17919 98578 1 240 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.707 -0.047 17919 98579 1 240 . 1 1 62 62 GLN CB C 62 31.650 31.650 32.493 -0.843 17919 98580 1 240 . 1 1 62 62 GLN H H 62 7.610 7.610 7.878 -0.268 17919 98581 1 240 . 1 1 63 63 LYS N N 63 120.300 120.300 120.439 -0.139 17919 98582 1 240 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.056 -0.055 17919 98583 1 240 . 1 1 63 63 LYS C C 63 175.810 175.810 177.115 -1.305 17919 98584 1 240 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.808 -0.018 17919 98585 1 240 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.758 0.892 17919 98586 1 240 . 1 1 63 63 LYS H H 63 8.490 8.490 8.615 -0.125 17919 98587 1 240 . 1 1 64 64 GLU N N 64 113.950 113.950 119.115 -5.165 17919 98588 1 240 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.900 -0.435 17919 98589 1 240 . 1 1 64 64 GLU C C 64 175.250 175.250 175.973 -0.723 17919 98590 1 240 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.898 -0.008 17919 98591 1 240 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.612 -2.712 17919 98592 1 240 . 1 1 64 64 GLU H H 64 9.280 9.280 9.034 0.246 17919 98593 1 240 . 1 1 65 65 SER N N 65 114.730 114.730 115.815 -1.085 17919 98594 1 240 . 1 1 65 65 SER HA H 65 4.640 4.640 4.597 0.043 17919 98595 1 240 . 1 1 65 65 SER C C 65 172.160 172.160 173.638 -1.478 17919 98596 1 240 . 1 1 65 65 SER CA C 65 60.890 60.890 60.074 0.816 17919 98597 1 240 . 1 1 65 65 SER CB C 65 64.910 64.910 63.968 0.942 17919 98598 1 240 . 1 1 65 65 SER H H 65 7.670 7.670 7.786 -0.116 17919 98599 1 240 . 1 1 66 66 THR N N 66 117.110 117.110 119.107 -1.997 17919 98600 1 240 . 1 1 66 66 THR HA H 66 5.270 5.270 5.171 0.099 17919 98601 1 240 . 1 1 66 66 THR C C 66 173.950 173.950 173.994 -0.044 17919 98602 1 240 . 1 1 66 66 THR CA C 66 62.340 62.340 61.765 0.575 17919 98603 1 240 . 1 1 66 66 THR CB C 66 70.080 70.080 70.168 -0.088 17919 98604 1 240 . 1 1 66 66 THR H H 66 8.730 8.730 8.357 0.373 17919 98605 1 240 . 1 1 67 67 LEU N N 67 127.110 127.110 127.456 -0.346 17919 98606 1 240 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.829 0.231 17919 98607 1 240 . 1 1 67 67 LEU C C 67 175.770 175.770 175.536 0.234 17919 98608 1 240 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.985 -0.085 17919 98609 1 240 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.924 0.336 17919 98610 1 240 . 1 1 67 67 LEU H H 67 9.410 9.410 8.859 0.551 17919 98611 1 240 . 1 1 68 68 HIS N N 68 118.380 118.380 120.767 -2.387 17919 98612 1 240 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.421 -0.181 17919 98613 1 240 . 1 1 68 68 HIS C C 68 173.150 173.150 173.944 -0.794 17919 98614 1 240 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.746 0.254 17919 98615 1 240 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.450 -1.920 17919 98616 1 240 . 1 1 68 68 HIS H H 68 9.230 9.230 8.843 0.387 17919 98617 1 240 . 1 1 69 69 LEU N N 69 124.460 124.460 128.015 -3.555 17919 98618 1 240 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.052 0.138 17919 98619 1 240 . 1 1 69 69 LEU C C 69 175.270 175.270 174.440 0.830 17919 98620 1 240 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.502 0.389 17919 98621 1 240 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.886 -0.506 17919 98622 1 240 . 1 1 69 69 LEU H H 69 8.340 8.340 8.673 -0.333 17919 98623 1 240 . 1 1 70 70 VAL N N 70 126.940 126.940 126.176 0.764 17919 98624 1 240 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.355 -0.005 17919 98625 1 240 . 1 1 70 70 VAL C C 70 174.000 174.000 174.681 -0.681 17919 98626 1 240 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.794 0.006 17919 98627 1 240 . 1 1 70 70 VAL CB C 70 34.910 34.910 34.062 0.848 17919 98628 1 240 . 1 1 70 70 VAL H H 70 9.200 9.200 9.148 0.052 17919 98629 1 240 . 1 1 71 71 LEU N N 71 123.130 123.130 124.758 -1.628 17919 98630 1 240 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.830 0.230 17919 98631 1 240 . 1 1 71 71 LEU C C 71 177.830 177.830 176.786 1.044 17919 98632 1 240 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.337 0.603 17919 98633 1 240 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.399 -0.549 17919 98634 1 240 . 1 1 71 71 LEU H H 71 8.120 8.120 8.520 -0.400 17919 98635 1 240 . 1 1 72 72 ARG N N 72 123.490 123.490 122.112 1.378 17919 98636 1 240 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.217 0.084 17919 98637 1 240 . 1 1 72 72 ARG C C 72 175.350 175.350 176.198 -0.848 17919 98638 1 240 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.992 -0.382 17919 98639 1 240 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.380 0.970 17919 98640 1 240 . 1 1 72 72 ARG H H 72 8.580 8.580 8.251 0.329 17919 98641 1 241 . 1 1 2 2 GLN N N 2 123.220 123.220 119.669 3.551 17919 98642 1 241 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.361 -0.112 17919 98643 1 241 . 1 1 2 2 GLN C C 2 175.920 175.920 175.734 0.186 17919 98644 1 241 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.671 0.409 17919 98645 1 241 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.615 0.145 17919 98646 1 241 . 1 1 2 2 GLN H H 2 8.900 8.900 8.331 0.569 17919 98647 1 241 . 1 1 3 3 ILE N N 3 115.340 115.340 116.262 -0.922 17919 98648 1 241 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.297 -0.084 17919 98649 1 241 . 1 1 3 3 ILE C C 3 172.450 172.450 173.456 -1.006 17919 98650 1 241 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.395 0.175 17919 98651 1 241 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.995 0.215 17919 98652 1 241 . 1 1 3 3 ILE H H 3 8.320 8.320 8.540 -0.220 17919 98653 1 241 . 1 1 4 4 PHE N N 4 118.110 118.110 119.249 -1.139 17919 98654 1 241 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.598 0.032 17919 98655 1 241 . 1 1 4 4 PHE C C 4 175.320 175.320 175.282 0.038 17919 98656 1 241 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.690 -0.480 17919 98657 1 241 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.278 0.202 17919 98658 1 241 . 1 1 4 4 PHE H H 4 8.610 8.610 8.676 -0.066 17919 98659 1 241 . 1 1 5 5 VAL N N 5 121.000 121.000 123.527 -2.527 17919 98660 1 241 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.852 -0.127 17919 98661 1 241 . 1 1 5 5 VAL C C 5 174.870 174.870 174.773 0.097 17919 98662 1 241 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.323 -0.703 17919 98663 1 241 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.759 0.471 17919 98664 1 241 . 1 1 5 5 VAL H H 5 9.300 9.300 9.374 -0.074 17919 98665 1 241 . 1 1 6 6 LYS N N 6 127.520 127.520 128.643 -1.123 17919 98666 1 241 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.438 -0.071 17919 98667 1 241 . 1 1 6 6 LYS C C 6 177.140 177.140 176.063 1.077 17919 98668 1 241 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.160 0.360 17919 98669 1 241 . 1 1 6 6 LYS CB C 6 35.050 35.050 36.130 -1.079 17919 98670 1 241 . 1 1 6 6 LYS H H 6 8.820 8.820 9.348 -0.528 17919 98671 1 241 . 1 1 7 7 THR N N 7 115.400 115.400 116.960 -1.560 17919 98672 1 241 . 1 1 7 7 THR HA H 7 4.970 4.970 4.473 0.497 17919 98673 1 241 . 1 1 7 7 THR C C 7 176.910 176.910 176.009 0.901 17919 98674 1 241 . 1 1 7 7 THR CA C 7 60.470 60.470 60.612 -0.142 17919 98675 1 241 . 1 1 7 7 THR CB C 7 70.630 70.630 70.581 0.049 17919 98676 1 241 . 1 1 7 7 THR H H 7 8.730 8.730 8.735 -0.005 17919 98677 1 241 . 1 1 8 8 LEU N N 8 121.330 121.330 122.975 -1.645 17919 98678 1 241 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.454 -0.144 17919 98679 1 241 . 1 1 8 8 LEU C C 8 178.800 178.800 177.692 1.108 17919 98680 1 241 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.180 0.400 17919 98681 1 241 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.213 -0.243 17919 98682 1 241 . 1 1 8 8 LEU H H 8 9.100 9.100 8.901 0.199 17919 98683 1 241 . 1 1 9 9 THR N N 9 105.590 105.590 108.024 -2.434 17919 98684 1 241 . 1 1 9 9 THR HA H 9 4.428 4.428 4.381 0.047 17919 98685 1 241 . 1 1 9 9 THR C C 9 175.520 175.520 175.358 0.162 17919 98686 1 241 . 1 1 9 9 THR CA C 9 61.400 61.400 61.575 -0.175 17919 98687 1 241 . 1 1 9 9 THR CB C 9 69.140 69.140 69.327 -0.187 17919 98688 1 241 . 1 1 9 9 THR H H 9 7.630 7.630 7.416 0.214 17919 98689 1 241 . 1 1 10 10 GLY N N 10 108.890 108.890 110.872 -1.982 17919 98690 1 241 . 1 1 10 10 GLY C C 10 174.070 174.070 173.824 0.246 17919 98691 1 241 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.036 0.424 17919 98692 1 241 . 1 1 10 10 GLY H H 10 7.810 7.810 7.753 0.057 17919 98693 1 241 . 1 1 11 11 LYS N N 11 121.600 121.600 121.933 -0.333 17919 98694 1 241 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.363 -0.002 17919 98695 1 241 . 1 1 11 11 LYS C C 11 175.940 175.940 175.030 0.910 17919 98696 1 241 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.713 -0.433 17919 98697 1 241 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.544 -0.344 17919 98698 1 241 . 1 1 11 11 LYS H H 11 7.280 7.280 8.012 -0.732 17919 98699 1 241 . 1 1 12 12 THR N N 12 120.440 120.440 120.508 -0.068 17919 98700 1 241 . 1 1 12 12 THR HA H 12 5.046 5.046 5.120 -0.074 17919 98701 1 241 . 1 1 12 12 THR C C 12 174.320 174.320 174.099 0.221 17919 98702 1 241 . 1 1 12 12 THR CA C 12 62.390 62.390 61.622 0.768 17919 98703 1 241 . 1 1 12 12 THR CB C 12 69.910 69.910 69.939 -0.029 17919 98704 1 241 . 1 1 12 12 THR H H 12 8.650 8.650 8.245 0.405 17919 98705 1 241 . 1 1 13 13 ILE N N 13 127.110 127.110 122.354 4.756 17919 98706 1 241 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.754 -0.210 17919 98707 1 241 . 1 1 13 13 ILE C C 13 175.220 175.220 174.641 0.579 17919 98708 1 241 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.217 0.763 17919 98709 1 241 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.677 -0.727 17919 98710 1 241 . 1 1 13 13 ILE H H 13 9.450 9.450 9.096 0.354 17919 98711 1 241 . 1 1 14 14 THR N N 14 121.520 121.520 122.186 -0.666 17919 98712 1 241 . 1 1 14 14 THR HA H 14 4.964 4.964 5.079 -0.115 17919 98713 1 241 . 1 1 14 14 THR C C 14 173.790 173.790 174.537 -0.747 17919 98714 1 241 . 1 1 14 14 THR CA C 14 61.940 61.940 62.229 -0.289 17919 98715 1 241 . 1 1 14 14 THR CB C 14 69.650 69.650 69.434 0.216 17919 98716 1 241 . 1 1 14 14 THR H H 14 8.710 8.710 8.508 0.202 17919 98717 1 241 . 1 1 15 15 LEU N N 15 124.800 124.800 127.054 -2.254 17919 98718 1 241 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.697 0.083 17919 98719 1 241 . 1 1 15 15 LEU C C 15 174.670 174.670 174.880 -0.210 17919 98720 1 241 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.676 -0.846 17919 98721 1 241 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.572 1.498 17919 98722 1 241 . 1 1 15 15 LEU H H 15 8.710 8.710 8.562 0.148 17919 98723 1 241 . 1 1 16 16 GLU N N 16 122.160 122.160 123.898 -1.738 17919 98724 1 241 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.188 -0.271 17919 98725 1 241 . 1 1 16 16 GLU C C 16 175.860 175.860 176.258 -0.398 17919 98726 1 241 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.039 -0.219 17919 98727 1 241 . 1 1 16 16 GLU CB C 16 29.450 29.450 29.959 -0.509 17919 98728 1 241 . 1 1 16 16 GLU H H 16 8.140 8.140 8.653 -0.513 17919 98729 1 241 . 1 1 17 17 VAL N N 17 117.210 117.210 118.022 -0.812 17919 98730 1 241 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.904 -0.190 17919 98731 1 241 . 1 1 17 17 VAL C C 17 174.160 174.160 174.845 -0.685 17919 98732 1 241 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.815 -0.385 17919 98733 1 241 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.654 0.746 17919 98734 1 241 . 1 1 17 17 VAL H H 17 8.900 8.900 8.593 0.307 17919 98735 1 241 . 1 1 18 18 GLU N N 18 118.990 118.990 122.275 -3.285 17919 98736 1 241 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.721 0.358 17919 98737 1 241 . 1 1 18 18 GLU C C 18 176.160 176.160 175.225 0.935 17919 98738 1 241 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.909 -0.189 17919 98739 1 241 . 1 1 18 18 GLU CB C 18 30.310 30.310 29.920 0.390 17919 98740 1 241 . 1 1 18 18 GLU H H 18 8.640 8.640 8.267 0.373 17919 98741 1 241 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.195 -0.054 17919 98742 1 241 . 1 1 19 19 PRO C C 19 175.310 175.310 177.704 -2.394 17919 98743 1 241 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.639 -0.170 17919 98744 1 241 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.876 0.074 17919 98745 1 241 . 1 1 20 20 SER N N 20 103.400 103.400 109.587 -6.187 17919 98746 1 241 . 1 1 20 20 SER HA H 20 4.370 4.370 4.303 0.067 17919 98747 1 241 . 1 1 20 20 SER C C 20 174.660 174.660 174.847 -0.187 17919 98748 1 241 . 1 1 20 20 SER CA C 20 57.400 57.400 59.149 -1.749 17919 98749 1 241 . 1 1 20 20 SER CB C 20 63.370 63.370 62.894 0.476 17919 98750 1 241 . 1 1 20 20 SER H H 20 7.040 7.040 7.981 -0.941 17919 98751 1 241 . 1 1 21 21 ASP N N 21 123.480 123.480 123.622 -0.142 17919 98752 1 241 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.548 0.147 17919 98753 1 241 . 1 1 21 21 ASP C C 21 176.360 176.360 176.334 0.026 17919 98754 1 241 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.531 0.169 17919 98755 1 241 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.603 -0.803 17919 98756 1 241 . 1 1 21 21 ASP H H 21 8.030 8.030 7.665 0.365 17919 98757 1 241 . 1 1 22 22 THR N N 22 108.800 108.800 112.145 -3.345 17919 98758 1 241 . 1 1 22 22 THR HA H 22 4.920 4.920 4.742 0.177 17919 98759 1 241 . 1 1 22 22 THR C C 22 176.750 176.750 175.878 0.872 17919 98760 1 241 . 1 1 22 22 THR CA C 22 59.690 59.690 61.113 -1.423 17919 98761 1 241 . 1 1 22 22 THR CB C 22 71.200 71.200 70.543 0.657 17919 98762 1 241 . 1 1 22 22 THR H H 22 7.900 7.900 8.228 -0.328 17919 98763 1 241 . 1 1 23 23 ILE N N 23 121.190 121.190 122.606 -1.416 17919 98764 1 241 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.827 -0.170 17919 98765 1 241 . 1 1 23 23 ILE C C 23 179.040 179.040 177.674 1.366 17919 98766 1 241 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.555 -0.295 17919 98767 1 241 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.424 -2.074 17919 98768 1 241 . 1 1 23 23 ILE H H 23 8.560 8.560 8.530 0.030 17919 98769 1 241 . 1 1 24 24 GLU N N 24 120.830 120.830 121.185 -0.355 17919 98770 1 241 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.807 0.110 17919 98771 1 241 . 1 1 24 24 GLU C C 24 178.640 178.640 178.717 -0.077 17919 98772 1 241 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.088 0.132 17919 98773 1 241 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.361 -1.081 17919 98774 1 241 . 1 1 24 24 GLU H H 24 9.760 9.760 8.282 1.478 17919 98775 1 241 . 1 1 25 25 ASN N N 25 120.570 120.570 117.474 3.096 17919 98776 1 241 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.538 -0.013 17919 98777 1 241 . 1 1 25 25 ASN C C 25 178.380 178.380 177.973 0.407 17919 98778 1 241 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.996 0.064 17919 98779 1 241 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.678 -0.228 17919 98780 1 241 . 1 1 25 25 ASN H H 25 7.920 7.920 7.516 0.404 17919 98781 1 241 . 1 1 26 26 VAL N N 26 121.710 121.710 120.713 0.997 17919 98782 1 241 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.685 -0.288 17919 98783 1 241 . 1 1 26 26 VAL C C 26 177.950 177.950 178.054 -0.104 17919 98784 1 241 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.084 1.577 17919 98785 1 241 . 1 1 26 26 VAL CB C 26 30.840 30.840 30.876 -0.036 17919 98786 1 241 . 1 1 26 26 VAL H H 26 8.070 8.070 8.475 -0.405 17919 98787 1 241 . 1 1 27 27 LYS N N 27 118.860 118.860 120.077 -1.217 17919 98788 1 241 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.198 0.382 17919 98789 1 241 . 1 1 27 27 LYS C C 27 180.550 180.550 179.103 1.447 17919 98790 1 241 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.698 -0.448 17919 98791 1 241 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.246 1.484 17919 98792 1 241 . 1 1 27 27 LYS H H 27 8.560 8.560 8.510 0.050 17919 98793 1 241 . 1 1 28 28 ALA N N 28 123.440 123.440 122.495 0.945 17919 98794 1 241 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.110 0.050 17919 98795 1 241 . 1 1 28 28 ALA C C 28 180.300 180.300 179.176 1.124 17919 98796 1 241 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.947 0.423 17919 98797 1 241 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.312 -0.602 17919 98798 1 241 . 1 1 28 28 ALA H H 28 8.060 8.060 7.844 0.216 17919 98799 1 241 . 1 1 29 29 LYS N N 29 119.940 119.940 119.443 0.497 17919 98800 1 241 . 1 1 29 29 LYS HA H 29 4.207 4.207 3.974 0.233 17919 98801 1 241 . 1 1 29 29 LYS C C 29 180.320 180.320 179.173 1.147 17919 98802 1 241 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.473 0.177 17919 98803 1 241 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.293 0.997 17919 98804 1 241 . 1 1 29 29 LYS H H 29 7.850 7.850 7.967 -0.117 17919 98805 1 241 . 1 1 30 30 ILE N N 30 121.080 121.080 120.155 0.925 17919 98806 1 241 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.564 -0.057 17919 98807 1 241 . 1 1 30 30 ILE C C 30 178.310 178.310 177.418 0.892 17919 98808 1 241 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.541 0.609 17919 98809 1 241 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.824 -1.024 17919 98810 1 241 . 1 1 30 30 ILE H H 30 8.280 8.280 8.163 0.117 17919 98811 1 241 . 1 1 31 31 GLN N N 31 123.490 123.490 119.742 3.748 17919 98812 1 241 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.966 -0.137 17919 98813 1 241 . 1 1 31 31 GLN C C 31 178.890 178.890 178.616 0.274 17919 98814 1 241 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.068 0.932 17919 98815 1 241 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.436 -0.716 17919 98816 1 241 . 1 1 31 31 GLN H H 31 8.580 8.580 7.850 0.730 17919 98817 1 241 . 1 1 32 32 ASP N N 32 119.360 119.360 120.266 -0.906 17919 98818 1 241 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.421 -0.067 17919 98819 1 241 . 1 1 32 32 ASP C C 32 177.250 177.250 177.835 -0.585 17919 98820 1 241 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.751 0.439 17919 98821 1 241 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.894 -0.314 17919 98822 1 241 . 1 1 32 32 ASP H H 32 8.010 8.010 8.325 -0.315 17919 98823 1 241 . 1 1 33 33 LYS N N 33 115.130 115.130 117.220 -2.090 17919 98824 1 241 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.383 -0.046 17919 98825 1 241 . 1 1 33 33 LYS C C 33 177.870 177.870 177.708 0.162 17919 98826 1 241 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.078 -0.028 17919 98827 1 241 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.590 0.579 17919 98828 1 241 . 1 1 33 33 LYS H H 33 7.430 7.430 7.489 -0.059 17919 98829 1 241 . 1 1 34 34 GLU N N 34 113.870 113.870 114.075 -0.205 17919 98830 1 241 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.524 0.101 17919 98831 1 241 . 1 1 34 34 GLU C C 34 177.840 177.840 176.763 1.077 17919 98832 1 241 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.607 -0.437 17919 98833 1 241 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.392 1.268 17919 98834 1 241 . 1 1 34 34 GLU H H 34 8.740 8.740 8.220 0.520 17919 98835 1 241 . 1 1 35 35 GLY N N 35 108.650 108.650 108.293 0.357 17919 98836 1 241 . 1 1 35 35 GLY C C 35 173.960 173.960 174.614 -0.654 17919 98837 1 241 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.534 0.546 17919 98838 1 241 . 1 1 35 35 GLY H H 35 8.530 8.530 7.853 0.677 17919 98839 1 241 . 1 1 36 36 ILE N N 36 119.880 119.880 122.034 -2.154 17919 98840 1 241 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.221 0.224 17919 98841 1 241 . 1 1 36 36 ILE C C 36 173.590 173.590 174.229 -0.639 17919 98842 1 241 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.471 0.279 17919 98843 1 241 . 1 1 36 36 ILE CB C 36 40.580 40.580 35.987 4.593 17919 98844 1 241 . 1 1 36 36 ILE H H 36 6.150 6.150 7.884 -1.734 17919 98845 1 241 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.744 -0.110 17919 98846 1 241 . 1 1 37 37 PRO C C 37 176.940 176.940 175.929 1.011 17919 98847 1 241 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.776 -0.116 17919 98848 1 241 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.713 0.137 17919 98849 1 241 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.123 -0.006 17919 98850 1 241 . 1 1 38 38 PRO C C 38 178.320 178.320 178.461 -0.141 17919 98851 1 241 . 1 1 38 38 PRO CA C 38 66.260 66.260 66.002 0.258 17919 98852 1 241 . 1 1 38 38 PRO CB C 38 32.890 32.890 32.010 0.880 17919 98853 1 241 . 1 1 39 39 ASP N N 39 113.380 113.380 115.376 -1.996 17919 98854 1 241 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.364 0.066 17919 98855 1 241 . 1 1 39 39 ASP C C 39 177.090 177.090 178.233 -1.143 17919 98856 1 241 . 1 1 39 39 ASP CA C 39 55.640 55.640 57.252 -1.612 17919 98857 1 241 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.589 -1.049 17919 98858 1 241 . 1 1 39 39 ASP H H 39 8.550 8.550 8.681 -0.131 17919 98859 1 241 . 1 1 40 40 GLN N N 40 116.780 116.780 118.793 -2.013 17919 98860 1 241 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.172 0.292 17919 98861 1 241 . 1 1 40 40 GLN C C 40 175.380 175.380 177.021 -1.641 17919 98862 1 241 . 1 1 40 40 GLN CA C 40 55.640 55.640 57.491 -1.851 17919 98863 1 241 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.548 0.592 17919 98864 1 241 . 1 1 40 40 GLN H H 40 7.820 7.820 7.911 -0.091 17919 98865 1 241 . 1 1 41 41 GLN N N 41 117.720 117.720 120.118 -2.398 17919 98866 1 241 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.003 0.241 17919 98867 1 241 . 1 1 41 41 GLN C C 41 176.300 176.300 175.164 1.136 17919 98868 1 241 . 1 1 41 41 GLN CA C 41 56.470 56.470 57.734 -1.264 17919 98869 1 241 . 1 1 41 41 GLN CB C 41 31.650 31.650 28.760 2.890 17919 98870 1 241 . 1 1 41 41 GLN H H 41 7.480 7.480 7.830 -0.350 17919 98871 1 241 . 1 1 42 42 ARG N N 42 122.680 122.680 121.911 0.769 17919 98872 1 241 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.671 -0.171 17919 98873 1 241 . 1 1 42 42 ARG C C 42 174.050 174.050 174.403 -0.353 17919 98874 1 241 . 1 1 42 42 ARG CA C 42 55.050 55.050 53.233 1.817 17919 98875 1 241 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.893 -1.143 17919 98876 1 241 . 1 1 42 42 ARG H H 42 8.530 8.530 8.814 -0.284 17919 98877 1 241 . 1 1 43 43 LEU N N 43 124.040 124.040 125.037 -0.997 17919 98878 1 241 . 1 1 43 43 LEU C C 43 175.290 175.290 175.807 -0.517 17919 98879 1 241 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.393 -1.413 17919 98880 1 241 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.411 1.379 17919 98881 1 241 . 1 1 43 43 LEU H H 43 8.820 8.820 8.779 0.041 17919 98882 1 241 . 1 1 44 44 ILE N N 44 121.920 121.920 121.884 0.036 17919 98883 1 241 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.094 -0.102 17919 98884 1 241 . 1 1 44 44 ILE C C 44 176.060 176.060 174.250 1.810 17919 98885 1 241 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.190 -1.210 17919 98886 1 241 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.313 0.107 17919 98887 1 241 . 1 1 44 44 ILE H H 44 9.030 9.030 9.130 -0.100 17919 98888 1 241 . 1 1 45 45 PHE N N 45 125.390 125.390 127.164 -1.774 17919 98889 1 241 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.047 -0.002 17919 98890 1 241 . 1 1 45 45 PHE C C 45 174.470 174.470 174.435 0.035 17919 98891 1 241 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.531 0.490 17919 98892 1 241 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.275 0.485 17919 98893 1 241 . 1 1 45 45 PHE H H 45 8.830 8.830 8.765 0.065 17919 98894 1 241 . 1 1 46 46 ALA N N 46 132.200 132.200 128.622 3.578 17919 98895 1 241 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.630 0.060 17919 98896 1 241 . 1 1 46 46 ALA C C 46 177.290 177.290 177.984 -0.694 17919 98897 1 241 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.696 -0.156 17919 98898 1 241 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.751 -0.181 17919 98899 1 241 . 1 1 46 46 ALA H H 46 8.810 8.810 8.603 0.207 17919 98900 1 241 . 1 1 47 47 GLY N N 47 102.340 102.340 104.309 -1.969 17919 98901 1 241 . 1 1 47 47 GLY C C 47 173.810 173.810 174.314 -0.504 17919 98902 1 241 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.907 0.443 17919 98903 1 241 . 1 1 47 47 GLY H H 47 8.130 8.130 8.417 -0.287 17919 98904 1 241 . 1 1 48 48 LYS N N 48 121.570 121.570 121.642 -0.072 17919 98905 1 241 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.604 0.018 17919 98906 1 241 . 1 1 48 48 LYS C C 48 174.700 174.700 175.580 -0.880 17919 98907 1 241 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.946 -0.396 17919 98908 1 241 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.518 0.012 17919 98909 1 241 . 1 1 48 48 LYS H H 48 7.980 7.980 7.922 0.058 17919 98910 1 241 . 1 1 49 49 GLN N N 49 122.410 122.410 124.150 -1.740 17919 98911 1 241 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.389 0.171 17919 98912 1 241 . 1 1 49 49 GLN C C 49 175.670 175.670 175.299 0.371 17919 98913 1 241 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.932 -1.192 17919 98914 1 241 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.442 -0.442 17919 98915 1 241 . 1 1 49 49 GLN H H 49 8.600 8.600 8.675 -0.075 17919 98916 1 241 . 1 1 50 50 LEU N N 50 125.520 125.520 126.852 -1.332 17919 98917 1 241 . 1 1 50 50 LEU HA H 50 4.090 4.090 3.982 0.108 17919 98918 1 241 . 1 1 50 50 LEU C C 50 176.660 176.660 175.049 1.611 17919 98919 1 241 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.931 0.310 17919 98920 1 241 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.630 -1.060 17919 98921 1 241 . 1 1 50 50 LEU H H 50 8.530 8.530 8.902 -0.372 17919 98922 1 241 . 1 1 51 51 GLU N N 51 122.940 122.940 123.550 -0.610 17919 98923 1 241 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.582 -0.094 17919 98924 1 241 . 1 1 51 51 GLU C C 51 175.870 175.870 176.778 -0.908 17919 98925 1 241 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.194 0.766 17919 98926 1 241 . 1 1 51 51 GLU CB C 51 31.570 31.570 33.328 -1.758 17919 98927 1 241 . 1 1 51 51 GLU H H 51 8.400 8.400 8.039 0.361 17919 98928 1 241 . 1 1 52 52 ASP N N 52 120.030 120.030 122.899 -2.869 17919 98929 1 241 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.476 -0.117 17919 98930 1 241 . 1 1 52 52 ASP C C 52 177.330 177.330 177.501 -0.171 17919 98931 1 241 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.351 -0.391 17919 98932 1 241 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.816 0.034 17919 98933 1 241 . 1 1 52 52 ASP H H 52 8.160 8.160 8.859 -0.699 17919 98934 1 241 . 1 1 53 53 GLY N N 53 106.660 106.660 105.139 1.521 17919 98935 1 241 . 1 1 53 53 GLY C C 53 174.870 174.870 174.264 0.606 17919 98936 1 241 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.924 0.246 17919 98937 1 241 . 1 1 53 53 GLY H H 53 9.390 9.390 8.513 0.877 17919 98938 1 241 . 1 1 54 54 ARG N N 54 119.050 119.050 121.119 -2.069 17919 98939 1 241 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.767 -0.072 17919 98940 1 241 . 1 1 54 54 ARG C C 54 175.350 175.350 175.129 0.221 17919 98941 1 241 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.344 0.046 17919 98942 1 241 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.503 -0.853 17919 98943 1 241 . 1 1 54 54 ARG H H 54 7.460 7.460 7.629 -0.169 17919 98944 1 241 . 1 1 55 55 THR N N 55 108.400 108.400 112.442 -4.042 17919 98945 1 241 . 1 1 55 55 THR HA H 55 5.240 5.240 5.135 0.105 17919 98946 1 241 . 1 1 55 55 THR C C 55 176.560 176.560 176.245 0.315 17919 98947 1 241 . 1 1 55 55 THR CA C 55 59.690 59.690 60.541 -0.851 17919 98948 1 241 . 1 1 55 55 THR CB C 55 72.260 72.260 71.104 1.156 17919 98949 1 241 . 1 1 55 55 THR H H 55 8.730 8.730 9.057 -0.327 17919 98950 1 241 . 1 1 56 56 LEU N N 56 117.920 117.920 123.698 -5.778 17919 98951 1 241 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.865 0.195 17919 98952 1 241 . 1 1 56 56 LEU C C 56 180.810 180.810 179.257 1.553 17919 98953 1 241 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.403 0.307 17919 98954 1 241 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.343 -0.973 17919 98955 1 241 . 1 1 56 56 LEU H H 56 8.140 8.140 8.610 -0.470 17919 98956 1 241 . 1 1 57 57 SER N N 57 113.330 113.330 114.871 -1.541 17919 98957 1 241 . 1 1 57 57 SER HA H 57 4.370 4.370 4.025 0.345 17919 98958 1 241 . 1 1 57 57 SER C C 57 178.310 178.310 176.625 1.685 17919 98959 1 241 . 1 1 57 57 SER CA C 57 61.080 61.080 62.455 -1.375 17919 98960 1 241 . 1 1 57 57 SER CB C 57 62.530 62.530 62.837 -0.307 17919 98961 1 241 . 1 1 57 57 SER H H 57 8.470 8.470 8.315 0.155 17919 98962 1 241 . 1 1 58 58 ASP N N 58 124.190 124.190 120.397 3.793 17919 98963 1 241 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.359 -0.063 17919 98964 1 241 . 1 1 58 58 ASP C C 58 177.400 177.400 176.702 0.698 17919 98965 1 241 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.317 0.863 17919 98966 1 241 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.515 -0.415 17919 98967 1 241 . 1 1 58 58 ASP H H 58 7.930 7.930 7.668 0.262 17919 98968 1 241 . 1 1 59 59 TYR N N 59 115.510 115.510 116.152 -0.642 17919 98969 1 241 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.515 0.155 17919 98970 1 241 . 1 1 59 59 TYR C C 59 174.700 174.700 175.568 -0.868 17919 98971 1 241 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.654 0.596 17919 98972 1 241 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.343 1.727 17919 98973 1 241 . 1 1 59 59 TYR H H 59 7.250 7.250 7.628 -0.378 17919 98974 1 241 . 1 1 60 60 ASN N N 60 115.900 115.900 114.265 1.635 17919 98975 1 241 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.396 -0.041 17919 98976 1 241 . 1 1 60 60 ASN C C 60 174.340 174.340 174.327 0.013 17919 98977 1 241 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.426 -0.306 17919 98978 1 241 . 1 1 60 60 ASN CB C 60 37.410 37.410 36.878 0.532 17919 98979 1 241 . 1 1 60 60 ASN H H 60 8.150 8.150 7.827 0.323 17919 98980 1 241 . 1 1 61 61 ILE N N 61 118.600 118.600 120.292 -1.692 17919 98981 1 241 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.636 -0.243 17919 98982 1 241 . 1 1 61 61 ILE C C 61 174.610 174.610 175.583 -0.973 17919 98983 1 241 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.120 1.300 17919 98984 1 241 . 1 1 61 61 ILE CB C 61 36.740 36.740 36.446 0.294 17919 98985 1 241 . 1 1 61 61 ILE H H 61 7.250 7.250 7.589 -0.339 17919 98986 1 241 . 1 1 62 62 GLN N N 62 124.740 124.740 125.229 -0.489 17919 98987 1 241 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.725 -0.219 17919 98988 1 241 . 1 1 62 62 GLN C C 62 175.970 175.970 175.767 0.203 17919 98989 1 241 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.694 -0.034 17919 98990 1 241 . 1 1 62 62 GLN CB C 62 31.650 31.650 32.713 -1.063 17919 98991 1 241 . 1 1 62 62 GLN H H 62 7.610 7.610 7.857 -0.247 17919 98992 1 241 . 1 1 63 63 LYS N N 63 120.300 120.300 120.540 -0.240 17919 98993 1 241 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.111 -0.110 17919 98994 1 241 . 1 1 63 63 LYS C C 63 175.810 175.810 177.508 -1.698 17919 98995 1 241 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.685 0.104 17919 98996 1 241 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.337 0.313 17919 98997 1 241 . 1 1 63 63 LYS H H 63 8.490 8.490 8.749 -0.259 17919 98998 1 241 . 1 1 64 64 GLU N N 64 113.950 113.950 119.209 -5.259 17919 98999 1 241 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.557 -0.092 17919 99000 1 241 . 1 1 64 64 GLU C C 64 175.250 175.250 176.077 -0.827 17919 99001 1 241 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.446 0.444 17919 99002 1 241 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.372 -2.472 17919 99003 1 241 . 1 1 64 64 GLU H H 64 9.280 9.280 8.947 0.333 17919 99004 1 241 . 1 1 65 65 SER N N 65 114.730 114.730 115.120 -0.390 17919 99005 1 241 . 1 1 65 65 SER HA H 65 4.640 4.640 4.521 0.119 17919 99006 1 241 . 1 1 65 65 SER C C 65 172.160 172.160 174.124 -1.964 17919 99007 1 241 . 1 1 65 65 SER CA C 65 60.890 60.890 60.273 0.617 17919 99008 1 241 . 1 1 65 65 SER CB C 65 64.910 64.910 64.216 0.694 17919 99009 1 241 . 1 1 65 65 SER H H 65 7.670 7.670 7.743 -0.073 17919 99010 1 241 . 1 1 66 66 THR N N 66 117.110 117.110 118.952 -1.842 17919 99011 1 241 . 1 1 66 66 THR HA H 66 5.270 5.270 5.132 0.138 17919 99012 1 241 . 1 1 66 66 THR C C 66 173.950 173.950 174.160 -0.210 17919 99013 1 241 . 1 1 66 66 THR CA C 66 62.340 62.340 62.070 0.270 17919 99014 1 241 . 1 1 66 66 THR CB C 66 70.080 70.080 70.479 -0.399 17919 99015 1 241 . 1 1 66 66 THR H H 66 8.730 8.730 8.557 0.173 17919 99016 1 241 . 1 1 67 67 LEU N N 67 127.110 127.110 127.779 -0.669 17919 99017 1 241 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.957 0.103 17919 99018 1 241 . 1 1 67 67 LEU C C 67 175.770 175.770 175.278 0.492 17919 99019 1 241 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.104 -0.204 17919 99020 1 241 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.695 0.565 17919 99021 1 241 . 1 1 67 67 LEU H H 67 9.410 9.410 9.248 0.162 17919 99022 1 241 . 1 1 68 68 HIS N N 68 118.380 118.380 122.541 -4.161 17919 99023 1 241 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.464 -0.224 17919 99024 1 241 . 1 1 68 68 HIS C C 68 173.150 173.150 173.724 -0.574 17919 99025 1 241 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.480 0.520 17919 99026 1 241 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.832 -2.302 17919 99027 1 241 . 1 1 68 68 HIS H H 68 9.230 9.230 8.959 0.271 17919 99028 1 241 . 1 1 69 69 LEU N N 69 124.460 124.460 129.461 -5.001 17919 99029 1 241 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.969 0.221 17919 99030 1 241 . 1 1 69 69 LEU C C 69 175.270 175.270 174.223 1.047 17919 99031 1 241 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.628 0.262 17919 99032 1 241 . 1 1 69 69 LEU CB C 69 44.380 44.380 43.835 0.545 17919 99033 1 241 . 1 1 69 69 LEU H H 69 8.340 8.340 8.051 0.289 17919 99034 1 241 . 1 1 70 70 VAL N N 70 126.940 126.940 125.575 1.365 17919 99035 1 241 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.372 -0.022 17919 99036 1 241 . 1 1 70 70 VAL C C 70 174.000 174.000 174.492 -0.492 17919 99037 1 241 . 1 1 70 70 VAL CA C 70 60.800 60.800 61.146 -0.346 17919 99038 1 241 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.810 -0.900 17919 99039 1 241 . 1 1 70 70 VAL H H 70 9.200 9.200 8.906 0.294 17919 99040 1 241 . 1 1 71 71 LEU N N 71 123.130 123.130 125.444 -2.314 17919 99041 1 241 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.967 0.093 17919 99042 1 241 . 1 1 71 71 LEU C C 71 177.830 177.830 176.979 0.851 17919 99043 1 241 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.364 0.576 17919 99044 1 241 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.409 -0.559 17919 99045 1 241 . 1 1 71 71 LEU H H 71 8.120 8.120 8.438 -0.318 17919 99046 1 241 . 1 1 72 72 ARG N N 72 123.490 123.490 120.827 2.663 17919 99047 1 241 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.563 -0.262 17919 99048 1 241 . 1 1 72 72 ARG C C 72 175.350 175.350 175.398 -0.048 17919 99049 1 241 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.120 0.490 17919 99050 1 241 . 1 1 72 72 ARG CB C 72 31.350 31.350 31.338 0.012 17919 99051 1 241 . 1 1 72 72 ARG H H 72 8.580 8.580 7.988 0.592 17919 99052 1 242 . 1 1 2 2 GLN N N 2 123.220 123.220 121.524 1.696 17919 99053 1 242 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.020 0.229 17919 99054 1 242 . 1 1 2 2 GLN C C 2 175.920 175.920 175.203 0.717 17919 99055 1 242 . 1 1 2 2 GLN CA C 2 55.080 55.080 55.589 -0.509 17919 99056 1 242 . 1 1 2 2 GLN CB C 2 30.760 30.760 29.968 0.792 17919 99057 1 242 . 1 1 2 2 GLN H H 2 8.900 8.900 8.602 0.297 17919 99058 1 242 . 1 1 3 3 ILE N N 3 115.340 115.340 117.531 -2.191 17919 99059 1 242 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.770 -0.557 17919 99060 1 242 . 1 1 3 3 ILE C C 3 172.450 172.450 173.230 -0.780 17919 99061 1 242 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.075 0.495 17919 99062 1 242 . 1 1 3 3 ILE CB C 3 42.210 42.210 42.082 0.128 17919 99063 1 242 . 1 1 3 3 ILE H H 3 8.320 8.320 8.594 -0.274 17919 99064 1 242 . 1 1 4 4 PHE N N 4 118.110 118.110 119.490 -1.380 17919 99065 1 242 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.544 0.086 17919 99066 1 242 . 1 1 4 4 PHE C C 4 175.320 175.320 175.185 0.135 17919 99067 1 242 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.768 -0.558 17919 99068 1 242 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.550 -1.070 17919 99069 1 242 . 1 1 4 4 PHE H H 4 8.610 8.610 8.762 -0.152 17919 99070 1 242 . 1 1 5 5 VAL N N 5 121.000 121.000 121.166 -0.166 17919 99071 1 242 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.751 -0.026 17919 99072 1 242 . 1 1 5 5 VAL C C 5 174.870 174.870 174.966 -0.096 17919 99073 1 242 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.119 -0.499 17919 99074 1 242 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.429 -0.199 17919 99075 1 242 . 1 1 5 5 VAL H H 5 9.300 9.300 9.252 0.048 17919 99076 1 242 . 1 1 6 6 LYS N N 6 127.520 127.520 127.686 -0.166 17919 99077 1 242 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.237 0.130 17919 99078 1 242 . 1 1 6 6 LYS C C 6 177.140 177.140 176.714 0.426 17919 99079 1 242 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.463 0.057 17919 99080 1 242 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.864 0.186 17919 99081 1 242 . 1 1 6 6 LYS H H 6 8.820 8.820 9.144 -0.324 17919 99082 1 242 . 1 1 7 7 THR N N 7 115.400 115.400 117.358 -1.958 17919 99083 1 242 . 1 1 7 7 THR HA H 7 4.970 4.970 4.413 0.557 17919 99084 1 242 . 1 1 7 7 THR C C 7 176.910 176.910 176.217 0.693 17919 99085 1 242 . 1 1 7 7 THR CA C 7 60.470 60.470 62.159 -1.689 17919 99086 1 242 . 1 1 7 7 THR CB C 7 70.630 70.630 70.236 0.394 17919 99087 1 242 . 1 1 7 7 THR H H 7 8.730 8.730 8.891 -0.161 17919 99088 1 242 . 1 1 8 8 LEU N N 8 121.330 121.330 125.657 -4.327 17919 99089 1 242 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.173 0.137 17919 99090 1 242 . 1 1 8 8 LEU C C 8 178.800 178.800 177.857 0.943 17919 99091 1 242 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.980 -0.400 17919 99092 1 242 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.072 -0.102 17919 99093 1 242 . 1 1 8 8 LEU H H 8 9.100 9.100 8.764 0.336 17919 99094 1 242 . 1 1 9 9 THR N N 9 105.590 105.590 109.221 -3.631 17919 99095 1 242 . 1 1 9 9 THR HA H 9 4.428 4.428 4.417 0.011 17919 99096 1 242 . 1 1 9 9 THR C C 9 175.520 175.520 175.491 0.029 17919 99097 1 242 . 1 1 9 9 THR CA C 9 61.400 61.400 61.344 0.056 17919 99098 1 242 . 1 1 9 9 THR CB C 9 69.140 69.140 69.533 -0.393 17919 99099 1 242 . 1 1 9 9 THR H H 9 7.630 7.630 7.608 0.022 17919 99100 1 242 . 1 1 10 10 GLY N N 10 108.890 108.890 110.737 -1.847 17919 99101 1 242 . 1 1 10 10 GLY C C 10 174.070 174.070 173.703 0.367 17919 99102 1 242 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.226 0.234 17919 99103 1 242 . 1 1 10 10 GLY H H 10 7.810 7.810 8.184 -0.374 17919 99104 1 242 . 1 1 11 11 LYS N N 11 121.600 121.600 120.000 1.600 17919 99105 1 242 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.704 -0.343 17919 99106 1 242 . 1 1 11 11 LYS C C 11 175.940 175.940 175.020 0.920 17919 99107 1 242 . 1 1 11 11 LYS CA C 11 56.280 56.280 54.292 1.988 17919 99108 1 242 . 1 1 11 11 LYS CB C 11 33.200 33.200 35.524 -2.324 17919 99109 1 242 . 1 1 11 11 LYS H H 11 7.280 7.280 7.645 -0.365 17919 99110 1 242 . 1 1 12 12 THR N N 12 120.440 120.440 118.392 2.048 17919 99111 1 242 . 1 1 12 12 THR HA H 12 5.046 5.046 5.189 -0.143 17919 99112 1 242 . 1 1 12 12 THR C C 12 174.320 174.320 174.375 -0.055 17919 99113 1 242 . 1 1 12 12 THR CA C 12 62.390 62.390 61.914 0.475 17919 99114 1 242 . 1 1 12 12 THR CB C 12 69.910 69.910 69.865 0.045 17919 99115 1 242 . 1 1 12 12 THR H H 12 8.650 8.650 8.455 0.195 17919 99116 1 242 . 1 1 13 13 ILE N N 13 127.110 127.110 128.277 -1.167 17919 99117 1 242 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.525 0.019 17919 99118 1 242 . 1 1 13 13 ILE C C 13 175.220 175.220 175.478 -0.258 17919 99119 1 242 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.333 -0.353 17919 99120 1 242 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.920 0.030 17919 99121 1 242 . 1 1 13 13 ILE H H 13 9.450 9.450 9.180 0.270 17919 99122 1 242 . 1 1 14 14 THR N N 14 121.520 121.520 122.927 -1.407 17919 99123 1 242 . 1 1 14 14 THR HA H 14 4.964 4.964 5.101 -0.137 17919 99124 1 242 . 1 1 14 14 THR C C 14 173.790 173.790 173.811 -0.021 17919 99125 1 242 . 1 1 14 14 THR CA C 14 61.940 61.940 61.451 0.489 17919 99126 1 242 . 1 1 14 14 THR CB C 14 69.650 69.650 69.980 -0.330 17919 99127 1 242 . 1 1 14 14 THR H H 14 8.710 8.710 8.239 0.470 17919 99128 1 242 . 1 1 15 15 LEU N N 15 124.800 124.800 126.399 -1.599 17919 99129 1 242 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.765 0.015 17919 99130 1 242 . 1 1 15 15 LEU C C 15 174.670 174.670 175.142 -0.472 17919 99131 1 242 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.484 -0.654 17919 99132 1 242 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.335 1.735 17919 99133 1 242 . 1 1 15 15 LEU H H 15 8.710 8.710 8.980 -0.270 17919 99134 1 242 . 1 1 16 16 GLU N N 16 122.160 122.160 120.432 1.728 17919 99135 1 242 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.563 -0.646 17919 99136 1 242 . 1 1 16 16 GLU C C 16 175.860 175.860 175.938 -0.078 17919 99137 1 242 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.152 -0.332 17919 99138 1 242 . 1 1 16 16 GLU CB C 16 29.450 29.450 32.054 -2.604 17919 99139 1 242 . 1 1 16 16 GLU H H 16 8.140 8.140 8.566 -0.426 17919 99140 1 242 . 1 1 17 17 VAL N N 17 117.210 117.210 117.876 -0.666 17919 99141 1 242 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.815 -0.101 17919 99142 1 242 . 1 1 17 17 VAL C C 17 174.160 174.160 174.667 -0.507 17919 99143 1 242 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.517 -1.087 17919 99144 1 242 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.320 1.080 17919 99145 1 242 . 1 1 17 17 VAL H H 17 8.900 8.900 8.592 0.308 17919 99146 1 242 . 1 1 18 18 GLU N N 18 118.990 118.990 121.912 -2.922 17919 99147 1 242 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.734 0.345 17919 99148 1 242 . 1 1 18 18 GLU C C 18 176.160 176.160 175.281 0.879 17919 99149 1 242 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.386 -0.666 17919 99150 1 242 . 1 1 18 18 GLU CB C 18 30.310 30.310 29.861 0.449 17919 99151 1 242 . 1 1 18 18 GLU H H 18 8.640 8.640 8.592 0.048 17919 99152 1 242 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.407 -0.266 17919 99153 1 242 . 1 1 19 19 PRO C C 19 175.310 175.310 177.403 -2.093 17919 99154 1 242 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.081 0.389 17919 99155 1 242 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.984 -0.034 17919 99156 1 242 . 1 1 20 20 SER N N 20 103.400 103.400 110.593 -7.193 17919 99157 1 242 . 1 1 20 20 SER HA H 20 4.370 4.370 4.271 0.099 17919 99158 1 242 . 1 1 20 20 SER C C 20 174.660 174.660 173.819 0.841 17919 99159 1 242 . 1 1 20 20 SER CA C 20 57.400 57.400 59.668 -2.268 17919 99160 1 242 . 1 1 20 20 SER CB C 20 63.370 63.370 62.722 0.648 17919 99161 1 242 . 1 1 20 20 SER H H 20 7.040 7.040 8.082 -1.042 17919 99162 1 242 . 1 1 21 21 ASP N N 21 123.480 123.480 122.633 0.847 17919 99163 1 242 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.731 -0.036 17919 99164 1 242 . 1 1 21 21 ASP C C 21 176.360 176.360 175.624 0.736 17919 99165 1 242 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.674 1.026 17919 99166 1 242 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.773 -0.973 17919 99167 1 242 . 1 1 21 21 ASP H H 21 8.030 8.030 7.444 0.586 17919 99168 1 242 . 1 1 22 22 THR N N 22 108.800 108.800 112.446 -3.646 17919 99169 1 242 . 1 1 22 22 THR HA H 22 4.920 4.920 4.822 0.098 17919 99170 1 242 . 1 1 22 22 THR C C 22 176.750 176.750 176.041 0.709 17919 99171 1 242 . 1 1 22 22 THR CA C 22 59.690 59.690 60.743 -1.053 17919 99172 1 242 . 1 1 22 22 THR CB C 22 71.200 71.200 70.801 0.399 17919 99173 1 242 . 1 1 22 22 THR H H 22 7.900 7.900 8.306 -0.406 17919 99174 1 242 . 1 1 23 23 ILE N N 23 121.190 121.190 122.334 -1.144 17919 99175 1 242 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.868 -0.211 17919 99176 1 242 . 1 1 23 23 ILE C C 23 179.040 179.040 177.648 1.392 17919 99177 1 242 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.166 0.093 17919 99178 1 242 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.306 -1.956 17919 99179 1 242 . 1 1 23 23 ILE H H 23 8.560 8.560 8.993 -0.433 17919 99180 1 242 . 1 1 24 24 GLU N N 24 120.830 120.830 121.284 -0.454 17919 99181 1 242 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.825 0.092 17919 99182 1 242 . 1 1 24 24 GLU C C 24 178.640 178.640 177.974 0.666 17919 99183 1 242 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.398 -0.178 17919 99184 1 242 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.413 -1.133 17919 99185 1 242 . 1 1 24 24 GLU H H 24 9.760 9.760 8.596 1.164 17919 99186 1 242 . 1 1 25 25 ASN N N 25 120.570 120.570 117.393 3.177 17919 99187 1 242 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.522 0.003 17919 99188 1 242 . 1 1 25 25 ASN C C 25 178.380 178.380 177.918 0.462 17919 99189 1 242 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.046 0.014 17919 99190 1 242 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.759 -0.309 17919 99191 1 242 . 1 1 25 25 ASN H H 25 7.920 7.920 7.788 0.132 17919 99192 1 242 . 1 1 26 26 VAL N N 26 121.710 121.710 121.016 0.694 17919 99193 1 242 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.600 -0.203 17919 99194 1 242 . 1 1 26 26 VAL C C 26 177.950 177.950 177.816 0.134 17919 99195 1 242 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.527 1.133 17919 99196 1 242 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.147 -0.307 17919 99197 1 242 . 1 1 26 26 VAL H H 26 8.070 8.070 8.020 0.050 17919 99198 1 242 . 1 1 27 27 LYS N N 27 118.860 118.860 120.311 -1.451 17919 99199 1 242 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.161 0.419 17919 99200 1 242 . 1 1 27 27 LYS C C 27 180.550 180.550 179.274 1.276 17919 99201 1 242 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.819 -0.569 17919 99202 1 242 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.227 1.503 17919 99203 1 242 . 1 1 27 27 LYS H H 27 8.560 8.560 8.439 0.121 17919 99204 1 242 . 1 1 28 28 ALA N N 28 123.440 123.440 119.752 3.688 17919 99205 1 242 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.199 -0.039 17919 99206 1 242 . 1 1 28 28 ALA C C 28 180.300 180.300 179.030 1.270 17919 99207 1 242 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.271 1.099 17919 99208 1 242 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.492 -0.783 17919 99209 1 242 . 1 1 28 28 ALA H H 28 8.060 8.060 8.033 0.027 17919 99210 1 242 . 1 1 29 29 LYS N N 29 119.940 119.940 119.204 0.736 17919 99211 1 242 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.112 0.095 17919 99212 1 242 . 1 1 29 29 LYS C C 29 180.320 180.320 178.857 1.463 17919 99213 1 242 . 1 1 29 29 LYS CA C 29 59.650 59.650 58.884 0.766 17919 99214 1 242 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.506 0.784 17919 99215 1 242 . 1 1 29 29 LYS H H 29 7.850 7.850 7.907 -0.057 17919 99216 1 242 . 1 1 30 30 ILE N N 30 121.080 121.080 119.918 1.162 17919 99217 1 242 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.707 -0.200 17919 99218 1 242 . 1 1 30 30 ILE C C 30 178.310 178.310 176.884 1.426 17919 99219 1 242 . 1 1 30 30 ILE CA C 30 66.150 66.150 64.464 1.686 17919 99220 1 242 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.925 -1.125 17919 99221 1 242 . 1 1 30 30 ILE H H 30 8.280 8.280 8.056 0.224 17919 99222 1 242 . 1 1 31 31 GLN N N 31 123.490 123.490 120.838 2.652 17919 99223 1 242 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.076 -0.247 17919 99224 1 242 . 1 1 31 31 GLN C C 31 178.890 178.890 177.699 1.191 17919 99225 1 242 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.016 0.984 17919 99226 1 242 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.622 -0.902 17919 99227 1 242 . 1 1 31 31 GLN H H 31 8.580 8.580 7.731 0.849 17919 99228 1 242 . 1 1 32 32 ASP N N 32 119.360 119.360 118.091 1.269 17919 99229 1 242 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.415 -0.061 17919 99230 1 242 . 1 1 32 32 ASP C C 32 177.250 177.250 177.886 -0.636 17919 99231 1 242 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.482 0.708 17919 99232 1 242 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.776 -0.196 17919 99233 1 242 . 1 1 32 32 ASP H H 32 8.010 8.010 7.972 0.038 17919 99234 1 242 . 1 1 33 33 LYS N N 33 115.130 115.130 119.061 -3.931 17919 99235 1 242 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.264 0.073 17919 99236 1 242 . 1 1 33 33 LYS C C 33 177.870 177.870 178.316 -0.446 17919 99237 1 242 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.947 0.103 17919 99238 1 242 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.258 0.912 17919 99239 1 242 . 1 1 33 33 LYS H H 33 7.430 7.430 7.547 -0.117 17919 99240 1 242 . 1 1 34 34 GLU N N 34 113.870 113.870 114.354 -0.484 17919 99241 1 242 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.529 0.096 17919 99242 1 242 . 1 1 34 34 GLU C C 34 177.840 177.840 176.932 0.908 17919 99243 1 242 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.905 -0.735 17919 99244 1 242 . 1 1 34 34 GLU CB C 34 32.660 32.660 30.855 1.805 17919 99245 1 242 . 1 1 34 34 GLU H H 34 8.740 8.740 7.919 0.821 17919 99246 1 242 . 1 1 35 35 GLY N N 35 108.650 108.650 109.014 -0.364 17919 99247 1 242 . 1 1 35 35 GLY C C 35 173.960 173.960 174.490 -0.530 17919 99248 1 242 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.755 0.325 17919 99249 1 242 . 1 1 35 35 GLY H H 35 8.530 8.530 7.796 0.734 17919 99250 1 242 . 1 1 36 36 ILE N N 36 119.880 119.880 121.499 -1.619 17919 99251 1 242 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.299 0.146 17919 99252 1 242 . 1 1 36 36 ILE C C 36 173.590 173.590 173.934 -0.344 17919 99253 1 242 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.109 -0.359 17919 99254 1 242 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.173 2.407 17919 99255 1 242 . 1 1 36 36 ILE H H 36 6.150 6.150 7.731 -1.581 17919 99256 1 242 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.538 0.096 17919 99257 1 242 . 1 1 37 37 PRO C C 37 176.940 176.940 176.476 0.464 17919 99258 1 242 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.853 -0.193 17919 99259 1 242 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.081 0.769 17919 99260 1 242 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.207 -0.090 17919 99261 1 242 . 1 1 38 38 PRO C C 38 178.320 178.320 178.154 0.166 17919 99262 1 242 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.468 0.792 17919 99263 1 242 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.715 1.175 17919 99264 1 242 . 1 1 39 39 ASP N N 39 113.380 113.380 119.280 -5.900 17919 99265 1 242 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.372 0.058 17919 99266 1 242 . 1 1 39 39 ASP C C 39 177.090 177.090 177.703 -0.613 17919 99267 1 242 . 1 1 39 39 ASP CA C 39 55.640 55.640 57.693 -2.053 17919 99268 1 242 . 1 1 39 39 ASP CB C 39 39.540 39.540 39.725 -0.185 17919 99269 1 242 . 1 1 39 39 ASP H H 39 8.550 8.550 8.769 -0.219 17919 99270 1 242 . 1 1 40 40 GLN N N 40 116.780 116.780 117.584 -0.804 17919 99271 1 242 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.264 0.200 17919 99272 1 242 . 1 1 40 40 GLN C C 40 175.380 175.380 175.315 0.065 17919 99273 1 242 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.638 -0.998 17919 99274 1 242 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.811 0.329 17919 99275 1 242 . 1 1 40 40 GLN H H 40 7.820 7.820 7.966 -0.146 17919 99276 1 242 . 1 1 41 41 GLN N N 41 117.720 117.720 118.829 -1.109 17919 99277 1 242 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.367 -0.123 17919 99278 1 242 . 1 1 41 41 GLN C C 41 176.300 176.300 175.768 0.532 17919 99279 1 242 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.460 0.010 17919 99280 1 242 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.695 1.956 17919 99281 1 242 . 1 1 41 41 GLN H H 41 7.480 7.480 7.263 0.217 17919 99282 1 242 . 1 1 42 42 ARG N N 42 122.680 122.680 122.122 0.558 17919 99283 1 242 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.607 -0.107 17919 99284 1 242 . 1 1 42 42 ARG C C 42 174.050 174.050 174.379 -0.329 17919 99285 1 242 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.054 0.996 17919 99286 1 242 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.753 -2.003 17919 99287 1 242 . 1 1 42 42 ARG H H 42 8.530 8.530 8.614 -0.084 17919 99288 1 242 . 1 1 43 43 LEU N N 43 124.040 124.040 123.641 0.399 17919 99289 1 242 . 1 1 43 43 LEU C C 43 175.290 175.290 175.687 -0.397 17919 99290 1 242 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.742 -0.762 17919 99291 1 242 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.070 2.720 17919 99292 1 242 . 1 1 43 43 LEU H H 43 8.820 8.820 8.855 -0.035 17919 99293 1 242 . 1 1 44 44 ILE N N 44 121.920 121.920 122.369 -0.449 17919 99294 1 242 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.885 0.107 17919 99295 1 242 . 1 1 44 44 ILE C C 44 176.060 176.060 174.416 1.644 17919 99296 1 242 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.285 -0.305 17919 99297 1 242 . 1 1 44 44 ILE CB C 44 41.420 41.420 39.174 2.246 17919 99298 1 242 . 1 1 44 44 ILE H H 44 9.030 9.030 8.912 0.118 17919 99299 1 242 . 1 1 45 45 PHE N N 45 125.390 125.390 127.549 -2.159 17919 99300 1 242 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.043 0.002 17919 99301 1 242 . 1 1 45 45 PHE C C 45 174.470 174.470 174.622 -0.152 17919 99302 1 242 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.227 0.793 17919 99303 1 242 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.106 0.654 17919 99304 1 242 . 1 1 45 45 PHE H H 45 8.830 8.830 8.634 0.196 17919 99305 1 242 . 1 1 46 46 ALA N N 46 132.200 132.200 129.279 2.921 17919 99306 1 242 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.616 0.074 17919 99307 1 242 . 1 1 46 46 ALA C C 46 177.290 177.290 177.740 -0.450 17919 99308 1 242 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.421 0.119 17919 99309 1 242 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.450 0.120 17919 99310 1 242 . 1 1 46 46 ALA H H 46 8.810 8.810 8.588 0.222 17919 99311 1 242 . 1 1 47 47 GLY N N 47 102.340 102.340 103.787 -1.447 17919 99312 1 242 . 1 1 47 47 GLY C C 47 173.810 173.810 174.043 -0.233 17919 99313 1 242 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.750 0.600 17919 99314 1 242 . 1 1 47 47 GLY H H 47 8.130 8.130 8.364 -0.234 17919 99315 1 242 . 1 1 48 48 LYS N N 48 121.570 121.570 121.274 0.296 17919 99316 1 242 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.603 0.019 17919 99317 1 242 . 1 1 48 48 LYS C C 48 174.700 174.700 174.834 -0.134 17919 99318 1 242 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.966 -0.416 17919 99319 1 242 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.970 -0.440 17919 99320 1 242 . 1 1 48 48 LYS H H 48 7.980 7.980 7.955 0.025 17919 99321 1 242 . 1 1 49 49 GLN N N 49 122.410 122.410 125.434 -3.024 17919 99322 1 242 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.379 0.181 17919 99323 1 242 . 1 1 49 49 GLN C C 49 175.670 175.670 175.477 0.193 17919 99324 1 242 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.580 0.161 17919 99325 1 242 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.364 -0.364 17919 99326 1 242 . 1 1 49 49 GLN H H 49 8.600 8.600 8.574 0.026 17919 99327 1 242 . 1 1 50 50 LEU N N 50 125.520 125.520 128.660 -3.140 17919 99328 1 242 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.303 -0.213 17919 99329 1 242 . 1 1 50 50 LEU C C 50 176.660 176.660 176.073 0.587 17919 99330 1 242 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.113 0.127 17919 99331 1 242 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.081 -0.511 17919 99332 1 242 . 1 1 50 50 LEU H H 50 8.530 8.530 8.388 0.142 17919 99333 1 242 . 1 1 51 51 GLU N N 51 122.940 122.940 123.043 -0.103 17919 99334 1 242 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.564 -0.076 17919 99335 1 242 . 1 1 51 51 GLU C C 51 175.870 175.870 177.007 -1.137 17919 99336 1 242 . 1 1 51 51 GLU CA C 51 55.960 55.960 54.973 0.987 17919 99337 1 242 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.215 -0.645 17919 99338 1 242 . 1 1 51 51 GLU H H 51 8.400 8.400 8.568 -0.168 17919 99339 1 242 . 1 1 52 52 ASP N N 52 120.030 120.030 127.430 -7.400 17919 99340 1 242 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.496 -0.137 17919 99341 1 242 . 1 1 52 52 ASP C C 52 177.330 177.330 177.818 -0.488 17919 99342 1 242 . 1 1 52 52 ASP CA C 52 56.960 56.960 56.601 0.359 17919 99343 1 242 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.118 0.732 17919 99344 1 242 . 1 1 52 52 ASP H H 52 8.160 8.160 8.785 -0.625 17919 99345 1 242 . 1 1 53 53 GLY N N 53 106.660 106.660 107.337 -0.677 17919 99346 1 242 . 1 1 53 53 GLY C C 53 174.870 174.870 174.367 0.503 17919 99347 1 242 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.216 -0.046 17919 99348 1 242 . 1 1 53 53 GLY H H 53 9.390 9.390 8.681 0.709 17919 99349 1 242 . 1 1 54 54 ARG N N 54 119.050 119.050 119.709 -0.659 17919 99350 1 242 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.720 -0.025 17919 99351 1 242 . 1 1 54 54 ARG C C 54 175.350 175.350 175.525 -0.175 17919 99352 1 242 . 1 1 54 54 ARG CA C 54 54.390 54.390 52.861 1.529 17919 99353 1 242 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.291 0.359 17919 99354 1 242 . 1 1 54 54 ARG H H 54 7.460 7.460 7.358 0.102 17919 99355 1 242 . 1 1 55 55 THR N N 55 108.400 108.400 111.482 -3.082 17919 99356 1 242 . 1 1 55 55 THR HA H 55 5.240 5.240 4.799 0.441 17919 99357 1 242 . 1 1 55 55 THR C C 55 176.560 176.560 176.430 0.130 17919 99358 1 242 . 1 1 55 55 THR CA C 55 59.690 59.690 60.578 -0.888 17919 99359 1 242 . 1 1 55 55 THR CB C 55 72.260 72.260 70.896 1.364 17919 99360 1 242 . 1 1 55 55 THR H H 55 8.730 8.730 8.671 0.059 17919 99361 1 242 . 1 1 56 56 LEU N N 56 117.920 117.920 122.354 -4.434 17919 99362 1 242 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.927 0.133 17919 99363 1 242 . 1 1 56 56 LEU C C 56 180.810 180.810 178.984 1.826 17919 99364 1 242 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.739 -0.029 17919 99365 1 242 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.239 -0.869 17919 99366 1 242 . 1 1 56 56 LEU H H 56 8.140 8.140 8.962 -0.822 17919 99367 1 242 . 1 1 57 57 SER N N 57 113.330 113.330 113.863 -0.533 17919 99368 1 242 . 1 1 57 57 SER HA H 57 4.370 4.370 4.137 0.233 17919 99369 1 242 . 1 1 57 57 SER C C 57 178.310 178.310 177.184 1.126 17919 99370 1 242 . 1 1 57 57 SER CA C 57 61.080 61.080 61.511 -0.431 17919 99371 1 242 . 1 1 57 57 SER CB C 57 62.530 62.530 62.553 -0.023 17919 99372 1 242 . 1 1 57 57 SER H H 57 8.470 8.470 8.500 -0.030 17919 99373 1 242 . 1 1 58 58 ASP N N 58 124.190 124.190 122.621 1.569 17919 99374 1 242 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.357 -0.061 17919 99375 1 242 . 1 1 58 58 ASP C C 58 177.400 177.400 176.803 0.597 17919 99376 1 242 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.495 0.685 17919 99377 1 242 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.438 -0.339 17919 99378 1 242 . 1 1 58 58 ASP H H 58 7.930 7.930 8.253 -0.323 17919 99379 1 242 . 1 1 59 59 TYR N N 59 115.510 115.510 116.237 -0.727 17919 99380 1 242 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.499 0.171 17919 99381 1 242 . 1 1 59 59 TYR C C 59 174.700 174.700 174.794 -0.094 17919 99382 1 242 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.420 0.830 17919 99383 1 242 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.467 1.603 17919 99384 1 242 . 1 1 59 59 TYR H H 59 7.250 7.250 7.083 0.167 17919 99385 1 242 . 1 1 60 60 ASN N N 60 115.900 115.900 114.924 0.976 17919 99386 1 242 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.284 0.071 17919 99387 1 242 . 1 1 60 60 ASN C C 60 174.340 174.340 174.423 -0.083 17919 99388 1 242 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.100 0.020 17919 99389 1 242 . 1 1 60 60 ASN CB C 60 37.410 37.410 36.603 0.807 17919 99390 1 242 . 1 1 60 60 ASN H H 60 8.150 8.150 7.697 0.453 17919 99391 1 242 . 1 1 61 61 ILE N N 61 118.600 118.600 119.909 -1.309 17919 99392 1 242 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.724 -0.331 17919 99393 1 242 . 1 1 61 61 ILE C C 61 174.610 174.610 175.294 -0.684 17919 99394 1 242 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.723 0.697 17919 99395 1 242 . 1 1 61 61 ILE CB C 61 36.740 36.740 38.153 -1.413 17919 99396 1 242 . 1 1 61 61 ILE H H 61 7.250 7.250 7.877 -0.626 17919 99397 1 242 . 1 1 62 62 GLN N N 62 124.740 124.740 124.921 -0.181 17919 99398 1 242 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.801 -0.295 17919 99399 1 242 . 1 1 62 62 GLN C C 62 175.970 175.970 176.010 -0.040 17919 99400 1 242 . 1 1 62 62 GLN CA C 62 53.660 53.660 52.668 0.992 17919 99401 1 242 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.451 0.199 17919 99402 1 242 . 1 1 62 62 GLN H H 62 7.610 7.610 8.026 -0.416 17919 99403 1 242 . 1 1 63 63 LYS N N 63 120.300 120.300 121.318 -1.018 17919 99404 1 242 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.239 -0.238 17919 99405 1 242 . 1 1 63 63 LYS C C 63 175.810 175.810 176.942 -1.132 17919 99406 1 242 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.696 0.094 17919 99407 1 242 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.167 0.483 17919 99408 1 242 . 1 1 63 63 LYS H H 63 8.490 8.490 8.635 -0.145 17919 99409 1 242 . 1 1 64 64 GLU N N 64 113.950 113.950 118.916 -4.966 17919 99410 1 242 . 1 1 64 64 GLU HA H 64 3.465 3.465 4.089 -0.624 17919 99411 1 242 . 1 1 64 64 GLU C C 64 175.250 175.250 176.346 -1.096 17919 99412 1 242 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.360 0.530 17919 99413 1 242 . 1 1 64 64 GLU CB C 64 25.900 25.900 27.644 -1.744 17919 99414 1 242 . 1 1 64 64 GLU H H 64 9.280 9.280 8.740 0.540 17919 99415 1 242 . 1 1 65 65 SER N N 65 114.730 114.730 116.370 -1.640 17919 99416 1 242 . 1 1 65 65 SER HA H 65 4.640 4.640 4.599 0.041 17919 99417 1 242 . 1 1 65 65 SER C C 65 172.160 172.160 174.015 -1.855 17919 99418 1 242 . 1 1 65 65 SER CA C 65 60.890 60.890 60.046 0.844 17919 99419 1 242 . 1 1 65 65 SER CB C 65 64.910 64.910 64.277 0.633 17919 99420 1 242 . 1 1 65 65 SER H H 65 7.670 7.670 7.672 -0.002 17919 99421 1 242 . 1 1 66 66 THR N N 66 117.110 117.110 119.707 -2.597 17919 99422 1 242 . 1 1 66 66 THR HA H 66 5.270 5.270 5.149 0.121 17919 99423 1 242 . 1 1 66 66 THR C C 66 173.950 173.950 174.247 -0.297 17919 99424 1 242 . 1 1 66 66 THR CA C 66 62.340 62.340 61.627 0.713 17919 99425 1 242 . 1 1 66 66 THR CB C 66 70.080 70.080 70.275 -0.195 17919 99426 1 242 . 1 1 66 66 THR H H 66 8.730 8.730 8.512 0.218 17919 99427 1 242 . 1 1 67 67 LEU N N 67 127.110 127.110 128.255 -1.145 17919 99428 1 242 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.759 0.301 17919 99429 1 242 . 1 1 67 67 LEU C C 67 175.770 175.770 175.858 -0.088 17919 99430 1 242 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.410 -0.510 17919 99431 1 242 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.428 0.832 17919 99432 1 242 . 1 1 67 67 LEU H H 67 9.410 9.410 9.097 0.313 17919 99433 1 242 . 1 1 68 68 HIS N N 68 118.380 118.380 119.240 -0.860 17919 99434 1 242 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.377 -0.137 17919 99435 1 242 . 1 1 68 68 HIS C C 68 173.150 173.150 174.084 -0.934 17919 99436 1 242 . 1 1 68 68 HIS CA C 68 55.000 55.000 55.107 -0.107 17919 99437 1 242 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.435 -1.905 17919 99438 1 242 . 1 1 68 68 HIS H H 68 9.230 9.230 8.726 0.504 17919 99439 1 242 . 1 1 69 69 LEU N N 69 124.460 124.460 126.949 -2.489 17919 99440 1 242 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.013 0.177 17919 99441 1 242 . 1 1 69 69 LEU C C 69 175.270 175.270 174.557 0.713 17919 99442 1 242 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.615 0.275 17919 99443 1 242 . 1 1 69 69 LEU CB C 69 44.380 44.380 43.818 0.562 17919 99444 1 242 . 1 1 69 69 LEU H H 69 8.340 8.340 9.052 -0.712 17919 99445 1 242 . 1 1 70 70 VAL N N 70 126.940 126.940 123.536 3.404 17919 99446 1 242 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.698 -0.348 17919 99447 1 242 . 1 1 70 70 VAL C C 70 174.000 174.000 173.568 0.432 17919 99448 1 242 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.803 0.997 17919 99449 1 242 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.504 -0.594 17919 99450 1 242 . 1 1 70 70 VAL H H 70 9.200 9.200 8.957 0.243 17919 99451 1 242 . 1 1 71 71 LEU N N 71 123.130 123.130 124.537 -1.407 17919 99452 1 242 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.978 0.082 17919 99453 1 242 . 1 1 71 71 LEU C C 71 177.830 177.830 177.815 0.015 17919 99454 1 242 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.508 0.432 17919 99455 1 242 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.756 -0.906 17919 99456 1 242 . 1 1 71 71 LEU H H 71 8.120 8.120 8.394 -0.274 17919 99457 1 242 . 1 1 72 72 ARG N N 72 123.490 123.490 123.222 0.268 17919 99458 1 242 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.334 -0.033 17919 99459 1 242 . 1 1 72 72 ARG C C 72 175.350 175.350 177.624 -2.274 17919 99460 1 242 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.875 -0.265 17919 99461 1 242 . 1 1 72 72 ARG CB C 72 31.350 31.350 27.829 3.521 17919 99462 1 242 . 1 1 72 72 ARG H H 72 8.580 8.580 8.790 -0.210 17919 99463 1 243 . 1 1 2 2 GLN N N 2 123.220 123.220 120.285 2.935 17919 99464 1 243 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.249 -0.000 17919 99465 1 243 . 1 1 2 2 GLN C C 2 175.920 175.920 175.284 0.636 17919 99466 1 243 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.754 0.326 17919 99467 1 243 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.174 0.587 17919 99468 1 243 . 1 1 2 2 GLN H H 2 8.900 8.900 8.346 0.554 17919 99469 1 243 . 1 1 3 3 ILE N N 3 115.340 115.340 115.959 -0.619 17919 99470 1 243 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.275 -0.062 17919 99471 1 243 . 1 1 3 3 ILE C C 3 172.450 172.450 173.583 -1.133 17919 99472 1 243 . 1 1 3 3 ILE CA C 3 59.570 59.570 58.328 1.242 17919 99473 1 243 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.577 0.633 17919 99474 1 243 . 1 1 3 3 ILE H H 3 8.320 8.320 8.847 -0.527 17919 99475 1 243 . 1 1 4 4 PHE N N 4 118.110 118.110 119.032 -0.922 17919 99476 1 243 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.473 0.157 17919 99477 1 243 . 1 1 4 4 PHE C C 4 175.320 175.320 174.924 0.396 17919 99478 1 243 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.276 -0.066 17919 99479 1 243 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.046 -0.566 17919 99480 1 243 . 1 1 4 4 PHE H H 4 8.610 8.610 8.117 0.493 17919 99481 1 243 . 1 1 5 5 VAL N N 5 121.000 121.000 122.587 -1.587 17919 99482 1 243 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.370 0.355 17919 99483 1 243 . 1 1 5 5 VAL C C 5 174.870 174.870 174.677 0.193 17919 99484 1 243 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.264 -0.644 17919 99485 1 243 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.616 -0.386 17919 99486 1 243 . 1 1 5 5 VAL H H 5 9.300 9.300 9.342 -0.042 17919 99487 1 243 . 1 1 6 6 LYS N N 6 127.520 127.520 130.213 -2.693 17919 99488 1 243 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.097 0.270 17919 99489 1 243 . 1 1 6 6 LYS C C 6 177.140 177.140 176.114 1.026 17919 99490 1 243 . 1 1 6 6 LYS CA C 6 54.520 54.520 55.104 -0.584 17919 99491 1 243 . 1 1 6 6 LYS CB C 6 35.050 35.050 33.657 1.393 17919 99492 1 243 . 1 1 6 6 LYS H H 6 8.820 8.820 8.537 0.283 17919 99493 1 243 . 1 1 7 7 THR N N 7 115.400 115.400 118.780 -3.380 17919 99494 1 243 . 1 1 7 7 THR HA H 7 4.970 4.970 4.752 0.218 17919 99495 1 243 . 1 1 7 7 THR C C 7 176.910 176.910 176.189 0.721 17919 99496 1 243 . 1 1 7 7 THR CA C 7 60.470 60.470 59.102 1.368 17919 99497 1 243 . 1 1 7 7 THR CB C 7 70.630 70.630 71.325 -0.695 17919 99498 1 243 . 1 1 7 7 THR H H 7 8.730 8.730 8.754 -0.024 17919 99499 1 243 . 1 1 8 8 LEU N N 8 121.330 121.330 121.993 -0.663 17919 99500 1 243 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.043 0.267 17919 99501 1 243 . 1 1 8 8 LEU C C 8 178.800 178.800 178.620 0.180 17919 99502 1 243 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.911 -0.331 17919 99503 1 243 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.378 0.592 17919 99504 1 243 . 1 1 8 8 LEU H H 8 9.100 9.100 8.851 0.249 17919 99505 1 243 . 1 1 9 9 THR N N 9 105.590 105.590 107.296 -1.706 17919 99506 1 243 . 1 1 9 9 THR HA H 9 4.428 4.428 4.214 0.214 17919 99507 1 243 . 1 1 9 9 THR C C 9 175.520 175.520 175.758 -0.238 17919 99508 1 243 . 1 1 9 9 THR CA C 9 61.400 61.400 62.623 -1.223 17919 99509 1 243 . 1 1 9 9 THR CB C 9 69.140 69.140 68.251 0.889 17919 99510 1 243 . 1 1 9 9 THR H H 9 7.630 7.630 7.875 -0.245 17919 99511 1 243 . 1 1 10 10 GLY N N 10 108.890 108.890 111.132 -2.242 17919 99512 1 243 . 1 1 10 10 GLY C C 10 174.070 174.070 173.581 0.489 17919 99513 1 243 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.921 0.539 17919 99514 1 243 . 1 1 10 10 GLY H H 10 7.810 7.810 8.366 -0.556 17919 99515 1 243 . 1 1 11 11 LYS N N 11 121.600 121.600 121.767 -0.167 17919 99516 1 243 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.606 -0.245 17919 99517 1 243 . 1 1 11 11 LYS C C 11 175.940 175.940 175.089 0.851 17919 99518 1 243 . 1 1 11 11 LYS CA C 11 56.280 56.280 55.572 0.708 17919 99519 1 243 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.440 -0.239 17919 99520 1 243 . 1 1 11 11 LYS H H 11 7.280 7.280 7.651 -0.371 17919 99521 1 243 . 1 1 12 12 THR N N 12 120.440 120.440 117.229 3.211 17919 99522 1 243 . 1 1 12 12 THR HA H 12 5.046 5.046 4.973 0.073 17919 99523 1 243 . 1 1 12 12 THR C C 12 174.320 174.320 174.320 0.000 17919 99524 1 243 . 1 1 12 12 THR CA C 12 62.390 62.390 62.029 0.361 17919 99525 1 243 . 1 1 12 12 THR CB C 12 69.910 69.910 69.732 0.178 17919 99526 1 243 . 1 1 12 12 THR H H 12 8.650 8.650 8.209 0.441 17919 99527 1 243 . 1 1 13 13 ILE N N 13 127.110 127.110 122.587 4.523 17919 99528 1 243 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.720 -0.176 17919 99529 1 243 . 1 1 13 13 ILE C C 13 175.220 175.220 174.566 0.654 17919 99530 1 243 . 1 1 13 13 ILE CA C 13 59.980 59.980 58.956 1.024 17919 99531 1 243 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.536 -0.586 17919 99532 1 243 . 1 1 13 13 ILE H H 13 9.450 9.450 9.039 0.411 17919 99533 1 243 . 1 1 14 14 THR N N 14 121.520 121.520 123.779 -2.259 17919 99534 1 243 . 1 1 14 14 THR HA H 14 4.964 4.964 5.097 -0.133 17919 99535 1 243 . 1 1 14 14 THR C C 14 173.790 173.790 174.052 -0.262 17919 99536 1 243 . 1 1 14 14 THR CA C 14 61.940 61.940 62.486 -0.546 17919 99537 1 243 . 1 1 14 14 THR CB C 14 69.650 69.650 69.645 0.005 17919 99538 1 243 . 1 1 14 14 THR H H 14 8.710 8.710 8.508 0.202 17919 99539 1 243 . 1 1 15 15 LEU N N 15 124.800 124.800 126.480 -1.680 17919 99540 1 243 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.783 -0.003 17919 99541 1 243 . 1 1 15 15 LEU C C 15 174.670 174.670 175.449 -0.779 17919 99542 1 243 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.133 -0.303 17919 99543 1 243 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.766 1.304 17919 99544 1 243 . 1 1 15 15 LEU H H 15 8.710 8.710 8.653 0.057 17919 99545 1 243 . 1 1 16 16 GLU N N 16 122.160 122.160 120.823 1.337 17919 99546 1 243 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.407 -0.490 17919 99547 1 243 . 1 1 16 16 GLU C C 16 175.860 175.860 175.997 -0.137 17919 99548 1 243 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.195 -0.375 17919 99549 1 243 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.811 -1.361 17919 99550 1 243 . 1 1 16 16 GLU H H 16 8.140 8.140 8.627 -0.487 17919 99551 1 243 . 1 1 17 17 VAL N N 17 117.210 117.210 118.316 -1.106 17919 99552 1 243 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.957 -0.243 17919 99553 1 243 . 1 1 17 17 VAL C C 17 174.160 174.160 174.855 -0.695 17919 99554 1 243 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.900 -0.470 17919 99555 1 243 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.613 0.787 17919 99556 1 243 . 1 1 17 17 VAL H H 17 8.900 8.900 8.832 0.068 17919 99557 1 243 . 1 1 18 18 GLU N N 18 118.990 118.990 122.192 -3.202 17919 99558 1 243 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.689 0.390 17919 99559 1 243 . 1 1 18 18 GLU C C 18 176.160 176.160 175.476 0.684 17919 99560 1 243 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.923 -0.203 17919 99561 1 243 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.224 0.086 17919 99562 1 243 . 1 1 18 18 GLU H H 18 8.640 8.640 8.492 0.148 17919 99563 1 243 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.409 -0.268 17919 99564 1 243 . 1 1 19 19 PRO C C 19 175.310 175.310 177.600 -2.290 17919 99565 1 243 . 1 1 19 19 PRO CA C 19 65.470 65.470 64.945 0.525 17919 99566 1 243 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.041 -0.091 17919 99567 1 243 . 1 1 20 20 SER N N 20 103.400 103.400 114.060 -10.660 17919 99568 1 243 . 1 1 20 20 SER HA H 20 4.370 4.370 4.399 -0.029 17919 99569 1 243 . 1 1 20 20 SER C C 20 174.660 174.660 174.188 0.472 17919 99570 1 243 . 1 1 20 20 SER CA C 20 57.400 57.400 59.147 -1.747 17919 99571 1 243 . 1 1 20 20 SER CB C 20 63.370 63.370 62.971 0.399 17919 99572 1 243 . 1 1 20 20 SER H H 20 7.040 7.040 8.372 -1.332 17919 99573 1 243 . 1 1 21 21 ASP N N 21 123.480 123.480 123.213 0.267 17919 99574 1 243 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.556 0.139 17919 99575 1 243 . 1 1 21 21 ASP C C 21 176.360 176.360 175.893 0.467 17919 99576 1 243 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.663 0.037 17919 99577 1 243 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.339 -0.539 17919 99578 1 243 . 1 1 21 21 ASP H H 21 8.030 8.030 7.510 0.520 17919 99579 1 243 . 1 1 22 22 THR N N 22 108.800 108.800 113.592 -4.792 17919 99580 1 243 . 1 1 22 22 THR HA H 22 4.920 4.920 4.699 0.221 17919 99581 1 243 . 1 1 22 22 THR C C 22 176.750 176.750 176.191 0.559 17919 99582 1 243 . 1 1 22 22 THR CA C 22 59.690 59.690 61.382 -1.692 17919 99583 1 243 . 1 1 22 22 THR CB C 22 71.200 71.200 70.395 0.805 17919 99584 1 243 . 1 1 22 22 THR H H 22 7.900 7.900 8.430 -0.530 17919 99585 1 243 . 1 1 23 23 ILE N N 23 121.190 121.190 122.748 -1.558 17919 99586 1 243 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.711 -0.054 17919 99587 1 243 . 1 1 23 23 ILE C C 23 179.040 179.040 177.730 1.310 17919 99588 1 243 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.139 -0.879 17919 99589 1 243 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.411 -2.061 17919 99590 1 243 . 1 1 23 23 ILE H H 23 8.560 8.560 8.639 -0.079 17919 99591 1 243 . 1 1 24 24 GLU N N 24 120.830 120.830 120.483 0.347 17919 99592 1 243 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.872 0.045 17919 99593 1 243 . 1 1 24 24 GLU C C 24 178.640 178.640 178.399 0.241 17919 99594 1 243 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.129 0.091 17919 99595 1 243 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.374 -1.094 17919 99596 1 243 . 1 1 24 24 GLU H H 24 9.760 9.760 7.909 1.851 17919 99597 1 243 . 1 1 25 25 ASN N N 25 120.570 120.570 117.657 2.913 17919 99598 1 243 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.427 0.098 17919 99599 1 243 . 1 1 25 25 ASN C C 25 178.380 178.380 178.037 0.343 17919 99600 1 243 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.910 0.151 17919 99601 1 243 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.410 0.040 17919 99602 1 243 . 1 1 25 25 ASN H H 25 7.920 7.920 7.717 0.203 17919 99603 1 243 . 1 1 26 26 VAL N N 26 121.710 121.710 120.059 1.651 17919 99604 1 243 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.663 -0.266 17919 99605 1 243 . 1 1 26 26 VAL C C 26 177.950 177.950 177.370 0.580 17919 99606 1 243 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.262 1.398 17919 99607 1 243 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.500 -0.660 17919 99608 1 243 . 1 1 26 26 VAL H H 26 8.070 8.070 7.495 0.575 17919 99609 1 243 . 1 1 27 27 LYS N N 27 118.860 118.860 120.147 -1.287 17919 99610 1 243 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.267 0.313 17919 99611 1 243 . 1 1 27 27 LYS C C 27 180.550 180.550 178.833 1.717 17919 99612 1 243 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.266 -0.015 17919 99613 1 243 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.203 1.527 17919 99614 1 243 . 1 1 27 27 LYS H H 27 8.560 8.560 8.138 0.422 17919 99615 1 243 . 1 1 28 28 ALA N N 28 123.440 123.440 122.451 0.989 17919 99616 1 243 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.204 -0.044 17919 99617 1 243 . 1 1 28 28 ALA C C 28 180.300 180.300 178.976 1.324 17919 99618 1 243 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.036 0.334 17919 99619 1 243 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.751 -1.041 17919 99620 1 243 . 1 1 28 28 ALA H H 28 8.060 8.060 8.075 -0.015 17919 99621 1 243 . 1 1 29 29 LYS N N 29 119.940 119.940 118.370 1.570 17919 99622 1 243 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.058 0.149 17919 99623 1 243 . 1 1 29 29 LYS C C 29 180.320 180.320 178.343 1.977 17919 99624 1 243 . 1 1 29 29 LYS CA C 29 59.650 59.650 58.973 0.677 17919 99625 1 243 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.267 1.023 17919 99626 1 243 . 1 1 29 29 LYS H H 29 7.850 7.850 7.316 0.534 17919 99627 1 243 . 1 1 30 30 ILE N N 30 121.080 121.080 119.593 1.487 17919 99628 1 243 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.687 -0.180 17919 99629 1 243 . 1 1 30 30 ILE C C 30 178.310 178.310 177.052 1.258 17919 99630 1 243 . 1 1 30 30 ILE CA C 30 66.150 66.150 64.797 1.353 17919 99631 1 243 . 1 1 30 30 ILE CB C 30 36.800 36.800 38.196 -1.396 17919 99632 1 243 . 1 1 30 30 ILE H H 30 8.280 8.280 7.890 0.390 17919 99633 1 243 . 1 1 31 31 GLN N N 31 123.490 123.490 120.781 2.709 17919 99634 1 243 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.853 -0.024 17919 99635 1 243 . 1 1 31 31 GLN C C 31 178.890 178.890 178.225 0.665 17919 99636 1 243 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.411 0.589 17919 99637 1 243 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.412 -0.692 17919 99638 1 243 . 1 1 31 31 GLN H H 31 8.580 8.580 7.879 0.701 17919 99639 1 243 . 1 1 32 32 ASP N N 32 119.360 119.360 117.554 1.806 17919 99640 1 243 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.480 -0.126 17919 99641 1 243 . 1 1 32 32 ASP C C 32 177.250 177.250 177.174 0.076 17919 99642 1 243 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.089 1.101 17919 99643 1 243 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.639 -0.059 17919 99644 1 243 . 1 1 32 32 ASP H H 32 8.010 8.010 7.860 0.150 17919 99645 1 243 . 1 1 33 33 LYS N N 33 115.130 115.130 116.914 -1.784 17919 99646 1 243 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.486 -0.149 17919 99647 1 243 . 1 1 33 33 LYS C C 33 177.870 177.870 177.699 0.171 17919 99648 1 243 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.487 0.563 17919 99649 1 243 . 1 1 33 33 LYS CB C 33 34.170 34.170 34.425 -0.255 17919 99650 1 243 . 1 1 33 33 LYS H H 33 7.430 7.430 7.539 -0.109 17919 99651 1 243 . 1 1 34 34 GLU N N 34 113.870 113.870 116.207 -2.337 17919 99652 1 243 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.436 0.189 17919 99653 1 243 . 1 1 34 34 GLU C C 34 177.840 177.840 177.442 0.398 17919 99654 1 243 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.398 -1.228 17919 99655 1 243 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.849 0.811 17919 99656 1 243 . 1 1 34 34 GLU H H 34 8.740 8.740 8.269 0.471 17919 99657 1 243 . 1 1 35 35 GLY N N 35 108.650 108.650 109.863 -1.213 17919 99658 1 243 . 1 1 35 35 GLY C C 35 173.960 173.960 174.177 -0.217 17919 99659 1 243 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.433 0.647 17919 99660 1 243 . 1 1 35 35 GLY H H 35 8.530 8.530 8.459 0.071 17919 99661 1 243 . 1 1 36 36 ILE N N 36 119.880 119.880 117.516 2.364 17919 99662 1 243 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.585 -0.140 17919 99663 1 243 . 1 1 36 36 ILE C C 36 173.590 173.590 174.021 -0.431 17919 99664 1 243 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.499 0.251 17919 99665 1 243 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.735 1.845 17919 99666 1 243 . 1 1 36 36 ILE H H 36 6.150 6.150 7.523 -1.373 17919 99667 1 243 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.604 0.030 17919 99668 1 243 . 1 1 37 37 PRO C C 37 176.940 176.940 176.189 0.751 17919 99669 1 243 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.584 0.076 17919 99670 1 243 . 1 1 37 37 PRO CB C 37 31.850 31.850 30.879 0.971 17919 99671 1 243 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.073 0.044 17919 99672 1 243 . 1 1 38 38 PRO C C 38 178.320 178.320 178.701 -0.381 17919 99673 1 243 . 1 1 38 38 PRO CA C 38 66.260 66.260 66.087 0.173 17919 99674 1 243 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.872 1.018 17919 99675 1 243 . 1 1 39 39 ASP N N 39 113.380 113.380 114.604 -1.224 17919 99676 1 243 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.369 0.061 17919 99677 1 243 . 1 1 39 39 ASP C C 39 177.090 177.090 176.803 0.287 17919 99678 1 243 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.169 -0.529 17919 99679 1 243 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.352 -0.812 17919 99680 1 243 . 1 1 39 39 ASP H H 39 8.550 8.550 8.507 0.043 17919 99681 1 243 . 1 1 40 40 GLN N N 40 116.780 116.780 115.503 1.277 17919 99682 1 243 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.394 0.070 17919 99683 1 243 . 1 1 40 40 GLN C C 40 175.380 175.380 175.772 -0.392 17919 99684 1 243 . 1 1 40 40 GLN CA C 40 55.640 55.640 54.981 0.659 17919 99685 1 243 . 1 1 40 40 GLN CB C 40 30.140 30.140 28.980 1.160 17919 99686 1 243 . 1 1 40 40 GLN H H 40 7.820 7.820 7.664 0.156 17919 99687 1 243 . 1 1 41 41 GLN N N 41 117.720 117.720 119.440 -1.720 17919 99688 1 243 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.539 -0.295 17919 99689 1 243 . 1 1 41 41 GLN C C 41 176.300 176.300 175.313 0.987 17919 99690 1 243 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.521 0.949 17919 99691 1 243 . 1 1 41 41 GLN CB C 41 31.650 31.650 30.102 1.548 17919 99692 1 243 . 1 1 41 41 GLN H H 41 7.480 7.480 7.540 -0.060 17919 99693 1 243 . 1 1 42 42 ARG N N 42 122.680 122.680 124.287 -1.607 17919 99694 1 243 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.608 -0.108 17919 99695 1 243 . 1 1 42 42 ARG C C 42 174.050 174.050 174.633 -0.583 17919 99696 1 243 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.795 0.255 17919 99697 1 243 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.030 -1.280 17919 99698 1 243 . 1 1 42 42 ARG H H 42 8.530 8.530 9.017 -0.487 17919 99699 1 243 . 1 1 43 43 LEU N N 43 124.040 124.040 124.130 -0.090 17919 99700 1 243 . 1 1 43 43 LEU C C 43 175.290 175.290 175.488 -0.198 17919 99701 1 243 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.460 -0.480 17919 99702 1 243 . 1 1 43 43 LEU CB C 43 45.790 45.790 45.019 0.771 17919 99703 1 243 . 1 1 43 43 LEU H H 43 8.820 8.820 8.735 0.085 17919 99704 1 243 . 1 1 44 44 ILE N N 44 121.920 121.920 120.983 0.937 17919 99705 1 243 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.437 -0.445 17919 99706 1 243 . 1 1 44 44 ILE C C 44 176.060 176.060 174.656 1.404 17919 99707 1 243 . 1 1 44 44 ILE CA C 44 58.980 58.980 58.455 0.525 17919 99708 1 243 . 1 1 44 44 ILE CB C 44 41.420 41.420 40.540 0.880 17919 99709 1 243 . 1 1 44 44 ILE H H 44 9.030 9.030 8.754 0.276 17919 99710 1 243 . 1 1 45 45 PHE N N 45 125.390 125.390 126.282 -0.892 17919 99711 1 243 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.905 0.140 17919 99712 1 243 . 1 1 45 45 PHE C C 45 174.470 174.470 174.144 0.326 17919 99713 1 243 . 1 1 45 45 PHE CA C 45 57.020 57.020 57.408 -0.388 17919 99714 1 243 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.885 0.875 17919 99715 1 243 . 1 1 45 45 PHE H H 45 8.830 8.830 8.958 -0.128 17919 99716 1 243 . 1 1 46 46 ALA N N 46 132.200 132.200 129.294 2.906 17919 99717 1 243 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.674 0.016 17919 99718 1 243 . 1 1 46 46 ALA C C 46 177.290 177.290 177.732 -0.442 17919 99719 1 243 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.651 -0.111 17919 99720 1 243 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.733 -0.163 17919 99721 1 243 . 1 1 46 46 ALA H H 46 8.810 8.810 8.806 0.004 17919 99722 1 243 . 1 1 47 47 GLY N N 47 102.340 102.340 104.168 -1.828 17919 99723 1 243 . 1 1 47 47 GLY C C 47 173.810 173.810 174.422 -0.612 17919 99724 1 243 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.855 0.495 17919 99725 1 243 . 1 1 47 47 GLY H H 47 8.130 8.130 8.398 -0.268 17919 99726 1 243 . 1 1 48 48 LYS N N 48 121.570 121.570 122.472 -0.902 17919 99727 1 243 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.573 0.049 17919 99728 1 243 . 1 1 48 48 LYS C C 48 174.700 174.700 175.277 -0.577 17919 99729 1 243 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.420 -0.870 17919 99730 1 243 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.228 0.302 17919 99731 1 243 . 1 1 48 48 LYS H H 48 7.980 7.980 7.773 0.207 17919 99732 1 243 . 1 1 49 49 GLN N N 49 122.410 122.410 124.700 -2.290 17919 99733 1 243 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.719 -0.159 17919 99734 1 243 . 1 1 49 49 GLN C C 49 175.670 175.670 175.157 0.513 17919 99735 1 243 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.843 -0.103 17919 99736 1 243 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.927 -0.927 17919 99737 1 243 . 1 1 49 49 GLN H H 49 8.600 8.600 8.667 -0.067 17919 99738 1 243 . 1 1 50 50 LEU N N 50 125.520 125.520 127.803 -2.283 17919 99739 1 243 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.082 0.008 17919 99740 1 243 . 1 1 50 50 LEU C C 50 176.660 176.660 175.863 0.797 17919 99741 1 243 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.647 0.593 17919 99742 1 243 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.176 0.394 17919 99743 1 243 . 1 1 50 50 LEU H H 50 8.530 8.530 8.489 0.041 17919 99744 1 243 . 1 1 51 51 GLU N N 51 122.940 122.940 124.779 -1.839 17919 99745 1 243 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.499 -0.011 17919 99746 1 243 . 1 1 51 51 GLU C C 51 175.870 175.870 176.664 -0.794 17919 99747 1 243 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.469 0.490 17919 99748 1 243 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.346 0.224 17919 99749 1 243 . 1 1 51 51 GLU H H 51 8.400 8.400 8.912 -0.512 17919 99750 1 243 . 1 1 52 52 ASP N N 52 120.030 120.030 122.251 -2.221 17919 99751 1 243 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.521 -0.162 17919 99752 1 243 . 1 1 52 52 ASP C C 52 177.330 177.330 177.662 -0.332 17919 99753 1 243 . 1 1 52 52 ASP CA C 52 56.960 56.960 56.895 0.065 17919 99754 1 243 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.788 0.062 17919 99755 1 243 . 1 1 52 52 ASP H H 52 8.160 8.160 8.782 -0.622 17919 99756 1 243 . 1 1 53 53 GLY N N 53 106.660 106.660 105.362 1.298 17919 99757 1 243 . 1 1 53 53 GLY C C 53 174.870 174.870 174.363 0.507 17919 99758 1 243 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.866 0.304 17919 99759 1 243 . 1 1 53 53 GLY H H 53 9.390 9.390 8.568 0.822 17919 99760 1 243 . 1 1 54 54 ARG N N 54 119.050 119.050 120.593 -1.543 17919 99761 1 243 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.809 -0.114 17919 99762 1 243 . 1 1 54 54 ARG C C 54 175.350 175.350 175.332 0.018 17919 99763 1 243 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.229 0.161 17919 99764 1 243 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.915 -0.265 17919 99765 1 243 . 1 1 54 54 ARG H H 54 7.460 7.460 7.415 0.045 17919 99766 1 243 . 1 1 55 55 THR N N 55 108.400 108.400 112.353 -3.953 17919 99767 1 243 . 1 1 55 55 THR HA H 55 5.240 5.240 5.157 0.083 17919 99768 1 243 . 1 1 55 55 THR C C 55 176.560 176.560 176.419 0.141 17919 99769 1 243 . 1 1 55 55 THR CA C 55 59.690 59.690 59.912 -0.222 17919 99770 1 243 . 1 1 55 55 THR CB C 55 72.260 72.260 71.046 1.214 17919 99771 1 243 . 1 1 55 55 THR H H 55 8.730 8.730 9.036 -0.306 17919 99772 1 243 . 1 1 56 56 LEU N N 56 117.920 117.920 123.010 -5.090 17919 99773 1 243 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.791 0.269 17919 99774 1 243 . 1 1 56 56 LEU C C 56 180.810 180.810 178.951 1.859 17919 99775 1 243 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.710 -0.000 17919 99776 1 243 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.297 -0.927 17919 99777 1 243 . 1 1 56 56 LEU H H 56 8.140 8.140 8.424 -0.284 17919 99778 1 243 . 1 1 57 57 SER N N 57 113.330 113.330 114.626 -1.296 17919 99779 1 243 . 1 1 57 57 SER HA H 57 4.370 4.370 4.180 0.190 17919 99780 1 243 . 1 1 57 57 SER C C 57 178.310 178.310 176.996 1.314 17919 99781 1 243 . 1 1 57 57 SER CA C 57 61.080 61.080 62.088 -1.008 17919 99782 1 243 . 1 1 57 57 SER CB C 57 62.530 62.530 62.693 -0.163 17919 99783 1 243 . 1 1 57 57 SER H H 57 8.470 8.470 8.178 0.292 17919 99784 1 243 . 1 1 58 58 ASP N N 58 124.190 124.190 122.780 1.410 17919 99785 1 243 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.312 -0.016 17919 99786 1 243 . 1 1 58 58 ASP C C 58 177.400 177.400 177.359 0.041 17919 99787 1 243 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.828 0.352 17919 99788 1 243 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.460 -0.360 17919 99789 1 243 . 1 1 58 58 ASP H H 58 7.930 7.930 7.770 0.160 17919 99790 1 243 . 1 1 59 59 TYR N N 59 115.510 115.510 115.284 0.226 17919 99791 1 243 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.589 0.081 17919 99792 1 243 . 1 1 59 59 TYR C C 59 174.700 174.700 175.297 -0.597 17919 99793 1 243 . 1 1 59 59 TYR CA C 59 58.250 58.250 58.089 0.161 17919 99794 1 243 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.758 1.312 17919 99795 1 243 . 1 1 59 59 TYR H H 59 7.250 7.250 7.444 -0.194 17919 99796 1 243 . 1 1 60 60 ASN N N 60 115.900 115.900 117.415 -1.515 17919 99797 1 243 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.459 -0.104 17919 99798 1 243 . 1 1 60 60 ASN C C 60 174.340 174.340 174.115 0.225 17919 99799 1 243 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.106 0.014 17919 99800 1 243 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.603 -0.193 17919 99801 1 243 . 1 1 60 60 ASN H H 60 8.150 8.150 8.018 0.132 17919 99802 1 243 . 1 1 61 61 ILE N N 61 118.600 118.600 120.401 -1.801 17919 99803 1 243 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.989 -0.596 17919 99804 1 243 . 1 1 61 61 ILE C C 61 174.610 174.610 175.266 -0.656 17919 99805 1 243 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.513 0.907 17919 99806 1 243 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.734 -0.994 17919 99807 1 243 . 1 1 61 61 ILE H H 61 7.250 7.250 8.013 -0.763 17919 99808 1 243 . 1 1 62 62 GLN N N 62 124.740 124.740 126.744 -2.004 17919 99809 1 243 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.632 -0.126 17919 99810 1 243 . 1 1 62 62 GLN C C 62 175.970 175.970 176.042 -0.072 17919 99811 1 243 . 1 1 62 62 GLN CA C 62 53.660 53.660 54.511 -0.852 17919 99812 1 243 . 1 1 62 62 GLN CB C 62 31.650 31.650 30.047 1.603 17919 99813 1 243 . 1 1 62 62 GLN H H 62 7.610 7.610 8.118 -0.508 17919 99814 1 243 . 1 1 63 63 LYS N N 63 120.300 120.300 121.110 -0.810 17919 99815 1 243 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.066 -0.065 17919 99816 1 243 . 1 1 63 63 LYS C C 63 175.810 175.810 176.944 -1.134 17919 99817 1 243 . 1 1 63 63 LYS CA C 63 57.790 57.790 56.928 0.862 17919 99818 1 243 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.968 0.682 17919 99819 1 243 . 1 1 63 63 LYS H H 63 8.490 8.490 8.432 0.058 17919 99820 1 243 . 1 1 64 64 GLU N N 64 113.950 113.950 115.407 -1.457 17919 99821 1 243 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.443 0.022 17919 99822 1 243 . 1 1 64 64 GLU C C 64 175.250 175.250 175.781 -0.531 17919 99823 1 243 . 1 1 64 64 GLU CA C 64 57.890 57.890 58.245 -0.355 17919 99824 1 243 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.774 -2.874 17919 99825 1 243 . 1 1 64 64 GLU H H 64 9.280 9.280 8.868 0.412 17919 99826 1 243 . 1 1 65 65 SER N N 65 114.730 114.730 115.743 -1.013 17919 99827 1 243 . 1 1 65 65 SER HA H 65 4.640 4.640 4.461 0.179 17919 99828 1 243 . 1 1 65 65 SER C C 65 172.160 172.160 173.794 -1.634 17919 99829 1 243 . 1 1 65 65 SER CA C 65 60.890 60.890 60.795 0.095 17919 99830 1 243 . 1 1 65 65 SER CB C 65 64.910 64.910 63.792 1.118 17919 99831 1 243 . 1 1 65 65 SER H H 65 7.670 7.670 7.487 0.183 17919 99832 1 243 . 1 1 66 66 THR N N 66 117.110 117.110 118.830 -1.720 17919 99833 1 243 . 1 1 66 66 THR HA H 66 5.270 5.270 5.178 0.092 17919 99834 1 243 . 1 1 66 66 THR C C 66 173.950 173.950 174.310 -0.360 17919 99835 1 243 . 1 1 66 66 THR CA C 66 62.340 62.340 61.649 0.691 17919 99836 1 243 . 1 1 66 66 THR CB C 66 70.080 70.080 69.857 0.223 17919 99837 1 243 . 1 1 66 66 THR H H 66 8.730 8.730 8.309 0.421 17919 99838 1 243 . 1 1 67 67 LEU N N 67 127.110 127.110 127.604 -0.494 17919 99839 1 243 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.749 0.311 17919 99840 1 243 . 1 1 67 67 LEU C C 67 175.770 175.770 176.252 -0.482 17919 99841 1 243 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.572 -0.672 17919 99842 1 243 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.170 1.090 17919 99843 1 243 . 1 1 67 67 LEU H H 67 9.410 9.410 9.039 0.371 17919 99844 1 243 . 1 1 68 68 HIS N N 68 118.380 118.380 120.085 -1.705 17919 99845 1 243 . 1 1 68 68 HIS HA H 68 5.240 5.240 4.897 0.343 17919 99846 1 243 . 1 1 68 68 HIS C C 68 173.150 173.150 173.545 -0.395 17919 99847 1 243 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.602 0.398 17919 99848 1 243 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.564 -2.034 17919 99849 1 243 . 1 1 68 68 HIS H H 68 9.230 9.230 8.497 0.733 17919 99850 1 243 . 1 1 69 69 LEU N N 69 124.460 124.460 130.064 -5.604 17919 99851 1 243 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.025 0.165 17919 99852 1 243 . 1 1 69 69 LEU C C 69 175.270 175.270 174.233 1.037 17919 99853 1 243 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.779 0.111 17919 99854 1 243 . 1 1 69 69 LEU CB C 69 44.380 44.380 43.561 0.819 17919 99855 1 243 . 1 1 69 69 LEU H H 69 8.340 8.340 7.951 0.389 17919 99856 1 243 . 1 1 70 70 VAL N N 70 126.940 126.940 122.310 4.630 17919 99857 1 243 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.516 -0.166 17919 99858 1 243 . 1 1 70 70 VAL C C 70 174.000 174.000 173.630 0.370 17919 99859 1 243 . 1 1 70 70 VAL CA C 70 60.800 60.800 58.930 1.870 17919 99860 1 243 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.392 -0.481 17919 99861 1 243 . 1 1 70 70 VAL H H 70 9.200 9.200 8.830 0.370 17919 99862 1 243 . 1 1 71 71 LEU N N 71 123.130 123.130 121.933 1.197 17919 99863 1 243 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.020 0.040 17919 99864 1 243 . 1 1 71 71 LEU C C 71 177.830 177.830 176.705 1.125 17919 99865 1 243 . 1 1 71 71 LEU CA C 71 53.940 53.940 52.795 1.145 17919 99866 1 243 . 1 1 71 71 LEU CB C 71 42.850 42.850 44.037 -1.187 17919 99867 1 243 . 1 1 71 71 LEU H H 71 8.120 8.120 8.377 -0.257 17919 99868 1 243 . 1 1 72 72 ARG N N 72 123.490 123.490 121.289 2.201 17919 99869 1 243 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.234 0.067 17919 99870 1 243 . 1 1 72 72 ARG C C 72 175.350 175.350 175.507 -0.157 17919 99871 1 243 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.065 -0.455 17919 99872 1 243 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.981 0.369 17919 99873 1 243 . 1 1 72 72 ARG H H 72 8.580 8.580 8.075 0.505 17919 99874 1 244 . 1 1 2 2 GLN N N 2 123.220 123.220 122.547 0.673 17919 99875 1 244 . 1 1 2 2 GLN HA H 2 5.249 5.249 4.955 0.294 17919 99876 1 244 . 1 1 2 2 GLN C C 2 175.920 175.920 174.940 0.980 17919 99877 1 244 . 1 1 2 2 GLN CA C 2 55.080 55.080 55.048 0.032 17919 99878 1 244 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.137 0.624 17919 99879 1 244 . 1 1 2 2 GLN H H 2 8.900 8.900 8.470 0.430 17919 99880 1 244 . 1 1 3 3 ILE N N 3 115.340 115.340 117.273 -1.933 17919 99881 1 244 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.518 -0.305 17919 99882 1 244 . 1 1 3 3 ILE C C 3 172.450 172.450 173.349 -0.899 17919 99883 1 244 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.302 0.268 17919 99884 1 244 . 1 1 3 3 ILE CB C 3 42.210 42.210 42.087 0.123 17919 99885 1 244 . 1 1 3 3 ILE H H 3 8.320 8.320 8.364 -0.044 17919 99886 1 244 . 1 1 4 4 PHE N N 4 118.110 118.110 118.250 -0.140 17919 99887 1 244 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.681 -0.051 17919 99888 1 244 . 1 1 4 4 PHE C C 4 175.320 175.320 175.151 0.169 17919 99889 1 244 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.508 -0.298 17919 99890 1 244 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.389 -0.909 17919 99891 1 244 . 1 1 4 4 PHE H H 4 8.610 8.610 8.472 0.138 17919 99892 1 244 . 1 1 5 5 VAL N N 5 121.000 121.000 121.794 -0.794 17919 99893 1 244 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.948 -0.223 17919 99894 1 244 . 1 1 5 5 VAL C C 5 174.870 174.870 175.385 -0.515 17919 99895 1 244 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.385 -0.765 17919 99896 1 244 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.301 0.929 17919 99897 1 244 . 1 1 5 5 VAL H H 5 9.300 9.300 9.401 -0.101 17919 99898 1 244 . 1 1 6 6 LYS N N 6 127.520 127.520 128.411 -0.891 17919 99899 1 244 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.232 0.135 17919 99900 1 244 . 1 1 6 6 LYS C C 6 177.140 177.140 176.650 0.490 17919 99901 1 244 . 1 1 6 6 LYS CA C 6 54.520 54.520 55.022 -0.502 17919 99902 1 244 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.391 0.659 17919 99903 1 244 . 1 1 6 6 LYS H H 6 8.820 8.820 9.407 -0.587 17919 99904 1 244 . 1 1 7 7 THR N N 7 115.400 115.400 115.742 -0.342 17919 99905 1 244 . 1 1 7 7 THR HA H 7 4.970 4.970 4.889 0.081 17919 99906 1 244 . 1 1 7 7 THR C C 7 176.910 176.910 177.057 -0.147 17919 99907 1 244 . 1 1 7 7 THR CA C 7 60.470 60.470 60.159 0.311 17919 99908 1 244 . 1 1 7 7 THR CB C 7 70.630 70.630 71.245 -0.615 17919 99909 1 244 . 1 1 7 7 THR H H 7 8.730 8.730 8.771 -0.041 17919 99910 1 244 . 1 1 8 8 LEU N N 8 121.330 121.330 118.639 2.691 17919 99911 1 244 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.295 0.015 17919 99912 1 244 . 1 1 8 8 LEU C C 8 178.800 178.800 177.085 1.715 17919 99913 1 244 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.417 0.163 17919 99914 1 244 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.724 0.246 17919 99915 1 244 . 1 1 8 8 LEU H H 8 9.100 9.100 8.694 0.406 17919 99916 1 244 . 1 1 9 9 THR N N 9 105.590 105.590 107.197 -1.607 17919 99917 1 244 . 1 1 9 9 THR HA H 9 4.428 4.428 4.376 0.052 17919 99918 1 244 . 1 1 9 9 THR C C 9 175.520 175.520 175.766 -0.246 17919 99919 1 244 . 1 1 9 9 THR CA C 9 61.400 61.400 61.649 -0.249 17919 99920 1 244 . 1 1 9 9 THR CB C 9 69.140 69.140 69.318 -0.178 17919 99921 1 244 . 1 1 9 9 THR H H 9 7.630 7.630 7.285 0.345 17919 99922 1 244 . 1 1 10 10 GLY N N 10 108.890 108.890 110.899 -2.009 17919 99923 1 244 . 1 1 10 10 GLY C C 10 174.070 174.070 174.237 -0.167 17919 99924 1 244 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.329 0.131 17919 99925 1 244 . 1 1 10 10 GLY H H 10 7.810 7.810 8.085 -0.275 17919 99926 1 244 . 1 1 11 11 LYS N N 11 121.600 121.600 118.584 3.016 17919 99927 1 244 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.817 -0.456 17919 99928 1 244 . 1 1 11 11 LYS C C 11 175.940 175.940 174.569 1.371 17919 99929 1 244 . 1 1 11 11 LYS CA C 11 56.280 56.280 54.086 2.194 17919 99930 1 244 . 1 1 11 11 LYS CB C 11 33.200 33.200 34.309 -1.109 17919 99931 1 244 . 1 1 11 11 LYS H H 11 7.280 7.280 7.635 -0.355 17919 99932 1 244 . 1 1 12 12 THR N N 12 120.440 120.440 117.007 3.433 17919 99933 1 244 . 1 1 12 12 THR HA H 12 5.046 5.046 5.287 -0.241 17919 99934 1 244 . 1 1 12 12 THR C C 12 174.320 174.320 174.146 0.174 17919 99935 1 244 . 1 1 12 12 THR CA C 12 62.390 62.390 61.773 0.617 17919 99936 1 244 . 1 1 12 12 THR CB C 12 69.910 69.910 70.331 -0.421 17919 99937 1 244 . 1 1 12 12 THR H H 12 8.650 8.650 8.374 0.276 17919 99938 1 244 . 1 1 13 13 ILE N N 13 127.110 127.110 128.157 -1.047 17919 99939 1 244 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.517 0.027 17919 99940 1 244 . 1 1 13 13 ILE C C 13 175.220 175.220 175.122 0.098 17919 99941 1 244 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.024 -0.044 17919 99942 1 244 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.733 -0.783 17919 99943 1 244 . 1 1 13 13 ILE H H 13 9.450 9.450 9.281 0.169 17919 99944 1 244 . 1 1 14 14 THR N N 14 121.520 121.520 122.254 -0.734 17919 99945 1 244 . 1 1 14 14 THR HA H 14 4.964 4.964 4.808 0.156 17919 99946 1 244 . 1 1 14 14 THR C C 14 173.790 173.790 174.019 -0.229 17919 99947 1 244 . 1 1 14 14 THR CA C 14 61.940 61.940 62.088 -0.148 17919 99948 1 244 . 1 1 14 14 THR CB C 14 69.650 69.650 69.330 0.320 17919 99949 1 244 . 1 1 14 14 THR H H 14 8.710 8.710 8.585 0.125 17919 99950 1 244 . 1 1 15 15 LEU N N 15 124.800 124.800 128.673 -3.873 17919 99951 1 244 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.599 0.181 17919 99952 1 244 . 1 1 15 15 LEU C C 15 174.670 174.670 175.281 -0.611 17919 99953 1 244 . 1 1 15 15 LEU CA C 15 52.830 52.830 54.079 -1.249 17919 99954 1 244 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.072 1.998 17919 99955 1 244 . 1 1 15 15 LEU H H 15 8.710 8.710 8.410 0.300 17919 99956 1 244 . 1 1 16 16 GLU N N 16 122.160 122.160 125.981 -3.821 17919 99957 1 244 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.478 0.439 17919 99958 1 244 . 1 1 16 16 GLU C C 16 175.860 175.860 175.882 -0.022 17919 99959 1 244 . 1 1 16 16 GLU CA C 16 54.820 54.820 56.213 -1.393 17919 99960 1 244 . 1 1 16 16 GLU CB C 16 29.450 29.450 29.286 0.164 17919 99961 1 244 . 1 1 16 16 GLU H H 16 8.140 8.140 8.745 -0.605 17919 99962 1 244 . 1 1 17 17 VAL N N 17 117.210 117.210 121.028 -3.818 17919 99963 1 244 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.793 -0.079 17919 99964 1 244 . 1 1 17 17 VAL C C 17 174.160 174.160 174.498 -0.338 17919 99965 1 244 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.119 -0.689 17919 99966 1 244 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.688 0.712 17919 99967 1 244 . 1 1 17 17 VAL H H 17 8.900 8.900 9.047 -0.147 17919 99968 1 244 . 1 1 18 18 GLU N N 18 118.990 118.990 121.192 -2.202 17919 99969 1 244 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.854 0.225 17919 99970 1 244 . 1 1 18 18 GLU C C 18 176.160 176.160 175.725 0.435 17919 99971 1 244 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.140 -0.420 17919 99972 1 244 . 1 1 18 18 GLU CB C 18 30.310 30.310 31.178 -0.869 17919 99973 1 244 . 1 1 18 18 GLU H H 18 8.640 8.640 8.616 0.024 17919 99974 1 244 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.228 -0.087 17919 99975 1 244 . 1 1 19 19 PRO C C 19 175.310 175.310 177.655 -2.345 17919 99976 1 244 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.697 -0.227 17919 99977 1 244 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.947 0.003 17919 99978 1 244 . 1 1 20 20 SER N N 20 103.400 103.400 108.290 -4.890 17919 99979 1 244 . 1 1 20 20 SER HA H 20 4.370 4.370 4.327 0.043 17919 99980 1 244 . 1 1 20 20 SER C C 20 174.660 174.660 174.709 -0.049 17919 99981 1 244 . 1 1 20 20 SER CA C 20 57.400 57.400 58.370 -0.970 17919 99982 1 244 . 1 1 20 20 SER CB C 20 63.370 63.370 62.892 0.478 17919 99983 1 244 . 1 1 20 20 SER H H 20 7.040 7.040 8.315 -1.275 17919 99984 1 244 . 1 1 21 21 ASP N N 21 123.480 123.480 123.566 -0.086 17919 99985 1 244 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.775 -0.080 17919 99986 1 244 . 1 1 21 21 ASP C C 21 176.360 176.360 175.476 0.884 17919 99987 1 244 . 1 1 21 21 ASP CA C 21 55.700 55.700 53.776 1.924 17919 99988 1 244 . 1 1 21 21 ASP CB C 21 40.800 40.800 42.731 -1.931 17919 99989 1 244 . 1 1 21 21 ASP H H 21 8.030 8.030 7.843 0.187 17919 99990 1 244 . 1 1 22 22 THR N N 22 108.800 108.800 113.290 -4.490 17919 99991 1 244 . 1 1 22 22 THR HA H 22 4.920 4.920 5.129 -0.209 17919 99992 1 244 . 1 1 22 22 THR C C 22 176.750 176.750 176.048 0.702 17919 99993 1 244 . 1 1 22 22 THR CA C 22 59.690 59.690 60.067 -0.377 17919 99994 1 244 . 1 1 22 22 THR CB C 22 71.200 71.200 71.651 -0.451 17919 99995 1 244 . 1 1 22 22 THR H H 22 7.900 7.900 8.152 -0.252 17919 99996 1 244 . 1 1 23 23 ILE N N 23 121.190 121.190 123.489 -2.299 17919 99997 1 244 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.830 -0.173 17919 99998 1 244 . 1 1 23 23 ILE C C 23 179.040 179.040 177.832 1.208 17919 99999 1 244 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.436 -0.176 17919 100000 1 244 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.323 -1.973 17919 100001 1 244 . 1 1 23 23 ILE H H 23 8.560 8.560 8.602 -0.042 17919 100002 1 244 . 1 1 24 24 GLU N N 24 120.830 120.830 121.298 -0.468 17919 100003 1 244 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.928 -0.011 17919 100004 1 244 . 1 1 24 24 GLU C C 24 178.640 178.640 178.393 0.247 17919 100005 1 244 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.973 0.247 17919 100006 1 244 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.277 -0.997 17919 100007 1 244 . 1 1 24 24 GLU H H 24 9.760 9.760 8.663 1.097 17919 100008 1 244 . 1 1 25 25 ASN N N 25 120.570 120.570 117.355 3.215 17919 100009 1 244 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.566 -0.041 17919 100010 1 244 . 1 1 25 25 ASN C C 25 178.380 178.380 178.008 0.372 17919 100011 1 244 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.513 0.547 17919 100012 1 244 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.521 -0.071 17919 100013 1 244 . 1 1 25 25 ASN H H 25 7.920 7.920 7.635 0.285 17919 100014 1 244 . 1 1 26 26 VAL N N 26 121.710 121.710 120.817 0.893 17919 100015 1 244 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.561 -0.164 17919 100016 1 244 . 1 1 26 26 VAL C C 26 177.950 177.950 177.670 0.280 17919 100017 1 244 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.551 1.109 17919 100018 1 244 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.653 -0.813 17919 100019 1 244 . 1 1 26 26 VAL H H 26 8.070 8.070 8.428 -0.358 17919 100020 1 244 . 1 1 27 27 LYS N N 27 118.860 118.860 119.981 -1.121 17919 100021 1 244 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.229 0.351 17919 100022 1 244 . 1 1 27 27 LYS C C 27 180.550 180.550 178.971 1.579 17919 100023 1 244 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.349 -0.099 17919 100024 1 244 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.478 1.252 17919 100025 1 244 . 1 1 27 27 LYS H H 27 8.560 8.560 8.340 0.220 17919 100026 1 244 . 1 1 28 28 ALA N N 28 123.440 123.440 121.889 1.551 17919 100027 1 244 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.179 -0.019 17919 100028 1 244 . 1 1 28 28 ALA C C 28 180.300 180.300 178.929 1.371 17919 100029 1 244 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.810 0.560 17919 100030 1 244 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.390 -0.680 17919 100031 1 244 . 1 1 28 28 ALA H H 28 8.060 8.060 8.493 -0.433 17919 100032 1 244 . 1 1 29 29 LYS N N 29 119.940 119.940 118.747 1.193 17919 100033 1 244 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.121 0.086 17919 100034 1 244 . 1 1 29 29 LYS C C 29 180.320 180.320 178.777 1.543 17919 100035 1 244 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.119 0.531 17919 100036 1 244 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.396 0.894 17919 100037 1 244 . 1 1 29 29 LYS H H 29 7.850 7.850 7.554 0.296 17919 100038 1 244 . 1 1 30 30 ILE N N 30 121.080 121.080 119.780 1.300 17919 100039 1 244 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.831 -0.324 17919 100040 1 244 . 1 1 30 30 ILE C C 30 178.310 178.310 177.295 1.015 17919 100041 1 244 . 1 1 30 30 ILE CA C 30 66.150 66.150 63.250 2.900 17919 100042 1 244 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.320 -0.520 17919 100043 1 244 . 1 1 30 30 ILE H H 30 8.280 8.280 7.607 0.673 17919 100044 1 244 . 1 1 31 31 GLN N N 31 123.490 123.490 121.085 2.405 17919 100045 1 244 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.900 -0.071 17919 100046 1 244 . 1 1 31 31 GLN C C 31 178.890 178.890 178.217 0.673 17919 100047 1 244 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.673 0.327 17919 100048 1 244 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.399 -0.679 17919 100049 1 244 . 1 1 31 31 GLN H H 31 8.580 8.580 8.001 0.579 17919 100050 1 244 . 1 1 32 32 ASP N N 32 119.360 119.360 118.698 0.662 17919 100051 1 244 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.376 -0.022 17919 100052 1 244 . 1 1 32 32 ASP C C 32 177.250 177.250 177.490 -0.240 17919 100053 1 244 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.627 0.563 17919 100054 1 244 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.798 -0.218 17919 100055 1 244 . 1 1 32 32 ASP H H 32 8.010 8.010 8.235 -0.225 17919 100056 1 244 . 1 1 33 33 LYS N N 33 115.130 115.130 116.545 -1.415 17919 100057 1 244 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.516 -0.179 17919 100058 1 244 . 1 1 33 33 LYS C C 33 177.870 177.870 177.149 0.721 17919 100059 1 244 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.334 0.716 17919 100060 1 244 . 1 1 33 33 LYS CB C 33 34.170 34.170 34.244 -0.074 17919 100061 1 244 . 1 1 33 33 LYS H H 33 7.430 7.430 7.573 -0.143 17919 100062 1 244 . 1 1 34 34 GLU N N 34 113.870 113.870 114.703 -0.833 17919 100063 1 244 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.543 0.082 17919 100064 1 244 . 1 1 34 34 GLU C C 34 177.840 177.840 177.192 0.648 17919 100065 1 244 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.930 -0.760 17919 100066 1 244 . 1 1 34 34 GLU CB C 34 32.660 32.660 32.338 0.322 17919 100067 1 244 . 1 1 34 34 GLU H H 34 8.740 8.740 8.357 0.383 17919 100068 1 244 . 1 1 35 35 GLY N N 35 108.650 108.650 109.657 -1.007 17919 100069 1 244 . 1 1 35 35 GLY C C 35 173.960 173.960 174.330 -0.370 17919 100070 1 244 . 1 1 35 35 GLY CA C 35 46.080 46.080 46.020 0.060 17919 100071 1 244 . 1 1 35 35 GLY H H 35 8.530 8.530 8.220 0.310 17919 100072 1 244 . 1 1 36 36 ILE N N 36 119.880 119.880 121.430 -1.550 17919 100073 1 244 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.218 0.227 17919 100074 1 244 . 1 1 36 36 ILE C C 36 173.590 173.590 173.934 -0.344 17919 100075 1 244 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.063 -0.313 17919 100076 1 244 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.666 1.915 17919 100077 1 244 . 1 1 36 36 ILE H H 36 6.150 6.150 7.639 -1.489 17919 100078 1 244 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.545 0.089 17919 100079 1 244 . 1 1 37 37 PRO C C 37 176.940 176.940 175.697 1.243 17919 100080 1 244 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.822 -0.162 17919 100081 1 244 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.478 0.372 17919 100082 1 244 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.238 -0.121 17919 100083 1 244 . 1 1 38 38 PRO C C 38 178.320 178.320 178.021 0.299 17919 100084 1 244 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.421 0.839 17919 100085 1 244 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.773 1.117 17919 100086 1 244 . 1 1 39 39 ASP N N 39 113.380 113.380 114.367 -0.987 17919 100087 1 244 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.344 0.086 17919 100088 1 244 . 1 1 39 39 ASP C C 39 177.090 177.090 176.709 0.381 17919 100089 1 244 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.438 -0.798 17919 100090 1 244 . 1 1 39 39 ASP CB C 39 39.540 39.540 39.156 0.384 17919 100091 1 244 . 1 1 39 39 ASP H H 39 8.550 8.550 8.859 -0.309 17919 100092 1 244 . 1 1 40 40 GLN N N 40 116.780 116.780 118.187 -1.407 17919 100093 1 244 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.532 -0.068 17919 100094 1 244 . 1 1 40 40 GLN C C 40 175.380 175.380 175.678 -0.298 17919 100095 1 244 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.965 -0.325 17919 100096 1 244 . 1 1 40 40 GLN CB C 40 30.140 30.140 31.152 -1.012 17919 100097 1 244 . 1 1 40 40 GLN H H 40 7.820 7.820 7.523 0.297 17919 100098 1 244 . 1 1 41 41 GLN N N 41 117.720 117.720 121.047 -3.327 17919 100099 1 244 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.128 0.116 17919 100100 1 244 . 1 1 41 41 GLN C C 41 176.300 176.300 174.440 1.860 17919 100101 1 244 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.899 -0.429 17919 100102 1 244 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.177 2.473 17919 100103 1 244 . 1 1 41 41 GLN H H 41 7.480 7.480 7.865 -0.385 17919 100104 1 244 . 1 1 42 42 ARG N N 42 122.680 122.680 125.745 -3.065 17919 100105 1 244 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.513 -0.013 17919 100106 1 244 . 1 1 42 42 ARG C C 42 174.050 174.050 174.275 -0.225 17919 100107 1 244 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.924 0.126 17919 100108 1 244 . 1 1 42 42 ARG CB C 42 31.750 31.750 31.615 0.135 17919 100109 1 244 . 1 1 42 42 ARG H H 42 8.530 8.530 8.756 -0.226 17919 100110 1 244 . 1 1 43 43 LEU N N 43 124.040 124.040 128.024 -3.984 17919 100111 1 244 . 1 1 43 43 LEU C C 43 175.290 175.290 175.608 -0.318 17919 100112 1 244 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.713 -0.733 17919 100113 1 244 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.074 1.716 17919 100114 1 244 . 1 1 43 43 LEU H H 43 8.820 8.820 8.798 0.022 17919 100115 1 244 . 1 1 44 44 ILE N N 44 121.920 121.920 119.915 2.005 17919 100116 1 244 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.979 0.013 17919 100117 1 244 . 1 1 44 44 ILE C C 44 176.060 176.060 175.082 0.978 17919 100118 1 244 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.347 -1.367 17919 100119 1 244 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.642 -0.222 17919 100120 1 244 . 1 1 44 44 ILE H H 44 9.030 9.030 8.893 0.137 17919 100121 1 244 . 1 1 45 45 PHE N N 45 125.390 125.390 128.096 -2.706 17919 100122 1 244 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.885 0.160 17919 100123 1 244 . 1 1 45 45 PHE C C 45 174.470 174.470 175.495 -1.025 17919 100124 1 244 . 1 1 45 45 PHE CA C 45 57.020 57.020 58.413 -1.393 17919 100125 1 244 . 1 1 45 45 PHE CB C 45 43.760 43.760 41.101 2.659 17919 100126 1 244 . 1 1 45 45 PHE H H 45 8.830 8.830 8.082 0.748 17919 100127 1 244 . 1 1 46 46 ALA N N 46 132.200 132.200 122.867 9.333 17919 100128 1 244 . 1 1 46 46 ALA HA H 46 3.690 3.690 4.397 -0.707 17919 100129 1 244 . 1 1 46 46 ALA C C 46 177.290 177.290 177.657 -0.367 17919 100130 1 244 . 1 1 46 46 ALA CA C 46 52.540 52.540 51.579 0.961 17919 100131 1 244 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.994 -0.424 17919 100132 1 244 . 1 1 46 46 ALA H H 46 8.810 8.810 8.453 0.357 17919 100133 1 244 . 1 1 47 47 GLY N N 47 102.340 102.340 107.470 -5.130 17919 100134 1 244 . 1 1 47 47 GLY C C 47 173.810 173.810 174.599 -0.789 17919 100135 1 244 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.677 -0.327 17919 100136 1 244 . 1 1 47 47 GLY H H 47 8.130 8.130 8.159 -0.029 17919 100137 1 244 . 1 1 48 48 LYS N N 48 121.570 121.570 120.394 1.176 17919 100138 1 244 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.470 0.152 17919 100139 1 244 . 1 1 48 48 LYS C C 48 174.700 174.700 176.101 -1.401 17919 100140 1 244 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.179 -0.629 17919 100141 1 244 . 1 1 48 48 LYS CB C 48 34.530 34.530 33.349 1.181 17919 100142 1 244 . 1 1 48 48 LYS H H 48 7.980 7.980 7.766 0.214 17919 100143 1 244 . 1 1 49 49 GLN N N 49 122.410 122.410 120.694 1.716 17919 100144 1 244 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.688 -0.128 17919 100145 1 244 . 1 1 49 49 GLN C C 49 175.670 175.670 175.646 0.024 17919 100146 1 244 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.164 -0.424 17919 100147 1 244 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.250 -0.250 17919 100148 1 244 . 1 1 49 49 GLN H H 49 8.600 8.600 8.429 0.171 17919 100149 1 244 . 1 1 50 50 LEU N N 50 125.520 125.520 124.227 1.293 17919 100150 1 244 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.229 -0.139 17919 100151 1 244 . 1 1 50 50 LEU C C 50 176.660 176.660 176.919 -0.259 17919 100152 1 244 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.284 -0.044 17919 100153 1 244 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.168 -0.598 17919 100154 1 244 . 1 1 50 50 LEU H H 50 8.530 8.530 8.447 0.083 17919 100155 1 244 . 1 1 51 51 GLU N N 51 122.940 122.940 122.655 0.285 17919 100156 1 244 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.520 -0.032 17919 100157 1 244 . 1 1 51 51 GLU C C 51 175.870 175.870 176.748 -0.878 17919 100158 1 244 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.333 0.627 17919 100159 1 244 . 1 1 51 51 GLU CB C 51 31.570 31.570 30.719 0.851 17919 100160 1 244 . 1 1 51 51 GLU H H 51 8.400 8.400 8.498 -0.098 17919 100161 1 244 . 1 1 52 52 ASP N N 52 120.030 120.030 124.425 -4.395 17919 100162 1 244 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.437 -0.078 17919 100163 1 244 . 1 1 52 52 ASP C C 52 177.330 177.330 177.419 -0.089 17919 100164 1 244 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.773 -0.813 17919 100165 1 244 . 1 1 52 52 ASP CB C 52 40.850 40.850 41.177 -0.327 17919 100166 1 244 . 1 1 52 52 ASP H H 52 8.160 8.160 8.903 -0.743 17919 100167 1 244 . 1 1 53 53 GLY N N 53 106.660 106.660 105.486 1.174 17919 100168 1 244 . 1 1 53 53 GLY C C 53 174.870 174.870 173.950 0.920 17919 100169 1 244 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.490 0.680 17919 100170 1 244 . 1 1 53 53 GLY H H 53 9.390 9.390 8.280 1.110 17919 100171 1 244 . 1 1 54 54 ARG N N 54 119.050 119.050 120.274 -1.224 17919 100172 1 244 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.654 0.041 17919 100173 1 244 . 1 1 54 54 ARG C C 54 175.350 175.350 175.909 -0.559 17919 100174 1 244 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.323 0.067 17919 100175 1 244 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.239 0.411 17919 100176 1 244 . 1 1 54 54 ARG H H 54 7.460 7.460 7.346 0.114 17919 100177 1 244 . 1 1 55 55 THR N N 55 108.400 108.400 113.810 -5.410 17919 100178 1 244 . 1 1 55 55 THR HA H 55 5.240 5.240 4.813 0.427 17919 100179 1 244 . 1 1 55 55 THR C C 55 176.560 176.560 176.646 -0.086 17919 100180 1 244 . 1 1 55 55 THR CA C 55 59.690 59.690 60.681 -0.991 17919 100181 1 244 . 1 1 55 55 THR CB C 55 72.260 72.260 70.365 1.895 17919 100182 1 244 . 1 1 55 55 THR H H 55 8.730 8.730 8.917 -0.187 17919 100183 1 244 . 1 1 56 56 LEU N N 56 117.920 117.920 123.097 -5.177 17919 100184 1 244 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.863 0.197 17919 100185 1 244 . 1 1 56 56 LEU C C 56 180.810 180.810 178.689 2.121 17919 100186 1 244 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.556 0.154 17919 100187 1 244 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.375 -1.005 17919 100188 1 244 . 1 1 56 56 LEU H H 56 8.140 8.140 8.733 -0.593 17919 100189 1 244 . 1 1 57 57 SER N N 57 113.330 113.330 114.407 -1.077 17919 100190 1 244 . 1 1 57 57 SER HA H 57 4.370 4.370 4.182 0.188 17919 100191 1 244 . 1 1 57 57 SER C C 57 178.310 178.310 176.918 1.392 17919 100192 1 244 . 1 1 57 57 SER CA C 57 61.080 61.080 62.054 -0.974 17919 100193 1 244 . 1 1 57 57 SER CB C 57 62.530 62.530 62.519 0.011 17919 100194 1 244 . 1 1 57 57 SER H H 57 8.470 8.470 8.220 0.250 17919 100195 1 244 . 1 1 58 58 ASP N N 58 124.190 124.190 121.562 2.628 17919 100196 1 244 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.337 -0.041 17919 100197 1 244 . 1 1 58 58 ASP C C 58 177.400 177.400 176.764 0.636 17919 100198 1 244 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.615 0.565 17919 100199 1 244 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.573 -0.473 17919 100200 1 244 . 1 1 58 58 ASP H H 58 7.930 7.930 7.927 0.003 17919 100201 1 244 . 1 1 59 59 TYR N N 59 115.510 115.510 115.325 0.185 17919 100202 1 244 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.630 0.040 17919 100203 1 244 . 1 1 59 59 TYR C C 59 174.700 174.700 174.781 -0.081 17919 100204 1 244 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.408 0.842 17919 100205 1 244 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.375 1.695 17919 100206 1 244 . 1 1 59 59 TYR H H 59 7.250 7.250 7.336 -0.086 17919 100207 1 244 . 1 1 60 60 ASN N N 60 115.900 115.900 114.928 0.972 17919 100208 1 244 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.415 -0.060 17919 100209 1 244 . 1 1 60 60 ASN C C 60 174.340 174.340 174.585 -0.245 17919 100210 1 244 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.211 -0.090 17919 100211 1 244 . 1 1 60 60 ASN CB C 60 37.410 37.410 36.841 0.569 17919 100212 1 244 . 1 1 60 60 ASN H H 60 8.150 8.150 7.946 0.204 17919 100213 1 244 . 1 1 61 61 ILE N N 61 118.600 118.600 119.554 -0.954 17919 100214 1 244 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.739 -0.346 17919 100215 1 244 . 1 1 61 61 ILE C C 61 174.610 174.610 175.672 -1.062 17919 100216 1 244 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.257 0.163 17919 100217 1 244 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.378 -0.638 17919 100218 1 244 . 1 1 61 61 ILE H H 61 7.250 7.250 8.221 -0.971 17919 100219 1 244 . 1 1 62 62 GLN N N 62 124.740 124.740 126.351 -1.611 17919 100220 1 244 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.725 -0.219 17919 100221 1 244 . 1 1 62 62 GLN C C 62 175.970 175.970 175.889 0.081 17919 100222 1 244 . 1 1 62 62 GLN CA C 62 53.660 53.660 54.147 -0.487 17919 100223 1 244 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.058 0.592 17919 100224 1 244 . 1 1 62 62 GLN H H 62 7.610 7.610 8.128 -0.518 17919 100225 1 244 . 1 1 63 63 LYS N N 63 120.300 120.300 122.116 -1.816 17919 100226 1 244 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.154 -0.153 17919 100227 1 244 . 1 1 63 63 LYS C C 63 175.810 175.810 176.769 -0.959 17919 100228 1 244 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.346 0.444 17919 100229 1 244 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.112 0.538 17919 100230 1 244 . 1 1 63 63 LYS H H 63 8.490 8.490 8.658 -0.168 17919 100231 1 244 . 1 1 64 64 GLU N N 64 113.950 113.950 119.362 -5.412 17919 100232 1 244 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.876 -0.411 17919 100233 1 244 . 1 1 64 64 GLU C C 64 175.250 175.250 176.484 -1.234 17919 100234 1 244 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.734 0.156 17919 100235 1 244 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.329 -2.429 17919 100236 1 244 . 1 1 64 64 GLU H H 64 9.280 9.280 9.155 0.125 17919 100237 1 244 . 1 1 65 65 SER N N 65 114.730 114.730 115.687 -0.957 17919 100238 1 244 . 1 1 65 65 SER HA H 65 4.640 4.640 4.544 0.096 17919 100239 1 244 . 1 1 65 65 SER C C 65 172.160 172.160 173.673 -1.513 17919 100240 1 244 . 1 1 65 65 SER CA C 65 60.890 60.890 60.684 0.206 17919 100241 1 244 . 1 1 65 65 SER CB C 65 64.910 64.910 64.180 0.730 17919 100242 1 244 . 1 1 65 65 SER H H 65 7.670 7.670 7.835 -0.165 17919 100243 1 244 . 1 1 66 66 THR N N 66 117.110 117.110 118.754 -1.644 17919 100244 1 244 . 1 1 66 66 THR HA H 66 5.270 5.270 5.104 0.166 17919 100245 1 244 . 1 1 66 66 THR C C 66 173.950 173.950 173.966 -0.016 17919 100246 1 244 . 1 1 66 66 THR CA C 66 62.340 62.340 61.960 0.380 17919 100247 1 244 . 1 1 66 66 THR CB C 66 70.080 70.080 70.100 -0.020 17919 100248 1 244 . 1 1 66 66 THR H H 66 8.730 8.730 8.292 0.438 17919 100249 1 244 . 1 1 67 67 LEU N N 67 127.110 127.110 127.242 -0.132 17919 100250 1 244 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.833 0.227 17919 100251 1 244 . 1 1 67 67 LEU C C 67 175.770 175.770 175.032 0.738 17919 100252 1 244 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.087 -0.186 17919 100253 1 244 . 1 1 67 67 LEU CB C 67 44.260 44.260 45.285 -1.025 17919 100254 1 244 . 1 1 67 67 LEU H H 67 9.410 9.410 9.256 0.154 17919 100255 1 244 . 1 1 68 68 HIS N N 68 118.380 118.380 122.454 -4.074 17919 100256 1 244 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.242 -0.002 17919 100257 1 244 . 1 1 68 68 HIS C C 68 173.150 173.150 173.852 -0.702 17919 100258 1 244 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.143 0.857 17919 100259 1 244 . 1 1 68 68 HIS CB C 68 30.530 30.530 31.420 -0.890 17919 100260 1 244 . 1 1 68 68 HIS H H 68 9.230 9.230 8.487 0.743 17919 100261 1 244 . 1 1 69 69 LEU N N 69 124.460 124.460 129.949 -5.489 17919 100262 1 244 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.888 0.302 17919 100263 1 244 . 1 1 69 69 LEU C C 69 175.270 175.270 174.146 1.124 17919 100264 1 244 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.459 0.431 17919 100265 1 244 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.027 0.353 17919 100266 1 244 . 1 1 69 69 LEU H H 69 8.340 8.340 8.520 -0.180 17919 100267 1 244 . 1 1 70 70 VAL N N 70 126.940 126.940 121.322 5.618 17919 100268 1 244 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.471 -0.121 17919 100269 1 244 . 1 1 70 70 VAL C C 70 174.000 174.000 173.730 0.270 17919 100270 1 244 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.579 1.221 17919 100271 1 244 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.767 -0.857 17919 100272 1 244 . 1 1 70 70 VAL H H 70 9.200 9.200 8.814 0.386 17919 100273 1 244 . 1 1 71 71 LEU N N 71 123.130 123.130 121.172 1.958 17919 100274 1 244 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.113 -0.053 17919 100275 1 244 . 1 1 71 71 LEU C C 71 177.830 177.830 177.161 0.669 17919 100276 1 244 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.726 0.214 17919 100277 1 244 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.599 0.251 17919 100278 1 244 . 1 1 71 71 LEU H H 71 8.120 8.120 8.232 -0.112 17919 100279 1 244 . 1 1 72 72 ARG N N 72 123.490 123.490 125.792 -2.302 17919 100280 1 244 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.519 -0.218 17919 100281 1 244 . 1 1 72 72 ARG C C 72 175.350 175.350 174.502 0.848 17919 100282 1 244 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.537 0.073 17919 100283 1 244 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.365 0.985 17919 100284 1 244 . 1 1 72 72 ARG H H 72 8.580 8.580 8.430 0.150 17919 100285 1 245 . 1 1 2 2 GLN N N 2 123.220 123.220 121.494 1.726 17919 100286 1 245 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.310 -0.061 17919 100287 1 245 . 1 1 2 2 GLN C C 2 175.920 175.920 174.476 1.444 17919 100288 1 245 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.554 0.526 17919 100289 1 245 . 1 1 2 2 GLN CB C 2 30.760 30.760 31.118 -0.358 17919 100290 1 245 . 1 1 2 2 GLN H H 2 8.900 8.900 8.420 0.480 17919 100291 1 245 . 1 1 3 3 ILE N N 3 115.340 115.340 119.378 -4.038 17919 100292 1 245 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.778 -0.565 17919 100293 1 245 . 1 1 3 3 ILE C C 3 172.450 172.450 173.241 -0.791 17919 100294 1 245 . 1 1 3 3 ILE CA C 3 59.570 59.570 58.911 0.659 17919 100295 1 245 . 1 1 3 3 ILE CB C 3 42.210 42.210 42.022 0.188 17919 100296 1 245 . 1 1 3 3 ILE H H 3 8.320 8.320 8.827 -0.507 17919 100297 1 245 . 1 1 4 4 PHE N N 4 118.110 118.110 120.684 -2.574 17919 100298 1 245 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.358 0.272 17919 100299 1 245 . 1 1 4 4 PHE C C 4 175.320 175.320 175.104 0.216 17919 100300 1 245 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.901 -0.691 17919 100301 1 245 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.800 -0.320 17919 100302 1 245 . 1 1 4 4 PHE H H 4 8.610 8.610 8.619 -0.009 17919 100303 1 245 . 1 1 5 5 VAL N N 5 121.000 121.000 122.922 -1.922 17919 100304 1 245 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.645 0.080 17919 100305 1 245 . 1 1 5 5 VAL C C 5 174.870 174.870 175.189 -0.319 17919 100306 1 245 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.495 -0.875 17919 100307 1 245 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.874 0.355 17919 100308 1 245 . 1 1 5 5 VAL H H 5 9.300 9.300 9.248 0.052 17919 100309 1 245 . 1 1 6 6 LYS N N 6 127.520 127.520 127.467 0.053 17919 100310 1 245 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.590 -0.223 17919 100311 1 245 . 1 1 6 6 LYS C C 6 177.140 177.140 176.618 0.522 17919 100312 1 245 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.423 0.097 17919 100313 1 245 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.527 -0.477 17919 100314 1 245 . 1 1 6 6 LYS H H 6 8.820 8.820 9.243 -0.423 17919 100315 1 245 . 1 1 7 7 THR N N 7 115.400 115.400 114.508 0.892 17919 100316 1 245 . 1 1 7 7 THR HA H 7 4.970 4.970 4.658 0.312 17919 100317 1 245 . 1 1 7 7 THR C C 7 176.910 176.910 176.699 0.211 17919 100318 1 245 . 1 1 7 7 THR CA C 7 60.470 60.470 60.339 0.131 17919 100319 1 245 . 1 1 7 7 THR CB C 7 70.630 70.630 70.219 0.411 17919 100320 1 245 . 1 1 7 7 THR H H 7 8.730 8.730 8.816 -0.086 17919 100321 1 245 . 1 1 8 8 LEU N N 8 121.330 121.330 121.036 0.294 17919 100322 1 245 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.337 -0.027 17919 100323 1 245 . 1 1 8 8 LEU C C 8 178.800 178.800 177.767 1.033 17919 100324 1 245 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.871 -0.291 17919 100325 1 245 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.561 0.409 17919 100326 1 245 . 1 1 8 8 LEU H H 8 9.100 9.100 8.914 0.186 17919 100327 1 245 . 1 1 9 9 THR N N 9 105.590 105.590 106.649 -1.059 17919 100328 1 245 . 1 1 9 9 THR HA H 9 4.428 4.428 4.267 0.161 17919 100329 1 245 . 1 1 9 9 THR C C 9 175.520 175.520 175.799 -0.279 17919 100330 1 245 . 1 1 9 9 THR CA C 9 61.400 61.400 62.143 -0.743 17919 100331 1 245 . 1 1 9 9 THR CB C 9 69.140 69.140 68.728 0.412 17919 100332 1 245 . 1 1 9 9 THR H H 9 7.630 7.630 7.707 -0.077 17919 100333 1 245 . 1 1 10 10 GLY N N 10 108.890 108.890 110.076 -1.186 17919 100334 1 245 . 1 1 10 10 GLY C C 10 174.070 174.070 174.191 -0.121 17919 100335 1 245 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.104 0.356 17919 100336 1 245 . 1 1 10 10 GLY H H 10 7.810 7.810 7.671 0.139 17919 100337 1 245 . 1 1 11 11 LYS N N 11 121.600 121.600 120.781 0.819 17919 100338 1 245 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.338 0.023 17919 100339 1 245 . 1 1 11 11 LYS C C 11 175.940 175.940 175.590 0.350 17919 100340 1 245 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.658 -0.378 17919 100341 1 245 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.086 0.114 17919 100342 1 245 . 1 1 11 11 LYS H H 11 7.280 7.280 7.638 -0.358 17919 100343 1 245 . 1 1 12 12 THR N N 12 120.440 120.440 116.391 4.049 17919 100344 1 245 . 1 1 12 12 THR HA H 12 5.046 5.046 5.058 -0.012 17919 100345 1 245 . 1 1 12 12 THR C C 12 174.320 174.320 174.354 -0.034 17919 100346 1 245 . 1 1 12 12 THR CA C 12 62.390 62.390 61.795 0.595 17919 100347 1 245 . 1 1 12 12 THR CB C 12 69.910 69.910 69.847 0.063 17919 100348 1 245 . 1 1 12 12 THR H H 12 8.650 8.650 8.237 0.413 17919 100349 1 245 . 1 1 13 13 ILE N N 13 127.110 127.110 123.435 3.675 17919 100350 1 245 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.749 -0.205 17919 100351 1 245 . 1 1 13 13 ILE C C 13 175.220 175.220 174.837 0.383 17919 100352 1 245 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.546 0.434 17919 100353 1 245 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.487 0.463 17919 100354 1 245 . 1 1 13 13 ILE H H 13 9.450 9.450 9.256 0.194 17919 100355 1 245 . 1 1 14 14 THR N N 14 121.520 121.520 122.768 -1.248 17919 100356 1 245 . 1 1 14 14 THR HA H 14 4.964 4.964 4.933 0.031 17919 100357 1 245 . 1 1 14 14 THR C C 14 173.790 173.790 174.030 -0.240 17919 100358 1 245 . 1 1 14 14 THR CA C 14 61.940 61.940 62.178 -0.238 17919 100359 1 245 . 1 1 14 14 THR CB C 14 69.650 69.650 69.771 -0.121 17919 100360 1 245 . 1 1 14 14 THR H H 14 8.710 8.710 8.529 0.181 17919 100361 1 245 . 1 1 15 15 LEU N N 15 124.800 124.800 126.245 -1.445 17919 100362 1 245 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.778 0.002 17919 100363 1 245 . 1 1 15 15 LEU C C 15 174.670 174.670 175.336 -0.666 17919 100364 1 245 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.368 -0.538 17919 100365 1 245 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.666 1.404 17919 100366 1 245 . 1 1 15 15 LEU H H 15 8.710 8.710 9.054 -0.344 17919 100367 1 245 . 1 1 16 16 GLU N N 16 122.160 122.160 122.633 -0.473 17919 100368 1 245 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.007 -0.090 17919 100369 1 245 . 1 1 16 16 GLU C C 16 175.860 175.860 175.878 -0.018 17919 100370 1 245 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.440 -0.620 17919 100371 1 245 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.950 -1.500 17919 100372 1 245 . 1 1 16 16 GLU H H 16 8.140 8.140 8.580 -0.440 17919 100373 1 245 . 1 1 17 17 VAL N N 17 117.210 117.210 120.424 -3.214 17919 100374 1 245 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.808 -0.094 17919 100375 1 245 . 1 1 17 17 VAL C C 17 174.160 174.160 174.909 -0.749 17919 100376 1 245 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.913 -0.484 17919 100377 1 245 . 1 1 17 17 VAL CB C 17 36.400 36.400 36.065 0.335 17919 100378 1 245 . 1 1 17 17 VAL H H 17 8.900 8.900 9.017 -0.117 17919 100379 1 245 . 1 1 18 18 GLU N N 18 118.990 118.990 121.264 -2.274 17919 100380 1 245 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.864 0.215 17919 100381 1 245 . 1 1 18 18 GLU C C 18 176.160 176.160 175.825 0.335 17919 100382 1 245 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.670 0.049 17919 100383 1 245 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.969 -0.659 17919 100384 1 245 . 1 1 18 18 GLU H H 18 8.640 8.640 8.405 0.235 17919 100385 1 245 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.394 -0.253 17919 100386 1 245 . 1 1 19 19 PRO C C 19 175.310 175.310 177.492 -2.182 17919 100387 1 245 . 1 1 19 19 PRO CA C 19 65.470 65.470 64.862 0.608 17919 100388 1 245 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.007 -0.057 17919 100389 1 245 . 1 1 20 20 SER N N 20 103.400 103.400 111.792 -8.392 17919 100390 1 245 . 1 1 20 20 SER HA H 20 4.370 4.370 4.384 -0.014 17919 100391 1 245 . 1 1 20 20 SER C C 20 174.660 174.660 174.656 0.004 17919 100392 1 245 . 1 1 20 20 SER CA C 20 57.400 57.400 58.289 -0.889 17919 100393 1 245 . 1 1 20 20 SER CB C 20 63.370 63.370 62.663 0.707 17919 100394 1 245 . 1 1 20 20 SER H H 20 7.040 7.040 8.225 -1.185 17919 100395 1 245 . 1 1 21 21 ASP N N 21 123.480 123.480 124.139 -0.659 17919 100396 1 245 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.771 -0.076 17919 100397 1 245 . 1 1 21 21 ASP C C 21 176.360 176.360 175.578 0.782 17919 100398 1 245 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.363 1.337 17919 100399 1 245 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.916 -1.116 17919 100400 1 245 . 1 1 21 21 ASP H H 21 8.030 8.030 8.113 -0.083 17919 100401 1 245 . 1 1 22 22 THR N N 22 108.800 108.800 111.793 -2.993 17919 100402 1 245 . 1 1 22 22 THR HA H 22 4.920 4.920 4.905 0.015 17919 100403 1 245 . 1 1 22 22 THR C C 22 176.750 176.750 176.364 0.386 17919 100404 1 245 . 1 1 22 22 THR CA C 22 59.690 59.690 60.852 -1.162 17919 100405 1 245 . 1 1 22 22 THR CB C 22 71.200 71.200 71.080 0.120 17919 100406 1 245 . 1 1 22 22 THR H H 22 7.900 7.900 8.149 -0.249 17919 100407 1 245 . 1 1 23 23 ILE N N 23 121.190 121.190 122.278 -1.088 17919 100408 1 245 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.832 -0.175 17919 100409 1 245 . 1 1 23 23 ILE C C 23 179.040 179.040 177.645 1.395 17919 100410 1 245 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.625 -0.365 17919 100411 1 245 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.386 -2.036 17919 100412 1 245 . 1 1 23 23 ILE H H 23 8.560 8.560 8.764 -0.204 17919 100413 1 245 . 1 1 24 24 GLU N N 24 120.830 120.830 121.573 -0.743 17919 100414 1 245 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.822 0.095 17919 100415 1 245 . 1 1 24 24 GLU C C 24 178.640 178.640 178.539 0.101 17919 100416 1 245 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.235 -0.015 17919 100417 1 245 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.375 -1.095 17919 100418 1 245 . 1 1 24 24 GLU H H 24 9.760 9.760 8.813 0.947 17919 100419 1 245 . 1 1 25 25 ASN N N 25 120.570 120.570 117.456 3.114 17919 100420 1 245 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.497 0.028 17919 100421 1 245 . 1 1 25 25 ASN C C 25 178.380 178.380 177.761 0.619 17919 100422 1 245 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.975 0.085 17919 100423 1 245 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.684 -0.234 17919 100424 1 245 . 1 1 25 25 ASN H H 25 7.920 7.920 7.536 0.384 17919 100425 1 245 . 1 1 26 26 VAL N N 26 121.710 121.710 120.339 1.371 17919 100426 1 245 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.662 -0.265 17919 100427 1 245 . 1 1 26 26 VAL C C 26 177.950 177.950 178.011 -0.061 17919 100428 1 245 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.328 1.332 17919 100429 1 245 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.035 -0.195 17919 100430 1 245 . 1 1 26 26 VAL H H 26 8.070 8.070 7.954 0.116 17919 100431 1 245 . 1 1 27 27 LYS N N 27 118.860 118.860 120.236 -1.376 17919 100432 1 245 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.134 0.446 17919 100433 1 245 . 1 1 27 27 LYS C C 27 180.550 180.550 179.181 1.369 17919 100434 1 245 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.804 -0.555 17919 100435 1 245 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.231 1.499 17919 100436 1 245 . 1 1 27 27 LYS H H 27 8.560 8.560 8.498 0.062 17919 100437 1 245 . 1 1 28 28 ALA N N 28 123.440 123.440 121.516 1.924 17919 100438 1 245 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.150 0.010 17919 100439 1 245 . 1 1 28 28 ALA C C 28 180.300 180.300 179.319 0.981 17919 100440 1 245 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.698 0.672 17919 100441 1 245 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.505 -0.795 17919 100442 1 245 . 1 1 28 28 ALA H H 28 8.060 8.060 7.887 0.173 17919 100443 1 245 . 1 1 29 29 LYS N N 29 119.940 119.940 118.776 1.164 17919 100444 1 245 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.048 0.159 17919 100445 1 245 . 1 1 29 29 LYS C C 29 180.320 180.320 179.221 1.099 17919 100446 1 245 . 1 1 29 29 LYS CA C 29 59.650 59.650 58.962 0.688 17919 100447 1 245 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.378 0.912 17919 100448 1 245 . 1 1 29 29 LYS H H 29 7.850 7.850 7.775 0.075 17919 100449 1 245 . 1 1 30 30 ILE N N 30 121.080 121.080 120.759 0.321 17919 100450 1 245 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.652 -0.145 17919 100451 1 245 . 1 1 30 30 ILE C C 30 178.310 178.310 177.278 1.032 17919 100452 1 245 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.065 1.085 17919 100453 1 245 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.854 -1.054 17919 100454 1 245 . 1 1 30 30 ILE H H 30 8.280 8.280 8.318 -0.038 17919 100455 1 245 . 1 1 31 31 GLN N N 31 123.490 123.490 120.687 2.803 17919 100456 1 245 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.867 -0.038 17919 100457 1 245 . 1 1 31 31 GLN C C 31 178.890 178.890 177.977 0.913 17919 100458 1 245 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.307 0.693 17919 100459 1 245 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.222 -0.502 17919 100460 1 245 . 1 1 31 31 GLN H H 31 8.580 8.580 8.056 0.524 17919 100461 1 245 . 1 1 32 32 ASP N N 32 119.360 119.360 118.902 0.458 17919 100462 1 245 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.413 -0.059 17919 100463 1 245 . 1 1 32 32 ASP C C 32 177.250 177.250 177.916 -0.666 17919 100464 1 245 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.535 0.655 17919 100465 1 245 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.846 -0.266 17919 100466 1 245 . 1 1 32 32 ASP H H 32 8.010 8.010 8.065 -0.055 17919 100467 1 245 . 1 1 33 33 LYS N N 33 115.130 115.130 117.472 -2.342 17919 100468 1 245 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.336 0.001 17919 100469 1 245 . 1 1 33 33 LYS C C 33 177.870 177.870 178.047 -0.177 17919 100470 1 245 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.739 0.311 17919 100471 1 245 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.447 0.723 17919 100472 1 245 . 1 1 33 33 LYS H H 33 7.430 7.430 7.992 -0.562 17919 100473 1 245 . 1 1 34 34 GLU N N 34 113.870 113.870 117.219 -3.349 17919 100474 1 245 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.394 0.231 17919 100475 1 245 . 1 1 34 34 GLU C C 34 177.840 177.840 177.713 0.127 17919 100476 1 245 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.665 -1.495 17919 100477 1 245 . 1 1 34 34 GLU CB C 34 32.660 32.660 30.588 2.072 17919 100478 1 245 . 1 1 34 34 GLU H H 34 8.740 8.740 7.875 0.865 17919 100479 1 245 . 1 1 35 35 GLY N N 35 108.650 108.650 109.226 -0.576 17919 100480 1 245 . 1 1 35 35 GLY C C 35 173.960 173.960 174.291 -0.331 17919 100481 1 245 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.185 0.895 17919 100482 1 245 . 1 1 35 35 GLY H H 35 8.530 8.530 8.064 0.466 17919 100483 1 245 . 1 1 36 36 ILE N N 36 119.880 119.880 117.387 2.493 17919 100484 1 245 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.705 -0.260 17919 100485 1 245 . 1 1 36 36 ILE C C 36 173.590 173.590 173.653 -0.063 17919 100486 1 245 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.562 0.188 17919 100487 1 245 . 1 1 36 36 ILE CB C 36 40.580 40.580 39.076 1.504 17919 100488 1 245 . 1 1 36 36 ILE H H 36 6.150 6.150 7.631 -1.481 17919 100489 1 245 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.535 0.099 17919 100490 1 245 . 1 1 37 37 PRO C C 37 176.940 176.940 176.478 0.462 17919 100491 1 245 . 1 1 37 37 PRO CA C 37 61.660 61.660 62.152 -0.492 17919 100492 1 245 . 1 1 37 37 PRO CB C 37 31.850 31.850 30.905 0.945 17919 100493 1 245 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.279 -0.162 17919 100494 1 245 . 1 1 38 38 PRO C C 38 178.320 178.320 178.192 0.128 17919 100495 1 245 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.106 1.154 17919 100496 1 245 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.680 1.210 17919 100497 1 245 . 1 1 39 39 ASP N N 39 113.380 113.380 118.454 -5.074 17919 100498 1 245 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.385 0.045 17919 100499 1 245 . 1 1 39 39 ASP C C 39 177.090 177.090 177.322 -0.232 17919 100500 1 245 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.807 -1.167 17919 100501 1 245 . 1 1 39 39 ASP CB C 39 39.540 39.540 39.969 -0.429 17919 100502 1 245 . 1 1 39 39 ASP H H 39 8.550 8.550 8.571 -0.021 17919 100503 1 245 . 1 1 40 40 GLN N N 40 116.780 116.780 116.339 0.441 17919 100504 1 245 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.296 0.168 17919 100505 1 245 . 1 1 40 40 GLN C C 40 175.380 175.380 175.687 -0.307 17919 100506 1 245 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.507 0.133 17919 100507 1 245 . 1 1 40 40 GLN CB C 40 30.140 30.140 28.787 1.353 17919 100508 1 245 . 1 1 40 40 GLN H H 40 7.820 7.820 7.611 0.209 17919 100509 1 245 . 1 1 41 41 GLN N N 41 117.720 117.720 118.960 -1.240 17919 100510 1 245 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.851 -0.607 17919 100511 1 245 . 1 1 41 41 GLN C C 41 176.300 176.300 174.456 1.844 17919 100512 1 245 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.104 1.366 17919 100513 1 245 . 1 1 41 41 GLN CB C 41 31.650 31.650 31.900 -0.250 17919 100514 1 245 . 1 1 41 41 GLN H H 41 7.480 7.480 7.496 -0.016 17919 100515 1 245 . 1 1 42 42 ARG N N 42 122.680 122.680 122.784 -0.104 17919 100516 1 245 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.686 -0.186 17919 100517 1 245 . 1 1 42 42 ARG C C 42 174.050 174.050 173.666 0.384 17919 100518 1 245 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.629 0.421 17919 100519 1 245 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.531 -1.781 17919 100520 1 245 . 1 1 42 42 ARG H H 42 8.530 8.530 8.953 -0.423 17919 100521 1 245 . 1 1 43 43 LEU N N 43 124.040 124.040 125.710 -1.670 17919 100522 1 245 . 1 1 43 43 LEU C C 43 175.290 175.290 175.344 -0.054 17919 100523 1 245 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.926 -0.946 17919 100524 1 245 . 1 1 43 43 LEU CB C 43 45.790 45.790 45.310 0.479 17919 100525 1 245 . 1 1 43 43 LEU H H 43 8.820 8.820 8.656 0.164 17919 100526 1 245 . 1 1 44 44 ILE N N 44 121.920 121.920 123.925 -2.005 17919 100527 1 245 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.058 -0.066 17919 100528 1 245 . 1 1 44 44 ILE C C 44 176.060 176.060 174.132 1.928 17919 100529 1 245 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.127 -1.147 17919 100530 1 245 . 1 1 44 44 ILE CB C 44 41.420 41.420 40.607 0.813 17919 100531 1 245 . 1 1 44 44 ILE H H 44 9.030 9.030 9.079 -0.049 17919 100532 1 245 . 1 1 45 45 PHE N N 45 125.390 125.390 127.578 -2.188 17919 100533 1 245 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.024 0.021 17919 100534 1 245 . 1 1 45 45 PHE C C 45 174.470 174.470 174.447 0.023 17919 100535 1 245 . 1 1 45 45 PHE CA C 45 57.020 57.020 55.887 1.133 17919 100536 1 245 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.056 0.704 17919 100537 1 245 . 1 1 45 45 PHE H H 45 8.830 8.830 8.821 0.009 17919 100538 1 245 . 1 1 46 46 ALA N N 46 132.200 132.200 130.330 1.870 17919 100539 1 245 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.774 -0.084 17919 100540 1 245 . 1 1 46 46 ALA C C 46 177.290 177.290 177.723 -0.433 17919 100541 1 245 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.533 0.007 17919 100542 1 245 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.442 0.129 17919 100543 1 245 . 1 1 46 46 ALA H H 46 8.810 8.810 8.991 -0.181 17919 100544 1 245 . 1 1 47 47 GLY N N 47 102.340 102.340 104.193 -1.853 17919 100545 1 245 . 1 1 47 47 GLY C C 47 173.810 173.810 174.273 -0.463 17919 100546 1 245 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.059 0.291 17919 100547 1 245 . 1 1 47 47 GLY H H 47 8.130 8.130 8.532 -0.402 17919 100548 1 245 . 1 1 48 48 LYS N N 48 121.570 121.570 121.498 0.072 17919 100549 1 245 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.657 -0.035 17919 100550 1 245 . 1 1 48 48 LYS C C 48 174.700 174.700 175.638 -0.938 17919 100551 1 245 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.926 -0.376 17919 100552 1 245 . 1 1 48 48 LYS CB C 48 34.530 34.530 33.709 0.821 17919 100553 1 245 . 1 1 48 48 LYS H H 48 7.980 7.980 8.002 -0.022 17919 100554 1 245 . 1 1 49 49 GLN N N 49 122.410 122.410 122.547 -0.137 17919 100555 1 245 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.524 0.036 17919 100556 1 245 . 1 1 49 49 GLN C C 49 175.670 175.670 176.138 -0.468 17919 100557 1 245 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.343 -0.603 17919 100558 1 245 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.057 -0.057 17919 100559 1 245 . 1 1 49 49 GLN H H 49 8.600 8.600 8.469 0.131 17919 100560 1 245 . 1 1 50 50 LEU N N 50 125.520 125.520 126.174 -0.654 17919 100561 1 245 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.287 -0.197 17919 100562 1 245 . 1 1 50 50 LEU C C 50 176.660 176.660 176.375 0.285 17919 100563 1 245 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.020 0.220 17919 100564 1 245 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.609 -1.039 17919 100565 1 245 . 1 1 50 50 LEU H H 50 8.530 8.530 8.516 0.014 17919 100566 1 245 . 1 1 51 51 GLU N N 51 122.940 122.940 123.349 -0.409 17919 100567 1 245 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.506 -0.018 17919 100568 1 245 . 1 1 51 51 GLU C C 51 175.870 175.870 177.011 -1.141 17919 100569 1 245 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.500 0.460 17919 100570 1 245 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.606 -0.036 17919 100571 1 245 . 1 1 51 51 GLU H H 51 8.400 8.400 8.783 -0.383 17919 100572 1 245 . 1 1 52 52 ASP N N 52 120.030 120.030 127.287 -7.257 17919 100573 1 245 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.369 -0.010 17919 100574 1 245 . 1 1 52 52 ASP C C 52 177.330 177.330 177.609 -0.279 17919 100575 1 245 . 1 1 52 52 ASP CA C 52 56.960 56.960 58.033 -1.073 17919 100576 1 245 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.667 0.182 17919 100577 1 245 . 1 1 52 52 ASP H H 52 8.160 8.160 8.937 -0.777 17919 100578 1 245 . 1 1 53 53 GLY N N 53 106.660 106.660 104.884 1.776 17919 100579 1 245 . 1 1 53 53 GLY C C 53 174.870 174.870 173.394 1.476 17919 100580 1 245 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.720 0.450 17919 100581 1 245 . 1 1 53 53 GLY H H 53 9.390 9.390 8.611 0.779 17919 100582 1 245 . 1 1 54 54 ARG N N 54 119.050 119.050 118.956 0.094 17919 100583 1 245 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.576 0.119 17919 100584 1 245 . 1 1 54 54 ARG C C 54 175.350 175.350 174.736 0.614 17919 100585 1 245 . 1 1 54 54 ARG CA C 54 54.390 54.390 53.696 0.694 17919 100586 1 245 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.869 -0.219 17919 100587 1 245 . 1 1 54 54 ARG H H 54 7.460 7.460 7.194 0.266 17919 100588 1 245 . 1 1 55 55 THR N N 55 108.400 108.400 111.516 -3.116 17919 100589 1 245 . 1 1 55 55 THR HA H 55 5.240 5.240 4.964 0.276 17919 100590 1 245 . 1 1 55 55 THR C C 55 176.560 176.560 176.362 0.198 17919 100591 1 245 . 1 1 55 55 THR CA C 55 59.690 59.690 60.566 -0.877 17919 100592 1 245 . 1 1 55 55 THR CB C 55 72.260 72.260 70.585 1.675 17919 100593 1 245 . 1 1 55 55 THR H H 55 8.730 8.730 8.575 0.155 17919 100594 1 245 . 1 1 56 56 LEU N N 56 117.920 117.920 122.253 -4.333 17919 100595 1 245 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.037 0.023 17919 100596 1 245 . 1 1 56 56 LEU C C 56 180.810 180.810 179.017 1.793 17919 100597 1 245 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.551 0.159 17919 100598 1 245 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.270 -0.900 17919 100599 1 245 . 1 1 56 56 LEU H H 56 8.140 8.140 8.663 -0.523 17919 100600 1 245 . 1 1 57 57 SER N N 57 113.330 113.330 115.391 -2.061 17919 100601 1 245 . 1 1 57 57 SER HA H 57 4.370 4.370 4.229 0.141 17919 100602 1 245 . 1 1 57 57 SER C C 57 178.310 178.310 176.715 1.595 17919 100603 1 245 . 1 1 57 57 SER CA C 57 61.080 61.080 62.173 -1.093 17919 100604 1 245 . 1 1 57 57 SER CB C 57 62.530 62.530 62.748 -0.218 17919 100605 1 245 . 1 1 57 57 SER H H 57 8.470 8.470 8.137 0.333 17919 100606 1 245 . 1 1 58 58 ASP N N 58 124.190 124.190 121.193 2.997 17919 100607 1 245 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.290 0.006 17919 100608 1 245 . 1 1 58 58 ASP C C 58 177.400 177.400 176.592 0.808 17919 100609 1 245 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.828 0.352 17919 100610 1 245 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.388 -0.288 17919 100611 1 245 . 1 1 58 58 ASP H H 58 7.930 7.930 7.793 0.137 17919 100612 1 245 . 1 1 59 59 TYR N N 59 115.510 115.510 115.229 0.281 17919 100613 1 245 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.611 0.059 17919 100614 1 245 . 1 1 59 59 TYR C C 59 174.700 174.700 175.275 -0.575 17919 100615 1 245 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.767 0.483 17919 100616 1 245 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.337 1.733 17919 100617 1 245 . 1 1 59 59 TYR H H 59 7.250 7.250 7.295 -0.045 17919 100618 1 245 . 1 1 60 60 ASN N N 60 115.900 115.900 116.943 -1.043 17919 100619 1 245 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.343 0.012 17919 100620 1 245 . 1 1 60 60 ASN C C 60 174.340 174.340 174.388 -0.048 17919 100621 1 245 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.354 -0.234 17919 100622 1 245 . 1 1 60 60 ASN CB C 60 37.410 37.410 36.597 0.813 17919 100623 1 245 . 1 1 60 60 ASN H H 60 8.150 8.150 8.037 0.113 17919 100624 1 245 . 1 1 61 61 ILE N N 61 118.600 118.600 119.637 -1.037 17919 100625 1 245 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.912 -0.519 17919 100626 1 245 . 1 1 61 61 ILE C C 61 174.610 174.610 175.699 -1.089 17919 100627 1 245 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.879 0.541 17919 100628 1 245 . 1 1 61 61 ILE CB C 61 36.740 36.740 38.049 -1.309 17919 100629 1 245 . 1 1 61 61 ILE H H 61 7.250 7.250 7.931 -0.681 17919 100630 1 245 . 1 1 62 62 GLN N N 62 124.740 124.740 126.219 -1.479 17919 100631 1 245 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.815 -0.309 17919 100632 1 245 . 1 1 62 62 GLN C C 62 175.970 175.970 176.072 -0.102 17919 100633 1 245 . 1 1 62 62 GLN CA C 62 53.660 53.660 52.530 1.130 17919 100634 1 245 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.830 -0.180 17919 100635 1 245 . 1 1 62 62 GLN H H 62 7.610 7.610 8.035 -0.425 17919 100636 1 245 . 1 1 63 63 LYS N N 63 120.300 120.300 122.063 -1.763 17919 100637 1 245 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.057 -0.056 17919 100638 1 245 . 1 1 63 63 LYS C C 63 175.810 175.810 176.868 -1.058 17919 100639 1 245 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.641 0.149 17919 100640 1 245 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.234 0.416 17919 100641 1 245 . 1 1 63 63 LYS H H 63 8.490 8.490 8.642 -0.152 17919 100642 1 245 . 1 1 64 64 GLU N N 64 113.950 113.950 117.643 -3.693 17919 100643 1 245 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.715 -0.250 17919 100644 1 245 . 1 1 64 64 GLU C C 64 175.250 175.250 176.070 -0.820 17919 100645 1 245 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.964 -0.074 17919 100646 1 245 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.667 -2.767 17919 100647 1 245 . 1 1 64 64 GLU H H 64 9.280 9.280 9.078 0.202 17919 100648 1 245 . 1 1 65 65 SER N N 65 114.730 114.730 115.688 -0.958 17919 100649 1 245 . 1 1 65 65 SER HA H 65 4.640 4.640 4.399 0.241 17919 100650 1 245 . 1 1 65 65 SER C C 65 172.160 172.160 173.785 -1.625 17919 100651 1 245 . 1 1 65 65 SER CA C 65 60.890 60.890 60.837 0.053 17919 100652 1 245 . 1 1 65 65 SER CB C 65 64.910 64.910 63.886 1.024 17919 100653 1 245 . 1 1 65 65 SER H H 65 7.670 7.670 7.725 -0.055 17919 100654 1 245 . 1 1 66 66 THR N N 66 117.110 117.110 119.034 -1.924 17919 100655 1 245 . 1 1 66 66 THR HA H 66 5.270 5.270 5.202 0.068 17919 100656 1 245 . 1 1 66 66 THR C C 66 173.950 173.950 174.084 -0.134 17919 100657 1 245 . 1 1 66 66 THR CA C 66 62.340 62.340 62.023 0.318 17919 100658 1 245 . 1 1 66 66 THR CB C 66 70.080 70.080 70.042 0.038 17919 100659 1 245 . 1 1 66 66 THR H H 66 8.730 8.730 8.293 0.437 17919 100660 1 245 . 1 1 67 67 LEU N N 67 127.110 127.110 126.049 1.061 17919 100661 1 245 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.813 0.247 17919 100662 1 245 . 1 1 67 67 LEU C C 67 175.770 175.770 175.316 0.454 17919 100663 1 245 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.460 0.440 17919 100664 1 245 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.510 -0.250 17919 100665 1 245 . 1 1 67 67 LEU H H 67 9.410 9.410 9.187 0.223 17919 100666 1 245 . 1 1 68 68 HIS N N 68 118.380 118.380 121.036 -2.656 17919 100667 1 245 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.296 -0.056 17919 100668 1 245 . 1 1 68 68 HIS C C 68 173.150 173.150 173.576 -0.426 17919 100669 1 245 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.498 0.502 17919 100670 1 245 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.157 -1.627 17919 100671 1 245 . 1 1 68 68 HIS H H 68 9.230 9.230 8.461 0.769 17919 100672 1 245 . 1 1 69 69 LEU N N 69 124.460 124.460 128.646 -4.186 17919 100673 1 245 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.283 -0.093 17919 100674 1 245 . 1 1 69 69 LEU C C 69 175.270 175.270 174.353 0.917 17919 100675 1 245 . 1 1 69 69 LEU CA C 69 53.890 53.890 52.977 0.913 17919 100676 1 245 . 1 1 69 69 LEU CB C 69 44.380 44.380 45.498 -1.118 17919 100677 1 245 . 1 1 69 69 LEU H H 69 8.340 8.340 8.106 0.234 17919 100678 1 245 . 1 1 70 70 VAL N N 70 126.940 126.940 120.636 6.304 17919 100679 1 245 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.492 -0.142 17919 100680 1 245 . 1 1 70 70 VAL C C 70 174.000 174.000 173.674 0.326 17919 100681 1 245 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.109 0.691 17919 100682 1 245 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.693 -0.783 17919 100683 1 245 . 1 1 70 70 VAL H H 70 9.200 9.200 8.975 0.225 17919 100684 1 245 . 1 1 71 71 LEU N N 71 123.130 123.130 122.585 0.545 17919 100685 1 245 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.167 -0.107 17919 100686 1 245 . 1 1 71 71 LEU C C 71 177.830 177.830 177.208 0.622 17919 100687 1 245 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.078 0.862 17919 100688 1 245 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.854 -1.004 17919 100689 1 245 . 1 1 71 71 LEU H H 71 8.120 8.120 8.353 -0.233 17919 100690 1 245 . 1 1 72 72 ARG N N 72 123.490 123.490 122.774 0.716 17919 100691 1 245 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.261 0.040 17919 100692 1 245 . 1 1 72 72 ARG C C 72 175.350 175.350 174.364 0.986 17919 100693 1 245 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.612 -1.002 17919 100694 1 245 . 1 1 72 72 ARG CB C 72 31.350 31.350 31.076 0.275 17919 100695 1 245 . 1 1 72 72 ARG H H 72 8.580 8.580 8.627 -0.047 17919 100696 1 246 . 1 1 2 2 GLN N N 2 123.220 123.220 120.293 2.927 17919 100697 1 246 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.270 -0.021 17919 100698 1 246 . 1 1 2 2 GLN C C 2 175.920 175.920 174.915 1.005 17919 100699 1 246 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.768 0.312 17919 100700 1 246 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.723 0.037 17919 100701 1 246 . 1 1 2 2 GLN H H 2 8.900 8.900 8.315 0.585 17919 100702 1 246 . 1 1 3 3 ILE N N 3 115.340 115.340 117.851 -2.511 17919 100703 1 246 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.277 -0.064 17919 100704 1 246 . 1 1 3 3 ILE C C 3 172.450 172.450 173.072 -0.622 17919 100705 1 246 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.340 0.230 17919 100706 1 246 . 1 1 3 3 ILE CB C 3 42.210 42.210 42.107 0.103 17919 100707 1 246 . 1 1 3 3 ILE H H 3 8.320 8.320 8.745 -0.425 17919 100708 1 246 . 1 1 4 4 PHE N N 4 118.110 118.110 118.803 -0.693 17919 100709 1 246 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.502 0.128 17919 100710 1 246 . 1 1 4 4 PHE C C 4 175.320 175.320 175.161 0.159 17919 100711 1 246 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.264 -0.054 17919 100712 1 246 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.267 -0.787 17919 100713 1 246 . 1 1 4 4 PHE H H 4 8.610 8.610 8.466 0.144 17919 100714 1 246 . 1 1 5 5 VAL N N 5 121.000 121.000 122.068 -1.068 17919 100715 1 246 . 1 1 5 5 VAL HA H 5 4.725 4.725 5.034 -0.309 17919 100716 1 246 . 1 1 5 5 VAL C C 5 174.870 174.870 174.500 0.370 17919 100717 1 246 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.187 -0.567 17919 100718 1 246 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.911 -0.681 17919 100719 1 246 . 1 1 5 5 VAL H H 5 9.300 9.300 9.353 -0.053 17919 100720 1 246 . 1 1 6 6 LYS N N 6 127.520 127.520 127.276 0.244 17919 100721 1 246 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.562 -0.195 17919 100722 1 246 . 1 1 6 6 LYS C C 6 177.140 177.140 176.110 1.030 17919 100723 1 246 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.050 0.470 17919 100724 1 246 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.872 -0.822 17919 100725 1 246 . 1 1 6 6 LYS H H 6 8.820 8.820 9.365 -0.545 17919 100726 1 246 . 1 1 7 7 THR N N 7 115.400 115.400 112.848 2.552 17919 100727 1 246 . 1 1 7 7 THR HA H 7 4.970 4.970 4.581 0.389 17919 100728 1 246 . 1 1 7 7 THR C C 7 176.910 176.910 176.016 0.894 17919 100729 1 246 . 1 1 7 7 THR CA C 7 60.470 60.470 59.817 0.653 17919 100730 1 246 . 1 1 7 7 THR CB C 7 70.630 70.630 71.222 -0.593 17919 100731 1 246 . 1 1 7 7 THR H H 7 8.730 8.730 8.515 0.215 17919 100732 1 246 . 1 1 8 8 LEU N N 8 121.330 121.330 119.610 1.720 17919 100733 1 246 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.350 -0.040 17919 100734 1 246 . 1 1 8 8 LEU C C 8 178.800 178.800 178.232 0.568 17919 100735 1 246 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.321 0.259 17919 100736 1 246 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.084 -0.114 17919 100737 1 246 . 1 1 8 8 LEU H H 8 9.100 9.100 8.787 0.313 17919 100738 1 246 . 1 1 9 9 THR N N 9 105.590 105.590 108.647 -3.057 17919 100739 1 246 . 1 1 9 9 THR HA H 9 4.428 4.428 4.388 0.040 17919 100740 1 246 . 1 1 9 9 THR C C 9 175.520 175.520 175.532 -0.012 17919 100741 1 246 . 1 1 9 9 THR CA C 9 61.400 61.400 61.934 -0.534 17919 100742 1 246 . 1 1 9 9 THR CB C 9 69.140 69.140 69.577 -0.437 17919 100743 1 246 . 1 1 9 9 THR H H 9 7.630 7.630 7.638 -0.008 17919 100744 1 246 . 1 1 10 10 GLY N N 10 108.890 108.890 110.583 -1.693 17919 100745 1 246 . 1 1 10 10 GLY C C 10 174.070 174.070 174.296 -0.226 17919 100746 1 246 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.251 0.209 17919 100747 1 246 . 1 1 10 10 GLY H H 10 7.810 7.810 7.731 0.079 17919 100748 1 246 . 1 1 11 11 LYS N N 11 121.600 121.600 121.043 0.557 17919 100749 1 246 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.603 -0.242 17919 100750 1 246 . 1 1 11 11 LYS C C 11 175.940 175.940 175.806 0.134 17919 100751 1 246 . 1 1 11 11 LYS CA C 11 56.280 56.280 54.798 1.482 17919 100752 1 246 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.646 -0.446 17919 100753 1 246 . 1 1 11 11 LYS H H 11 7.280 7.280 7.929 -0.649 17919 100754 1 246 . 1 1 12 12 THR N N 12 120.440 120.440 118.436 2.004 17919 100755 1 246 . 1 1 12 12 THR HA H 12 5.046 5.046 4.910 0.136 17919 100756 1 246 . 1 1 12 12 THR C C 12 174.320 174.320 174.532 -0.212 17919 100757 1 246 . 1 1 12 12 THR CA C 12 62.390 62.390 62.395 -0.005 17919 100758 1 246 . 1 1 12 12 THR CB C 12 69.910 69.910 69.629 0.281 17919 100759 1 246 . 1 1 12 12 THR H H 12 8.650 8.650 8.400 0.250 17919 100760 1 246 . 1 1 13 13 ILE N N 13 127.110 127.110 128.776 -1.666 17919 100761 1 246 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.431 0.113 17919 100762 1 246 . 1 1 13 13 ILE C C 13 175.220 175.220 175.126 0.094 17919 100763 1 246 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.678 -0.698 17919 100764 1 246 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.021 -0.071 17919 100765 1 246 . 1 1 13 13 ILE H H 13 9.450 9.450 9.270 0.180 17919 100766 1 246 . 1 1 14 14 THR N N 14 121.520 121.520 123.696 -2.176 17919 100767 1 246 . 1 1 14 14 THR HA H 14 4.964 4.964 4.956 0.008 17919 100768 1 246 . 1 1 14 14 THR C C 14 173.790 173.790 173.791 -0.001 17919 100769 1 246 . 1 1 14 14 THR CA C 14 61.940 61.940 62.508 -0.568 17919 100770 1 246 . 1 1 14 14 THR CB C 14 69.650 69.650 69.539 0.111 17919 100771 1 246 . 1 1 14 14 THR H H 14 8.710 8.710 8.574 0.136 17919 100772 1 246 . 1 1 15 15 LEU N N 15 124.800 124.800 128.781 -3.981 17919 100773 1 246 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.672 0.108 17919 100774 1 246 . 1 1 15 15 LEU C C 15 174.670 174.670 175.384 -0.714 17919 100775 1 246 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.684 -0.854 17919 100776 1 246 . 1 1 15 15 LEU CB C 15 47.070 47.070 44.820 2.250 17919 100777 1 246 . 1 1 15 15 LEU H H 15 8.710 8.710 9.129 -0.419 17919 100778 1 246 . 1 1 16 16 GLU N N 16 122.160 122.160 122.909 -0.749 17919 100779 1 246 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.137 -0.220 17919 100780 1 246 . 1 1 16 16 GLU C C 16 175.860 175.860 176.054 -0.194 17919 100781 1 246 . 1 1 16 16 GLU CA C 16 54.820 54.820 54.449 0.371 17919 100782 1 246 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.407 -0.957 17919 100783 1 246 . 1 1 16 16 GLU H H 16 8.140 8.140 8.773 -0.633 17919 100784 1 246 . 1 1 17 17 VAL N N 17 117.210 117.210 119.721 -2.511 17919 100785 1 246 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.999 -0.285 17919 100786 1 246 . 1 1 17 17 VAL C C 17 174.160 174.160 175.557 -1.397 17919 100787 1 246 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.684 -0.253 17919 100788 1 246 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.364 1.036 17919 100789 1 246 . 1 1 17 17 VAL H H 17 8.900 8.900 8.922 -0.022 17919 100790 1 246 . 1 1 18 18 GLU N N 18 118.990 118.990 121.097 -2.107 17919 100791 1 246 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.871 0.208 17919 100792 1 246 . 1 1 18 18 GLU C C 18 176.160 176.160 175.853 0.307 17919 100793 1 246 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.422 0.298 17919 100794 1 246 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.487 -0.177 17919 100795 1 246 . 1 1 18 18 GLU H H 18 8.640 8.640 8.785 -0.145 17919 100796 1 246 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.188 -0.047 17919 100797 1 246 . 1 1 19 19 PRO C C 19 175.310 175.310 177.706 -2.396 17919 100798 1 246 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.391 0.079 17919 100799 1 246 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.829 0.121 17919 100800 1 246 . 1 1 20 20 SER N N 20 103.400 103.400 109.309 -5.909 17919 100801 1 246 . 1 1 20 20 SER HA H 20 4.370 4.370 4.282 0.088 17919 100802 1 246 . 1 1 20 20 SER C C 20 174.660 174.660 174.353 0.307 17919 100803 1 246 . 1 1 20 20 SER CA C 20 57.400 57.400 58.626 -1.226 17919 100804 1 246 . 1 1 20 20 SER CB C 20 63.370 63.370 62.375 0.995 17919 100805 1 246 . 1 1 20 20 SER H H 20 7.040 7.040 8.219 -1.179 17919 100806 1 246 . 1 1 21 21 ASP N N 21 123.480 123.480 124.779 -1.299 17919 100807 1 246 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.627 0.068 17919 100808 1 246 . 1 1 21 21 ASP C C 21 176.360 176.360 176.114 0.246 17919 100809 1 246 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.316 0.384 17919 100810 1 246 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.109 -0.309 17919 100811 1 246 . 1 1 21 21 ASP H H 21 8.030 8.030 7.782 0.248 17919 100812 1 246 . 1 1 22 22 THR N N 22 108.800 108.800 114.299 -5.499 17919 100813 1 246 . 1 1 22 22 THR HA H 22 4.920 4.920 4.741 0.179 17919 100814 1 246 . 1 1 22 22 THR C C 22 176.750 176.750 176.219 0.531 17919 100815 1 246 . 1 1 22 22 THR CA C 22 59.690 59.690 61.599 -1.909 17919 100816 1 246 . 1 1 22 22 THR CB C 22 71.200 71.200 70.613 0.587 17919 100817 1 246 . 1 1 22 22 THR H H 22 7.900 7.900 8.240 -0.340 17919 100818 1 246 . 1 1 23 23 ILE N N 23 121.190 121.190 124.339 -3.149 17919 100819 1 246 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.731 -0.074 17919 100820 1 246 . 1 1 23 23 ILE C C 23 179.040 179.040 177.928 1.112 17919 100821 1 246 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.625 -1.365 17919 100822 1 246 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.321 -1.971 17919 100823 1 246 . 1 1 23 23 ILE H H 23 8.560 8.560 8.775 -0.215 17919 100824 1 246 . 1 1 24 24 GLU N N 24 120.830 120.830 120.366 0.464 17919 100825 1 246 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.932 -0.015 17919 100826 1 246 . 1 1 24 24 GLU C C 24 178.640 178.640 178.551 0.089 17919 100827 1 246 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.690 0.530 17919 100828 1 246 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.252 -0.972 17919 100829 1 246 . 1 1 24 24 GLU H H 24 9.760 9.760 8.107 1.653 17919 100830 1 246 . 1 1 25 25 ASN N N 25 120.570 120.570 117.740 2.830 17919 100831 1 246 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.455 0.070 17919 100832 1 246 . 1 1 25 25 ASN C C 25 178.380 178.380 177.748 0.632 17919 100833 1 246 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.242 -0.181 17919 100834 1 246 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.641 -0.191 17919 100835 1 246 . 1 1 25 25 ASN H H 25 7.920 7.920 7.571 0.349 17919 100836 1 246 . 1 1 26 26 VAL N N 26 121.710 121.710 120.488 1.222 17919 100837 1 246 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.579 -0.182 17919 100838 1 246 . 1 1 26 26 VAL C C 26 177.950 177.950 177.818 0.132 17919 100839 1 246 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.596 1.064 17919 100840 1 246 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.405 -0.565 17919 100841 1 246 . 1 1 26 26 VAL H H 26 8.070 8.070 8.163 -0.093 17919 100842 1 246 . 1 1 27 27 LYS N N 27 118.860 118.860 119.637 -0.777 17919 100843 1 246 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.202 0.378 17919 100844 1 246 . 1 1 27 27 LYS C C 27 180.550 180.550 179.131 1.419 17919 100845 1 246 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.591 -0.341 17919 100846 1 246 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.246 1.484 17919 100847 1 246 . 1 1 27 27 LYS H H 27 8.560 8.560 8.081 0.479 17919 100848 1 246 . 1 1 28 28 ALA N N 28 123.440 123.440 122.229 1.211 17919 100849 1 246 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.137 0.023 17919 100850 1 246 . 1 1 28 28 ALA C C 28 180.300 180.300 179.163 1.137 17919 100851 1 246 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.881 0.489 17919 100852 1 246 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.441 -0.731 17919 100853 1 246 . 1 1 28 28 ALA H H 28 8.060 8.060 7.860 0.200 17919 100854 1 246 . 1 1 29 29 LYS N N 29 119.940 119.940 118.815 1.125 17919 100855 1 246 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.066 0.141 17919 100856 1 246 . 1 1 29 29 LYS C C 29 180.320 180.320 179.210 1.110 17919 100857 1 246 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.310 0.340 17919 100858 1 246 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.374 0.916 17919 100859 1 246 . 1 1 29 29 LYS H H 29 7.850 7.850 8.056 -0.206 17919 100860 1 246 . 1 1 30 30 ILE N N 30 121.080 121.080 119.525 1.555 17919 100861 1 246 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.741 -0.234 17919 100862 1 246 . 1 1 30 30 ILE C C 30 178.310 178.310 177.067 1.243 17919 100863 1 246 . 1 1 30 30 ILE CA C 30 66.150 66.150 64.801 1.349 17919 100864 1 246 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.635 -0.835 17919 100865 1 246 . 1 1 30 30 ILE H H 30 8.280 8.280 7.915 0.365 17919 100866 1 246 . 1 1 31 31 GLN N N 31 123.490 123.490 121.638 1.852 17919 100867 1 246 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.933 -0.104 17919 100868 1 246 . 1 1 31 31 GLN C C 31 178.890 178.890 178.322 0.568 17919 100869 1 246 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.441 0.559 17919 100870 1 246 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.280 -0.560 17919 100871 1 246 . 1 1 31 31 GLN H H 31 8.580 8.580 7.682 0.898 17919 100872 1 246 . 1 1 32 32 ASP N N 32 119.360 119.360 119.791 -0.431 17919 100873 1 246 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.361 -0.007 17919 100874 1 246 . 1 1 32 32 ASP C C 32 177.250 177.250 178.011 -0.761 17919 100875 1 246 . 1 1 32 32 ASP CA C 32 57.190 57.190 57.108 0.082 17919 100876 1 246 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.766 -0.186 17919 100877 1 246 . 1 1 32 32 ASP H H 32 8.010 8.010 7.896 0.114 17919 100878 1 246 . 1 1 33 33 LYS N N 33 115.130 115.130 118.217 -3.087 17919 100879 1 246 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.205 0.132 17919 100880 1 246 . 1 1 33 33 LYS C C 33 177.870 177.870 177.917 -0.047 17919 100881 1 246 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.075 -0.025 17919 100882 1 246 . 1 1 33 33 LYS CB C 33 34.170 34.170 32.966 1.204 17919 100883 1 246 . 1 1 33 33 LYS H H 33 7.430 7.430 7.608 -0.178 17919 100884 1 246 . 1 1 34 34 GLU N N 34 113.870 113.870 114.817 -0.947 17919 100885 1 246 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.483 0.142 17919 100886 1 246 . 1 1 34 34 GLU C C 34 177.840 177.840 177.334 0.506 17919 100887 1 246 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.310 -1.140 17919 100888 1 246 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.523 1.137 17919 100889 1 246 . 1 1 34 34 GLU H H 34 8.740 8.740 8.443 0.297 17919 100890 1 246 . 1 1 35 35 GLY N N 35 108.650 108.650 109.658 -1.008 17919 100891 1 246 . 1 1 35 35 GLY C C 35 173.960 173.960 174.073 -0.113 17919 100892 1 246 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.402 0.678 17919 100893 1 246 . 1 1 35 35 GLY H H 35 8.530 8.530 8.301 0.229 17919 100894 1 246 . 1 1 36 36 ILE N N 36 119.880 119.880 117.137 2.743 17919 100895 1 246 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.675 -0.230 17919 100896 1 246 . 1 1 36 36 ILE C C 36 173.590 173.590 173.465 0.125 17919 100897 1 246 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.477 0.273 17919 100898 1 246 . 1 1 36 36 ILE CB C 36 40.580 40.580 39.245 1.335 17919 100899 1 246 . 1 1 36 36 ILE H H 36 6.150 6.150 7.433 -1.283 17919 100900 1 246 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.572 0.062 17919 100901 1 246 . 1 1 37 37 PRO C C 37 176.940 176.940 176.013 0.927 17919 100902 1 246 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.993 -0.333 17919 100903 1 246 . 1 1 37 37 PRO CB C 37 31.850 31.850 30.914 0.936 17919 100904 1 246 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.095 0.022 17919 100905 1 246 . 1 1 38 38 PRO C C 38 178.320 178.320 178.210 0.110 17919 100906 1 246 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.628 0.632 17919 100907 1 246 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.900 0.990 17919 100908 1 246 . 1 1 39 39 ASP N N 39 113.380 113.380 115.155 -1.775 17919 100909 1 246 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.400 0.030 17919 100910 1 246 . 1 1 39 39 ASP C C 39 177.090 177.090 177.857 -0.767 17919 100911 1 246 . 1 1 39 39 ASP CA C 39 55.640 55.640 57.041 -1.401 17919 100912 1 246 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.618 -1.078 17919 100913 1 246 . 1 1 39 39 ASP H H 39 8.550 8.550 8.688 -0.138 17919 100914 1 246 . 1 1 40 40 GLN N N 40 116.780 116.780 116.636 0.144 17919 100915 1 246 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.523 -0.059 17919 100916 1 246 . 1 1 40 40 GLN C C 40 175.380 175.380 176.243 -0.863 17919 100917 1 246 . 1 1 40 40 GLN CA C 40 55.640 55.640 54.915 0.725 17919 100918 1 246 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.813 0.327 17919 100919 1 246 . 1 1 40 40 GLN H H 40 7.820 7.820 7.858 -0.038 17919 100920 1 246 . 1 1 41 41 GLN N N 41 117.720 117.720 119.716 -1.996 17919 100921 1 246 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.335 -0.091 17919 100922 1 246 . 1 1 41 41 GLN C C 41 176.300 176.300 175.878 0.422 17919 100923 1 246 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.771 -0.301 17919 100924 1 246 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.614 2.036 17919 100925 1 246 . 1 1 41 41 GLN H H 41 7.480 7.480 7.524 -0.044 17919 100926 1 246 . 1 1 42 42 ARG N N 42 122.680 122.680 122.056 0.624 17919 100927 1 246 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.680 -0.180 17919 100928 1 246 . 1 1 42 42 ARG C C 42 174.050 174.050 174.229 -0.179 17919 100929 1 246 . 1 1 42 42 ARG CA C 42 55.050 55.050 53.504 1.546 17919 100930 1 246 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.895 -2.145 17919 100931 1 246 . 1 1 42 42 ARG H H 42 8.530 8.530 8.806 -0.276 17919 100932 1 246 . 1 1 43 43 LEU N N 43 124.040 124.040 123.301 0.739 17919 100933 1 246 . 1 1 43 43 LEU C C 43 175.290 175.290 175.691 -0.401 17919 100934 1 246 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.656 -0.676 17919 100935 1 246 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.908 0.881 17919 100936 1 246 . 1 1 43 43 LEU H H 43 8.820 8.820 8.796 0.024 17919 100937 1 246 . 1 1 44 44 ILE N N 44 121.920 121.920 121.252 0.668 17919 100938 1 246 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.176 -0.184 17919 100939 1 246 . 1 1 44 44 ILE C C 44 176.060 176.060 174.592 1.468 17919 100940 1 246 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.044 -1.064 17919 100941 1 246 . 1 1 44 44 ILE CB C 44 41.420 41.420 40.929 0.491 17919 100942 1 246 . 1 1 44 44 ILE H H 44 9.030 9.030 8.700 0.330 17919 100943 1 246 . 1 1 45 45 PHE N N 45 125.390 125.390 127.846 -2.456 17919 100944 1 246 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.958 0.087 17919 100945 1 246 . 1 1 45 45 PHE C C 45 174.470 174.470 174.379 0.091 17919 100946 1 246 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.489 0.531 17919 100947 1 246 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.913 0.846 17919 100948 1 246 . 1 1 45 45 PHE H H 45 8.830 8.830 8.447 0.383 17919 100949 1 246 . 1 1 46 46 ALA N N 46 132.200 132.200 129.592 2.608 17919 100950 1 246 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.664 0.026 17919 100951 1 246 . 1 1 46 46 ALA C C 46 177.290 177.290 177.540 -0.250 17919 100952 1 246 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.419 0.121 17919 100953 1 246 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.564 0.007 17919 100954 1 246 . 1 1 46 46 ALA H H 46 8.810 8.810 8.828 -0.018 17919 100955 1 246 . 1 1 47 47 GLY N N 47 102.340 102.340 104.047 -1.707 17919 100956 1 246 . 1 1 47 47 GLY C C 47 173.810 173.810 174.468 -0.658 17919 100957 1 246 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.905 0.445 17919 100958 1 246 . 1 1 47 47 GLY H H 47 8.130 8.130 8.429 -0.299 17919 100959 1 246 . 1 1 48 48 LYS N N 48 121.570 121.570 121.875 -0.305 17919 100960 1 246 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.602 0.020 17919 100961 1 246 . 1 1 48 48 LYS C C 48 174.700 174.700 175.610 -0.910 17919 100962 1 246 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.084 0.466 17919 100963 1 246 . 1 1 48 48 LYS CB C 48 34.530 34.530 33.505 1.025 17919 100964 1 246 . 1 1 48 48 LYS H H 48 7.980 7.980 7.718 0.263 17919 100965 1 246 . 1 1 49 49 GLN N N 49 122.410 122.410 121.845 0.565 17919 100966 1 246 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.623 -0.063 17919 100967 1 246 . 1 1 49 49 GLN C C 49 175.670 175.670 176.043 -0.373 17919 100968 1 246 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.906 -0.166 17919 100969 1 246 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.181 -0.181 17919 100970 1 246 . 1 1 49 49 GLN H H 49 8.600 8.600 8.495 0.105 17919 100971 1 246 . 1 1 50 50 LEU N N 50 125.520 125.520 128.091 -2.571 17919 100972 1 246 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.156 -0.066 17919 100973 1 246 . 1 1 50 50 LEU C C 50 176.660 176.660 176.956 -0.296 17919 100974 1 246 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.663 -0.423 17919 100975 1 246 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.291 -0.722 17919 100976 1 246 . 1 1 50 50 LEU H H 50 8.530 8.530 8.628 -0.098 17919 100977 1 246 . 1 1 51 51 GLU N N 51 122.940 122.940 122.063 0.877 17919 100978 1 246 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.602 -0.114 17919 100979 1 246 . 1 1 51 51 GLU C C 51 175.870 175.870 176.937 -1.067 17919 100980 1 246 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.585 0.375 17919 100981 1 246 . 1 1 51 51 GLU CB C 51 31.570 31.570 30.873 0.697 17919 100982 1 246 . 1 1 51 51 GLU H H 51 8.400 8.400 9.258 -0.858 17919 100983 1 246 . 1 1 52 52 ASP N N 52 120.030 120.030 125.158 -5.128 17919 100984 1 246 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.481 -0.122 17919 100985 1 246 . 1 1 52 52 ASP C C 52 177.330 177.330 177.191 0.139 17919 100986 1 246 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.246 -0.286 17919 100987 1 246 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.745 0.105 17919 100988 1 246 . 1 1 52 52 ASP H H 52 8.160 8.160 8.830 -0.670 17919 100989 1 246 . 1 1 53 53 GLY N N 53 106.660 106.660 105.638 1.022 17919 100990 1 246 . 1 1 53 53 GLY C C 53 174.870 174.870 174.844 0.026 17919 100991 1 246 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.554 0.615 17919 100992 1 246 . 1 1 53 53 GLY H H 53 9.390 9.390 8.271 1.119 17919 100993 1 246 . 1 1 54 54 ARG N N 54 119.050 119.050 120.941 -1.891 17919 100994 1 246 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.659 0.036 17919 100995 1 246 . 1 1 54 54 ARG C C 54 175.350 175.350 176.036 -0.686 17919 100996 1 246 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.354 0.036 17919 100997 1 246 . 1 1 54 54 ARG CB C 54 32.650 32.650 31.290 1.360 17919 100998 1 246 . 1 1 54 54 ARG H H 54 7.460 7.460 7.605 -0.145 17919 100999 1 246 . 1 1 55 55 THR N N 55 108.400 108.400 111.640 -3.240 17919 101000 1 246 . 1 1 55 55 THR HA H 55 5.240 5.240 5.104 0.136 17919 101001 1 246 . 1 1 55 55 THR C C 55 176.560 176.560 176.221 0.339 17919 101002 1 246 . 1 1 55 55 THR CA C 55 59.690 59.690 59.794 -0.104 17919 101003 1 246 . 1 1 55 55 THR CB C 55 72.260 72.260 71.425 0.835 17919 101004 1 246 . 1 1 55 55 THR H H 55 8.730 8.730 9.015 -0.285 17919 101005 1 246 . 1 1 56 56 LEU N N 56 117.920 117.920 122.490 -4.570 17919 101006 1 246 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.799 0.261 17919 101007 1 246 . 1 1 56 56 LEU C C 56 180.810 180.810 178.696 2.114 17919 101008 1 246 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.574 0.136 17919 101009 1 246 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.416 -1.046 17919 101010 1 246 . 1 1 56 56 LEU H H 56 8.140 8.140 8.419 -0.279 17919 101011 1 246 . 1 1 57 57 SER N N 57 113.330 113.330 114.340 -1.010 17919 101012 1 246 . 1 1 57 57 SER HA H 57 4.370 4.370 4.161 0.209 17919 101013 1 246 . 1 1 57 57 SER C C 57 178.310 178.310 176.758 1.552 17919 101014 1 246 . 1 1 57 57 SER CA C 57 61.080 61.080 62.063 -0.983 17919 101015 1 246 . 1 1 57 57 SER CB C 57 62.530 62.530 62.821 -0.291 17919 101016 1 246 . 1 1 57 57 SER H H 57 8.470 8.470 7.963 0.507 17919 101017 1 246 . 1 1 58 58 ASP N N 58 124.190 124.190 122.007 2.183 17919 101018 1 246 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.342 -0.046 17919 101019 1 246 . 1 1 58 58 ASP C C 58 177.400 177.400 177.140 0.260 17919 101020 1 246 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.675 0.505 17919 101021 1 246 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.210 -0.110 17919 101022 1 246 . 1 1 58 58 ASP H H 58 7.930 7.930 7.646 0.284 17919 101023 1 246 . 1 1 59 59 TYR N N 59 115.510 115.510 115.871 -0.361 17919 101024 1 246 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.667 0.003 17919 101025 1 246 . 1 1 59 59 TYR C C 59 174.700 174.700 174.907 -0.207 17919 101026 1 246 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.236 1.014 17919 101027 1 246 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.578 1.492 17919 101028 1 246 . 1 1 59 59 TYR H H 59 7.250 7.250 7.288 -0.038 17919 101029 1 246 . 1 1 60 60 ASN N N 60 115.900 115.900 118.652 -2.752 17919 101030 1 246 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.359 -0.004 17919 101031 1 246 . 1 1 60 60 ASN C C 60 174.340 174.340 174.486 -0.146 17919 101032 1 246 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.227 -0.107 17919 101033 1 246 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.133 0.277 17919 101034 1 246 . 1 1 60 60 ASN H H 60 8.150 8.150 7.881 0.269 17919 101035 1 246 . 1 1 61 61 ILE N N 61 118.600 118.600 119.034 -0.434 17919 101036 1 246 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.995 -0.602 17919 101037 1 246 . 1 1 61 61 ILE C C 61 174.610 174.610 175.164 -0.554 17919 101038 1 246 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.023 1.397 17919 101039 1 246 . 1 1 61 61 ILE CB C 61 36.740 36.740 38.289 -1.549 17919 101040 1 246 . 1 1 61 61 ILE H H 61 7.250 7.250 7.857 -0.607 17919 101041 1 246 . 1 1 62 62 GLN N N 62 124.740 124.740 127.253 -2.513 17919 101042 1 246 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.668 -0.162 17919 101043 1 246 . 1 1 62 62 GLN C C 62 175.970 175.970 175.415 0.555 17919 101044 1 246 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.601 0.059 17919 101045 1 246 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.296 0.354 17919 101046 1 246 . 1 1 62 62 GLN H H 62 7.610 7.610 8.326 -0.716 17919 101047 1 246 . 1 1 63 63 LYS N N 63 120.300 120.300 121.431 -1.131 17919 101048 1 246 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.195 -0.194 17919 101049 1 246 . 1 1 63 63 LYS C C 63 175.810 175.810 176.772 -0.962 17919 101050 1 246 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.423 0.367 17919 101051 1 246 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.868 0.782 17919 101052 1 246 . 1 1 63 63 LYS H H 63 8.490 8.490 8.496 -0.006 17919 101053 1 246 . 1 1 64 64 GLU N N 64 113.950 113.950 119.008 -5.058 17919 101054 1 246 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.726 -0.261 17919 101055 1 246 . 1 1 64 64 GLU C C 64 175.250 175.250 176.268 -1.018 17919 101056 1 246 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.855 0.035 17919 101057 1 246 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.379 -2.479 17919 101058 1 246 . 1 1 64 64 GLU H H 64 9.280 9.280 8.781 0.499 17919 101059 1 246 . 1 1 65 65 SER N N 65 114.730 114.730 116.149 -1.419 17919 101060 1 246 . 1 1 65 65 SER HA H 65 4.640 4.640 4.466 0.174 17919 101061 1 246 . 1 1 65 65 SER C C 65 172.160 172.160 173.811 -1.651 17919 101062 1 246 . 1 1 65 65 SER CA C 65 60.890 60.890 60.394 0.496 17919 101063 1 246 . 1 1 65 65 SER CB C 65 64.910 64.910 64.105 0.805 17919 101064 1 246 . 1 1 65 65 SER H H 65 7.670 7.670 7.533 0.137 17919 101065 1 246 . 1 1 66 66 THR N N 66 117.110 117.110 118.936 -1.826 17919 101066 1 246 . 1 1 66 66 THR HA H 66 5.270 5.270 5.179 0.091 17919 101067 1 246 . 1 1 66 66 THR C C 66 173.950 173.950 174.483 -0.533 17919 101068 1 246 . 1 1 66 66 THR CA C 66 62.340 62.340 61.957 0.383 17919 101069 1 246 . 1 1 66 66 THR CB C 66 70.080 70.080 70.544 -0.464 17919 101070 1 246 . 1 1 66 66 THR H H 66 8.730 8.730 8.416 0.314 17919 101071 1 246 . 1 1 67 67 LEU N N 67 127.110 127.110 127.168 -0.058 17919 101072 1 246 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.773 0.287 17919 101073 1 246 . 1 1 67 67 LEU C C 67 175.770 175.770 175.223 0.547 17919 101074 1 246 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.275 -0.375 17919 101075 1 246 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.082 0.178 17919 101076 1 246 . 1 1 67 67 LEU H H 67 9.410 9.410 9.067 0.343 17919 101077 1 246 . 1 1 68 68 HIS N N 68 118.380 118.380 121.786 -3.406 17919 101078 1 246 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.383 -0.143 17919 101079 1 246 . 1 1 68 68 HIS C C 68 173.150 173.150 174.237 -1.087 17919 101080 1 246 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.152 0.848 17919 101081 1 246 . 1 1 68 68 HIS CB C 68 30.530 30.530 31.940 -1.410 17919 101082 1 246 . 1 1 68 68 HIS H H 68 9.230 9.230 8.878 0.352 17919 101083 1 246 . 1 1 69 69 LEU N N 69 124.460 124.460 130.512 -6.052 17919 101084 1 246 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.998 0.192 17919 101085 1 246 . 1 1 69 69 LEU C C 69 175.270 175.270 174.610 0.660 17919 101086 1 246 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.121 -0.231 17919 101087 1 246 . 1 1 69 69 LEU CB C 69 44.380 44.380 43.578 0.802 17919 101088 1 246 . 1 1 69 69 LEU H H 69 8.340 8.340 8.240 0.100 17919 101089 1 246 . 1 1 70 70 VAL N N 70 126.940 126.940 123.856 3.084 17919 101090 1 246 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.479 -0.129 17919 101091 1 246 . 1 1 70 70 VAL C C 70 174.000 174.000 173.619 0.381 17919 101092 1 246 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.060 0.740 17919 101093 1 246 . 1 1 70 70 VAL CB C 70 34.910 34.910 36.239 -1.329 17919 101094 1 246 . 1 1 70 70 VAL H H 70 9.200 9.200 8.949 0.251 17919 101095 1 246 . 1 1 71 71 LEU N N 71 123.130 123.130 121.290 1.840 17919 101096 1 246 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.038 0.022 17919 101097 1 246 . 1 1 71 71 LEU C C 71 177.830 177.830 177.161 0.669 17919 101098 1 246 . 1 1 71 71 LEU CA C 71 53.940 53.940 52.452 1.488 17919 101099 1 246 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.828 0.022 17919 101100 1 246 . 1 1 71 71 LEU H H 71 8.120 8.120 8.115 0.005 17919 101101 1 246 . 1 1 72 72 ARG N N 72 123.490 123.490 124.098 -0.608 17919 101102 1 246 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.020 0.281 17919 101103 1 246 . 1 1 72 72 ARG C C 72 175.350 175.350 175.578 -0.228 17919 101104 1 246 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.999 -1.389 17919 101105 1 246 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.059 1.291 17919 101106 1 246 . 1 1 72 72 ARG H H 72 8.580 8.580 8.130 0.450 17919 101107 1 247 . 1 1 2 2 GLN N N 2 123.220 123.220 121.649 1.571 17919 101108 1 247 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.275 -0.026 17919 101109 1 247 . 1 1 2 2 GLN C C 2 175.920 175.920 175.710 0.210 17919 101110 1 247 . 1 1 2 2 GLN CA C 2 55.080 55.080 55.426 -0.346 17919 101111 1 247 . 1 1 2 2 GLN CB C 2 30.760 30.760 29.462 1.298 17919 101112 1 247 . 1 1 2 2 GLN H H 2 8.900 8.900 8.439 0.461 17919 101113 1 247 . 1 1 3 3 ILE N N 3 115.340 115.340 117.436 -2.096 17919 101114 1 247 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.578 -0.365 17919 101115 1 247 . 1 1 3 3 ILE C C 3 172.450 172.450 173.481 -1.031 17919 101116 1 247 . 1 1 3 3 ILE CA C 3 59.570 59.570 58.999 0.571 17919 101117 1 247 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.404 0.806 17919 101118 1 247 . 1 1 3 3 ILE H H 3 8.320 8.320 8.465 -0.145 17919 101119 1 247 . 1 1 4 4 PHE N N 4 118.110 118.110 120.890 -2.780 17919 101120 1 247 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.575 0.055 17919 101121 1 247 . 1 1 4 4 PHE C C 4 175.320 175.320 175.557 -0.237 17919 101122 1 247 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.368 -0.158 17919 101123 1 247 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.715 -0.235 17919 101124 1 247 . 1 1 4 4 PHE H H 4 8.610 8.610 8.275 0.335 17919 101125 1 247 . 1 1 5 5 VAL N N 5 121.000 121.000 121.983 -0.983 17919 101126 1 247 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.653 0.072 17919 101127 1 247 . 1 1 5 5 VAL C C 5 174.870 174.870 174.447 0.423 17919 101128 1 247 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.322 -0.702 17919 101129 1 247 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.060 0.170 17919 101130 1 247 . 1 1 5 5 VAL H H 5 9.300 9.300 9.245 0.055 17919 101131 1 247 . 1 1 6 6 LYS N N 6 127.520 127.520 129.022 -1.502 17919 101132 1 247 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.283 0.084 17919 101133 1 247 . 1 1 6 6 LYS C C 6 177.140 177.140 176.618 0.522 17919 101134 1 247 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.123 0.397 17919 101135 1 247 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.538 -0.488 17919 101136 1 247 . 1 1 6 6 LYS H H 6 8.820 8.820 9.224 -0.404 17919 101137 1 247 . 1 1 7 7 THR N N 7 115.400 115.400 118.856 -3.456 17919 101138 1 247 . 1 1 7 7 THR HA H 7 4.970 4.970 4.545 0.425 17919 101139 1 247 . 1 1 7 7 THR C C 7 176.910 176.910 176.498 0.412 17919 101140 1 247 . 1 1 7 7 THR CA C 7 60.470 60.470 61.540 -1.070 17919 101141 1 247 . 1 1 7 7 THR CB C 7 70.630 70.630 70.013 0.617 17919 101142 1 247 . 1 1 7 7 THR H H 7 8.730 8.730 8.710 0.020 17919 101143 1 247 . 1 1 8 8 LEU N N 8 121.330 121.330 123.116 -1.786 17919 101144 1 247 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.181 0.129 17919 101145 1 247 . 1 1 8 8 LEU C C 8 178.800 178.800 178.023 0.777 17919 101146 1 247 . 1 1 8 8 LEU CA C 8 57.580 57.580 58.294 -0.714 17919 101147 1 247 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.839 0.131 17919 101148 1 247 . 1 1 8 8 LEU H H 8 9.100 9.100 8.379 0.721 17919 101149 1 247 . 1 1 9 9 THR N N 9 105.590 105.590 107.089 -1.499 17919 101150 1 247 . 1 1 9 9 THR HA H 9 4.428 4.428 4.277 0.151 17919 101151 1 247 . 1 1 9 9 THR C C 9 175.520 175.520 175.315 0.205 17919 101152 1 247 . 1 1 9 9 THR CA C 9 61.400 61.400 62.685 -1.285 17919 101153 1 247 . 1 1 9 9 THR CB C 9 69.140 69.140 68.676 0.464 17919 101154 1 247 . 1 1 9 9 THR H H 9 7.630 7.630 7.912 -0.282 17919 101155 1 247 . 1 1 10 10 GLY N N 10 108.890 108.890 109.838 -0.948 17919 101156 1 247 . 1 1 10 10 GLY C C 10 174.070 174.070 173.689 0.381 17919 101157 1 247 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.694 0.766 17919 101158 1 247 . 1 1 10 10 GLY H H 10 7.810 7.810 7.659 0.151 17919 101159 1 247 . 1 1 11 11 LYS N N 11 121.600 121.600 122.891 -1.291 17919 101160 1 247 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.466 -0.105 17919 101161 1 247 . 1 1 11 11 LYS C C 11 175.940 175.940 175.673 0.267 17919 101162 1 247 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.043 0.237 17919 101163 1 247 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.712 -0.512 17919 101164 1 247 . 1 1 11 11 LYS H H 11 7.280 7.280 8.148 -0.868 17919 101165 1 247 . 1 1 12 12 THR N N 12 120.440 120.440 117.258 3.182 17919 101166 1 247 . 1 1 12 12 THR HA H 12 5.046 5.046 5.308 -0.262 17919 101167 1 247 . 1 1 12 12 THR C C 12 174.320 174.320 174.934 -0.614 17919 101168 1 247 . 1 1 12 12 THR CA C 12 62.390 62.390 60.586 1.804 17919 101169 1 247 . 1 1 12 12 THR CB C 12 69.910 69.910 69.996 -0.086 17919 101170 1 247 . 1 1 12 12 THR H H 12 8.650 8.650 8.228 0.422 17919 101171 1 247 . 1 1 13 13 ILE N N 13 127.110 127.110 118.377 8.733 17919 101172 1 247 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.697 -0.153 17919 101173 1 247 . 1 1 13 13 ILE C C 13 175.220 175.220 174.979 0.241 17919 101174 1 247 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.348 0.632 17919 101175 1 247 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.273 -0.322 17919 101176 1 247 . 1 1 13 13 ILE H H 13 9.450 9.450 9.076 0.374 17919 101177 1 247 . 1 1 14 14 THR N N 14 121.520 121.520 120.897 0.623 17919 101178 1 247 . 1 1 14 14 THR HA H 14 4.964 4.964 4.820 0.144 17919 101179 1 247 . 1 1 14 14 THR C C 14 173.790 173.790 173.884 -0.094 17919 101180 1 247 . 1 1 14 14 THR CA C 14 61.940 61.940 62.162 -0.222 17919 101181 1 247 . 1 1 14 14 THR CB C 14 69.650 69.650 69.518 0.132 17919 101182 1 247 . 1 1 14 14 THR H H 14 8.710 8.710 8.489 0.221 17919 101183 1 247 . 1 1 15 15 LEU N N 15 124.800 124.800 127.313 -2.513 17919 101184 1 247 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.748 0.032 17919 101185 1 247 . 1 1 15 15 LEU C C 15 174.670 174.670 175.246 -0.576 17919 101186 1 247 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.472 -0.642 17919 101187 1 247 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.473 1.597 17919 101188 1 247 . 1 1 15 15 LEU H H 15 8.710 8.710 8.673 0.037 17919 101189 1 247 . 1 1 16 16 GLU N N 16 122.160 122.160 122.919 -0.759 17919 101190 1 247 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.960 -0.043 17919 101191 1 247 . 1 1 16 16 GLU C C 16 175.860 175.860 175.864 -0.004 17919 101192 1 247 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.239 -0.419 17919 101193 1 247 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.341 -0.891 17919 101194 1 247 . 1 1 16 16 GLU H H 16 8.140 8.140 8.595 -0.455 17919 101195 1 247 . 1 1 17 17 VAL N N 17 117.210 117.210 121.195 -3.985 17919 101196 1 247 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.634 0.080 17919 101197 1 247 . 1 1 17 17 VAL C C 17 174.160 174.160 175.133 -0.973 17919 101198 1 247 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.690 -0.260 17919 101199 1 247 . 1 1 17 17 VAL CB C 17 36.400 36.400 34.928 1.472 17919 101200 1 247 . 1 1 17 17 VAL H H 17 8.900 8.900 8.500 0.400 17919 101201 1 247 . 1 1 18 18 GLU N N 18 118.990 118.990 119.008 -0.018 17919 101202 1 247 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.855 0.224 17919 101203 1 247 . 1 1 18 18 GLU C C 18 176.160 176.160 175.668 0.492 17919 101204 1 247 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.695 0.025 17919 101205 1 247 . 1 1 18 18 GLU CB C 18 30.310 30.310 29.871 0.439 17919 101206 1 247 . 1 1 18 18 GLU H H 18 8.640 8.640 8.115 0.525 17919 101207 1 247 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.233 -0.092 17919 101208 1 247 . 1 1 19 19 PRO C C 19 175.310 175.310 178.007 -2.697 17919 101209 1 247 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.628 -0.158 17919 101210 1 247 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.973 -0.023 17919 101211 1 247 . 1 1 20 20 SER N N 20 103.400 103.400 108.761 -5.361 17919 101212 1 247 . 1 1 20 20 SER HA H 20 4.370 4.370 4.294 0.076 17919 101213 1 247 . 1 1 20 20 SER C C 20 174.660 174.660 174.842 -0.182 17919 101214 1 247 . 1 1 20 20 SER CA C 20 57.400 57.400 59.269 -1.869 17919 101215 1 247 . 1 1 20 20 SER CB C 20 63.370 63.370 62.619 0.751 17919 101216 1 247 . 1 1 20 20 SER H H 20 7.040 7.040 8.127 -1.087 17919 101217 1 247 . 1 1 21 21 ASP N N 21 123.480 123.480 124.609 -1.129 17919 101218 1 247 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.680 0.015 17919 101219 1 247 . 1 1 21 21 ASP C C 21 176.360 176.360 176.135 0.225 17919 101220 1 247 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.236 0.464 17919 101221 1 247 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.631 -0.831 17919 101222 1 247 . 1 1 21 21 ASP H H 21 8.030 8.030 7.727 0.303 17919 101223 1 247 . 1 1 22 22 THR N N 22 108.800 108.800 111.626 -2.826 17919 101224 1 247 . 1 1 22 22 THR HA H 22 4.920 4.920 5.047 -0.127 17919 101225 1 247 . 1 1 22 22 THR C C 22 176.750 176.750 176.190 0.560 17919 101226 1 247 . 1 1 22 22 THR CA C 22 59.690 59.690 60.528 -0.838 17919 101227 1 247 . 1 1 22 22 THR CB C 22 71.200 71.200 71.327 -0.127 17919 101228 1 247 . 1 1 22 22 THR H H 22 7.900 7.900 7.963 -0.063 17919 101229 1 247 . 1 1 23 23 ILE N N 23 121.190 121.190 122.489 -1.299 17919 101230 1 247 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.730 -0.073 17919 101231 1 247 . 1 1 23 23 ILE C C 23 179.040 179.040 177.694 1.346 17919 101232 1 247 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.785 -0.525 17919 101233 1 247 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.225 -1.875 17919 101234 1 247 . 1 1 23 23 ILE H H 23 8.560 8.560 8.590 -0.030 17919 101235 1 247 . 1 1 24 24 GLU N N 24 120.830 120.830 120.862 -0.032 17919 101236 1 247 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.831 0.086 17919 101237 1 247 . 1 1 24 24 GLU C C 24 178.640 178.640 178.662 -0.022 17919 101238 1 247 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.067 0.153 17919 101239 1 247 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.404 -1.124 17919 101240 1 247 . 1 1 24 24 GLU H H 24 9.760 9.760 7.911 1.849 17919 101241 1 247 . 1 1 25 25 ASN N N 25 120.570 120.570 117.288 3.282 17919 101242 1 247 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.497 0.028 17919 101243 1 247 . 1 1 25 25 ASN C C 25 178.380 178.380 178.001 0.379 17919 101244 1 247 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.101 -0.041 17919 101245 1 247 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.915 -0.465 17919 101246 1 247 . 1 1 25 25 ASN H H 25 7.920 7.920 7.860 0.060 17919 101247 1 247 . 1 1 26 26 VAL N N 26 121.710 121.710 121.076 0.634 17919 101248 1 247 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.579 -0.182 17919 101249 1 247 . 1 1 26 26 VAL C C 26 177.950 177.950 177.395 0.555 17919 101250 1 247 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.558 1.102 17919 101251 1 247 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.734 -0.894 17919 101252 1 247 . 1 1 26 26 VAL H H 26 8.070 8.070 7.984 0.086 17919 101253 1 247 . 1 1 27 27 LYS N N 27 118.860 118.860 120.897 -2.037 17919 101254 1 247 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.063 0.517 17919 101255 1 247 . 1 1 27 27 LYS C C 27 180.550 180.550 178.778 1.772 17919 101256 1 247 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.799 -0.549 17919 101257 1 247 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.378 1.352 17919 101258 1 247 . 1 1 27 27 LYS H H 27 8.560 8.560 8.521 0.039 17919 101259 1 247 . 1 1 28 28 ALA N N 28 123.440 123.440 119.970 3.470 17919 101260 1 247 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.153 0.007 17919 101261 1 247 . 1 1 28 28 ALA C C 28 180.300 180.300 179.508 0.792 17919 101262 1 247 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.914 0.456 17919 101263 1 247 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.482 -0.772 17919 101264 1 247 . 1 1 28 28 ALA H H 28 8.060 8.060 7.998 0.062 17919 101265 1 247 . 1 1 29 29 LYS N N 29 119.940 119.940 119.336 0.604 17919 101266 1 247 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.050 0.157 17919 101267 1 247 . 1 1 29 29 LYS C C 29 180.320 180.320 179.047 1.273 17919 101268 1 247 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.284 0.366 17919 101269 1 247 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.306 0.984 17919 101270 1 247 . 1 1 29 29 LYS H H 29 7.850 7.850 7.549 0.301 17919 101271 1 247 . 1 1 30 30 ILE N N 30 121.080 121.080 120.999 0.081 17919 101272 1 247 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.591 -0.084 17919 101273 1 247 . 1 1 30 30 ILE C C 30 178.310 178.310 177.315 0.995 17919 101274 1 247 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.518 0.632 17919 101275 1 247 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.732 -0.932 17919 101276 1 247 . 1 1 30 30 ILE H H 30 8.280 8.280 8.308 -0.028 17919 101277 1 247 . 1 1 31 31 GLN N N 31 123.490 123.490 120.728 2.762 17919 101278 1 247 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.059 -0.230 17919 101279 1 247 . 1 1 31 31 GLN C C 31 178.890 178.890 178.377 0.513 17919 101280 1 247 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.028 0.973 17919 101281 1 247 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.443 -0.723 17919 101282 1 247 . 1 1 31 31 GLN H H 31 8.580 8.580 8.060 0.520 17919 101283 1 247 . 1 1 32 32 ASP N N 32 119.360 119.360 119.903 -0.543 17919 101284 1 247 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.395 -0.041 17919 101285 1 247 . 1 1 32 32 ASP C C 32 177.250 177.250 177.937 -0.687 17919 101286 1 247 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.771 0.419 17919 101287 1 247 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.887 -0.307 17919 101288 1 247 . 1 1 32 32 ASP H H 32 8.010 8.010 8.026 -0.016 17919 101289 1 247 . 1 1 33 33 LYS N N 33 115.130 115.130 118.001 -2.871 17919 101290 1 247 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.194 0.143 17919 101291 1 247 . 1 1 33 33 LYS C C 33 177.870 177.870 177.902 -0.032 17919 101292 1 247 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.479 -0.429 17919 101293 1 247 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.122 1.048 17919 101294 1 247 . 1 1 33 33 LYS H H 33 7.430 7.430 7.775 -0.345 17919 101295 1 247 . 1 1 34 34 GLU N N 34 113.870 113.870 114.731 -0.861 17919 101296 1 247 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.502 0.123 17919 101297 1 247 . 1 1 34 34 GLU C C 34 177.840 177.840 176.909 0.931 17919 101298 1 247 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.131 -0.961 17919 101299 1 247 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.456 1.204 17919 101300 1 247 . 1 1 34 34 GLU H H 34 8.740 8.740 8.032 0.708 17919 101301 1 247 . 1 1 35 35 GLY N N 35 108.650 108.650 108.365 0.285 17919 101302 1 247 . 1 1 35 35 GLY C C 35 173.960 173.960 174.507 -0.547 17919 101303 1 247 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.494 0.586 17919 101304 1 247 . 1 1 35 35 GLY H H 35 8.530 8.530 8.094 0.436 17919 101305 1 247 . 1 1 36 36 ILE N N 36 119.880 119.880 122.978 -3.098 17919 101306 1 247 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.218 0.227 17919 101307 1 247 . 1 1 36 36 ILE C C 36 173.590 173.590 174.451 -0.861 17919 101308 1 247 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.567 -0.817 17919 101309 1 247 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.038 2.542 17919 101310 1 247 . 1 1 36 36 ILE H H 36 6.150 6.150 7.772 -1.622 17919 101311 1 247 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.512 0.122 17919 101312 1 247 . 1 1 37 37 PRO C C 37 176.940 176.940 176.029 0.911 17919 101313 1 247 . 1 1 37 37 PRO CA C 37 61.660 61.660 62.208 -0.548 17919 101314 1 247 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.170 0.680 17919 101315 1 247 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.100 0.017 17919 101316 1 247 . 1 1 38 38 PRO C C 38 178.320 178.320 178.860 -0.540 17919 101317 1 247 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.961 0.299 17919 101318 1 247 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.853 1.037 17919 101319 1 247 . 1 1 39 39 ASP N N 39 113.380 113.380 116.044 -2.664 17919 101320 1 247 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.313 0.117 17919 101321 1 247 . 1 1 39 39 ASP C C 39 177.090 177.090 178.107 -1.017 17919 101322 1 247 . 1 1 39 39 ASP CA C 39 55.640 55.640 57.033 -1.393 17919 101323 1 247 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.370 -0.830 17919 101324 1 247 . 1 1 39 39 ASP H H 39 8.550 8.550 8.669 -0.119 17919 101325 1 247 . 1 1 40 40 GLN N N 40 116.780 116.780 116.598 0.182 17919 101326 1 247 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.195 0.269 17919 101327 1 247 . 1 1 40 40 GLN C C 40 175.380 175.380 176.634 -1.254 17919 101328 1 247 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.732 -1.092 17919 101329 1 247 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.012 1.128 17919 101330 1 247 . 1 1 40 40 GLN H H 40 7.820 7.820 8.079 -0.259 17919 101331 1 247 . 1 1 41 41 GLN N N 41 117.720 117.720 118.988 -1.268 17919 101332 1 247 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.295 -0.051 17919 101333 1 247 . 1 1 41 41 GLN C C 41 176.300 176.300 175.805 0.495 17919 101334 1 247 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.545 -0.075 17919 101335 1 247 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.586 2.064 17919 101336 1 247 . 1 1 41 41 GLN H H 41 7.480 7.480 7.694 -0.214 17919 101337 1 247 . 1 1 42 42 ARG N N 42 122.680 122.680 123.391 -0.711 17919 101338 1 247 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.617 -0.117 17919 101339 1 247 . 1 1 42 42 ARG C C 42 174.050 174.050 174.592 -0.542 17919 101340 1 247 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.898 0.152 17919 101341 1 247 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.742 -0.992 17919 101342 1 247 . 1 1 42 42 ARG H H 42 8.530 8.530 8.810 -0.280 17919 101343 1 247 . 1 1 43 43 LEU N N 43 124.040 124.040 126.092 -2.052 17919 101344 1 247 . 1 1 43 43 LEU C C 43 175.290 175.290 175.359 -0.069 17919 101345 1 247 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.076 -1.096 17919 101346 1 247 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.252 2.538 17919 101347 1 247 . 1 1 43 43 LEU H H 43 8.820 8.820 8.916 -0.096 17919 101348 1 247 . 1 1 44 44 ILE N N 44 121.920 121.920 121.858 0.062 17919 101349 1 247 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.080 -0.088 17919 101350 1 247 . 1 1 44 44 ILE C C 44 176.060 176.060 174.069 1.991 17919 101351 1 247 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.304 -1.325 17919 101352 1 247 . 1 1 44 44 ILE CB C 44 41.420 41.420 42.295 -0.875 17919 101353 1 247 . 1 1 44 44 ILE H H 44 9.030 9.030 8.681 0.349 17919 101354 1 247 . 1 1 45 45 PHE N N 45 125.390 125.390 126.802 -1.412 17919 101355 1 247 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.048 -0.003 17919 101356 1 247 . 1 1 45 45 PHE C C 45 174.470 174.470 174.421 0.049 17919 101357 1 247 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.470 0.550 17919 101358 1 247 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.514 1.246 17919 101359 1 247 . 1 1 45 45 PHE H H 45 8.830 8.830 9.067 -0.237 17919 101360 1 247 . 1 1 46 46 ALA N N 46 132.200 132.200 131.061 1.139 17919 101361 1 247 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.630 0.060 17919 101362 1 247 . 1 1 46 46 ALA C C 46 177.290 177.290 177.197 0.093 17919 101363 1 247 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.649 -0.109 17919 101364 1 247 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.744 -0.174 17919 101365 1 247 . 1 1 46 46 ALA H H 46 8.810 8.810 9.046 -0.236 17919 101366 1 247 . 1 1 47 47 GLY N N 47 102.340 102.340 103.598 -1.258 17919 101367 1 247 . 1 1 47 47 GLY C C 47 173.810 173.810 174.293 -0.483 17919 101368 1 247 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.277 0.073 17919 101369 1 247 . 1 1 47 47 GLY H H 47 8.130 8.130 8.488 -0.358 17919 101370 1 247 . 1 1 48 48 LYS N N 48 121.570 121.570 121.088 0.482 17919 101371 1 247 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.579 0.043 17919 101372 1 247 . 1 1 48 48 LYS C C 48 174.700 174.700 175.836 -1.136 17919 101373 1 247 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.985 -0.435 17919 101374 1 247 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.140 0.390 17919 101375 1 247 . 1 1 48 48 LYS H H 48 7.980 7.980 7.866 0.114 17919 101376 1 247 . 1 1 49 49 GLN N N 49 122.410 122.410 123.210 -0.800 17919 101377 1 247 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.149 0.411 17919 101378 1 247 . 1 1 49 49 GLN C C 49 175.670 175.670 175.703 -0.033 17919 101379 1 247 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.507 -0.767 17919 101380 1 247 . 1 1 49 49 GLN CB C 49 29.000 29.000 28.966 0.034 17919 101381 1 247 . 1 1 49 49 GLN H H 49 8.600 8.600 8.615 -0.015 17919 101382 1 247 . 1 1 50 50 LEU N N 50 125.520 125.520 128.225 -2.705 17919 101383 1 247 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.179 -0.089 17919 101384 1 247 . 1 1 50 50 LEU C C 50 176.660 176.660 176.347 0.313 17919 101385 1 247 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.201 0.039 17919 101386 1 247 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.892 -0.322 17919 101387 1 247 . 1 1 50 50 LEU H H 50 8.530 8.530 8.597 -0.067 17919 101388 1 247 . 1 1 51 51 GLU N N 51 122.940 122.940 124.714 -1.774 17919 101389 1 247 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.580 -0.092 17919 101390 1 247 . 1 1 51 51 GLU C C 51 175.870 175.870 177.081 -1.211 17919 101391 1 247 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.407 0.552 17919 101392 1 247 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.330 0.240 17919 101393 1 247 . 1 1 51 51 GLU H H 51 8.400 8.400 8.658 -0.258 17919 101394 1 247 . 1 1 52 52 ASP N N 52 120.030 120.030 125.981 -5.951 17919 101395 1 247 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.293 0.066 17919 101396 1 247 . 1 1 52 52 ASP C C 52 177.330 177.330 178.220 -0.890 17919 101397 1 247 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.532 -0.572 17919 101398 1 247 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.452 0.398 17919 101399 1 247 . 1 1 52 52 ASP H H 52 8.160 8.160 8.989 -0.829 17919 101400 1 247 . 1 1 53 53 GLY N N 53 106.660 106.660 106.973 -0.313 17919 101401 1 247 . 1 1 53 53 GLY C C 53 174.870 174.870 173.982 0.888 17919 101402 1 247 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.061 0.109 17919 101403 1 247 . 1 1 53 53 GLY H H 53 9.390 9.390 8.645 0.745 17919 101404 1 247 . 1 1 54 54 ARG N N 54 119.050 119.050 120.205 -1.155 17919 101405 1 247 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.622 0.073 17919 101406 1 247 . 1 1 54 54 ARG C C 54 175.350 175.350 175.205 0.145 17919 101407 1 247 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.480 -0.090 17919 101408 1 247 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.421 -0.771 17919 101409 1 247 . 1 1 54 54 ARG H H 54 7.460 7.460 7.557 -0.097 17919 101410 1 247 . 1 1 55 55 THR N N 55 108.400 108.400 111.622 -3.222 17919 101411 1 247 . 1 1 55 55 THR HA H 55 5.240 5.240 5.095 0.145 17919 101412 1 247 . 1 1 55 55 THR C C 55 176.560 176.560 176.054 0.506 17919 101413 1 247 . 1 1 55 55 THR CA C 55 59.690 59.690 60.432 -0.743 17919 101414 1 247 . 1 1 55 55 THR CB C 55 72.260 72.260 70.725 1.535 17919 101415 1 247 . 1 1 55 55 THR H H 55 8.730 8.730 8.819 -0.089 17919 101416 1 247 . 1 1 56 56 LEU N N 56 117.920 117.920 121.100 -3.180 17919 101417 1 247 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.039 0.021 17919 101418 1 247 . 1 1 56 56 LEU C C 56 180.810 180.810 178.512 2.298 17919 101419 1 247 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.392 0.318 17919 101420 1 247 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.603 -1.233 17919 101421 1 247 . 1 1 56 56 LEU H H 56 8.140 8.140 8.778 -0.638 17919 101422 1 247 . 1 1 57 57 SER N N 57 113.330 113.330 114.685 -1.355 17919 101423 1 247 . 1 1 57 57 SER HA H 57 4.370 4.370 4.303 0.067 17919 101424 1 247 . 1 1 57 57 SER C C 57 178.310 178.310 176.760 1.550 17919 101425 1 247 . 1 1 57 57 SER CA C 57 61.080 61.080 62.012 -0.932 17919 101426 1 247 . 1 1 57 57 SER CB C 57 62.530 62.530 62.890 -0.360 17919 101427 1 247 . 1 1 57 57 SER H H 57 8.470 8.470 8.076 0.394 17919 101428 1 247 . 1 1 58 58 ASP N N 58 124.190 124.190 122.800 1.390 17919 101429 1 247 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.337 -0.041 17919 101430 1 247 . 1 1 58 58 ASP C C 58 177.400 177.400 177.314 0.086 17919 101431 1 247 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.967 0.213 17919 101432 1 247 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.525 -0.425 17919 101433 1 247 . 1 1 58 58 ASP H H 58 7.930 7.930 7.823 0.107 17919 101434 1 247 . 1 1 59 59 TYR N N 59 115.510 115.510 115.222 0.288 17919 101435 1 247 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.624 0.046 17919 101436 1 247 . 1 1 59 59 TYR C C 59 174.700 174.700 174.949 -0.249 17919 101437 1 247 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.966 0.284 17919 101438 1 247 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.696 1.375 17919 101439 1 247 . 1 1 59 59 TYR H H 59 7.250 7.250 7.480 -0.230 17919 101440 1 247 . 1 1 60 60 ASN N N 60 115.900 115.900 118.088 -2.188 17919 101441 1 247 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.388 -0.033 17919 101442 1 247 . 1 1 60 60 ASN C C 60 174.340 174.340 174.984 -0.644 17919 101443 1 247 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.064 0.056 17919 101444 1 247 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.284 0.126 17919 101445 1 247 . 1 1 60 60 ASN H H 60 8.150 8.150 7.709 0.441 17919 101446 1 247 . 1 1 61 61 ILE N N 61 118.600 118.600 119.379 -0.779 17919 101447 1 247 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.666 -0.273 17919 101448 1 247 . 1 1 61 61 ILE C C 61 174.610 174.610 175.227 -0.617 17919 101449 1 247 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.876 0.544 17919 101450 1 247 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.691 -0.951 17919 101451 1 247 . 1 1 61 61 ILE H H 61 7.250 7.250 8.062 -0.812 17919 101452 1 247 . 1 1 62 62 GLN N N 62 124.740 124.740 124.496 0.244 17919 101453 1 247 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.789 -0.283 17919 101454 1 247 . 1 1 62 62 GLN C C 62 175.970 175.970 175.187 0.783 17919 101455 1 247 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.309 0.351 17919 101456 1 247 . 1 1 62 62 GLN CB C 62 31.650 31.650 32.112 -0.462 17919 101457 1 247 . 1 1 62 62 GLN H H 62 7.610 7.610 7.945 -0.335 17919 101458 1 247 . 1 1 63 63 LYS N N 63 120.300 120.300 123.198 -2.898 17919 101459 1 247 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.847 0.154 17919 101460 1 247 . 1 1 63 63 LYS C C 63 175.810 175.810 176.913 -1.103 17919 101461 1 247 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.466 -0.676 17919 101462 1 247 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.120 0.531 17919 101463 1 247 . 1 1 63 63 LYS H H 63 8.490 8.490 8.593 -0.103 17919 101464 1 247 . 1 1 64 64 GLU N N 64 113.950 113.950 121.646 -7.696 17919 101465 1 247 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.876 -0.411 17919 101466 1 247 . 1 1 64 64 GLU C C 64 175.250 175.250 175.946 -0.696 17919 101467 1 247 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.939 -0.049 17919 101468 1 247 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.584 -2.684 17919 101469 1 247 . 1 1 64 64 GLU H H 64 9.280 9.280 9.014 0.266 17919 101470 1 247 . 1 1 65 65 SER N N 65 114.730 114.730 115.818 -1.088 17919 101471 1 247 . 1 1 65 65 SER HA H 65 4.640 4.640 4.450 0.190 17919 101472 1 247 . 1 1 65 65 SER C C 65 172.160 172.160 173.720 -1.560 17919 101473 1 247 . 1 1 65 65 SER CA C 65 60.890 60.890 60.743 0.147 17919 101474 1 247 . 1 1 65 65 SER CB C 65 64.910 64.910 64.111 0.799 17919 101475 1 247 . 1 1 65 65 SER H H 65 7.670 7.670 7.428 0.241 17919 101476 1 247 . 1 1 66 66 THR N N 66 117.110 117.110 119.936 -2.826 17919 101477 1 247 . 1 1 66 66 THR HA H 66 5.270 5.270 5.208 0.062 17919 101478 1 247 . 1 1 66 66 THR C C 66 173.950 173.950 174.169 -0.219 17919 101479 1 247 . 1 1 66 66 THR CA C 66 62.340 62.340 61.963 0.377 17919 101480 1 247 . 1 1 66 66 THR CB C 66 70.080 70.080 70.641 -0.561 17919 101481 1 247 . 1 1 66 66 THR H H 66 8.730 8.730 8.531 0.199 17919 101482 1 247 . 1 1 67 67 LEU N N 67 127.110 127.110 127.133 -0.023 17919 101483 1 247 . 1 1 67 67 LEU HA H 67 5.060 5.060 5.001 0.059 17919 101484 1 247 . 1 1 67 67 LEU C C 67 175.770 175.770 175.284 0.486 17919 101485 1 247 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.015 -0.115 17919 101486 1 247 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.148 0.112 17919 101487 1 247 . 1 1 67 67 LEU H H 67 9.410 9.410 9.102 0.308 17919 101488 1 247 . 1 1 68 68 HIS N N 68 118.380 118.380 122.439 -4.059 17919 101489 1 247 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.279 -0.039 17919 101490 1 247 . 1 1 68 68 HIS C C 68 173.150 173.150 173.561 -0.411 17919 101491 1 247 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.421 0.579 17919 101492 1 247 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.559 -2.029 17919 101493 1 247 . 1 1 68 68 HIS H H 68 9.230 9.230 9.310 -0.080 17919 101494 1 247 . 1 1 69 69 LEU N N 69 124.460 124.460 130.306 -5.846 17919 101495 1 247 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.908 0.282 17919 101496 1 247 . 1 1 69 69 LEU C C 69 175.270 175.270 174.178 1.092 17919 101497 1 247 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.374 0.516 17919 101498 1 247 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.059 0.321 17919 101499 1 247 . 1 1 69 69 LEU H H 69 8.340 8.340 8.297 0.043 17919 101500 1 247 . 1 1 70 70 VAL N N 70 126.940 126.940 127.172 -0.232 17919 101501 1 247 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.490 -0.140 17919 101502 1 247 . 1 1 70 70 VAL C C 70 174.000 174.000 174.538 -0.538 17919 101503 1 247 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.980 -0.180 17919 101504 1 247 . 1 1 70 70 VAL CB C 70 34.910 34.910 34.378 0.532 17919 101505 1 247 . 1 1 70 70 VAL H H 70 9.200 9.200 8.913 0.287 17919 101506 1 247 . 1 1 71 71 LEU N N 71 123.130 123.130 124.483 -1.353 17919 101507 1 247 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.862 0.198 17919 101508 1 247 . 1 1 71 71 LEU C C 71 177.830 177.830 177.317 0.513 17919 101509 1 247 . 1 1 71 71 LEU CA C 71 53.940 53.940 52.615 1.325 17919 101510 1 247 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.509 -0.659 17919 101511 1 247 . 1 1 71 71 LEU H H 71 8.120 8.120 8.492 -0.372 17919 101512 1 247 . 1 1 72 72 ARG N N 72 123.490 123.490 121.296 2.194 17919 101513 1 247 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.199 0.102 17919 101514 1 247 . 1 1 72 72 ARG C C 72 175.350 175.350 175.809 -0.459 17919 101515 1 247 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.508 -0.898 17919 101516 1 247 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.473 0.877 17919 101517 1 247 . 1 1 72 72 ARG H H 72 8.580 8.580 8.160 0.420 17919 101518 1 248 . 1 1 2 2 GLN N N 2 123.220 123.220 120.086 3.134 17919 101519 1 248 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.089 0.160 17919 101520 1 248 . 1 1 2 2 GLN C C 2 175.920 175.920 174.652 1.268 17919 101521 1 248 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.573 0.507 17919 101522 1 248 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.247 0.513 17919 101523 1 248 . 1 1 2 2 GLN H H 2 8.900 8.900 8.190 0.710 17919 101524 1 248 . 1 1 3 3 ILE N N 3 115.340 115.340 115.477 -0.137 17919 101525 1 248 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.150 0.063 17919 101526 1 248 . 1 1 3 3 ILE C C 3 172.450 172.450 173.432 -0.982 17919 101527 1 248 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.700 -0.130 17919 101528 1 248 . 1 1 3 3 ILE CB C 3 42.210 42.210 42.228 -0.018 17919 101529 1 248 . 1 1 3 3 ILE H H 3 8.320 8.320 8.461 -0.141 17919 101530 1 248 . 1 1 4 4 PHE N N 4 118.110 118.110 119.577 -1.467 17919 101531 1 248 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.414 0.216 17919 101532 1 248 . 1 1 4 4 PHE C C 4 175.320 175.320 175.237 0.083 17919 101533 1 248 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.246 -0.036 17919 101534 1 248 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.044 0.437 17919 101535 1 248 . 1 1 4 4 PHE H H 4 8.610 8.610 8.468 0.142 17919 101536 1 248 . 1 1 5 5 VAL N N 5 121.000 121.000 124.136 -3.136 17919 101537 1 248 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.799 -0.074 17919 101538 1 248 . 1 1 5 5 VAL C C 5 174.870 174.870 175.106 -0.236 17919 101539 1 248 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.136 -0.516 17919 101540 1 248 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.184 1.046 17919 101541 1 248 . 1 1 5 5 VAL H H 5 9.300 9.300 9.398 -0.098 17919 101542 1 248 . 1 1 6 6 LYS N N 6 127.520 127.520 128.224 -0.704 17919 101543 1 248 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.326 0.041 17919 101544 1 248 . 1 1 6 6 LYS C C 6 177.140 177.140 176.173 0.967 17919 101545 1 248 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.506 0.014 17919 101546 1 248 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.913 0.137 17919 101547 1 248 . 1 1 6 6 LYS H H 6 8.820 8.820 9.165 -0.345 17919 101548 1 248 . 1 1 7 7 THR N N 7 115.400 115.400 113.985 1.415 17919 101549 1 248 . 1 1 7 7 THR HA H 7 4.970 4.970 4.784 0.186 17919 101550 1 248 . 1 1 7 7 THR C C 7 176.910 176.910 175.535 1.375 17919 101551 1 248 . 1 1 7 7 THR CA C 7 60.470 60.470 59.778 0.692 17919 101552 1 248 . 1 1 7 7 THR CB C 7 70.630 70.630 70.928 -0.298 17919 101553 1 248 . 1 1 7 7 THR H H 7 8.730 8.730 8.467 0.263 17919 101554 1 248 . 1 1 8 8 LEU N N 8 121.330 121.330 119.864 1.466 17919 101555 1 248 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.630 -0.320 17919 101556 1 248 . 1 1 8 8 LEU C C 8 178.800 178.800 177.387 1.413 17919 101557 1 248 . 1 1 8 8 LEU CA C 8 57.580 57.580 55.584 1.996 17919 101558 1 248 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.282 -0.312 17919 101559 1 248 . 1 1 8 8 LEU H H 8 9.100 9.100 8.497 0.603 17919 101560 1 248 . 1 1 9 9 THR N N 9 105.590 105.590 109.722 -4.132 17919 101561 1 248 . 1 1 9 9 THR HA H 9 4.428 4.428 4.380 0.048 17919 101562 1 248 . 1 1 9 9 THR C C 9 175.520 175.520 175.610 -0.090 17919 101563 1 248 . 1 1 9 9 THR CA C 9 61.400 61.400 61.934 -0.534 17919 101564 1 248 . 1 1 9 9 THR CB C 9 69.140 69.140 69.790 -0.650 17919 101565 1 248 . 1 1 9 9 THR H H 9 7.630 7.630 7.675 -0.045 17919 101566 1 248 . 1 1 10 10 GLY N N 10 108.890 108.890 111.502 -2.612 17919 101567 1 248 . 1 1 10 10 GLY C C 10 174.070 174.070 173.611 0.459 17919 101568 1 248 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.747 0.713 17919 101569 1 248 . 1 1 10 10 GLY H H 10 7.810 7.810 8.106 -0.296 17919 101570 1 248 . 1 1 11 11 LYS N N 11 121.600 121.600 120.539 1.061 17919 101571 1 248 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.706 -0.345 17919 101572 1 248 . 1 1 11 11 LYS C C 11 175.940 175.940 175.760 0.180 17919 101573 1 248 . 1 1 11 11 LYS CA C 11 56.280 56.280 54.489 1.791 17919 101574 1 248 . 1 1 11 11 LYS CB C 11 33.200 33.200 34.015 -0.815 17919 101575 1 248 . 1 1 11 11 LYS H H 11 7.280 7.280 7.525 -0.245 17919 101576 1 248 . 1 1 12 12 THR N N 12 120.440 120.440 120.482 -0.042 17919 101577 1 248 . 1 1 12 12 THR HA H 12 5.046 5.046 4.582 0.465 17919 101578 1 248 . 1 1 12 12 THR C C 12 174.320 174.320 174.559 -0.239 17919 101579 1 248 . 1 1 12 12 THR CA C 12 62.390 62.390 62.652 -0.262 17919 101580 1 248 . 1 1 12 12 THR CB C 12 69.910 69.910 69.099 0.811 17919 101581 1 248 . 1 1 12 12 THR H H 12 8.650 8.650 8.439 0.211 17919 101582 1 248 . 1 1 13 13 ILE N N 13 127.110 127.110 129.873 -2.763 17919 101583 1 248 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.328 0.216 17919 101584 1 248 . 1 1 13 13 ILE C C 13 175.220 175.220 175.340 -0.120 17919 101585 1 248 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.679 -0.699 17919 101586 1 248 . 1 1 13 13 ILE CB C 13 40.950 40.950 39.788 1.162 17919 101587 1 248 . 1 1 13 13 ILE H H 13 9.450 9.450 9.187 0.263 17919 101588 1 248 . 1 1 14 14 THR N N 14 121.520 121.520 123.470 -1.950 17919 101589 1 248 . 1 1 14 14 THR HA H 14 4.964 4.964 5.097 -0.133 17919 101590 1 248 . 1 1 14 14 THR C C 14 173.790 173.790 173.947 -0.157 17919 101591 1 248 . 1 1 14 14 THR CA C 14 61.940 61.940 61.878 0.062 17919 101592 1 248 . 1 1 14 14 THR CB C 14 69.650 69.650 69.697 -0.047 17919 101593 1 248 . 1 1 14 14 THR H H 14 8.710 8.710 8.599 0.111 17919 101594 1 248 . 1 1 15 15 LEU N N 15 124.800 124.800 128.180 -3.380 17919 101595 1 248 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.712 0.068 17919 101596 1 248 . 1 1 15 15 LEU C C 15 174.670 174.670 175.317 -0.647 17919 101597 1 248 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.744 -0.914 17919 101598 1 248 . 1 1 15 15 LEU CB C 15 47.070 47.070 44.747 2.323 17919 101599 1 248 . 1 1 15 15 LEU H H 15 8.710 8.710 8.924 -0.214 17919 101600 1 248 . 1 1 16 16 GLU N N 16 122.160 122.160 124.123 -1.963 17919 101601 1 248 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.125 -0.208 17919 101602 1 248 . 1 1 16 16 GLU C C 16 175.860 175.860 176.092 -0.232 17919 101603 1 248 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.742 -0.922 17919 101604 1 248 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.764 -1.314 17919 101605 1 248 . 1 1 16 16 GLU H H 16 8.140 8.140 8.749 -0.609 17919 101606 1 248 . 1 1 17 17 VAL N N 17 117.210 117.210 118.936 -1.726 17919 101607 1 248 . 1 1 17 17 VAL HA H 17 4.714 4.714 5.046 -0.332 17919 101608 1 248 . 1 1 17 17 VAL C C 17 174.160 174.160 175.072 -0.912 17919 101609 1 248 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.346 0.084 17919 101610 1 248 . 1 1 17 17 VAL CB C 17 36.400 36.400 34.917 1.483 17919 101611 1 248 . 1 1 17 17 VAL H H 17 8.900 8.900 8.518 0.382 17919 101612 1 248 . 1 1 18 18 GLU N N 18 118.990 118.990 120.101 -1.111 17919 101613 1 248 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.820 0.259 17919 101614 1 248 . 1 1 18 18 GLU C C 18 176.160 176.160 175.515 0.645 17919 101615 1 248 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.755 -0.035 17919 101616 1 248 . 1 1 18 18 GLU CB C 18 30.310 30.310 29.934 0.376 17919 101617 1 248 . 1 1 18 18 GLU H H 18 8.640 8.640 8.673 -0.033 17919 101618 1 248 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.221 -0.080 17919 101619 1 248 . 1 1 19 19 PRO C C 19 175.310 175.310 177.736 -2.426 17919 101620 1 248 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.558 -0.088 17919 101621 1 248 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.746 0.204 17919 101622 1 248 . 1 1 20 20 SER N N 20 103.400 103.400 109.092 -5.692 17919 101623 1 248 . 1 1 20 20 SER HA H 20 4.370 4.370 4.293 0.077 17919 101624 1 248 . 1 1 20 20 SER C C 20 174.660 174.660 174.353 0.307 17919 101625 1 248 . 1 1 20 20 SER CA C 20 57.400 57.400 59.122 -1.722 17919 101626 1 248 . 1 1 20 20 SER CB C 20 63.370 63.370 62.968 0.402 17919 101627 1 248 . 1 1 20 20 SER H H 20 7.040 7.040 8.019 -0.979 17919 101628 1 248 . 1 1 21 21 ASP N N 21 123.480 123.480 124.273 -0.793 17919 101629 1 248 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.859 -0.164 17919 101630 1 248 . 1 1 21 21 ASP C C 21 176.360 176.360 176.012 0.348 17919 101631 1 248 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.388 1.312 17919 101632 1 248 . 1 1 21 21 ASP CB C 21 40.800 40.800 42.076 -1.276 17919 101633 1 248 . 1 1 21 21 ASP H H 21 8.030 8.030 7.786 0.244 17919 101634 1 248 . 1 1 22 22 THR N N 22 108.800 108.800 112.647 -3.847 17919 101635 1 248 . 1 1 22 22 THR HA H 22 4.920 4.920 5.069 -0.149 17919 101636 1 248 . 1 1 22 22 THR C C 22 176.750 176.750 175.927 0.823 17919 101637 1 248 . 1 1 22 22 THR CA C 22 59.690 59.690 60.459 -0.769 17919 101638 1 248 . 1 1 22 22 THR CB C 22 71.200 71.200 71.314 -0.114 17919 101639 1 248 . 1 1 22 22 THR H H 22 7.900 7.900 8.029 -0.129 17919 101640 1 248 . 1 1 23 23 ILE N N 23 121.190 121.190 121.102 0.088 17919 101641 1 248 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.874 -0.217 17919 101642 1 248 . 1 1 23 23 ILE C C 23 179.040 179.040 177.801 1.239 17919 101643 1 248 . 1 1 23 23 ILE CA C 23 62.260 62.260 61.119 1.141 17919 101644 1 248 . 1 1 23 23 ILE CB C 23 34.350 34.350 35.929 -1.579 17919 101645 1 248 . 1 1 23 23 ILE H H 23 8.560 8.560 8.595 -0.035 17919 101646 1 248 . 1 1 24 24 GLU N N 24 120.830 120.830 122.393 -1.563 17919 101647 1 248 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.887 0.030 17919 101648 1 248 . 1 1 24 24 GLU C C 24 178.640 178.640 178.608 0.032 17919 101649 1 248 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.304 -0.084 17919 101650 1 248 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.385 -1.105 17919 101651 1 248 . 1 1 24 24 GLU H H 24 9.760 9.760 8.019 1.741 17919 101652 1 248 . 1 1 25 25 ASN N N 25 120.570 120.570 117.833 2.737 17919 101653 1 248 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.527 -0.002 17919 101654 1 248 . 1 1 25 25 ASN C C 25 178.380 178.380 178.019 0.361 17919 101655 1 248 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.905 0.155 17919 101656 1 248 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.755 -0.305 17919 101657 1 248 . 1 1 25 25 ASN H H 25 7.920 7.920 7.825 0.095 17919 101658 1 248 . 1 1 26 26 VAL N N 26 121.710 121.710 121.094 0.616 17919 101659 1 248 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.702 -0.305 17919 101660 1 248 . 1 1 26 26 VAL C C 26 177.950 177.950 177.500 0.450 17919 101661 1 248 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.220 1.440 17919 101662 1 248 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.359 -0.519 17919 101663 1 248 . 1 1 26 26 VAL H H 26 8.070 8.070 8.262 -0.192 17919 101664 1 248 . 1 1 27 27 LYS N N 27 118.860 118.860 119.941 -1.081 17919 101665 1 248 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.138 0.442 17919 101666 1 248 . 1 1 27 27 LYS C C 27 180.550 180.550 179.104 1.446 17919 101667 1 248 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.713 -0.463 17919 101668 1 248 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.299 1.431 17919 101669 1 248 . 1 1 27 27 LYS H H 27 8.560 8.560 8.528 0.032 17919 101670 1 248 . 1 1 28 28 ALA N N 28 123.440 123.440 120.545 2.895 17919 101671 1 248 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.272 -0.112 17919 101672 1 248 . 1 1 28 28 ALA C C 28 180.300 180.300 178.632 1.668 17919 101673 1 248 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.230 1.140 17919 101674 1 248 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.714 -1.004 17919 101675 1 248 . 1 1 28 28 ALA H H 28 8.060 8.060 8.337 -0.277 17919 101676 1 248 . 1 1 29 29 LYS N N 29 119.940 119.940 119.185 0.755 17919 101677 1 248 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.119 0.088 17919 101678 1 248 . 1 1 29 29 LYS C C 29 180.320 180.320 178.133 2.187 17919 101679 1 248 . 1 1 29 29 LYS CA C 29 59.650 59.650 58.722 0.928 17919 101680 1 248 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.403 0.887 17919 101681 1 248 . 1 1 29 29 LYS H H 29 7.850 7.850 7.615 0.235 17919 101682 1 248 . 1 1 30 30 ILE N N 30 121.080 121.080 118.790 2.290 17919 101683 1 248 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.665 -0.158 17919 101684 1 248 . 1 1 30 30 ILE C C 30 178.310 178.310 177.477 0.833 17919 101685 1 248 . 1 1 30 30 ILE CA C 30 66.150 66.150 64.811 1.339 17919 101686 1 248 . 1 1 30 30 ILE CB C 30 36.800 36.800 38.035 -1.235 17919 101687 1 248 . 1 1 30 30 ILE H H 30 8.280 8.280 8.089 0.191 17919 101688 1 248 . 1 1 31 31 GLN N N 31 123.490 123.490 120.189 3.301 17919 101689 1 248 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.981 -0.152 17919 101690 1 248 . 1 1 31 31 GLN C C 31 178.890 178.890 178.351 0.539 17919 101691 1 248 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.066 0.934 17919 101692 1 248 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.274 -0.554 17919 101693 1 248 . 1 1 31 31 GLN H H 31 8.580 8.580 7.691 0.889 17919 101694 1 248 . 1 1 32 32 ASP N N 32 119.360 119.360 118.464 0.896 17919 101695 1 248 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.461 -0.107 17919 101696 1 248 . 1 1 32 32 ASP C C 32 177.250 177.250 176.829 0.421 17919 101697 1 248 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.072 1.119 17919 101698 1 248 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.475 0.105 17919 101699 1 248 . 1 1 32 32 ASP H H 32 8.010 8.010 7.955 0.055 17919 101700 1 248 . 1 1 33 33 LYS N N 33 115.130 115.130 116.780 -1.650 17919 101701 1 248 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.454 -0.117 17919 101702 1 248 . 1 1 33 33 LYS C C 33 177.870 177.870 177.490 0.380 17919 101703 1 248 . 1 1 33 33 LYS CA C 33 58.050 58.050 56.990 1.060 17919 101704 1 248 . 1 1 33 33 LYS CB C 33 34.170 34.170 34.544 -0.374 17919 101705 1 248 . 1 1 33 33 LYS H H 33 7.430 7.430 7.556 -0.126 17919 101706 1 248 . 1 1 34 34 GLU N N 34 113.870 113.870 118.017 -4.147 17919 101707 1 248 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.376 0.249 17919 101708 1 248 . 1 1 34 34 GLU C C 34 177.840 177.840 177.247 0.593 17919 101709 1 248 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.888 -0.718 17919 101710 1 248 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.412 1.248 17919 101711 1 248 . 1 1 34 34 GLU H H 34 8.740 8.740 8.316 0.424 17919 101712 1 248 . 1 1 35 35 GLY N N 35 108.650 108.650 107.698 0.952 17919 101713 1 248 . 1 1 35 35 GLY C C 35 173.960 173.960 174.232 -0.272 17919 101714 1 248 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.561 0.519 17919 101715 1 248 . 1 1 35 35 GLY H H 35 8.530 8.530 8.065 0.465 17919 101716 1 248 . 1 1 36 36 ILE N N 36 119.880 119.880 121.081 -1.201 17919 101717 1 248 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.322 0.123 17919 101718 1 248 . 1 1 36 36 ILE C C 36 173.590 173.590 173.588 0.002 17919 101719 1 248 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.744 0.006 17919 101720 1 248 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.570 2.010 17919 101721 1 248 . 1 1 36 36 ILE H H 36 6.150 6.150 7.551 -1.401 17919 101722 1 248 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.779 -0.145 17919 101723 1 248 . 1 1 37 37 PRO C C 37 176.940 176.940 175.800 1.140 17919 101724 1 248 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.685 -0.025 17919 101725 1 248 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.605 0.245 17919 101726 1 248 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.222 -0.105 17919 101727 1 248 . 1 1 38 38 PRO C C 38 178.320 178.320 176.528 1.792 17919 101728 1 248 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.220 1.040 17919 101729 1 248 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.969 0.921 17919 101730 1 248 . 1 1 39 39 ASP N N 39 113.380 113.380 113.087 0.293 17919 101731 1 248 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.472 -0.042 17919 101732 1 248 . 1 1 39 39 ASP C C 39 177.090 177.090 177.072 0.018 17919 101733 1 248 . 1 1 39 39 ASP CA C 39 55.640 55.640 55.664 -0.024 17919 101734 1 248 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.232 -0.692 17919 101735 1 248 . 1 1 39 39 ASP H H 39 8.550 8.550 8.639 -0.089 17919 101736 1 248 . 1 1 40 40 GLN N N 40 116.780 116.780 118.264 -1.484 17919 101737 1 248 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.392 0.072 17919 101738 1 248 . 1 1 40 40 GLN C C 40 175.380 175.380 176.000 -0.620 17919 101739 1 248 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.039 -0.399 17919 101740 1 248 . 1 1 40 40 GLN CB C 40 30.140 30.140 30.108 0.032 17919 101741 1 248 . 1 1 40 40 GLN H H 40 7.820 7.820 7.557 0.263 17919 101742 1 248 . 1 1 41 41 GLN N N 41 117.720 117.720 119.349 -1.629 17919 101743 1 248 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.193 0.051 17919 101744 1 248 . 1 1 41 41 GLN C C 41 176.300 176.300 175.666 0.634 17919 101745 1 248 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.621 -0.151 17919 101746 1 248 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.238 2.412 17919 101747 1 248 . 1 1 41 41 GLN H H 41 7.480 7.480 7.501 -0.021 17919 101748 1 248 . 1 1 42 42 ARG N N 42 122.680 122.680 125.777 -3.097 17919 101749 1 248 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.640 -0.140 17919 101750 1 248 . 1 1 42 42 ARG C C 42 174.050 174.050 173.908 0.142 17919 101751 1 248 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.255 0.795 17919 101752 1 248 . 1 1 42 42 ARG CB C 42 31.750 31.750 31.608 0.142 17919 101753 1 248 . 1 1 42 42 ARG H H 42 8.530 8.530 8.340 0.190 17919 101754 1 248 . 1 1 43 43 LEU N N 43 124.040 124.040 129.154 -5.114 17919 101755 1 248 . 1 1 43 43 LEU C C 43 175.290 175.290 175.299 -0.009 17919 101756 1 248 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.934 -0.954 17919 101757 1 248 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.844 0.946 17919 101758 1 248 . 1 1 43 43 LEU H H 43 8.820 8.820 8.815 0.005 17919 101759 1 248 . 1 1 44 44 ILE N N 44 121.920 121.920 120.291 1.629 17919 101760 1 248 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.844 0.148 17919 101761 1 248 . 1 1 44 44 ILE C C 44 176.060 176.060 173.427 2.633 17919 101762 1 248 . 1 1 44 44 ILE CA C 44 58.980 58.980 58.948 0.032 17919 101763 1 248 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.289 0.131 17919 101764 1 248 . 1 1 44 44 ILE H H 44 9.030 9.030 9.052 -0.022 17919 101765 1 248 . 1 1 45 45 PHE N N 45 125.390 125.390 125.470 -0.080 17919 101766 1 248 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.976 0.069 17919 101767 1 248 . 1 1 45 45 PHE C C 45 174.470 174.470 175.005 -0.535 17919 101768 1 248 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.436 0.584 17919 101769 1 248 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.642 1.117 17919 101770 1 248 . 1 1 45 45 PHE H H 45 8.830 8.830 8.165 0.665 17919 101771 1 248 . 1 1 46 46 ALA N N 46 132.200 132.200 129.890 2.310 17919 101772 1 248 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.656 0.034 17919 101773 1 248 . 1 1 46 46 ALA C C 46 177.290 177.290 177.662 -0.372 17919 101774 1 248 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.176 0.364 17919 101775 1 248 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.509 0.061 17919 101776 1 248 . 1 1 46 46 ALA H H 46 8.810 8.810 8.636 0.174 17919 101777 1 248 . 1 1 47 47 GLY N N 47 102.340 102.340 103.131 -0.791 17919 101778 1 248 . 1 1 47 47 GLY C C 47 173.810 173.810 174.114 -0.304 17919 101779 1 248 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.996 0.354 17919 101780 1 248 . 1 1 47 47 GLY H H 47 8.130 8.130 8.480 -0.350 17919 101781 1 248 . 1 1 48 48 LYS N N 48 121.570 121.570 120.950 0.620 17919 101782 1 248 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.520 0.102 17919 101783 1 248 . 1 1 48 48 LYS C C 48 174.700 174.700 175.501 -0.801 17919 101784 1 248 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.026 -0.476 17919 101785 1 248 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.860 -0.330 17919 101786 1 248 . 1 1 48 48 LYS H H 48 7.980 7.980 7.742 0.238 17919 101787 1 248 . 1 1 49 49 GLN N N 49 122.410 122.410 124.527 -2.117 17919 101788 1 248 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.103 0.457 17919 101789 1 248 . 1 1 49 49 GLN C C 49 175.670 175.670 175.792 -0.122 17919 101790 1 248 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.560 -0.820 17919 101791 1 248 . 1 1 49 49 GLN CB C 49 29.000 29.000 28.534 0.466 17919 101792 1 248 . 1 1 49 49 GLN H H 49 8.600 8.600 8.596 0.004 17919 101793 1 248 . 1 1 50 50 LEU N N 50 125.520 125.520 127.842 -2.322 17919 101794 1 248 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.459 -0.369 17919 101795 1 248 . 1 1 50 50 LEU C C 50 176.660 176.660 177.778 -1.118 17919 101796 1 248 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.580 -0.340 17919 101797 1 248 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.952 -0.382 17919 101798 1 248 . 1 1 50 50 LEU H H 50 8.530 8.530 8.542 -0.012 17919 101799 1 248 . 1 1 51 51 GLU N N 51 122.940 122.940 124.541 -1.601 17919 101800 1 248 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.194 0.294 17919 101801 1 248 . 1 1 51 51 GLU C C 51 175.870 175.870 176.476 -0.606 17919 101802 1 248 . 1 1 51 51 GLU CA C 51 55.960 55.960 58.656 -2.696 17919 101803 1 248 . 1 1 51 51 GLU CB C 51 31.570 31.570 30.507 1.063 17919 101804 1 248 . 1 1 51 51 GLU H H 51 8.400 8.400 8.430 -0.030 17919 101805 1 248 . 1 1 52 52 ASP N N 52 120.030 120.030 116.876 3.154 17919 101806 1 248 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.684 -0.325 17919 101807 1 248 . 1 1 52 52 ASP C C 52 177.330 177.330 177.750 -0.420 17919 101808 1 248 . 1 1 52 52 ASP CA C 52 56.960 56.960 55.153 1.807 17919 101809 1 248 . 1 1 52 52 ASP CB C 52 40.850 40.850 42.703 -1.853 17919 101810 1 248 . 1 1 52 52 ASP H H 52 8.160 8.160 8.601 -0.441 17919 101811 1 248 . 1 1 53 53 GLY N N 53 106.660 106.660 108.515 -1.855 17919 101812 1 248 . 1 1 53 53 GLY C C 53 174.870 174.870 174.358 0.512 17919 101813 1 248 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.685 -0.515 17919 101814 1 248 . 1 1 53 53 GLY H H 53 9.390 9.390 8.501 0.889 17919 101815 1 248 . 1 1 54 54 ARG N N 54 119.050 119.050 119.972 -0.922 17919 101816 1 248 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.525 0.170 17919 101817 1 248 . 1 1 54 54 ARG C C 54 175.350 175.350 175.073 0.277 17919 101818 1 248 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.798 -0.408 17919 101819 1 248 . 1 1 54 54 ARG CB C 54 32.650 32.650 31.631 1.020 17919 101820 1 248 . 1 1 54 54 ARG H H 54 7.460 7.460 7.817 -0.357 17919 101821 1 248 . 1 1 55 55 THR N N 55 108.400 108.400 114.051 -5.651 17919 101822 1 248 . 1 1 55 55 THR HA H 55 5.240 5.240 4.835 0.405 17919 101823 1 248 . 1 1 55 55 THR C C 55 176.560 176.560 175.937 0.623 17919 101824 1 248 . 1 1 55 55 THR CA C 55 59.690 59.690 60.840 -1.150 17919 101825 1 248 . 1 1 55 55 THR CB C 55 72.260 72.260 70.670 1.590 17919 101826 1 248 . 1 1 55 55 THR H H 55 8.730 8.730 8.153 0.577 17919 101827 1 248 . 1 1 56 56 LEU N N 56 117.920 117.920 121.687 -3.767 17919 101828 1 248 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.032 0.028 17919 101829 1 248 . 1 1 56 56 LEU C C 56 180.810 180.810 178.848 1.962 17919 101830 1 248 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.280 0.430 17919 101831 1 248 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.329 -0.959 17919 101832 1 248 . 1 1 56 56 LEU H H 56 8.140 8.140 8.483 -0.343 17919 101833 1 248 . 1 1 57 57 SER N N 57 113.330 113.330 114.341 -1.011 17919 101834 1 248 . 1 1 57 57 SER HA H 57 4.370 4.370 4.196 0.174 17919 101835 1 248 . 1 1 57 57 SER C C 57 178.310 178.310 176.952 1.358 17919 101836 1 248 . 1 1 57 57 SER CA C 57 61.080 61.080 61.581 -0.501 17919 101837 1 248 . 1 1 57 57 SER CB C 57 62.530 62.530 62.496 0.034 17919 101838 1 248 . 1 1 57 57 SER H H 57 8.470 8.470 8.561 -0.091 17919 101839 1 248 . 1 1 58 58 ASP N N 58 124.190 124.190 121.964 2.226 17919 101840 1 248 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.456 -0.160 17919 101841 1 248 . 1 1 58 58 ASP C C 58 177.400 177.400 177.091 0.309 17919 101842 1 248 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.223 0.957 17919 101843 1 248 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.543 -0.443 17919 101844 1 248 . 1 1 58 58 ASP H H 58 7.930 7.930 7.781 0.149 17919 101845 1 248 . 1 1 59 59 TYR N N 59 115.510 115.510 115.112 0.398 17919 101846 1 248 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.597 0.073 17919 101847 1 248 . 1 1 59 59 TYR C C 59 174.700 174.700 174.909 -0.209 17919 101848 1 248 . 1 1 59 59 TYR CA C 59 58.250 58.250 58.338 -0.088 17919 101849 1 248 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.375 1.695 17919 101850 1 248 . 1 1 59 59 TYR H H 59 7.250 7.250 7.324 -0.074 17919 101851 1 248 . 1 1 60 60 ASN N N 60 115.900 115.900 114.954 0.946 17919 101852 1 248 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.418 -0.063 17919 101853 1 248 . 1 1 60 60 ASN C C 60 174.340 174.340 174.791 -0.451 17919 101854 1 248 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.481 -0.361 17919 101855 1 248 . 1 1 60 60 ASN CB C 60 37.410 37.410 36.604 0.806 17919 101856 1 248 . 1 1 60 60 ASN H H 60 8.150 8.150 7.884 0.266 17919 101857 1 248 . 1 1 61 61 ILE N N 61 118.600 118.600 119.784 -1.184 17919 101858 1 248 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.902 -0.509 17919 101859 1 248 . 1 1 61 61 ILE C C 61 174.610 174.610 175.544 -0.934 17919 101860 1 248 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.195 0.225 17919 101861 1 248 . 1 1 61 61 ILE CB C 61 36.740 36.740 38.205 -1.465 17919 101862 1 248 . 1 1 61 61 ILE H H 61 7.250 7.250 7.893 -0.643 17919 101863 1 248 . 1 1 62 62 GLN N N 62 124.740 124.740 124.847 -0.107 17919 101864 1 248 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.736 -0.230 17919 101865 1 248 . 1 1 62 62 GLN C C 62 175.970 175.970 175.311 0.659 17919 101866 1 248 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.445 0.215 17919 101867 1 248 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.658 -0.008 17919 101868 1 248 . 1 1 62 62 GLN H H 62 7.610 7.610 7.861 -0.251 17919 101869 1 248 . 1 1 63 63 LYS N N 63 120.300 120.300 120.050 0.250 17919 101870 1 248 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.085 -0.084 17919 101871 1 248 . 1 1 63 63 LYS C C 63 175.810 175.810 177.362 -1.552 17919 101872 1 248 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.801 -0.011 17919 101873 1 248 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.253 0.397 17919 101874 1 248 . 1 1 63 63 LYS H H 63 8.490 8.490 8.438 0.052 17919 101875 1 248 . 1 1 64 64 GLU N N 64 113.950 113.950 119.937 -5.987 17919 101876 1 248 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.170 0.295 17919 101877 1 248 . 1 1 64 64 GLU C C 64 175.250 175.250 175.962 -0.712 17919 101878 1 248 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.483 0.407 17919 101879 1 248 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.538 -2.638 17919 101880 1 248 . 1 1 64 64 GLU H H 64 9.280 9.280 8.851 0.429 17919 101881 1 248 . 1 1 65 65 SER N N 65 114.730 114.730 114.671 0.059 17919 101882 1 248 . 1 1 65 65 SER HA H 65 4.640 4.640 4.478 0.162 17919 101883 1 248 . 1 1 65 65 SER C C 65 172.160 172.160 173.849 -1.689 17919 101884 1 248 . 1 1 65 65 SER CA C 65 60.890 60.890 60.407 0.483 17919 101885 1 248 . 1 1 65 65 SER CB C 65 64.910 64.910 63.913 0.998 17919 101886 1 248 . 1 1 65 65 SER H H 65 7.670 7.670 7.458 0.212 17919 101887 1 248 . 1 1 66 66 THR N N 66 117.110 117.110 120.537 -3.427 17919 101888 1 248 . 1 1 66 66 THR HA H 66 5.270 5.270 5.126 0.144 17919 101889 1 248 . 1 1 66 66 THR C C 66 173.950 173.950 173.886 0.064 17919 101890 1 248 . 1 1 66 66 THR CA C 66 62.340 62.340 61.866 0.474 17919 101891 1 248 . 1 1 66 66 THR CB C 66 70.080 70.080 70.026 0.054 17919 101892 1 248 . 1 1 66 66 THR H H 66 8.730 8.730 8.244 0.486 17919 101893 1 248 . 1 1 67 67 LEU N N 67 127.110 127.110 126.110 1.000 17919 101894 1 248 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.952 0.108 17919 101895 1 248 . 1 1 67 67 LEU C C 67 175.770 175.770 175.364 0.406 17919 101896 1 248 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.988 -0.088 17919 101897 1 248 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.403 -0.143 17919 101898 1 248 . 1 1 67 67 LEU H H 67 9.410 9.410 8.779 0.631 17919 101899 1 248 . 1 1 68 68 HIS N N 68 118.380 118.380 122.634 -4.254 17919 101900 1 248 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.456 -0.216 17919 101901 1 248 . 1 1 68 68 HIS C C 68 173.150 173.150 173.983 -0.833 17919 101902 1 248 . 1 1 68 68 HIS CA C 68 55.000 55.000 55.602 -0.602 17919 101903 1 248 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.612 -2.082 17919 101904 1 248 . 1 1 68 68 HIS H H 68 9.230 9.230 8.938 0.292 17919 101905 1 248 . 1 1 69 69 LEU N N 69 124.460 124.460 128.828 -4.368 17919 101906 1 248 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.993 0.197 17919 101907 1 248 . 1 1 69 69 LEU C C 69 175.270 175.270 174.514 0.756 17919 101908 1 248 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.739 0.152 17919 101909 1 248 . 1 1 69 69 LEU CB C 69 44.380 44.380 43.934 0.446 17919 101910 1 248 . 1 1 69 69 LEU H H 69 8.340 8.340 7.915 0.425 17919 101911 1 248 . 1 1 70 70 VAL N N 70 126.940 126.940 127.275 -0.335 17919 101912 1 248 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.359 -0.009 17919 101913 1 248 . 1 1 70 70 VAL C C 70 174.000 174.000 174.626 -0.626 17919 101914 1 248 . 1 1 70 70 VAL CA C 70 60.800 60.800 62.784 -1.984 17919 101915 1 248 . 1 1 70 70 VAL CB C 70 34.910 34.910 32.263 2.647 17919 101916 1 248 . 1 1 70 70 VAL H H 70 9.200 9.200 8.937 0.263 17919 101917 1 248 . 1 1 71 71 LEU N N 71 123.130 123.130 125.041 -1.911 17919 101918 1 248 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.722 0.338 17919 101919 1 248 . 1 1 71 71 LEU C C 71 177.830 177.830 176.849 0.981 17919 101920 1 248 . 1 1 71 71 LEU CA C 71 53.940 53.940 52.617 1.323 17919 101921 1 248 . 1 1 71 71 LEU CB C 71 42.850 42.850 44.083 -1.233 17919 101922 1 248 . 1 1 71 71 LEU H H 71 8.120 8.120 8.253 -0.133 17919 101923 1 248 . 1 1 72 72 ARG N N 72 123.490 123.490 121.534 1.956 17919 101924 1 248 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.249 0.052 17919 101925 1 248 . 1 1 72 72 ARG C C 72 175.350 175.350 175.460 -0.110 17919 101926 1 248 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.472 -0.862 17919 101927 1 248 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.081 1.269 17919 101928 1 248 . 1 1 72 72 ARG H H 72 8.580 8.580 8.590 -0.010 17919 101929 1 249 . 1 1 2 2 GLN N N 2 123.220 123.220 121.977 1.243 17919 101930 1 249 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.469 -0.220 17919 101931 1 249 . 1 1 2 2 GLN C C 2 175.920 175.920 175.048 0.872 17919 101932 1 249 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.441 0.639 17919 101933 1 249 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.741 0.020 17919 101934 1 249 . 1 1 2 2 GLN H H 2 8.900 8.900 8.428 0.472 17919 101935 1 249 . 1 1 3 3 ILE N N 3 115.340 115.340 117.790 -2.450 17919 101936 1 249 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.332 -0.119 17919 101937 1 249 . 1 1 3 3 ILE C C 3 172.450 172.450 173.369 -0.919 17919 101938 1 249 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.171 0.399 17919 101939 1 249 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.831 0.379 17919 101940 1 249 . 1 1 3 3 ILE H H 3 8.320 8.320 8.867 -0.547 17919 101941 1 249 . 1 1 4 4 PHE N N 4 118.110 118.110 118.525 -0.415 17919 101942 1 249 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.584 0.046 17919 101943 1 249 . 1 1 4 4 PHE C C 4 175.320 175.320 175.214 0.106 17919 101944 1 249 . 1 1 4 4 PHE CA C 4 55.210 55.210 54.685 0.525 17919 101945 1 249 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.569 -1.089 17919 101946 1 249 . 1 1 4 4 PHE H H 4 8.610 8.610 8.631 -0.021 17919 101947 1 249 . 1 1 5 5 VAL N N 5 121.000 121.000 120.076 0.924 17919 101948 1 249 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.767 -0.042 17919 101949 1 249 . 1 1 5 5 VAL C C 5 174.870 174.870 174.224 0.646 17919 101950 1 249 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.335 -0.715 17919 101951 1 249 . 1 1 5 5 VAL CB C 5 34.230 34.230 35.124 -0.894 17919 101952 1 249 . 1 1 5 5 VAL H H 5 9.300 9.300 9.086 0.214 17919 101953 1 249 . 1 1 6 6 LYS N N 6 127.520 127.520 129.037 -1.517 17919 101954 1 249 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.491 -0.124 17919 101955 1 249 . 1 1 6 6 LYS C C 6 177.140 177.140 176.205 0.935 17919 101956 1 249 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.169 0.351 17919 101957 1 249 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.846 -0.796 17919 101958 1 249 . 1 1 6 6 LYS H H 6 8.820 8.820 9.353 -0.533 17919 101959 1 249 . 1 1 7 7 THR N N 7 115.400 115.400 117.852 -2.452 17919 101960 1 249 . 1 1 7 7 THR HA H 7 4.970 4.970 5.118 -0.148 17919 101961 1 249 . 1 1 7 7 THR C C 7 176.910 176.910 177.053 -0.143 17919 101962 1 249 . 1 1 7 7 THR CA C 7 60.470 60.470 60.525 -0.055 17919 101963 1 249 . 1 1 7 7 THR CB C 7 70.630 70.630 70.981 -0.351 17919 101964 1 249 . 1 1 7 7 THR H H 7 8.730 8.730 8.976 -0.246 17919 101965 1 249 . 1 1 8 8 LEU N N 8 121.330 121.330 119.280 2.050 17919 101966 1 249 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.329 -0.019 17919 101967 1 249 . 1 1 8 8 LEU C C 8 178.800 178.800 177.428 1.372 17919 101968 1 249 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.559 0.021 17919 101969 1 249 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.704 0.266 17919 101970 1 249 . 1 1 8 8 LEU H H 8 9.100 9.100 8.827 0.273 17919 101971 1 249 . 1 1 9 9 THR N N 9 105.590 105.590 108.624 -3.034 17919 101972 1 249 . 1 1 9 9 THR HA H 9 4.428 4.428 4.416 0.012 17919 101973 1 249 . 1 1 9 9 THR C C 9 175.520 175.520 175.772 -0.252 17919 101974 1 249 . 1 1 9 9 THR CA C 9 61.400 61.400 61.451 -0.051 17919 101975 1 249 . 1 1 9 9 THR CB C 9 69.140 69.140 69.479 -0.339 17919 101976 1 249 . 1 1 9 9 THR H H 9 7.630 7.630 7.573 0.057 17919 101977 1 249 . 1 1 10 10 GLY N N 10 108.890 108.890 111.407 -2.517 17919 101978 1 249 . 1 1 10 10 GLY C C 10 174.070 174.070 174.200 -0.130 17919 101979 1 249 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.242 0.217 17919 101980 1 249 . 1 1 10 10 GLY H H 10 7.810 7.810 8.109 -0.299 17919 101981 1 249 . 1 1 11 11 LYS N N 11 121.600 121.600 122.621 -1.021 17919 101982 1 249 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.363 -0.002 17919 101983 1 249 . 1 1 11 11 LYS C C 11 175.940 175.940 175.463 0.477 17919 101984 1 249 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.305 -0.025 17919 101985 1 249 . 1 1 11 11 LYS CB C 11 33.200 33.200 32.809 0.391 17919 101986 1 249 . 1 1 11 11 LYS H H 11 7.280 7.280 7.669 -0.389 17919 101987 1 249 . 1 1 12 12 THR N N 12 120.440 120.440 120.598 -0.158 17919 101988 1 249 . 1 1 12 12 THR HA H 12 5.046 5.046 5.266 -0.220 17919 101989 1 249 . 1 1 12 12 THR C C 12 174.320 174.320 174.740 -0.420 17919 101990 1 249 . 1 1 12 12 THR CA C 12 62.390 62.390 61.930 0.460 17919 101991 1 249 . 1 1 12 12 THR CB C 12 69.910 69.910 69.514 0.396 17919 101992 1 249 . 1 1 12 12 THR H H 12 8.650 8.650 8.447 0.203 17919 101993 1 249 . 1 1 13 13 ILE N N 13 127.110 127.110 127.826 -0.716 17919 101994 1 249 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.641 -0.097 17919 101995 1 249 . 1 1 13 13 ILE C C 13 175.220 175.220 174.954 0.266 17919 101996 1 249 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.418 -0.438 17919 101997 1 249 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.229 -0.279 17919 101998 1 249 . 1 1 13 13 ILE H H 13 9.450 9.450 8.906 0.544 17919 101999 1 249 . 1 1 14 14 THR N N 14 121.520 121.520 122.775 -1.255 17919 102000 1 249 . 1 1 14 14 THR HA H 14 4.964 4.964 5.114 -0.150 17919 102001 1 249 . 1 1 14 14 THR C C 14 173.790 173.790 173.902 -0.112 17919 102002 1 249 . 1 1 14 14 THR CA C 14 61.940 61.940 61.718 0.222 17919 102003 1 249 . 1 1 14 14 THR CB C 14 69.650 69.650 69.994 -0.344 17919 102004 1 249 . 1 1 14 14 THR H H 14 8.710 8.710 8.285 0.425 17919 102005 1 249 . 1 1 15 15 LEU N N 15 124.800 124.800 126.645 -1.845 17919 102006 1 249 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.785 -0.005 17919 102007 1 249 . 1 1 15 15 LEU C C 15 174.670 174.670 175.150 -0.480 17919 102008 1 249 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.735 -0.905 17919 102009 1 249 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.922 1.148 17919 102010 1 249 . 1 1 15 15 LEU H H 15 8.710 8.710 9.216 -0.506 17919 102011 1 249 . 1 1 16 16 GLU N N 16 122.160 122.160 122.344 -0.184 17919 102012 1 249 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.200 -0.283 17919 102013 1 249 . 1 1 16 16 GLU C C 16 175.860 175.860 175.965 -0.105 17919 102014 1 249 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.311 -0.491 17919 102015 1 249 . 1 1 16 16 GLU CB C 16 29.450 29.450 31.520 -2.070 17919 102016 1 249 . 1 1 16 16 GLU H H 16 8.140 8.140 8.574 -0.434 17919 102017 1 249 . 1 1 17 17 VAL N N 17 117.210 117.210 118.828 -1.618 17919 102018 1 249 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.705 0.009 17919 102019 1 249 . 1 1 17 17 VAL C C 17 174.160 174.160 174.357 -0.197 17919 102020 1 249 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.494 -1.064 17919 102021 1 249 . 1 1 17 17 VAL CB C 17 36.400 36.400 34.814 1.586 17919 102022 1 249 . 1 1 17 17 VAL H H 17 8.900 8.900 8.847 0.053 17919 102023 1 249 . 1 1 18 18 GLU N N 18 118.990 118.990 122.016 -3.026 17919 102024 1 249 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.854 0.225 17919 102025 1 249 . 1 1 18 18 GLU C C 18 176.160 176.160 175.552 0.608 17919 102026 1 249 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.438 0.282 17919 102027 1 249 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.446 -0.136 17919 102028 1 249 . 1 1 18 18 GLU H H 18 8.640 8.640 8.713 -0.073 17919 102029 1 249 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.298 -0.157 17919 102030 1 249 . 1 1 19 19 PRO C C 19 175.310 175.310 178.003 -2.693 17919 102031 1 249 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.065 0.405 17919 102032 1 249 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.758 0.192 17919 102033 1 249 . 1 1 20 20 SER N N 20 103.400 103.400 112.959 -9.559 17919 102034 1 249 . 1 1 20 20 SER HA H 20 4.370 4.370 4.309 0.061 17919 102035 1 249 . 1 1 20 20 SER C C 20 174.660 174.660 174.744 -0.084 17919 102036 1 249 . 1 1 20 20 SER CA C 20 57.400 57.400 58.852 -1.452 17919 102037 1 249 . 1 1 20 20 SER CB C 20 63.370 63.370 62.958 0.412 17919 102038 1 249 . 1 1 20 20 SER H H 20 7.040 7.040 8.115 -1.075 17919 102039 1 249 . 1 1 21 21 ASP N N 21 123.480 123.480 123.542 -0.062 17919 102040 1 249 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.902 -0.207 17919 102041 1 249 . 1 1 21 21 ASP C C 21 176.360 176.360 176.132 0.228 17919 102042 1 249 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.052 0.648 17919 102043 1 249 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.389 -0.590 17919 102044 1 249 . 1 1 21 21 ASP H H 21 8.030 8.030 7.637 0.393 17919 102045 1 249 . 1 1 22 22 THR N N 22 108.800 108.800 113.125 -4.325 17919 102046 1 249 . 1 1 22 22 THR HA H 22 4.920 4.920 4.839 0.081 17919 102047 1 249 . 1 1 22 22 THR C C 22 176.750 176.750 176.336 0.414 17919 102048 1 249 . 1 1 22 22 THR CA C 22 59.690 59.690 60.678 -0.988 17919 102049 1 249 . 1 1 22 22 THR CB C 22 71.200 71.200 70.514 0.686 17919 102050 1 249 . 1 1 22 22 THR H H 22 7.900 7.900 9.232 -1.332 17919 102051 1 249 . 1 1 23 23 ILE N N 23 121.190 121.190 121.455 -0.265 17919 102052 1 249 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.827 -0.170 17919 102053 1 249 . 1 1 23 23 ILE C C 23 179.040 179.040 177.499 1.541 17919 102054 1 249 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.466 -0.206 17919 102055 1 249 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.059 -1.709 17919 102056 1 249 . 1 1 23 23 ILE H H 23 8.560 8.560 8.730 -0.170 17919 102057 1 249 . 1 1 24 24 GLU N N 24 120.830 120.830 122.318 -1.488 17919 102058 1 249 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.949 -0.032 17919 102059 1 249 . 1 1 24 24 GLU C C 24 178.640 178.640 178.314 0.326 17919 102060 1 249 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.388 -0.168 17919 102061 1 249 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.487 -1.207 17919 102062 1 249 . 1 1 24 24 GLU H H 24 9.760 9.760 8.249 1.511 17919 102063 1 249 . 1 1 25 25 ASN N N 25 120.570 120.570 118.464 2.106 17919 102064 1 249 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.380 0.145 17919 102065 1 249 . 1 1 25 25 ASN C C 25 178.380 178.380 178.160 0.220 17919 102066 1 249 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.962 0.098 17919 102067 1 249 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.381 0.069 17919 102068 1 249 . 1 1 25 25 ASN H H 25 7.920 7.920 7.707 0.213 17919 102069 1 249 . 1 1 26 26 VAL N N 26 121.710 121.710 120.502 1.208 17919 102070 1 249 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.704 -0.307 17919 102071 1 249 . 1 1 26 26 VAL C C 26 177.950 177.950 177.480 0.470 17919 102072 1 249 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.351 1.309 17919 102073 1 249 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.490 -0.650 17919 102074 1 249 . 1 1 26 26 VAL H H 26 8.070 8.070 7.875 0.195 17919 102075 1 249 . 1 1 27 27 LYS N N 27 118.860 118.860 120.722 -1.862 17919 102076 1 249 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.199 0.381 17919 102077 1 249 . 1 1 27 27 LYS C C 27 180.550 180.550 178.853 1.697 17919 102078 1 249 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.547 -0.298 17919 102079 1 249 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.359 1.371 17919 102080 1 249 . 1 1 27 27 LYS H H 27 8.560 8.560 8.401 0.159 17919 102081 1 249 . 1 1 28 28 ALA N N 28 123.440 123.440 121.821 1.619 17919 102082 1 249 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.262 -0.102 17919 102083 1 249 . 1 1 28 28 ALA C C 28 180.300 180.300 179.079 1.221 17919 102084 1 249 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.449 0.921 17919 102085 1 249 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.520 -0.810 17919 102086 1 249 . 1 1 28 28 ALA H H 28 8.060 8.060 8.340 -0.280 17919 102087 1 249 . 1 1 29 29 LYS N N 29 119.940 119.940 119.919 0.021 17919 102088 1 249 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.041 0.166 17919 102089 1 249 . 1 1 29 29 LYS C C 29 180.320 180.320 178.957 1.363 17919 102090 1 249 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.319 0.331 17919 102091 1 249 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.417 0.873 17919 102092 1 249 . 1 1 29 29 LYS H H 29 7.850 7.850 7.457 0.393 17919 102093 1 249 . 1 1 30 30 ILE N N 30 121.080 121.080 119.962 1.118 17919 102094 1 249 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.625 -0.118 17919 102095 1 249 . 1 1 30 30 ILE C C 30 178.310 178.310 177.246 1.064 17919 102096 1 249 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.209 0.941 17919 102097 1 249 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.813 -1.014 17919 102098 1 249 . 1 1 30 30 ILE H H 30 8.280 8.280 8.022 0.258 17919 102099 1 249 . 1 1 31 31 GLN N N 31 123.490 123.490 120.981 2.509 17919 102100 1 249 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.053 -0.224 17919 102101 1 249 . 1 1 31 31 GLN C C 31 178.890 178.890 177.767 1.123 17919 102102 1 249 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.074 0.926 17919 102103 1 249 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.546 -0.826 17919 102104 1 249 . 1 1 31 31 GLN H H 31 8.580 8.580 8.163 0.417 17919 102105 1 249 . 1 1 32 32 ASP N N 32 119.360 119.360 117.563 1.797 17919 102106 1 249 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.407 -0.053 17919 102107 1 249 . 1 1 32 32 ASP C C 32 177.250 177.250 178.005 -0.755 17919 102108 1 249 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.554 0.636 17919 102109 1 249 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.757 -0.177 17919 102110 1 249 . 1 1 32 32 ASP H H 32 8.010 8.010 7.756 0.254 17919 102111 1 249 . 1 1 33 33 LYS N N 33 115.130 115.130 118.768 -3.638 17919 102112 1 249 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.325 0.012 17919 102113 1 249 . 1 1 33 33 LYS C C 33 177.870 177.870 178.404 -0.534 17919 102114 1 249 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.875 0.175 17919 102115 1 249 . 1 1 33 33 LYS CB C 33 34.170 34.170 32.971 1.199 17919 102116 1 249 . 1 1 33 33 LYS H H 33 7.430 7.430 7.638 -0.208 17919 102117 1 249 . 1 1 34 34 GLU N N 34 113.870 113.870 115.643 -1.773 17919 102118 1 249 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.421 0.204 17919 102119 1 249 . 1 1 34 34 GLU C C 34 177.840 177.840 177.612 0.228 17919 102120 1 249 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.266 -1.096 17919 102121 1 249 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.526 1.134 17919 102122 1 249 . 1 1 34 34 GLU H H 34 8.740 8.740 7.881 0.859 17919 102123 1 249 . 1 1 35 35 GLY N N 35 108.650 108.650 108.796 -0.146 17919 102124 1 249 . 1 1 35 35 GLY C C 35 173.960 173.960 174.105 -0.145 17919 102125 1 249 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.281 0.799 17919 102126 1 249 . 1 1 35 35 GLY H H 35 8.530 8.530 8.038 0.492 17919 102127 1 249 . 1 1 36 36 ILE N N 36 119.880 119.880 116.666 3.214 17919 102128 1 249 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.672 -0.227 17919 102129 1 249 . 1 1 36 36 ILE C C 36 173.590 173.590 173.489 0.101 17919 102130 1 249 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.433 0.317 17919 102131 1 249 . 1 1 36 36 ILE CB C 36 40.580 40.580 39.225 1.355 17919 102132 1 249 . 1 1 36 36 ILE H H 36 6.150 6.150 7.447 -1.297 17919 102133 1 249 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.537 0.097 17919 102134 1 249 . 1 1 37 37 PRO C C 37 176.940 176.940 176.045 0.895 17919 102135 1 249 . 1 1 37 37 PRO CA C 37 61.660 61.660 62.145 -0.485 17919 102136 1 249 . 1 1 37 37 PRO CB C 37 31.850 31.850 30.734 1.116 17919 102137 1 249 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.149 -0.032 17919 102138 1 249 . 1 1 38 38 PRO C C 38 178.320 178.320 178.429 -0.109 17919 102139 1 249 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.760 0.500 17919 102140 1 249 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.810 1.080 17919 102141 1 249 . 1 1 39 39 ASP N N 39 113.380 113.380 115.480 -2.100 17919 102142 1 249 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.456 -0.026 17919 102143 1 249 . 1 1 39 39 ASP C C 39 177.090 177.090 177.761 -0.671 17919 102144 1 249 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.592 -0.952 17919 102145 1 249 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.469 -0.929 17919 102146 1 249 . 1 1 39 39 ASP H H 39 8.550 8.550 8.628 -0.078 17919 102147 1 249 . 1 1 40 40 GLN N N 40 116.780 116.780 116.693 0.087 17919 102148 1 249 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.246 0.218 17919 102149 1 249 . 1 1 40 40 GLN C C 40 175.380 175.380 176.165 -0.785 17919 102150 1 249 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.974 -0.334 17919 102151 1 249 . 1 1 40 40 GLN CB C 40 30.140 30.140 28.837 1.303 17919 102152 1 249 . 1 1 40 40 GLN H H 40 7.820 7.820 7.804 0.016 17919 102153 1 249 . 1 1 41 41 GLN N N 41 117.720 117.720 119.280 -1.560 17919 102154 1 249 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.660 -0.416 17919 102155 1 249 . 1 1 41 41 GLN C C 41 176.300 176.300 175.659 0.641 17919 102156 1 249 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.721 0.749 17919 102157 1 249 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.401 2.249 17919 102158 1 249 . 1 1 41 41 GLN H H 41 7.480 7.480 7.400 0.080 17919 102159 1 249 . 1 1 42 42 ARG N N 42 122.680 122.680 124.960 -2.280 17919 102160 1 249 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.603 -0.103 17919 102161 1 249 . 1 1 42 42 ARG C C 42 174.050 174.050 174.333 -0.283 17919 102162 1 249 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.740 0.310 17919 102163 1 249 . 1 1 42 42 ARG CB C 42 31.750 31.750 31.909 -0.159 17919 102164 1 249 . 1 1 42 42 ARG H H 42 8.530 8.530 8.858 -0.328 17919 102165 1 249 . 1 1 43 43 LEU N N 43 124.040 124.040 127.347 -3.307 17919 102166 1 249 . 1 1 43 43 LEU C C 43 175.290 175.290 175.182 0.108 17919 102167 1 249 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.551 -1.571 17919 102168 1 249 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.004 1.786 17919 102169 1 249 . 1 1 43 43 LEU H H 43 8.820 8.820 8.831 -0.011 17919 102170 1 249 . 1 1 44 44 ILE N N 44 121.920 121.920 126.416 -4.496 17919 102171 1 249 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.933 0.059 17919 102172 1 249 . 1 1 44 44 ILE C C 44 176.060 176.060 173.990 2.070 17919 102173 1 249 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.470 -1.490 17919 102174 1 249 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.122 0.298 17919 102175 1 249 . 1 1 44 44 ILE H H 44 9.030 9.030 8.963 0.067 17919 102176 1 249 . 1 1 45 45 PHE N N 45 125.390 125.390 126.662 -1.272 17919 102177 1 249 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.982 0.063 17919 102178 1 249 . 1 1 45 45 PHE C C 45 174.470 174.470 174.206 0.264 17919 102179 1 249 . 1 1 45 45 PHE CA C 45 57.020 57.020 57.022 -0.002 17919 102180 1 249 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.700 0.060 17919 102181 1 249 . 1 1 45 45 PHE H H 45 8.830 8.830 9.059 -0.229 17919 102182 1 249 . 1 1 46 46 ALA N N 46 132.200 132.200 128.332 3.868 17919 102183 1 249 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.635 0.055 17919 102184 1 249 . 1 1 46 46 ALA C C 46 177.290 177.290 177.934 -0.644 17919 102185 1 249 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.469 0.071 17919 102186 1 249 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.733 -0.163 17919 102187 1 249 . 1 1 46 46 ALA H H 46 8.810 8.810 8.462 0.348 17919 102188 1 249 . 1 1 47 47 GLY N N 47 102.340 102.340 103.890 -1.550 17919 102189 1 249 . 1 1 47 47 GLY C C 47 173.810 173.810 174.061 -0.251 17919 102190 1 249 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.962 0.388 17919 102191 1 249 . 1 1 47 47 GLY H H 47 8.130 8.130 8.608 -0.478 17919 102192 1 249 . 1 1 48 48 LYS N N 48 121.570 121.570 121.243 0.327 17919 102193 1 249 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.647 -0.025 17919 102194 1 249 . 1 1 48 48 LYS C C 48 174.700 174.700 175.099 -0.399 17919 102195 1 249 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.876 -0.326 17919 102196 1 249 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.507 0.023 17919 102197 1 249 . 1 1 48 48 LYS H H 48 7.980 7.980 7.789 0.191 17919 102198 1 249 . 1 1 49 49 GLN N N 49 122.410 122.410 121.430 0.980 17919 102199 1 249 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.409 0.151 17919 102200 1 249 . 1 1 49 49 GLN C C 49 175.670 175.670 175.734 -0.064 17919 102201 1 249 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.991 -0.251 17919 102202 1 249 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.470 -0.470 17919 102203 1 249 . 1 1 49 49 GLN H H 49 8.600 8.600 8.424 0.176 17919 102204 1 249 . 1 1 50 50 LEU N N 50 125.520 125.520 127.016 -1.496 17919 102205 1 249 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.289 -0.199 17919 102206 1 249 . 1 1 50 50 LEU C C 50 176.660 176.660 176.315 0.345 17919 102207 1 249 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.058 0.182 17919 102208 1 249 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.357 -0.787 17919 102209 1 249 . 1 1 50 50 LEU H H 50 8.530 8.530 8.351 0.179 17919 102210 1 249 . 1 1 51 51 GLU N N 51 122.940 122.940 123.483 -0.543 17919 102211 1 249 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.541 -0.053 17919 102212 1 249 . 1 1 51 51 GLU C C 51 175.870 175.870 177.230 -1.360 17919 102213 1 249 . 1 1 51 51 GLU CA C 51 55.960 55.960 54.791 1.169 17919 102214 1 249 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.142 -0.572 17919 102215 1 249 . 1 1 51 51 GLU H H 51 8.400 8.400 8.717 -0.317 17919 102216 1 249 . 1 1 52 52 ASP N N 52 120.030 120.030 126.495 -6.465 17919 102217 1 249 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.353 0.006 17919 102218 1 249 . 1 1 52 52 ASP C C 52 177.330 177.330 177.166 0.164 17919 102219 1 249 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.435 -0.475 17919 102220 1 249 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.882 -0.032 17919 102221 1 249 . 1 1 52 52 ASP H H 52 8.160 8.160 8.827 -0.667 17919 102222 1 249 . 1 1 53 53 GLY N N 53 106.660 106.660 103.792 2.868 17919 102223 1 249 . 1 1 53 53 GLY C C 53 174.870 174.870 174.021 0.849 17919 102224 1 249 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.527 0.643 17919 102225 1 249 . 1 1 53 53 GLY H H 53 9.390 9.390 8.415 0.975 17919 102226 1 249 . 1 1 54 54 ARG N N 54 119.050 119.050 120.553 -1.503 17919 102227 1 249 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.597 0.098 17919 102228 1 249 . 1 1 54 54 ARG C C 54 175.350 175.350 175.444 -0.094 17919 102229 1 249 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.800 -0.410 17919 102230 1 249 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.215 -0.565 17919 102231 1 249 . 1 1 54 54 ARG H H 54 7.460 7.460 7.495 -0.035 17919 102232 1 249 . 1 1 55 55 THR N N 55 108.400 108.400 112.384 -3.984 17919 102233 1 249 . 1 1 55 55 THR HA H 55 5.240 5.240 5.024 0.216 17919 102234 1 249 . 1 1 55 55 THR C C 55 176.560 176.560 176.281 0.279 17919 102235 1 249 . 1 1 55 55 THR CA C 55 59.690 59.690 60.493 -0.803 17919 102236 1 249 . 1 1 55 55 THR CB C 55 72.260 72.260 70.577 1.683 17919 102237 1 249 . 1 1 55 55 THR H H 55 8.730 8.730 8.923 -0.193 17919 102238 1 249 . 1 1 56 56 LEU N N 56 117.920 117.920 121.410 -3.490 17919 102239 1 249 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.949 0.111 17919 102240 1 249 . 1 1 56 56 LEU C C 56 180.810 180.810 178.984 1.826 17919 102241 1 249 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.714 -0.004 17919 102242 1 249 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.247 -0.877 17919 102243 1 249 . 1 1 56 56 LEU H H 56 8.140 8.140 8.345 -0.205 17919 102244 1 249 . 1 1 57 57 SER N N 57 113.330 113.330 115.063 -1.733 17919 102245 1 249 . 1 1 57 57 SER HA H 57 4.370 4.370 4.077 0.293 17919 102246 1 249 . 1 1 57 57 SER C C 57 178.310 178.310 176.863 1.447 17919 102247 1 249 . 1 1 57 57 SER CA C 57 61.080 61.080 62.439 -1.359 17919 102248 1 249 . 1 1 57 57 SER CB C 57 62.530 62.530 62.799 -0.269 17919 102249 1 249 . 1 1 57 57 SER H H 57 8.470 8.470 8.218 0.252 17919 102250 1 249 . 1 1 58 58 ASP N N 58 124.190 124.190 120.833 3.357 17919 102251 1 249 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.347 -0.051 17919 102252 1 249 . 1 1 58 58 ASP C C 58 177.400 177.400 177.135 0.265 17919 102253 1 249 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.764 0.416 17919 102254 1 249 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.572 -0.472 17919 102255 1 249 . 1 1 58 58 ASP H H 58 7.930 7.930 8.012 -0.082 17919 102256 1 249 . 1 1 59 59 TYR N N 59 115.510 115.510 115.543 -0.033 17919 102257 1 249 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.550 0.120 17919 102258 1 249 . 1 1 59 59 TYR C C 59 174.700 174.700 175.248 -0.548 17919 102259 1 249 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.445 0.805 17919 102260 1 249 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.780 1.290 17919 102261 1 249 . 1 1 59 59 TYR H H 59 7.250 7.250 7.330 -0.080 17919 102262 1 249 . 1 1 60 60 ASN N N 60 115.900 115.900 117.088 -1.188 17919 102263 1 249 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.468 -0.113 17919 102264 1 249 . 1 1 60 60 ASN C C 60 174.340 174.340 175.201 -0.861 17919 102265 1 249 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.009 0.111 17919 102266 1 249 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.483 -0.073 17919 102267 1 249 . 1 1 60 60 ASN H H 60 8.150 8.150 7.914 0.236 17919 102268 1 249 . 1 1 61 61 ILE N N 61 118.600 118.600 118.663 -0.063 17919 102269 1 249 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.712 -0.319 17919 102270 1 249 . 1 1 61 61 ILE C C 61 174.610 174.610 175.535 -0.925 17919 102271 1 249 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.173 0.247 17919 102272 1 249 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.214 -0.474 17919 102273 1 249 . 1 1 61 61 ILE H H 61 7.250 7.250 7.611 -0.361 17919 102274 1 249 . 1 1 62 62 GLN N N 62 124.740 124.740 121.611 3.129 17919 102275 1 249 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.626 -0.120 17919 102276 1 249 . 1 1 62 62 GLN C C 62 175.970 175.970 175.458 0.512 17919 102277 1 249 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.938 -0.278 17919 102278 1 249 . 1 1 62 62 GLN CB C 62 31.650 31.650 32.963 -1.313 17919 102279 1 249 . 1 1 62 62 GLN H H 62 7.610 7.610 8.098 -0.488 17919 102280 1 249 . 1 1 63 63 LYS N N 63 120.300 120.300 121.345 -1.045 17919 102281 1 249 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.206 -0.205 17919 102282 1 249 . 1 1 63 63 LYS C C 63 175.810 175.810 177.303 -1.493 17919 102283 1 249 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.301 0.489 17919 102284 1 249 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.207 0.443 17919 102285 1 249 . 1 1 63 63 LYS H H 63 8.490 8.490 8.697 -0.207 17919 102286 1 249 . 1 1 64 64 GLU N N 64 113.950 113.950 118.203 -4.253 17919 102287 1 249 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.268 0.197 17919 102288 1 249 . 1 1 64 64 GLU C C 64 175.250 175.250 175.577 -0.327 17919 102289 1 249 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.633 0.257 17919 102290 1 249 . 1 1 64 64 GLU CB C 64 25.900 25.900 29.071 -3.171 17919 102291 1 249 . 1 1 64 64 GLU H H 64 9.280 9.280 8.572 0.708 17919 102292 1 249 . 1 1 65 65 SER N N 65 114.730 114.730 115.693 -0.963 17919 102293 1 249 . 1 1 65 65 SER HA H 65 4.640 4.640 4.593 0.047 17919 102294 1 249 . 1 1 65 65 SER C C 65 172.160 172.160 173.755 -1.595 17919 102295 1 249 . 1 1 65 65 SER CA C 65 60.890 60.890 59.631 1.259 17919 102296 1 249 . 1 1 65 65 SER CB C 65 64.910 64.910 64.575 0.335 17919 102297 1 249 . 1 1 65 65 SER H H 65 7.670 7.670 7.255 0.415 17919 102298 1 249 . 1 1 66 66 THR N N 66 117.110 117.110 120.729 -3.619 17919 102299 1 249 . 1 1 66 66 THR HA H 66 5.270 5.270 5.045 0.225 17919 102300 1 249 . 1 1 66 66 THR C C 66 173.950 173.950 174.664 -0.714 17919 102301 1 249 . 1 1 66 66 THR CA C 66 62.340 62.340 62.136 0.204 17919 102302 1 249 . 1 1 66 66 THR CB C 66 70.080 70.080 69.876 0.204 17919 102303 1 249 . 1 1 66 66 THR H H 66 8.730 8.730 8.589 0.141 17919 102304 1 249 . 1 1 67 67 LEU N N 67 127.110 127.110 127.386 -0.276 17919 102305 1 249 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.702 0.358 17919 102306 1 249 . 1 1 67 67 LEU C C 67 175.770 175.770 175.568 0.202 17919 102307 1 249 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.416 -0.516 17919 102308 1 249 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.002 0.258 17919 102309 1 249 . 1 1 67 67 LEU H H 67 9.410 9.410 9.005 0.405 17919 102310 1 249 . 1 1 68 68 HIS N N 68 118.380 118.380 121.601 -3.221 17919 102311 1 249 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.543 -0.303 17919 102312 1 249 . 1 1 68 68 HIS C C 68 173.150 173.150 173.667 -0.517 17919 102313 1 249 . 1 1 68 68 HIS CA C 68 55.000 55.000 53.762 1.238 17919 102314 1 249 . 1 1 68 68 HIS CB C 68 30.530 30.530 31.602 -1.072 17919 102315 1 249 . 1 1 68 68 HIS H H 68 9.230 9.230 8.990 0.240 17919 102316 1 249 . 1 1 69 69 LEU N N 69 124.460 124.460 130.286 -5.826 17919 102317 1 249 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.931 0.259 17919 102318 1 249 . 1 1 69 69 LEU C C 69 175.270 175.270 174.038 1.232 17919 102319 1 249 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.517 0.372 17919 102320 1 249 . 1 1 69 69 LEU CB C 69 44.380 44.380 45.067 -0.687 17919 102321 1 249 . 1 1 69 69 LEU H H 69 8.340 8.340 8.837 -0.497 17919 102322 1 249 . 1 1 70 70 VAL N N 70 126.940 126.940 126.548 0.392 17919 102323 1 249 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.337 0.013 17919 102324 1 249 . 1 1 70 70 VAL C C 70 174.000 174.000 174.189 -0.189 17919 102325 1 249 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.780 0.020 17919 102326 1 249 . 1 1 70 70 VAL CB C 70 34.910 34.910 34.601 0.309 17919 102327 1 249 . 1 1 70 70 VAL H H 70 9.200 9.200 8.994 0.206 17919 102328 1 249 . 1 1 71 71 LEU N N 71 123.130 123.130 126.072 -2.942 17919 102329 1 249 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.013 0.047 17919 102330 1 249 . 1 1 71 71 LEU C C 71 177.830 177.830 176.096 1.734 17919 102331 1 249 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.922 0.018 17919 102332 1 249 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.654 -0.804 17919 102333 1 249 . 1 1 71 71 LEU H H 71 8.120 8.120 8.514 -0.394 17919 102334 1 249 . 1 1 72 72 ARG N N 72 123.490 123.490 124.877 -1.387 17919 102335 1 249 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.647 -0.346 17919 102336 1 249 . 1 1 72 72 ARG C C 72 175.350 175.350 174.633 0.717 17919 102337 1 249 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.195 0.415 17919 102338 1 249 . 1 1 72 72 ARG CB C 72 31.350 31.350 31.641 -0.291 17919 102339 1 249 . 1 1 72 72 ARG H H 72 8.580 8.580 8.901 -0.321 17919 102340 1 250 . 1 1 2 2 GLN N N 2 123.220 123.220 122.867 0.353 17919 102341 1 250 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.290 -0.041 17919 102342 1 250 . 1 1 2 2 GLN C C 2 175.920 175.920 174.842 1.078 17919 102343 1 250 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.425 0.655 17919 102344 1 250 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.532 0.228 17919 102345 1 250 . 1 1 2 2 GLN H H 2 8.900 8.900 8.376 0.524 17919 102346 1 250 . 1 1 3 3 ILE N N 3 115.340 115.340 119.897 -4.557 17919 102347 1 250 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.244 -0.031 17919 102348 1 250 . 1 1 3 3 ILE C C 3 172.450 172.450 173.470 -1.020 17919 102349 1 250 . 1 1 3 3 ILE CA C 3 59.570 59.570 58.951 0.619 17919 102350 1 250 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.663 0.547 17919 102351 1 250 . 1 1 3 3 ILE H H 3 8.320 8.320 7.980 0.340 17919 102352 1 250 . 1 1 4 4 PHE N N 4 118.110 118.110 119.546 -1.436 17919 102353 1 250 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.059 0.571 17919 102354 1 250 . 1 1 4 4 PHE C C 4 175.320 175.320 175.342 -0.022 17919 102355 1 250 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.536 -0.326 17919 102356 1 250 . 1 1 4 4 PHE CB C 4 41.480 41.480 40.473 1.007 17919 102357 1 250 . 1 1 4 4 PHE H H 4 8.610 8.610 7.777 0.833 17919 102358 1 250 . 1 1 5 5 VAL N N 5 121.000 121.000 122.707 -1.707 17919 102359 1 250 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.738 -0.013 17919 102360 1 250 . 1 1 5 5 VAL C C 5 174.870 174.870 174.809 0.061 17919 102361 1 250 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.296 -0.676 17919 102362 1 250 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.432 0.798 17919 102363 1 250 . 1 1 5 5 VAL H H 5 9.300 9.300 9.318 -0.018 17919 102364 1 250 . 1 1 6 6 LYS N N 6 127.520 127.520 129.464 -1.944 17919 102365 1 250 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.103 0.264 17919 102366 1 250 . 1 1 6 6 LYS C C 6 177.140 177.140 176.578 0.562 17919 102367 1 250 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.606 -0.086 17919 102368 1 250 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.351 -0.301 17919 102369 1 250 . 1 1 6 6 LYS H H 6 8.820 8.820 9.230 -0.410 17919 102370 1 250 . 1 1 7 7 THR N N 7 115.400 115.400 121.539 -6.139 17919 102371 1 250 . 1 1 7 7 THR HA H 7 4.970 4.970 4.711 0.259 17919 102372 1 250 . 1 1 7 7 THR C C 7 176.910 176.910 175.288 1.622 17919 102373 1 250 . 1 1 7 7 THR CA C 7 60.470 60.470 62.403 -1.933 17919 102374 1 250 . 1 1 7 7 THR CB C 7 70.630 70.630 70.048 0.582 17919 102375 1 250 . 1 1 7 7 THR H H 7 8.730 8.730 8.970 -0.240 17919 102376 1 250 . 1 1 8 8 LEU N N 8 121.330 121.330 122.691 -1.361 17919 102377 1 250 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.349 -0.039 17919 102378 1 250 . 1 1 8 8 LEU C C 8 178.800 178.800 176.760 2.040 17919 102379 1 250 . 1 1 8 8 LEU CA C 8 57.580 57.580 56.556 1.024 17919 102380 1 250 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.296 -0.326 17919 102381 1 250 . 1 1 8 8 LEU H H 8 9.100 9.100 8.569 0.531 17919 102382 1 250 . 1 1 9 9 THR N N 9 105.590 105.590 108.166 -2.576 17919 102383 1 250 . 1 1 9 9 THR HA H 9 4.428 4.428 4.428 -0.000 17919 102384 1 250 . 1 1 9 9 THR C C 9 175.520 175.520 175.583 -0.063 17919 102385 1 250 . 1 1 9 9 THR CA C 9 61.400 61.400 60.960 0.440 17919 102386 1 250 . 1 1 9 9 THR CB C 9 69.140 69.140 68.377 0.763 17919 102387 1 250 . 1 1 9 9 THR H H 9 7.630 7.630 7.617 0.013 17919 102388 1 250 . 1 1 10 10 GLY N N 10 108.890 108.890 111.161 -2.271 17919 102389 1 250 . 1 1 10 10 GLY C C 10 174.070 174.070 173.797 0.273 17919 102390 1 250 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.276 0.184 17919 102391 1 250 . 1 1 10 10 GLY H H 10 7.810 7.810 7.993 -0.183 17919 102392 1 250 . 1 1 11 11 LYS N N 11 121.600 121.600 121.673 -0.073 17919 102393 1 250 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.287 0.074 17919 102394 1 250 . 1 1 11 11 LYS C C 11 175.940 175.940 175.564 0.376 17919 102395 1 250 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.756 -0.476 17919 102396 1 250 . 1 1 11 11 LYS CB C 11 33.200 33.200 32.932 0.268 17919 102397 1 250 . 1 1 11 11 LYS H H 11 7.280 7.280 8.060 -0.780 17919 102398 1 250 . 1 1 12 12 THR N N 12 120.440 120.440 122.645 -2.205 17919 102399 1 250 . 1 1 12 12 THR HA H 12 5.046 5.046 5.382 -0.336 17919 102400 1 250 . 1 1 12 12 THR C C 12 174.320 174.320 173.895 0.425 17919 102401 1 250 . 1 1 12 12 THR CA C 12 62.390 62.390 61.256 1.134 17919 102402 1 250 . 1 1 12 12 THR CB C 12 69.910 69.910 70.442 -0.532 17919 102403 1 250 . 1 1 12 12 THR H H 12 8.650 8.650 8.263 0.387 17919 102404 1 250 . 1 1 13 13 ILE N N 13 127.110 127.110 127.132 -0.022 17919 102405 1 250 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.526 0.018 17919 102406 1 250 . 1 1 13 13 ILE C C 13 175.220 175.220 174.846 0.374 17919 102407 1 250 . 1 1 13 13 ILE CA C 13 59.980 59.980 58.963 1.017 17919 102408 1 250 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.855 0.095 17919 102409 1 250 . 1 1 13 13 ILE H H 13 9.450 9.450 9.189 0.261 17919 102410 1 250 . 1 1 14 14 THR N N 14 121.520 121.520 122.205 -0.685 17919 102411 1 250 . 1 1 14 14 THR HA H 14 4.964 4.964 5.124 -0.160 17919 102412 1 250 . 1 1 14 14 THR C C 14 173.790 173.790 174.092 -0.302 17919 102413 1 250 . 1 1 14 14 THR CA C 14 61.940 61.940 62.263 -0.323 17919 102414 1 250 . 1 1 14 14 THR CB C 14 69.650 69.650 70.004 -0.354 17919 102415 1 250 . 1 1 14 14 THR H H 14 8.710 8.710 8.450 0.260 17919 102416 1 250 . 1 1 15 15 LEU N N 15 124.800 124.800 126.978 -2.178 17919 102417 1 250 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.712 0.068 17919 102418 1 250 . 1 1 15 15 LEU C C 15 174.670 174.670 175.087 -0.417 17919 102419 1 250 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.587 -0.757 17919 102420 1 250 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.297 1.773 17919 102421 1 250 . 1 1 15 15 LEU H H 15 8.710 8.710 8.911 -0.201 17919 102422 1 250 . 1 1 16 16 GLU N N 16 122.160 122.160 122.305 -0.145 17919 102423 1 250 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.832 0.085 17919 102424 1 250 . 1 1 16 16 GLU C C 16 175.860 175.860 175.573 0.287 17919 102425 1 250 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.163 -0.343 17919 102426 1 250 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.302 -0.852 17919 102427 1 250 . 1 1 16 16 GLU H H 16 8.140 8.140 8.635 -0.495 17919 102428 1 250 . 1 1 17 17 VAL N N 17 117.210 117.210 120.922 -3.712 17919 102429 1 250 . 1 1 17 17 VAL HA H 17 4.714 4.714 5.146 -0.432 17919 102430 1 250 . 1 1 17 17 VAL C C 17 174.160 174.160 175.119 -0.959 17919 102431 1 250 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.281 -0.851 17919 102432 1 250 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.879 0.521 17919 102433 1 250 . 1 1 17 17 VAL H H 17 8.900 8.900 8.802 0.098 17919 102434 1 250 . 1 1 18 18 GLU N N 18 118.990 118.990 122.315 -3.325 17919 102435 1 250 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.835 0.244 17919 102436 1 250 . 1 1 18 18 GLU C C 18 176.160 176.160 176.229 -0.069 17919 102437 1 250 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.359 0.361 17919 102438 1 250 . 1 1 18 18 GLU CB C 18 30.310 30.310 31.110 -0.800 17919 102439 1 250 . 1 1 18 18 GLU H H 18 8.640 8.640 8.831 -0.191 17919 102440 1 250 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.199 -0.058 17919 102441 1 250 . 1 1 19 19 PRO C C 19 175.310 175.310 177.713 -2.403 17919 102442 1 250 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.450 0.020 17919 102443 1 250 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.831 0.119 17919 102444 1 250 . 1 1 20 20 SER N N 20 103.400 103.400 110.649 -7.249 17919 102445 1 250 . 1 1 20 20 SER HA H 20 4.370 4.370 4.305 0.065 17919 102446 1 250 . 1 1 20 20 SER C C 20 174.660 174.660 174.902 -0.242 17919 102447 1 250 . 1 1 20 20 SER CA C 20 57.400 57.400 58.466 -1.066 17919 102448 1 250 . 1 1 20 20 SER CB C 20 63.370 63.370 63.106 0.264 17919 102449 1 250 . 1 1 20 20 SER H H 20 7.040 7.040 8.007 -0.967 17919 102450 1 250 . 1 1 21 21 ASP N N 21 123.480 123.480 124.893 -1.413 17919 102451 1 250 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.647 0.048 17919 102452 1 250 . 1 1 21 21 ASP C C 21 176.360 176.360 176.209 0.151 17919 102453 1 250 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.201 0.499 17919 102454 1 250 . 1 1 21 21 ASP CB C 21 40.800 40.800 42.136 -1.336 17919 102455 1 250 . 1 1 21 21 ASP H H 21 8.030 8.030 7.527 0.503 17919 102456 1 250 . 1 1 22 22 THR N N 22 108.800 108.800 114.090 -5.290 17919 102457 1 250 . 1 1 22 22 THR HA H 22 4.920 4.920 4.746 0.174 17919 102458 1 250 . 1 1 22 22 THR C C 22 176.750 176.750 176.549 0.201 17919 102459 1 250 . 1 1 22 22 THR CA C 22 59.690 59.690 61.356 -1.666 17919 102460 1 250 . 1 1 22 22 THR CB C 22 71.200 71.200 70.624 0.576 17919 102461 1 250 . 1 1 22 22 THR H H 22 7.900 7.900 8.232 -0.332 17919 102462 1 250 . 1 1 23 23 ILE N N 23 121.190 121.190 121.806 -0.616 17919 102463 1 250 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.720 -0.063 17919 102464 1 250 . 1 1 23 23 ILE C C 23 179.040 179.040 177.702 1.338 17919 102465 1 250 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.299 -1.039 17919 102466 1 250 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.204 -1.854 17919 102467 1 250 . 1 1 23 23 ILE H H 23 8.560 8.560 8.557 0.003 17919 102468 1 250 . 1 1 24 24 GLU N N 24 120.830 120.830 121.278 -0.448 17919 102469 1 250 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.883 0.034 17919 102470 1 250 . 1 1 24 24 GLU C C 24 178.640 178.640 178.502 0.138 17919 102471 1 250 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.156 0.064 17919 102472 1 250 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.463 -1.183 17919 102473 1 250 . 1 1 24 24 GLU H H 24 9.760 9.760 8.512 1.248 17919 102474 1 250 . 1 1 25 25 ASN N N 25 120.570 120.570 117.607 2.963 17919 102475 1 250 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.517 0.008 17919 102476 1 250 . 1 1 25 25 ASN C C 25 178.380 178.380 178.043 0.337 17919 102477 1 250 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.015 0.045 17919 102478 1 250 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.150 0.300 17919 102479 1 250 . 1 1 25 25 ASN H H 25 7.920 7.920 7.703 0.217 17919 102480 1 250 . 1 1 26 26 VAL N N 26 121.710 121.710 121.145 0.565 17919 102481 1 250 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.648 -0.251 17919 102482 1 250 . 1 1 26 26 VAL C C 26 177.950 177.950 177.395 0.555 17919 102483 1 250 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.840 0.820 17919 102484 1 250 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.613 -0.773 17919 102485 1 250 . 1 1 26 26 VAL H H 26 8.070 8.070 7.635 0.435 17919 102486 1 250 . 1 1 27 27 LYS N N 27 118.860 118.860 120.783 -1.923 17919 102487 1 250 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.079 0.501 17919 102488 1 250 . 1 1 27 27 LYS C C 27 180.550 180.550 179.100 1.450 17919 102489 1 250 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.917 -0.667 17919 102490 1 250 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.251 1.479 17919 102491 1 250 . 1 1 27 27 LYS H H 27 8.560 8.560 7.973 0.587 17919 102492 1 250 . 1 1 28 28 ALA N N 28 123.440 123.440 121.019 2.421 17919 102493 1 250 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.123 0.036 17919 102494 1 250 . 1 1 28 28 ALA C C 28 180.300 180.300 179.115 1.185 17919 102495 1 250 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.801 0.569 17919 102496 1 250 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.341 -0.631 17919 102497 1 250 . 1 1 28 28 ALA H H 28 8.060 8.060 8.132 -0.072 17919 102498 1 250 . 1 1 29 29 LYS N N 29 119.940 119.940 119.845 0.095 17919 102499 1 250 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.035 0.172 17919 102500 1 250 . 1 1 29 29 LYS C C 29 180.320 180.320 178.952 1.368 17919 102501 1 250 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.598 0.052 17919 102502 1 250 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.404 0.886 17919 102503 1 250 . 1 1 29 29 LYS H H 29 7.850 7.850 8.008 -0.158 17919 102504 1 250 . 1 1 30 30 ILE N N 30 121.080 121.080 120.685 0.395 17919 102505 1 250 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.586 -0.079 17919 102506 1 250 . 1 1 30 30 ILE C C 30 178.310 178.310 177.521 0.789 17919 102507 1 250 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.846 0.304 17919 102508 1 250 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.693 -0.893 17919 102509 1 250 . 1 1 30 30 ILE H H 30 8.280 8.280 8.369 -0.089 17919 102510 1 250 . 1 1 31 31 GLN N N 31 123.490 123.490 120.530 2.960 17919 102511 1 250 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.863 -0.034 17919 102512 1 250 . 1 1 31 31 GLN C C 31 178.890 178.890 178.144 0.746 17919 102513 1 250 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.549 0.451 17919 102514 1 250 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.469 -0.749 17919 102515 1 250 . 1 1 31 31 GLN H H 31 8.580 8.580 8.301 0.279 17919 102516 1 250 . 1 1 32 32 ASP N N 32 119.360 119.360 119.741 -0.381 17919 102517 1 250 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.347 0.007 17919 102518 1 250 . 1 1 32 32 ASP C C 32 177.250 177.250 178.283 -1.033 17919 102519 1 250 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.977 0.212 17919 102520 1 250 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.883 -0.303 17919 102521 1 250 . 1 1 32 32 ASP H H 32 8.010 8.010 8.256 -0.246 17919 102522 1 250 . 1 1 33 33 LYS N N 33 115.130 115.130 118.511 -3.381 17919 102523 1 250 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.201 0.136 17919 102524 1 250 . 1 1 33 33 LYS C C 33 177.870 177.870 178.320 -0.450 17919 102525 1 250 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.192 -0.142 17919 102526 1 250 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.225 0.945 17919 102527 1 250 . 1 1 33 33 LYS H H 33 7.430 7.430 7.826 -0.396 17919 102528 1 250 . 1 1 34 34 GLU N N 34 113.870 113.870 114.223 -0.353 17919 102529 1 250 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.523 0.102 17919 102530 1 250 . 1 1 34 34 GLU C C 34 177.840 177.840 176.490 1.350 17919 102531 1 250 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.708 -0.538 17919 102532 1 250 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.191 1.469 17919 102533 1 250 . 1 1 34 34 GLU H H 34 8.740 8.740 8.119 0.621 17919 102534 1 250 . 1 1 35 35 GLY N N 35 108.650 108.650 108.621 0.029 17919 102535 1 250 . 1 1 35 35 GLY C C 35 173.960 173.960 174.598 -0.638 17919 102536 1 250 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.990 0.090 17919 102537 1 250 . 1 1 35 35 GLY H H 35 8.530 8.530 8.228 0.302 17919 102538 1 250 . 1 1 36 36 ILE N N 36 119.880 119.880 122.057 -2.177 17919 102539 1 250 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.238 0.207 17919 102540 1 250 . 1 1 36 36 ILE C C 36 173.590 173.590 174.011 -0.421 17919 102541 1 250 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.432 -0.682 17919 102542 1 250 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.305 2.275 17919 102543 1 250 . 1 1 36 36 ILE H H 36 6.150 6.150 7.465 -1.315 17919 102544 1 250 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.413 0.221 17919 102545 1 250 . 1 1 37 37 PRO C C 37 176.940 176.940 176.448 0.492 17919 102546 1 250 . 1 1 37 37 PRO CA C 37 61.660 61.660 62.302 -0.642 17919 102547 1 250 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.447 0.404 17919 102548 1 250 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.233 -0.116 17919 102549 1 250 . 1 1 38 38 PRO C C 38 178.320 178.320 178.593 -0.273 17919 102550 1 250 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.586 0.674 17919 102551 1 250 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.997 0.893 17919 102552 1 250 . 1 1 39 39 ASP N N 39 113.380 113.380 117.761 -4.381 17919 102553 1 250 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.404 0.026 17919 102554 1 250 . 1 1 39 39 ASP C C 39 177.090 177.090 177.472 -0.382 17919 102555 1 250 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.626 -0.986 17919 102556 1 250 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.497 -0.957 17919 102557 1 250 . 1 1 39 39 ASP H H 39 8.550 8.550 8.558 -0.008 17919 102558 1 250 . 1 1 40 40 GLN N N 40 116.780 116.780 116.529 0.251 17919 102559 1 250 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.197 0.267 17919 102560 1 250 . 1 1 40 40 GLN C C 40 175.380 175.380 176.321 -0.941 17919 102561 1 250 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.717 -1.077 17919 102562 1 250 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.603 0.537 17919 102563 1 250 . 1 1 40 40 GLN H H 40 7.820 7.820 7.910 -0.090 17919 102564 1 250 . 1 1 41 41 GLN N N 41 117.720 117.720 118.338 -0.618 17919 102565 1 250 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.402 -0.158 17919 102566 1 250 . 1 1 41 41 GLN C C 41 176.300 176.300 175.649 0.651 17919 102567 1 250 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.008 0.462 17919 102568 1 250 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.713 1.937 17919 102569 1 250 . 1 1 41 41 GLN H H 41 7.480 7.480 7.318 0.162 17919 102570 1 250 . 1 1 42 42 ARG N N 42 122.680 122.680 124.381 -1.701 17919 102571 1 250 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.651 -0.151 17919 102572 1 250 . 1 1 42 42 ARG C C 42 174.050 174.050 173.928 0.122 17919 102573 1 250 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.421 0.629 17919 102574 1 250 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.553 -0.804 17919 102575 1 250 . 1 1 42 42 ARG H H 42 8.530 8.530 9.016 -0.486 17919 102576 1 250 . 1 1 43 43 LEU N N 43 124.040 124.040 127.659 -3.619 17919 102577 1 250 . 1 1 43 43 LEU C C 43 175.290 175.290 175.693 -0.403 17919 102578 1 250 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.405 -1.425 17919 102579 1 250 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.309 1.481 17919 102580 1 250 . 1 1 43 43 LEU H H 43 8.820 8.820 8.885 -0.065 17919 102581 1 250 . 1 1 44 44 ILE N N 44 121.920 121.920 120.883 1.037 17919 102582 1 250 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.892 0.100 17919 102583 1 250 . 1 1 44 44 ILE C C 44 176.060 176.060 174.113 1.947 17919 102584 1 250 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.521 -1.541 17919 102585 1 250 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.807 -0.387 17919 102586 1 250 . 1 1 44 44 ILE H H 44 9.030 9.030 8.388 0.642 17919 102587 1 250 . 1 1 45 45 PHE N N 45 125.390 125.390 126.690 -1.300 17919 102588 1 250 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.045 0.000 17919 102589 1 250 . 1 1 45 45 PHE C C 45 174.470 174.470 174.396 0.074 17919 102590 1 250 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.019 1.001 17919 102591 1 250 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.790 0.970 17919 102592 1 250 . 1 1 45 45 PHE H H 45 8.830 8.830 9.139 -0.309 17919 102593 1 250 . 1 1 46 46 ALA N N 46 132.200 132.200 130.577 1.623 17919 102594 1 250 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.776 -0.086 17919 102595 1 250 . 1 1 46 46 ALA C C 46 177.290 177.290 177.985 -0.695 17919 102596 1 250 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.647 -0.107 17919 102597 1 250 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.564 0.006 17919 102598 1 250 . 1 1 46 46 ALA H H 46 8.810 8.810 9.231 -0.421 17919 102599 1 250 . 1 1 47 47 GLY N N 47 102.340 102.340 103.585 -1.245 17919 102600 1 250 . 1 1 47 47 GLY C C 47 173.810 173.810 174.682 -0.872 17919 102601 1 250 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.737 -0.387 17919 102602 1 250 . 1 1 47 47 GLY H H 47 8.130 8.130 8.828 -0.698 17919 102603 1 250 . 1 1 48 48 LYS N N 48 121.570 121.570 120.737 0.833 17919 102604 1 250 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.603 0.019 17919 102605 1 250 . 1 1 48 48 LYS C C 48 174.700 174.700 175.608 -0.908 17919 102606 1 250 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.861 -0.311 17919 102607 1 250 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.525 0.005 17919 102608 1 250 . 1 1 48 48 LYS H H 48 7.980 7.980 7.929 0.051 17919 102609 1 250 . 1 1 49 49 GLN N N 49 122.410 122.410 122.066 0.344 17919 102610 1 250 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.290 0.270 17919 102611 1 250 . 1 1 49 49 GLN C C 49 175.670 175.670 175.634 0.036 17919 102612 1 250 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.341 -0.601 17919 102613 1 250 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.435 -0.435 17919 102614 1 250 . 1 1 49 49 GLN H H 49 8.600 8.600 8.578 0.022 17919 102615 1 250 . 1 1 50 50 LEU N N 50 125.520 125.520 127.471 -1.951 17919 102616 1 250 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.154 -0.064 17919 102617 1 250 . 1 1 50 50 LEU C C 50 176.660 176.660 175.670 0.990 17919 102618 1 250 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.691 0.550 17919 102619 1 250 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.776 -1.206 17919 102620 1 250 . 1 1 50 50 LEU H H 50 8.530 8.530 8.929 -0.399 17919 102621 1 250 . 1 1 51 51 GLU N N 51 122.940 122.940 122.627 0.313 17919 102622 1 250 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.434 0.054 17919 102623 1 250 . 1 1 51 51 GLU C C 51 175.870 175.870 176.671 -0.801 17919 102624 1 250 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.089 0.871 17919 102625 1 250 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.103 -0.533 17919 102626 1 250 . 1 1 51 51 GLU H H 51 8.400 8.400 7.963 0.437 17919 102627 1 250 . 1 1 52 52 ASP N N 52 120.030 120.030 122.355 -2.325 17919 102628 1 250 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.400 -0.041 17919 102629 1 250 . 1 1 52 52 ASP C C 52 177.330 177.330 177.641 -0.311 17919 102630 1 250 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.424 -0.464 17919 102631 1 250 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.698 0.152 17919 102632 1 250 . 1 1 52 52 ASP H H 52 8.160 8.160 8.865 -0.705 17919 102633 1 250 . 1 1 53 53 GLY N N 53 106.660 106.660 104.719 1.941 17919 102634 1 250 . 1 1 53 53 GLY C C 53 174.870 174.870 174.905 -0.035 17919 102635 1 250 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.003 0.167 17919 102636 1 250 . 1 1 53 53 GLY H H 53 9.390 9.390 8.537 0.853 17919 102637 1 250 . 1 1 54 54 ARG N N 54 119.050 119.050 119.712 -0.662 17919 102638 1 250 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.679 0.016 17919 102639 1 250 . 1 1 54 54 ARG C C 54 175.350 175.350 175.460 -0.110 17919 102640 1 250 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.590 -0.200 17919 102641 1 250 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.817 -0.167 17919 102642 1 250 . 1 1 54 54 ARG H H 54 7.460 7.460 7.397 0.063 17919 102643 1 250 . 1 1 55 55 THR N N 55 108.400 108.400 111.845 -3.445 17919 102644 1 250 . 1 1 55 55 THR HA H 55 5.240 5.240 4.874 0.366 17919 102645 1 250 . 1 1 55 55 THR C C 55 176.560 176.560 175.978 0.582 17919 102646 1 250 . 1 1 55 55 THR CA C 55 59.690 59.690 60.558 -0.868 17919 102647 1 250 . 1 1 55 55 THR CB C 55 72.260 72.260 71.147 1.113 17919 102648 1 250 . 1 1 55 55 THR H H 55 8.730 8.730 8.614 0.116 17919 102649 1 250 . 1 1 56 56 LEU N N 56 117.920 117.920 120.980 -3.060 17919 102650 1 250 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.023 0.037 17919 102651 1 250 . 1 1 56 56 LEU C C 56 180.810 180.810 178.979 1.831 17919 102652 1 250 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.152 0.558 17919 102653 1 250 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.277 -0.907 17919 102654 1 250 . 1 1 56 56 LEU H H 56 8.140 8.140 9.098 -0.958 17919 102655 1 250 . 1 1 57 57 SER N N 57 113.330 113.330 115.397 -2.067 17919 102656 1 250 . 1 1 57 57 SER HA H 57 4.370 4.370 4.231 0.139 17919 102657 1 250 . 1 1 57 57 SER C C 57 178.310 178.310 176.985 1.325 17919 102658 1 250 . 1 1 57 57 SER CA C 57 61.080 61.080 61.840 -0.760 17919 102659 1 250 . 1 1 57 57 SER CB C 57 62.530 62.530 62.737 -0.207 17919 102660 1 250 . 1 1 57 57 SER H H 57 8.470 8.470 8.093 0.377 17919 102661 1 250 . 1 1 58 58 ASP N N 58 124.190 124.190 123.413 0.777 17919 102662 1 250 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.329 -0.033 17919 102663 1 250 . 1 1 58 58 ASP C C 58 177.400 177.400 178.010 -0.610 17919 102664 1 250 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.908 0.272 17919 102665 1 250 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.423 -0.323 17919 102666 1 250 . 1 1 58 58 ASP H H 58 7.930 7.930 7.840 0.090 17919 102667 1 250 . 1 1 59 59 TYR N N 59 115.510 115.510 115.720 -0.210 17919 102668 1 250 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.535 0.135 17919 102669 1 250 . 1 1 59 59 TYR C C 59 174.700 174.700 175.123 -0.423 17919 102670 1 250 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.712 0.538 17919 102671 1 250 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.525 1.546 17919 102672 1 250 . 1 1 59 59 TYR H H 59 7.250 7.250 7.404 -0.154 17919 102673 1 250 . 1 1 60 60 ASN N N 60 115.900 115.900 117.941 -2.041 17919 102674 1 250 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.369 -0.014 17919 102675 1 250 . 1 1 60 60 ASN C C 60 174.340 174.340 175.023 -0.683 17919 102676 1 250 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.060 0.060 17919 102677 1 250 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.149 0.261 17919 102678 1 250 . 1 1 60 60 ASN H H 60 8.150 8.150 7.727 0.423 17919 102679 1 250 . 1 1 61 61 ILE N N 61 118.600 118.600 119.476 -0.876 17919 102680 1 250 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.288 0.105 17919 102681 1 250 . 1 1 61 61 ILE C C 61 174.610 174.610 175.295 -0.685 17919 102682 1 250 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.986 0.434 17919 102683 1 250 . 1 1 61 61 ILE CB C 61 36.740 36.740 38.477 -1.737 17919 102684 1 250 . 1 1 61 61 ILE H H 61 7.250 7.250 7.436 -0.186 17919 102685 1 250 . 1 1 62 62 GLN N N 62 124.740 124.740 120.945 3.795 17919 102686 1 250 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.550 -0.044 17919 102687 1 250 . 1 1 62 62 GLN C C 62 175.970 175.970 174.791 1.179 17919 102688 1 250 . 1 1 62 62 GLN CA C 62 53.660 53.660 54.433 -0.773 17919 102689 1 250 . 1 1 62 62 GLN CB C 62 31.650 31.650 33.204 -1.554 17919 102690 1 250 . 1 1 62 62 GLN H H 62 7.610 7.610 8.163 -0.553 17919 102691 1 250 . 1 1 63 63 LYS N N 63 120.300 120.300 124.574 -4.274 17919 102692 1 250 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.926 0.075 17919 102693 1 250 . 1 1 63 63 LYS C C 63 175.810 175.810 177.058 -1.248 17919 102694 1 250 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.257 -0.467 17919 102695 1 250 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.939 0.711 17919 102696 1 250 . 1 1 63 63 LYS H H 63 8.490 8.490 8.847 -0.357 17919 102697 1 250 . 1 1 64 64 GLU N N 64 113.950 113.950 121.671 -7.721 17919 102698 1 250 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.560 -0.095 17919 102699 1 250 . 1 1 64 64 GLU C C 64 175.250 175.250 176.217 -0.967 17919 102700 1 250 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.640 0.250 17919 102701 1 250 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.898 -2.998 17919 102702 1 250 . 1 1 64 64 GLU H H 64 9.280 9.280 8.927 0.353 17919 102703 1 250 . 1 1 65 65 SER N N 65 114.730 114.730 114.944 -0.214 17919 102704 1 250 . 1 1 65 65 SER HA H 65 4.640 4.640 4.373 0.267 17919 102705 1 250 . 1 1 65 65 SER C C 65 172.160 172.160 174.169 -2.009 17919 102706 1 250 . 1 1 65 65 SER CA C 65 60.890 60.890 59.947 0.944 17919 102707 1 250 . 1 1 65 65 SER CB C 65 64.910 64.910 64.111 0.800 17919 102708 1 250 . 1 1 65 65 SER H H 65 7.670 7.670 7.604 0.066 17919 102709 1 250 . 1 1 66 66 THR N N 66 117.110 117.110 119.049 -1.939 17919 102710 1 250 . 1 1 66 66 THR HA H 66 5.270 5.270 5.039 0.231 17919 102711 1 250 . 1 1 66 66 THR C C 66 173.950 173.950 173.740 0.210 17919 102712 1 250 . 1 1 66 66 THR CA C 66 62.340 62.340 62.203 0.137 17919 102713 1 250 . 1 1 66 66 THR CB C 66 70.080 70.080 70.270 -0.190 17919 102714 1 250 . 1 1 66 66 THR H H 66 8.730 8.730 8.498 0.232 17919 102715 1 250 . 1 1 67 67 LEU N N 67 127.110 127.110 126.399 0.711 17919 102716 1 250 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.531 0.529 17919 102717 1 250 . 1 1 67 67 LEU C C 67 175.770 175.770 174.999 0.771 17919 102718 1 250 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.424 0.476 17919 102719 1 250 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.966 -0.706 17919 102720 1 250 . 1 1 67 67 LEU H H 67 9.410 9.410 8.978 0.432 17919 102721 1 250 . 1 1 68 68 HIS N N 68 118.380 118.380 119.978 -1.598 17919 102722 1 250 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.276 -0.036 17919 102723 1 250 . 1 1 68 68 HIS C C 68 173.150 173.150 174.586 -1.436 17919 102724 1 250 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.988 0.012 17919 102725 1 250 . 1 1 68 68 HIS CB C 68 30.530 30.530 31.078 -0.548 17919 102726 1 250 . 1 1 68 68 HIS H H 68 9.230 9.230 8.879 0.351 17919 102727 1 250 . 1 1 69 69 LEU N N 69 124.460 124.460 127.535 -3.075 17919 102728 1 250 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.101 0.089 17919 102729 1 250 . 1 1 69 69 LEU C C 69 175.270 175.270 174.456 0.814 17919 102730 1 250 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.774 0.116 17919 102731 1 250 . 1 1 69 69 LEU CB C 69 44.380 44.380 43.707 0.673 17919 102732 1 250 . 1 1 69 69 LEU H H 69 8.340 8.340 8.875 -0.535 17919 102733 1 250 . 1 1 70 70 VAL N N 70 126.940 126.940 125.974 0.966 17919 102734 1 250 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.494 -0.144 17919 102735 1 250 . 1 1 70 70 VAL C C 70 174.000 174.000 174.046 -0.046 17919 102736 1 250 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.813 0.987 17919 102737 1 250 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.505 -0.595 17919 102738 1 250 . 1 1 70 70 VAL H H 70 9.200 9.200 8.941 0.259 17919 102739 1 250 . 1 1 71 71 LEU N N 71 123.130 123.130 127.756 -4.626 17919 102740 1 250 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.214 -0.154 17919 102741 1 250 . 1 1 71 71 LEU C C 71 177.830 177.830 177.395 0.435 17919 102742 1 250 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.407 0.532 17919 102743 1 250 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.626 0.224 17919 102744 1 250 . 1 1 71 71 LEU H H 71 8.120 8.120 8.471 -0.351 17919 102745 1 250 . 1 1 72 72 ARG N N 72 123.490 123.490 125.674 -2.184 17919 102746 1 250 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.344 -0.043 17919 102747 1 250 . 1 1 72 72 ARG C C 72 175.350 175.350 174.629 0.721 17919 102748 1 250 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.221 -0.611 17919 102749 1 250 . 1 1 72 72 ARG CB C 72 31.350 31.350 31.068 0.282 17919 102750 1 250 . 1 1 72 72 ARG H H 72 8.580 8.580 8.673 -0.093 17919 102751 1 251 . 1 1 2 2 GLN N N 2 123.220 123.220 119.428 3.792 17919 102752 1 251 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.514 -0.265 17919 102753 1 251 . 1 1 2 2 GLN C C 2 175.920 175.920 175.464 0.456 17919 102754 1 251 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.503 0.577 17919 102755 1 251 . 1 1 2 2 GLN CB C 2 30.760 30.760 31.322 -0.562 17919 102756 1 251 . 1 1 2 2 GLN H H 2 8.900 8.900 8.349 0.551 17919 102757 1 251 . 1 1 3 3 ILE N N 3 115.340 115.340 115.773 -0.433 17919 102758 1 251 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.145 0.068 17919 102759 1 251 . 1 1 3 3 ILE C C 3 172.450 172.450 173.334 -0.884 17919 102760 1 251 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.639 -0.069 17919 102761 1 251 . 1 1 3 3 ILE CB C 3 42.210 42.210 42.136 0.074 17919 102762 1 251 . 1 1 3 3 ILE H H 3 8.320 8.320 8.827 -0.507 17919 102763 1 251 . 1 1 4 4 PHE N N 4 118.110 118.110 119.643 -1.533 17919 102764 1 251 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.544 0.086 17919 102765 1 251 . 1 1 4 4 PHE C C 4 175.320 175.320 175.196 0.124 17919 102766 1 251 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.164 0.046 17919 102767 1 251 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.098 0.382 17919 102768 1 251 . 1 1 4 4 PHE H H 4 8.610 8.610 8.592 0.017 17919 102769 1 251 . 1 1 5 5 VAL N N 5 121.000 121.000 122.692 -1.692 17919 102770 1 251 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.851 -0.126 17919 102771 1 251 . 1 1 5 5 VAL C C 5 174.870 174.870 174.848 0.022 17919 102772 1 251 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.426 -0.806 17919 102773 1 251 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.846 0.384 17919 102774 1 251 . 1 1 5 5 VAL H H 5 9.300 9.300 9.327 -0.027 17919 102775 1 251 . 1 1 6 6 LYS N N 6 127.520 127.520 129.345 -1.825 17919 102776 1 251 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.193 0.174 17919 102777 1 251 . 1 1 6 6 LYS C C 6 177.140 177.140 175.964 1.176 17919 102778 1 251 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.631 -0.111 17919 102779 1 251 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.978 -0.928 17919 102780 1 251 . 1 1 6 6 LYS H H 6 8.820 8.820 9.410 -0.590 17919 102781 1 251 . 1 1 7 7 THR N N 7 115.400 115.400 118.258 -2.858 17919 102782 1 251 . 1 1 7 7 THR HA H 7 4.970 4.970 4.714 0.256 17919 102783 1 251 . 1 1 7 7 THR C C 7 176.910 176.910 175.613 1.297 17919 102784 1 251 . 1 1 7 7 THR CA C 7 60.470 60.470 60.793 -0.323 17919 102785 1 251 . 1 1 7 7 THR CB C 7 70.630 70.630 70.901 -0.271 17919 102786 1 251 . 1 1 7 7 THR H H 7 8.730 8.730 9.104 -0.374 17919 102787 1 251 . 1 1 8 8 LEU N N 8 121.330 121.330 122.363 -1.033 17919 102788 1 251 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.353 -0.043 17919 102789 1 251 . 1 1 8 8 LEU C C 8 178.800 178.800 177.294 1.506 17919 102790 1 251 . 1 1 8 8 LEU CA C 8 57.580 57.580 56.967 0.613 17919 102791 1 251 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.889 0.081 17919 102792 1 251 . 1 1 8 8 LEU H H 8 9.100 9.100 8.178 0.922 17919 102793 1 251 . 1 1 9 9 THR N N 9 105.590 105.590 111.102 -5.512 17919 102794 1 251 . 1 1 9 9 THR HA H 9 4.428 4.428 4.352 0.076 17919 102795 1 251 . 1 1 9 9 THR C C 9 175.520 175.520 175.385 0.135 17919 102796 1 251 . 1 1 9 9 THR CA C 9 61.400 61.400 61.966 -0.566 17919 102797 1 251 . 1 1 9 9 THR CB C 9 69.140 69.140 68.266 0.874 17919 102798 1 251 . 1 1 9 9 THR H H 9 7.630 7.630 7.535 0.095 17919 102799 1 251 . 1 1 10 10 GLY N N 10 108.890 108.890 111.331 -2.441 17919 102800 1 251 . 1 1 10 10 GLY C C 10 174.070 174.070 173.967 0.103 17919 102801 1 251 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.521 -0.061 17919 102802 1 251 . 1 1 10 10 GLY H H 10 7.810 7.810 8.086 -0.276 17919 102803 1 251 . 1 1 11 11 LYS N N 11 121.600 121.600 121.045 0.555 17919 102804 1 251 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.557 -0.196 17919 102805 1 251 . 1 1 11 11 LYS C C 11 175.940 175.940 175.559 0.381 17919 102806 1 251 . 1 1 11 11 LYS CA C 11 56.280 56.280 55.606 0.674 17919 102807 1 251 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.999 -0.799 17919 102808 1 251 . 1 1 11 11 LYS H H 11 7.280 7.280 7.817 -0.537 17919 102809 1 251 . 1 1 12 12 THR N N 12 120.440 120.440 117.300 3.140 17919 102810 1 251 . 1 1 12 12 THR HA H 12 5.046 5.046 5.133 -0.087 17919 102811 1 251 . 1 1 12 12 THR C C 12 174.320 174.320 174.031 0.289 17919 102812 1 251 . 1 1 12 12 THR CA C 12 62.390 62.390 61.006 1.384 17919 102813 1 251 . 1 1 12 12 THR CB C 12 69.910 69.910 70.589 -0.679 17919 102814 1 251 . 1 1 12 12 THR H H 12 8.650 8.650 8.227 0.423 17919 102815 1 251 . 1 1 13 13 ILE N N 13 127.110 127.110 121.587 5.523 17919 102816 1 251 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.812 -0.268 17919 102817 1 251 . 1 1 13 13 ILE C C 13 175.220 175.220 174.026 1.194 17919 102818 1 251 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.087 0.893 17919 102819 1 251 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.891 0.059 17919 102820 1 251 . 1 1 13 13 ILE H H 13 9.450 9.450 8.910 0.540 17919 102821 1 251 . 1 1 14 14 THR N N 14 121.520 121.520 120.561 0.959 17919 102822 1 251 . 1 1 14 14 THR HA H 14 4.964 4.964 5.526 -0.562 17919 102823 1 251 . 1 1 14 14 THR C C 14 173.790 173.790 173.850 -0.060 17919 102824 1 251 . 1 1 14 14 THR CA C 14 61.940 61.940 62.016 -0.076 17919 102825 1 251 . 1 1 14 14 THR CB C 14 69.650 69.650 69.998 -0.347 17919 102826 1 251 . 1 1 14 14 THR H H 14 8.710 8.710 8.523 0.187 17919 102827 1 251 . 1 1 15 15 LEU N N 15 124.800 124.800 125.454 -0.654 17919 102828 1 251 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.836 -0.056 17919 102829 1 251 . 1 1 15 15 LEU C C 15 174.670 174.670 175.066 -0.396 17919 102830 1 251 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.738 -0.908 17919 102831 1 251 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.521 1.549 17919 102832 1 251 . 1 1 15 15 LEU H H 15 8.710 8.710 8.861 -0.151 17919 102833 1 251 . 1 1 16 16 GLU N N 16 122.160 122.160 124.461 -2.301 17919 102834 1 251 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.308 -0.391 17919 102835 1 251 . 1 1 16 16 GLU C C 16 175.860 175.860 175.865 -0.005 17919 102836 1 251 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.637 -0.817 17919 102837 1 251 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.502 -1.052 17919 102838 1 251 . 1 1 16 16 GLU H H 16 8.140 8.140 8.557 -0.417 17919 102839 1 251 . 1 1 17 17 VAL N N 17 117.210 117.210 120.813 -3.603 17919 102840 1 251 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.914 -0.200 17919 102841 1 251 . 1 1 17 17 VAL C C 17 174.160 174.160 175.110 -0.950 17919 102842 1 251 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.508 -0.078 17919 102843 1 251 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.353 1.047 17919 102844 1 251 . 1 1 17 17 VAL H H 17 8.900 8.900 8.998 -0.098 17919 102845 1 251 . 1 1 18 18 GLU N N 18 118.990 118.990 121.440 -2.450 17919 102846 1 251 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.792 0.287 17919 102847 1 251 . 1 1 18 18 GLU C C 18 176.160 176.160 175.504 0.656 17919 102848 1 251 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.784 -0.064 17919 102849 1 251 . 1 1 18 18 GLU CB C 18 30.310 30.310 29.693 0.617 17919 102850 1 251 . 1 1 18 18 GLU H H 18 8.640 8.640 8.569 0.071 17919 102851 1 251 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.295 -0.154 17919 102852 1 251 . 1 1 19 19 PRO C C 19 175.310 175.310 177.949 -2.639 17919 102853 1 251 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.356 0.114 17919 102854 1 251 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.894 0.056 17919 102855 1 251 . 1 1 20 20 SER N N 20 103.400 103.400 111.056 -7.656 17919 102856 1 251 . 1 1 20 20 SER HA H 20 4.370 4.370 4.361 0.009 17919 102857 1 251 . 1 1 20 20 SER C C 20 174.660 174.660 174.325 0.335 17919 102858 1 251 . 1 1 20 20 SER CA C 20 57.400 57.400 58.554 -1.154 17919 102859 1 251 . 1 1 20 20 SER CB C 20 63.370 63.370 62.352 1.018 17919 102860 1 251 . 1 1 20 20 SER H H 20 7.040 7.040 8.178 -1.138 17919 102861 1 251 . 1 1 21 21 ASP N N 21 123.480 123.480 122.554 0.926 17919 102862 1 251 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.742 -0.047 17919 102863 1 251 . 1 1 21 21 ASP C C 21 176.360 176.360 175.926 0.434 17919 102864 1 251 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.687 1.013 17919 102865 1 251 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.704 -0.904 17919 102866 1 251 . 1 1 21 21 ASP H H 21 8.030 8.030 7.704 0.326 17919 102867 1 251 . 1 1 22 22 THR N N 22 108.800 108.800 111.893 -3.093 17919 102868 1 251 . 1 1 22 22 THR HA H 22 4.920 4.920 4.930 -0.010 17919 102869 1 251 . 1 1 22 22 THR C C 22 176.750 176.750 176.068 0.682 17919 102870 1 251 . 1 1 22 22 THR CA C 22 59.690 59.690 61.205 -1.515 17919 102871 1 251 . 1 1 22 22 THR CB C 22 71.200 71.200 70.972 0.227 17919 102872 1 251 . 1 1 22 22 THR H H 22 7.900 7.900 8.225 -0.325 17919 102873 1 251 . 1 1 23 23 ILE N N 23 121.190 121.190 122.704 -1.514 17919 102874 1 251 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.877 -0.220 17919 102875 1 251 . 1 1 23 23 ILE C C 23 179.040 179.040 177.792 1.248 17919 102876 1 251 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.416 -0.156 17919 102877 1 251 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.325 -1.975 17919 102878 1 251 . 1 1 23 23 ILE H H 23 8.560 8.560 8.512 0.048 17919 102879 1 251 . 1 1 24 24 GLU N N 24 120.830 120.830 120.823 0.007 17919 102880 1 251 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.887 0.030 17919 102881 1 251 . 1 1 24 24 GLU C C 24 178.640 178.640 178.486 0.154 17919 102882 1 251 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.987 0.233 17919 102883 1 251 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.446 -1.166 17919 102884 1 251 . 1 1 24 24 GLU H H 24 9.760 9.760 8.346 1.414 17919 102885 1 251 . 1 1 25 25 ASN N N 25 120.570 120.570 117.481 3.089 17919 102886 1 251 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.538 -0.013 17919 102887 1 251 . 1 1 25 25 ASN C C 25 178.380 178.380 177.781 0.599 17919 102888 1 251 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.044 0.016 17919 102889 1 251 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.713 -0.263 17919 102890 1 251 . 1 1 25 25 ASN H H 25 7.920 7.920 7.489 0.431 17919 102891 1 251 . 1 1 26 26 VAL N N 26 121.710 121.710 120.340 1.370 17919 102892 1 251 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.594 -0.197 17919 102893 1 251 . 1 1 26 26 VAL C C 26 177.950 177.950 177.760 0.190 17919 102894 1 251 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.765 0.895 17919 102895 1 251 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.335 -0.495 17919 102896 1 251 . 1 1 26 26 VAL H H 26 8.070 8.070 7.920 0.150 17919 102897 1 251 . 1 1 27 27 LYS N N 27 118.860 118.860 119.863 -1.003 17919 102898 1 251 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.263 0.317 17919 102899 1 251 . 1 1 27 27 LYS C C 27 180.550 180.550 178.813 1.737 17919 102900 1 251 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.523 -0.272 17919 102901 1 251 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.255 1.474 17919 102902 1 251 . 1 1 27 27 LYS H H 27 8.560 8.560 8.241 0.319 17919 102903 1 251 . 1 1 28 28 ALA N N 28 123.440 123.440 122.356 1.084 17919 102904 1 251 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.217 -0.057 17919 102905 1 251 . 1 1 28 28 ALA C C 28 180.300 180.300 179.137 1.163 17919 102906 1 251 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.691 0.678 17919 102907 1 251 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.482 -0.772 17919 102908 1 251 . 1 1 28 28 ALA H H 28 8.060 8.060 7.563 0.497 17919 102909 1 251 . 1 1 29 29 LYS N N 29 119.940 119.940 120.086 -0.146 17919 102910 1 251 . 1 1 29 29 LYS HA H 29 4.207 4.207 3.990 0.217 17919 102911 1 251 . 1 1 29 29 LYS C C 29 180.320 180.320 178.973 1.347 17919 102912 1 251 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.623 0.027 17919 102913 1 251 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.353 0.937 17919 102914 1 251 . 1 1 29 29 LYS H H 29 7.850 7.850 7.838 0.012 17919 102915 1 251 . 1 1 30 30 ILE N N 30 121.080 121.080 119.853 1.227 17919 102916 1 251 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.633 -0.126 17919 102917 1 251 . 1 1 30 30 ILE C C 30 178.310 178.310 177.353 0.957 17919 102918 1 251 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.598 0.552 17919 102919 1 251 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.870 -1.070 17919 102920 1 251 . 1 1 30 30 ILE H H 30 8.280 8.280 8.268 0.012 17919 102921 1 251 . 1 1 31 31 GLN N N 31 123.490 123.490 119.715 3.775 17919 102922 1 251 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.881 -0.052 17919 102923 1 251 . 1 1 31 31 GLN C C 31 178.890 178.890 177.982 0.908 17919 102924 1 251 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.145 0.855 17919 102925 1 251 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.420 -0.700 17919 102926 1 251 . 1 1 31 31 GLN H H 31 8.580 8.580 7.818 0.762 17919 102927 1 251 . 1 1 32 32 ASP N N 32 119.360 119.360 119.353 0.007 17919 102928 1 251 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.339 0.015 17919 102929 1 251 . 1 1 32 32 ASP C C 32 177.250 177.250 178.184 -0.934 17919 102930 1 251 . 1 1 32 32 ASP CA C 32 57.190 57.190 57.022 0.168 17919 102931 1 251 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.861 -0.281 17919 102932 1 251 . 1 1 32 32 ASP H H 32 8.010 8.010 8.205 -0.195 17919 102933 1 251 . 1 1 33 33 LYS N N 33 115.130 115.130 118.000 -2.870 17919 102934 1 251 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.314 0.023 17919 102935 1 251 . 1 1 33 33 LYS C C 33 177.870 177.870 178.621 -0.751 17919 102936 1 251 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.941 0.109 17919 102937 1 251 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.720 0.450 17919 102938 1 251 . 1 1 33 33 LYS H H 33 7.430 7.430 7.535 -0.105 17919 102939 1 251 . 1 1 34 34 GLU N N 34 113.870 113.870 115.807 -1.937 17919 102940 1 251 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.448 0.177 17919 102941 1 251 . 1 1 34 34 GLU C C 34 177.840 177.840 177.209 0.631 17919 102942 1 251 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.263 -1.093 17919 102943 1 251 . 1 1 34 34 GLU CB C 34 32.660 32.660 30.709 1.951 17919 102944 1 251 . 1 1 34 34 GLU H H 34 8.740 8.740 8.001 0.739 17919 102945 1 251 . 1 1 35 35 GLY N N 35 108.650 108.650 107.197 1.453 17919 102946 1 251 . 1 1 35 35 GLY C C 35 173.960 173.960 174.396 -0.436 17919 102947 1 251 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.342 0.738 17919 102948 1 251 . 1 1 35 35 GLY H H 35 8.530 8.530 7.911 0.619 17919 102949 1 251 . 1 1 36 36 ILE N N 36 119.880 119.880 123.407 -3.527 17919 102950 1 251 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.399 0.046 17919 102951 1 251 . 1 1 36 36 ILE C C 36 173.590 173.590 174.943 -1.353 17919 102952 1 251 . 1 1 36 36 ILE CA C 36 57.750 57.750 56.717 1.033 17919 102953 1 251 . 1 1 36 36 ILE CB C 36 40.580 40.580 37.599 2.981 17919 102954 1 251 . 1 1 36 36 ILE H H 36 6.150 6.150 7.821 -1.671 17919 102955 1 251 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.709 -0.075 17919 102956 1 251 . 1 1 37 37 PRO C C 37 176.940 176.940 176.210 0.730 17919 102957 1 251 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.322 0.338 17919 102958 1 251 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.509 0.341 17919 102959 1 251 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.232 -0.115 17919 102960 1 251 . 1 1 38 38 PRO C C 38 178.320 178.320 178.608 -0.288 17919 102961 1 251 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.528 0.732 17919 102962 1 251 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.863 1.027 17919 102963 1 251 . 1 1 39 39 ASP N N 39 113.380 113.380 116.372 -2.992 17919 102964 1 251 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.339 0.091 17919 102965 1 251 . 1 1 39 39 ASP C C 39 177.090 177.090 177.285 -0.195 17919 102966 1 251 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.590 -0.950 17919 102967 1 251 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.410 -0.870 17919 102968 1 251 . 1 1 39 39 ASP H H 39 8.550 8.550 8.659 -0.109 17919 102969 1 251 . 1 1 40 40 GLN N N 40 116.780 116.780 116.451 0.329 17919 102970 1 251 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.424 0.040 17919 102971 1 251 . 1 1 40 40 GLN C C 40 175.380 175.380 175.921 -0.541 17919 102972 1 251 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.753 -0.113 17919 102973 1 251 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.572 0.568 17919 102974 1 251 . 1 1 40 40 GLN H H 40 7.820 7.820 7.739 0.081 17919 102975 1 251 . 1 1 41 41 GLN N N 41 117.720 117.720 119.546 -1.826 17919 102976 1 251 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.486 -0.242 17919 102977 1 251 . 1 1 41 41 GLN C C 41 176.300 176.300 174.899 1.401 17919 102978 1 251 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.084 0.386 17919 102979 1 251 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.994 1.657 17919 102980 1 251 . 1 1 41 41 GLN H H 41 7.480 7.480 7.809 -0.329 17919 102981 1 251 . 1 1 42 42 ARG N N 42 122.680 122.680 122.558 0.122 17919 102982 1 251 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.701 -0.201 17919 102983 1 251 . 1 1 42 42 ARG C C 42 174.050 174.050 174.570 -0.520 17919 102984 1 251 . 1 1 42 42 ARG CA C 42 55.050 55.050 52.968 2.082 17919 102985 1 251 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.657 -0.907 17919 102986 1 251 . 1 1 42 42 ARG H H 42 8.530 8.530 8.932 -0.402 17919 102987 1 251 . 1 1 43 43 LEU N N 43 124.040 124.040 125.577 -1.537 17919 102988 1 251 . 1 1 43 43 LEU C C 43 175.290 175.290 176.162 -0.872 17919 102989 1 251 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.836 -0.856 17919 102990 1 251 . 1 1 43 43 LEU CB C 43 45.790 45.790 42.834 2.956 17919 102991 1 251 . 1 1 43 43 LEU H H 43 8.820 8.820 8.764 0.056 17919 102992 1 251 . 1 1 44 44 ILE N N 44 121.920 121.920 122.951 -1.031 17919 102993 1 251 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.752 0.240 17919 102994 1 251 . 1 1 44 44 ILE C C 44 176.060 176.060 174.220 1.840 17919 102995 1 251 . 1 1 44 44 ILE CA C 44 58.980 58.980 58.856 0.124 17919 102996 1 251 . 1 1 44 44 ILE CB C 44 41.420 41.420 39.211 2.209 17919 102997 1 251 . 1 1 44 44 ILE H H 44 9.030 9.030 9.115 -0.085 17919 102998 1 251 . 1 1 45 45 PHE N N 45 125.390 125.390 127.650 -2.260 17919 102999 1 251 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.980 0.065 17919 103000 1 251 . 1 1 45 45 PHE C C 45 174.470 174.470 174.976 -0.506 17919 103001 1 251 . 1 1 45 45 PHE CA C 45 57.020 57.020 55.970 1.050 17919 103002 1 251 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.564 1.196 17919 103003 1 251 . 1 1 45 45 PHE H H 45 8.830 8.830 8.572 0.258 17919 103004 1 251 . 1 1 46 46 ALA N N 46 132.200 132.200 129.965 2.235 17919 103005 1 251 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.681 0.009 17919 103006 1 251 . 1 1 46 46 ALA C C 46 177.290 177.290 177.241 0.049 17919 103007 1 251 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.754 -0.214 17919 103008 1 251 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.389 0.181 17919 103009 1 251 . 1 1 46 46 ALA H H 46 8.810 8.810 8.754 0.056 17919 103010 1 251 . 1 1 47 47 GLY N N 47 102.340 102.340 103.313 -0.973 17919 103011 1 251 . 1 1 47 47 GLY C C 47 173.810 173.810 174.608 -0.798 17919 103012 1 251 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.101 0.249 17919 103013 1 251 . 1 1 47 47 GLY H H 47 8.130 8.130 8.213 -0.083 17919 103014 1 251 . 1 1 48 48 LYS N N 48 121.570 121.570 120.680 0.890 17919 103015 1 251 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.567 0.055 17919 103016 1 251 . 1 1 48 48 LYS C C 48 174.700 174.700 175.378 -0.678 17919 103017 1 251 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.715 -0.165 17919 103018 1 251 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.340 0.190 17919 103019 1 251 . 1 1 48 48 LYS H H 48 7.980 7.980 8.403 -0.423 17919 103020 1 251 . 1 1 49 49 GLN N N 49 122.410 122.410 125.177 -2.767 17919 103021 1 251 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.464 0.096 17919 103022 1 251 . 1 1 49 49 GLN C C 49 175.670 175.670 175.716 -0.046 17919 103023 1 251 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.992 -0.252 17919 103024 1 251 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.354 -0.354 17919 103025 1 251 . 1 1 49 49 GLN H H 49 8.600 8.600 8.529 0.071 17919 103026 1 251 . 1 1 50 50 LEU N N 50 125.520 125.520 126.365 -0.845 17919 103027 1 251 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.165 -0.075 17919 103028 1 251 . 1 1 50 50 LEU C C 50 176.660 176.660 176.289 0.371 17919 103029 1 251 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.907 0.333 17919 103030 1 251 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.711 -1.141 17919 103031 1 251 . 1 1 50 50 LEU H H 50 8.530 8.530 8.370 0.160 17919 103032 1 251 . 1 1 51 51 GLU N N 51 122.940 122.940 122.950 -0.010 17919 103033 1 251 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.539 -0.051 17919 103034 1 251 . 1 1 51 51 GLU C C 51 175.870 175.870 177.025 -1.155 17919 103035 1 251 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.602 0.358 17919 103036 1 251 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.305 0.265 17919 103037 1 251 . 1 1 51 51 GLU H H 51 8.400 8.400 8.588 -0.188 17919 103038 1 251 . 1 1 52 52 ASP N N 52 120.030 120.030 125.126 -5.096 17919 103039 1 251 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.374 -0.015 17919 103040 1 251 . 1 1 52 52 ASP C C 52 177.330 177.330 177.814 -0.484 17919 103041 1 251 . 1 1 52 52 ASP CA C 52 56.960 56.960 58.108 -1.148 17919 103042 1 251 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.719 0.131 17919 103043 1 251 . 1 1 52 52 ASP H H 52 8.160 8.160 8.802 -0.642 17919 103044 1 251 . 1 1 53 53 GLY N N 53 106.660 106.660 105.839 0.821 17919 103045 1 251 . 1 1 53 53 GLY C C 53 174.870 174.870 174.200 0.670 17919 103046 1 251 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.975 0.195 17919 103047 1 251 . 1 1 53 53 GLY H H 53 9.390 9.390 8.596 0.794 17919 103048 1 251 . 1 1 54 54 ARG N N 54 119.050 119.050 120.343 -1.293 17919 103049 1 251 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.664 0.031 17919 103050 1 251 . 1 1 54 54 ARG C C 54 175.350 175.350 175.364 -0.014 17919 103051 1 251 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.210 0.180 17919 103052 1 251 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.093 -0.443 17919 103053 1 251 . 1 1 54 54 ARG H H 54 7.460 7.460 7.410 0.050 17919 103054 1 251 . 1 1 55 55 THR N N 55 108.400 108.400 112.778 -4.378 17919 103055 1 251 . 1 1 55 55 THR HA H 55 5.240 5.240 4.717 0.523 17919 103056 1 251 . 1 1 55 55 THR C C 55 176.560 176.560 176.070 0.490 17919 103057 1 251 . 1 1 55 55 THR CA C 55 59.690 59.690 61.090 -1.400 17919 103058 1 251 . 1 1 55 55 THR CB C 55 72.260 72.260 70.012 2.248 17919 103059 1 251 . 1 1 55 55 THR H H 55 8.730 8.730 8.823 -0.093 17919 103060 1 251 . 1 1 56 56 LEU N N 56 117.920 117.920 121.249 -3.329 17919 103061 1 251 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.002 0.058 17919 103062 1 251 . 1 1 56 56 LEU C C 56 180.810 180.810 178.751 2.059 17919 103063 1 251 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.164 0.546 17919 103064 1 251 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.457 -1.087 17919 103065 1 251 . 1 1 56 56 LEU H H 56 8.140 8.140 8.755 -0.615 17919 103066 1 251 . 1 1 57 57 SER N N 57 113.330 113.330 114.865 -1.535 17919 103067 1 251 . 1 1 57 57 SER HA H 57 4.370 4.370 4.153 0.217 17919 103068 1 251 . 1 1 57 57 SER C C 57 178.310 178.310 176.493 1.817 17919 103069 1 251 . 1 1 57 57 SER CA C 57 61.080 61.080 62.417 -1.337 17919 103070 1 251 . 1 1 57 57 SER CB C 57 62.530 62.530 62.781 -0.251 17919 103071 1 251 . 1 1 57 57 SER H H 57 8.470 8.470 7.933 0.537 17919 103072 1 251 . 1 1 58 58 ASP N N 58 124.190 124.190 121.038 3.152 17919 103073 1 251 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.320 -0.024 17919 103074 1 251 . 1 1 58 58 ASP C C 58 177.400 177.400 176.731 0.669 17919 103075 1 251 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.423 0.757 17919 103076 1 251 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.279 -0.179 17919 103077 1 251 . 1 1 58 58 ASP H H 58 7.930 7.930 7.799 0.131 17919 103078 1 251 . 1 1 59 59 TYR N N 59 115.510 115.510 115.197 0.313 17919 103079 1 251 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.603 0.067 17919 103080 1 251 . 1 1 59 59 TYR C C 59 174.700 174.700 174.606 0.094 17919 103081 1 251 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.156 1.094 17919 103082 1 251 . 1 1 59 59 TYR CB C 59 40.070 40.070 39.270 0.800 17919 103083 1 251 . 1 1 59 59 TYR H H 59 7.250 7.250 7.192 0.058 17919 103084 1 251 . 1 1 60 60 ASN N N 60 115.900 115.900 114.496 1.404 17919 103085 1 251 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.320 0.035 17919 103086 1 251 . 1 1 60 60 ASN C C 60 174.340 174.340 174.328 0.012 17919 103087 1 251 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.012 0.108 17919 103088 1 251 . 1 1 60 60 ASN CB C 60 37.410 37.410 36.630 0.780 17919 103089 1 251 . 1 1 60 60 ASN H H 60 8.150 8.150 8.025 0.125 17919 103090 1 251 . 1 1 61 61 ILE N N 61 118.600 118.600 120.178 -1.578 17919 103091 1 251 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.675 -0.282 17919 103092 1 251 . 1 1 61 61 ILE C C 61 174.610 174.610 175.930 -1.320 17919 103093 1 251 . 1 1 61 61 ILE CA C 61 62.420 62.420 60.061 2.359 17919 103094 1 251 . 1 1 61 61 ILE CB C 61 36.740 36.740 35.709 1.031 17919 103095 1 251 . 1 1 61 61 ILE H H 61 7.250 7.250 7.620 -0.370 17919 103096 1 251 . 1 1 62 62 GLN N N 62 124.740 124.740 126.114 -1.374 17919 103097 1 251 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.508 -0.002 17919 103098 1 251 . 1 1 62 62 GLN C C 62 175.970 175.970 176.637 -0.667 17919 103099 1 251 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.866 -0.206 17919 103100 1 251 . 1 1 62 62 GLN CB C 62 31.650 31.650 30.424 1.226 17919 103101 1 251 . 1 1 62 62 GLN H H 62 7.610 7.610 7.999 -0.389 17919 103102 1 251 . 1 1 63 63 LYS N N 63 120.300 120.300 121.162 -0.862 17919 103103 1 251 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.200 -0.199 17919 103104 1 251 . 1 1 63 63 LYS C C 63 175.810 175.810 177.141 -1.331 17919 103105 1 251 . 1 1 63 63 LYS CA C 63 57.790 57.790 56.906 0.884 17919 103106 1 251 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.655 0.995 17919 103107 1 251 . 1 1 63 63 LYS H H 63 8.490 8.490 8.586 -0.096 17919 103108 1 251 . 1 1 64 64 GLU N N 64 113.950 113.950 120.434 -6.484 17919 103109 1 251 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.312 0.153 17919 103110 1 251 . 1 1 64 64 GLU C C 64 175.250 175.250 175.972 -0.722 17919 103111 1 251 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.636 0.253 17919 103112 1 251 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.273 -2.373 17919 103113 1 251 . 1 1 64 64 GLU H H 64 9.280 9.280 8.945 0.335 17919 103114 1 251 . 1 1 65 65 SER N N 65 114.730 114.730 115.469 -0.739 17919 103115 1 251 . 1 1 65 65 SER HA H 65 4.640 4.640 4.498 0.142 17919 103116 1 251 . 1 1 65 65 SER C C 65 172.160 172.160 173.779 -1.619 17919 103117 1 251 . 1 1 65 65 SER CA C 65 60.890 60.890 60.820 0.070 17919 103118 1 251 . 1 1 65 65 SER CB C 65 64.910 64.910 64.073 0.837 17919 103119 1 251 . 1 1 65 65 SER H H 65 7.670 7.670 7.642 0.028 17919 103120 1 251 . 1 1 66 66 THR N N 66 117.110 117.110 119.562 -2.452 17919 103121 1 251 . 1 1 66 66 THR HA H 66 5.270 5.270 5.190 0.080 17919 103122 1 251 . 1 1 66 66 THR C C 66 173.950 173.950 174.395 -0.445 17919 103123 1 251 . 1 1 66 66 THR CA C 66 62.340 62.340 62.103 0.237 17919 103124 1 251 . 1 1 66 66 THR CB C 66 70.080 70.080 69.895 0.185 17919 103125 1 251 . 1 1 66 66 THR H H 66 8.730 8.730 8.416 0.314 17919 103126 1 251 . 1 1 67 67 LEU N N 67 127.110 127.110 127.586 -0.476 17919 103127 1 251 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.616 0.444 17919 103128 1 251 . 1 1 67 67 LEU C C 67 175.770 175.770 175.501 0.269 17919 103129 1 251 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.565 -0.665 17919 103130 1 251 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.413 0.847 17919 103131 1 251 . 1 1 67 67 LEU H H 67 9.410 9.410 9.263 0.147 17919 103132 1 251 . 1 1 68 68 HIS N N 68 118.380 118.380 121.385 -3.005 17919 103133 1 251 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.565 -0.325 17919 103134 1 251 . 1 1 68 68 HIS C C 68 173.150 173.150 173.690 -0.540 17919 103135 1 251 . 1 1 68 68 HIS CA C 68 55.000 55.000 53.837 1.163 17919 103136 1 251 . 1 1 68 68 HIS CB C 68 30.530 30.530 33.419 -2.889 17919 103137 1 251 . 1 1 68 68 HIS H H 68 9.230 9.230 8.778 0.452 17919 103138 1 251 . 1 1 69 69 LEU N N 69 124.460 124.460 129.388 -4.928 17919 103139 1 251 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.155 0.035 17919 103140 1 251 . 1 1 69 69 LEU C C 69 175.270 175.270 174.130 1.140 17919 103141 1 251 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.570 0.320 17919 103142 1 251 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.239 0.141 17919 103143 1 251 . 1 1 69 69 LEU H H 69 8.340 8.340 8.271 0.069 17919 103144 1 251 . 1 1 70 70 VAL N N 70 126.940 126.940 126.532 0.408 17919 103145 1 251 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.227 0.123 17919 103146 1 251 . 1 1 70 70 VAL C C 70 174.000 174.000 174.514 -0.514 17919 103147 1 251 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.983 -0.183 17919 103148 1 251 . 1 1 70 70 VAL CB C 70 34.910 34.910 34.613 0.297 17919 103149 1 251 . 1 1 70 70 VAL H H 70 9.200 9.200 8.789 0.411 17919 103150 1 251 . 1 1 71 71 LEU N N 71 123.130 123.130 125.108 -1.978 17919 103151 1 251 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.167 -0.107 17919 103152 1 251 . 1 1 71 71 LEU C C 71 177.830 177.830 176.852 0.978 17919 103153 1 251 . 1 1 71 71 LEU CA C 71 53.940 53.940 52.727 1.213 17919 103154 1 251 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.308 -0.458 17919 103155 1 251 . 1 1 71 71 LEU H H 71 8.120 8.120 8.159 -0.039 17919 103156 1 251 . 1 1 72 72 ARG N N 72 123.490 123.490 122.611 0.879 17919 103157 1 251 . 1 1 72 72 ARG HA H 72 4.301 4.301 3.989 0.312 17919 103158 1 251 . 1 1 72 72 ARG C C 72 175.350 175.350 176.378 -1.028 17919 103159 1 251 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.587 -0.977 17919 103160 1 251 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.692 0.659 17919 103161 1 251 . 1 1 72 72 ARG H H 72 8.580 8.580 8.249 0.331 17919 103162 1 252 . 1 1 2 2 GLN N N 2 123.220 123.220 120.628 2.592 17919 103163 1 252 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.154 0.095 17919 103164 1 252 . 1 1 2 2 GLN C C 2 175.920 175.920 174.522 1.398 17919 103165 1 252 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.664 0.416 17919 103166 1 252 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.368 0.392 17919 103167 1 252 . 1 1 2 2 GLN H H 2 8.900 8.900 8.278 0.622 17919 103168 1 252 . 1 1 3 3 ILE N N 3 115.340 115.340 118.383 -3.043 17919 103169 1 252 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.538 -0.325 17919 103170 1 252 . 1 1 3 3 ILE C C 3 172.450 172.450 173.034 -0.584 17919 103171 1 252 . 1 1 3 3 ILE CA C 3 59.570 59.570 60.001 -0.431 17919 103172 1 252 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.812 0.398 17919 103173 1 252 . 1 1 3 3 ILE H H 3 8.320 8.320 8.154 0.166 17919 103174 1 252 . 1 1 4 4 PHE N N 4 118.110 118.110 121.081 -2.971 17919 103175 1 252 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.611 0.019 17919 103176 1 252 . 1 1 4 4 PHE C C 4 175.320 175.320 175.150 0.170 17919 103177 1 252 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.767 -0.557 17919 103178 1 252 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.271 -0.791 17919 103179 1 252 . 1 1 4 4 PHE H H 4 8.610 8.610 8.591 0.019 17919 103180 1 252 . 1 1 5 5 VAL N N 5 121.000 121.000 116.471 4.529 17919 103181 1 252 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.988 -0.263 17919 103182 1 252 . 1 1 5 5 VAL C C 5 174.870 174.870 174.115 0.755 17919 103183 1 252 . 1 1 5 5 VAL CA C 5 60.620 60.620 60.100 0.520 17919 103184 1 252 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.618 -0.388 17919 103185 1 252 . 1 1 5 5 VAL H H 5 9.300 9.300 8.745 0.555 17919 103186 1 252 . 1 1 6 6 LYS N N 6 127.520 127.520 128.330 -0.810 17919 103187 1 252 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.224 0.143 17919 103188 1 252 . 1 1 6 6 LYS C C 6 177.140 177.140 176.730 0.410 17919 103189 1 252 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.566 -0.045 17919 103190 1 252 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.498 -0.448 17919 103191 1 252 . 1 1 6 6 LYS H H 6 8.820 8.820 9.058 -0.238 17919 103192 1 252 . 1 1 7 7 THR N N 7 115.400 115.400 118.746 -3.346 17919 103193 1 252 . 1 1 7 7 THR HA H 7 4.970 4.970 4.761 0.209 17919 103194 1 252 . 1 1 7 7 THR C C 7 176.910 176.910 176.570 0.340 17919 103195 1 252 . 1 1 7 7 THR CA C 7 60.470 60.470 61.729 -1.259 17919 103196 1 252 . 1 1 7 7 THR CB C 7 70.630 70.630 70.109 0.521 17919 103197 1 252 . 1 1 7 7 THR H H 7 8.730 8.730 9.009 -0.279 17919 103198 1 252 . 1 1 8 8 LEU N N 8 121.330 121.330 120.885 0.445 17919 103199 1 252 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.346 -0.036 17919 103200 1 252 . 1 1 8 8 LEU C C 8 178.800 178.800 177.890 0.910 17919 103201 1 252 . 1 1 8 8 LEU CA C 8 57.580 57.580 56.534 1.046 17919 103202 1 252 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.311 0.659 17919 103203 1 252 . 1 1 8 8 LEU H H 8 9.100 9.100 8.850 0.250 17919 103204 1 252 . 1 1 9 9 THR N N 9 105.590 105.590 108.670 -3.080 17919 103205 1 252 . 1 1 9 9 THR HA H 9 4.428 4.428 4.384 0.044 17919 103206 1 252 . 1 1 9 9 THR C C 9 175.520 175.520 175.592 -0.072 17919 103207 1 252 . 1 1 9 9 THR CA C 9 61.400 61.400 61.700 -0.300 17919 103208 1 252 . 1 1 9 9 THR CB C 9 69.140 69.140 69.420 -0.280 17919 103209 1 252 . 1 1 9 9 THR H H 9 7.630 7.630 7.611 0.019 17919 103210 1 252 . 1 1 10 10 GLY N N 10 108.890 108.890 111.432 -2.542 17919 103211 1 252 . 1 1 10 10 GLY C C 10 174.070 174.070 173.399 0.671 17919 103212 1 252 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.911 0.549 17919 103213 1 252 . 1 1 10 10 GLY H H 10 7.810 7.810 7.974 -0.164 17919 103214 1 252 . 1 1 11 11 LYS N N 11 121.600 121.600 122.093 -0.493 17919 103215 1 252 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.353 0.008 17919 103216 1 252 . 1 1 11 11 LYS C C 11 175.940 175.940 175.471 0.469 17919 103217 1 252 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.529 -0.249 17919 103218 1 252 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.352 -0.152 17919 103219 1 252 . 1 1 11 11 LYS H H 11 7.280 7.280 7.719 -0.439 17919 103220 1 252 . 1 1 12 12 THR N N 12 120.440 120.440 121.820 -1.380 17919 103221 1 252 . 1 1 12 12 THR HA H 12 5.046 5.046 5.414 -0.368 17919 103222 1 252 . 1 1 12 12 THR C C 12 174.320 174.320 174.434 -0.114 17919 103223 1 252 . 1 1 12 12 THR CA C 12 62.390 62.390 60.922 1.468 17919 103224 1 252 . 1 1 12 12 THR CB C 12 69.910 69.910 70.106 -0.196 17919 103225 1 252 . 1 1 12 12 THR H H 12 8.650 8.650 8.397 0.253 17919 103226 1 252 . 1 1 13 13 ILE N N 13 127.110 127.110 118.990 8.120 17919 103227 1 252 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.755 -0.211 17919 103228 1 252 . 1 1 13 13 ILE C C 13 175.220 175.220 173.960 1.260 17919 103229 1 252 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.101 0.879 17919 103230 1 252 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.553 -0.603 17919 103231 1 252 . 1 1 13 13 ILE H H 13 9.450 9.450 8.365 1.085 17919 103232 1 252 . 1 1 14 14 THR N N 14 121.520 121.520 118.538 2.982 17919 103233 1 252 . 1 1 14 14 THR HA H 14 4.964 4.964 4.772 0.192 17919 103234 1 252 . 1 1 14 14 THR C C 14 173.790 173.790 173.498 0.292 17919 103235 1 252 . 1 1 14 14 THR CA C 14 61.940 61.940 62.266 -0.326 17919 103236 1 252 . 1 1 14 14 THR CB C 14 69.650 69.650 69.611 0.039 17919 103237 1 252 . 1 1 14 14 THR H H 14 8.710 8.710 8.386 0.324 17919 103238 1 252 . 1 1 15 15 LEU N N 15 124.800 124.800 126.768 -1.968 17919 103239 1 252 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.703 0.077 17919 103240 1 252 . 1 1 15 15 LEU C C 15 174.670 174.670 175.217 -0.547 17919 103241 1 252 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.654 -0.824 17919 103242 1 252 . 1 1 15 15 LEU CB C 15 47.070 47.070 43.992 3.078 17919 103243 1 252 . 1 1 15 15 LEU H H 15 8.710 8.710 8.647 0.063 17919 103244 1 252 . 1 1 16 16 GLU N N 16 122.160 122.160 124.261 -2.101 17919 103245 1 252 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.987 -0.070 17919 103246 1 252 . 1 1 16 16 GLU C C 16 175.860 175.860 176.478 -0.618 17919 103247 1 252 . 1 1 16 16 GLU CA C 16 54.820 54.820 56.132 -1.312 17919 103248 1 252 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.412 -0.962 17919 103249 1 252 . 1 1 16 16 GLU H H 16 8.140 8.140 8.612 -0.472 17919 103250 1 252 . 1 1 17 17 VAL N N 17 117.210 117.210 119.889 -2.679 17919 103251 1 252 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.680 0.034 17919 103252 1 252 . 1 1 17 17 VAL C C 17 174.160 174.160 174.539 -0.379 17919 103253 1 252 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.198 -0.768 17919 103254 1 252 . 1 1 17 17 VAL CB C 17 36.400 36.400 34.437 1.963 17919 103255 1 252 . 1 1 17 17 VAL H H 17 8.900 8.900 8.138 0.762 17919 103256 1 252 . 1 1 18 18 GLU N N 18 118.990 118.990 120.846 -1.856 17919 103257 1 252 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.902 0.177 17919 103258 1 252 . 1 1 18 18 GLU C C 18 176.160 176.160 175.752 0.408 17919 103259 1 252 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.539 0.181 17919 103260 1 252 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.806 -0.496 17919 103261 1 252 . 1 1 18 18 GLU H H 18 8.640 8.640 9.149 -0.509 17919 103262 1 252 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.188 -0.047 17919 103263 1 252 . 1 1 19 19 PRO C C 19 175.310 175.310 177.902 -2.592 17919 103264 1 252 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.482 -0.012 17919 103265 1 252 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.856 0.094 17919 103266 1 252 . 1 1 20 20 SER N N 20 103.400 103.400 110.312 -6.912 17919 103267 1 252 . 1 1 20 20 SER HA H 20 4.370 4.370 4.282 0.088 17919 103268 1 252 . 1 1 20 20 SER C C 20 174.660 174.660 174.354 0.306 17919 103269 1 252 . 1 1 20 20 SER CA C 20 57.400 57.400 59.631 -2.231 17919 103270 1 252 . 1 1 20 20 SER CB C 20 63.370 63.370 62.597 0.773 17919 103271 1 252 . 1 1 20 20 SER H H 20 7.040 7.040 8.185 -1.145 17919 103272 1 252 . 1 1 21 21 ASP N N 21 123.480 123.480 122.629 0.851 17919 103273 1 252 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.821 -0.126 17919 103274 1 252 . 1 1 21 21 ASP C C 21 176.360 176.360 175.802 0.558 17919 103275 1 252 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.719 0.981 17919 103276 1 252 . 1 1 21 21 ASP CB C 21 40.800 40.800 42.024 -1.224 17919 103277 1 252 . 1 1 21 21 ASP H H 21 8.030 8.030 7.810 0.220 17919 103278 1 252 . 1 1 22 22 THR N N 22 108.800 108.800 113.396 -4.596 17919 103279 1 252 . 1 1 22 22 THR HA H 22 4.920 4.920 4.791 0.129 17919 103280 1 252 . 1 1 22 22 THR C C 22 176.750 176.750 176.422 0.328 17919 103281 1 252 . 1 1 22 22 THR CA C 22 59.690 59.690 61.363 -1.673 17919 103282 1 252 . 1 1 22 22 THR CB C 22 71.200 71.200 70.623 0.577 17919 103283 1 252 . 1 1 22 22 THR H H 22 7.900 7.900 8.189 -0.289 17919 103284 1 252 . 1 1 23 23 ILE N N 23 121.190 121.190 122.453 -1.263 17919 103285 1 252 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.712 -0.055 17919 103286 1 252 . 1 1 23 23 ILE C C 23 179.040 179.040 177.852 1.188 17919 103287 1 252 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.663 -0.403 17919 103288 1 252 . 1 1 23 23 ILE CB C 23 34.350 34.350 35.955 -1.605 17919 103289 1 252 . 1 1 23 23 ILE H H 23 8.560 8.560 8.533 0.027 17919 103290 1 252 . 1 1 24 24 GLU N N 24 120.830 120.830 120.118 0.712 17919 103291 1 252 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.844 0.073 17919 103292 1 252 . 1 1 24 24 GLU C C 24 178.640 178.640 178.582 0.058 17919 103293 1 252 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.050 0.170 17919 103294 1 252 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.412 -1.132 17919 103295 1 252 . 1 1 24 24 GLU H H 24 9.760 9.760 7.959 1.801 17919 103296 1 252 . 1 1 25 25 ASN N N 25 120.570 120.570 118.113 2.457 17919 103297 1 252 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.481 0.044 17919 103298 1 252 . 1 1 25 25 ASN C C 25 178.380 178.380 177.898 0.482 17919 103299 1 252 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.990 0.070 17919 103300 1 252 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.451 -0.001 17919 103301 1 252 . 1 1 25 25 ASN H H 25 7.920 7.920 7.531 0.389 17919 103302 1 252 . 1 1 26 26 VAL N N 26 121.710 121.710 120.513 1.197 17919 103303 1 252 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.470 -0.073 17919 103304 1 252 . 1 1 26 26 VAL C C 26 177.950 177.950 177.877 0.073 17919 103305 1 252 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.773 0.887 17919 103306 1 252 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.567 -0.727 17919 103307 1 252 . 1 1 26 26 VAL H H 26 8.070 8.070 7.956 0.114 17919 103308 1 252 . 1 1 27 27 LYS N N 27 118.860 118.860 119.761 -0.901 17919 103309 1 252 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.107 0.473 17919 103310 1 252 . 1 1 27 27 LYS C C 27 180.550 180.550 179.245 1.305 17919 103311 1 252 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.661 -0.411 17919 103312 1 252 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.217 1.513 17919 103313 1 252 . 1 1 27 27 LYS H H 27 8.560 8.560 8.275 0.285 17919 103314 1 252 . 1 1 28 28 ALA N N 28 123.440 123.440 121.353 2.087 17919 103315 1 252 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.083 0.077 17919 103316 1 252 . 1 1 28 28 ALA C C 28 180.300 180.300 179.258 1.042 17919 103317 1 252 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.927 0.443 17919 103318 1 252 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.416 -0.706 17919 103319 1 252 . 1 1 28 28 ALA H H 28 8.060 8.060 8.397 -0.337 17919 103320 1 252 . 1 1 29 29 LYS N N 29 119.940 119.940 119.581 0.359 17919 103321 1 252 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.296 -0.089 17919 103322 1 252 . 1 1 29 29 LYS C C 29 180.320 180.320 178.674 1.646 17919 103323 1 252 . 1 1 29 29 LYS CA C 29 59.650 59.650 58.805 0.845 17919 103324 1 252 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.120 1.170 17919 103325 1 252 . 1 1 29 29 LYS H H 29 7.850 7.850 7.685 0.165 17919 103326 1 252 . 1 1 30 30 ILE N N 30 121.080 121.080 119.322 1.758 17919 103327 1 252 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.618 -0.111 17919 103328 1 252 . 1 1 30 30 ILE C C 30 178.310 178.310 177.716 0.594 17919 103329 1 252 . 1 1 30 30 ILE CA C 30 66.150 66.150 64.837 1.313 17919 103330 1 252 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.851 -1.051 17919 103331 1 252 . 1 1 30 30 ILE H H 30 8.280 8.280 8.132 0.148 17919 103332 1 252 . 1 1 31 31 GLN N N 31 123.490 123.490 120.574 2.916 17919 103333 1 252 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.014 -0.185 17919 103334 1 252 . 1 1 31 31 GLN C C 31 178.890 178.890 178.573 0.317 17919 103335 1 252 . 1 1 31 31 GLN CA C 31 60.000 60.000 58.444 1.556 17919 103336 1 252 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.152 -0.433 17919 103337 1 252 . 1 1 31 31 GLN H H 31 8.580 8.580 8.084 0.496 17919 103338 1 252 . 1 1 32 32 ASP N N 32 119.360 119.360 118.734 0.626 17919 103339 1 252 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.522 -0.168 17919 103340 1 252 . 1 1 32 32 ASP C C 32 177.250 177.250 176.900 0.350 17919 103341 1 252 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.215 0.975 17919 103342 1 252 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.487 0.093 17919 103343 1 252 . 1 1 32 32 ASP H H 32 8.010 8.010 8.536 -0.526 17919 103344 1 252 . 1 1 33 33 LYS N N 33 115.130 115.130 118.030 -2.900 17919 103345 1 252 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.485 -0.148 17919 103346 1 252 . 1 1 33 33 LYS C C 33 177.870 177.870 177.486 0.384 17919 103347 1 252 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.106 0.944 17919 103348 1 252 . 1 1 33 33 LYS CB C 33 34.170 34.170 35.095 -0.925 17919 103349 1 252 . 1 1 33 33 LYS H H 33 7.430 7.430 7.396 0.034 17919 103350 1 252 . 1 1 34 34 GLU N N 34 113.870 113.870 115.184 -1.314 17919 103351 1 252 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.518 0.107 17919 103352 1 252 . 1 1 34 34 GLU C C 34 177.840 177.840 176.991 0.849 17919 103353 1 252 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.638 -0.468 17919 103354 1 252 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.675 0.985 17919 103355 1 252 . 1 1 34 34 GLU H H 34 8.740 8.740 8.281 0.459 17919 103356 1 252 . 1 1 35 35 GLY N N 35 108.650 108.650 108.802 -0.152 17919 103357 1 252 . 1 1 35 35 GLY C C 35 173.960 173.960 174.672 -0.712 17919 103358 1 252 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.956 0.124 17919 103359 1 252 . 1 1 35 35 GLY H H 35 8.530 8.530 7.761 0.769 17919 103360 1 252 . 1 1 36 36 ILE N N 36 119.880 119.880 122.147 -2.267 17919 103361 1 252 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.237 0.208 17919 103362 1 252 . 1 1 36 36 ILE C C 36 173.590 173.590 174.073 -0.483 17919 103363 1 252 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.497 -0.747 17919 103364 1 252 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.171 2.409 17919 103365 1 252 . 1 1 36 36 ILE H H 36 6.150 6.150 7.698 -1.548 17919 103366 1 252 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.808 -0.174 17919 103367 1 252 . 1 1 37 37 PRO C C 37 176.940 176.940 176.196 0.744 17919 103368 1 252 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.783 -0.123 17919 103369 1 252 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.440 0.410 17919 103370 1 252 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.246 -0.129 17919 103371 1 252 . 1 1 38 38 PRO C C 38 178.320 178.320 178.360 -0.040 17919 103372 1 252 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.293 0.967 17919 103373 1 252 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.903 0.987 17919 103374 1 252 . 1 1 39 39 ASP N N 39 113.380 113.380 116.815 -3.435 17919 103375 1 252 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.415 0.015 17919 103376 1 252 . 1 1 39 39 ASP C C 39 177.090 177.090 177.194 -0.104 17919 103377 1 252 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.343 -0.703 17919 103378 1 252 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.298 -0.758 17919 103379 1 252 . 1 1 39 39 ASP H H 39 8.550 8.550 8.795 -0.245 17919 103380 1 252 . 1 1 40 40 GLN N N 40 116.780 116.780 117.153 -0.373 17919 103381 1 252 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.443 0.021 17919 103382 1 252 . 1 1 40 40 GLN C C 40 175.380 175.380 175.331 0.049 17919 103383 1 252 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.745 -0.105 17919 103384 1 252 . 1 1 40 40 GLN CB C 40 30.140 30.140 30.097 0.043 17919 103385 1 252 . 1 1 40 40 GLN H H 40 7.820 7.820 7.793 0.027 17919 103386 1 252 . 1 1 41 41 GLN N N 41 117.720 117.720 119.245 -1.525 17919 103387 1 252 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.585 -0.341 17919 103388 1 252 . 1 1 41 41 GLN C C 41 176.300 176.300 174.539 1.761 17919 103389 1 252 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.569 0.901 17919 103390 1 252 . 1 1 41 41 GLN CB C 41 31.650 31.650 30.355 1.296 17919 103391 1 252 . 1 1 41 41 GLN H H 41 7.480 7.480 7.256 0.224 17919 103392 1 252 . 1 1 42 42 ARG N N 42 122.680 122.680 124.444 -1.764 17919 103393 1 252 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.646 -0.146 17919 103394 1 252 . 1 1 42 42 ARG C C 42 174.050 174.050 173.615 0.435 17919 103395 1 252 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.206 -0.156 17919 103396 1 252 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.730 -1.980 17919 103397 1 252 . 1 1 42 42 ARG H H 42 8.530 8.530 8.648 -0.118 17919 103398 1 252 . 1 1 43 43 LEU N N 43 124.040 124.040 127.144 -3.104 17919 103399 1 252 . 1 1 43 43 LEU C C 43 175.290 175.290 175.571 -0.281 17919 103400 1 252 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.503 -0.523 17919 103401 1 252 . 1 1 43 43 LEU CB C 43 45.790 45.790 45.061 0.729 17919 103402 1 252 . 1 1 43 43 LEU H H 43 8.820 8.820 8.750 0.070 17919 103403 1 252 . 1 1 44 44 ILE N N 44 121.920 121.920 117.673 4.247 17919 103404 1 252 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.275 -0.283 17919 103405 1 252 . 1 1 44 44 ILE C C 44 176.060 176.060 173.586 2.474 17919 103406 1 252 . 1 1 44 44 ILE CA C 44 58.980 58.980 58.999 -0.019 17919 103407 1 252 . 1 1 44 44 ILE CB C 44 41.420 41.420 42.235 -0.815 17919 103408 1 252 . 1 1 44 44 ILE H H 44 9.030 9.030 8.974 0.056 17919 103409 1 252 . 1 1 45 45 PHE N N 45 125.390 125.390 126.707 -1.317 17919 103410 1 252 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.097 -0.052 17919 103411 1 252 . 1 1 45 45 PHE C C 45 174.470 174.470 174.862 -0.392 17919 103412 1 252 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.115 0.905 17919 103413 1 252 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.047 0.713 17919 103414 1 252 . 1 1 45 45 PHE H H 45 8.830 8.830 8.448 0.382 17919 103415 1 252 . 1 1 46 46 ALA N N 46 132.200 132.200 129.981 2.219 17919 103416 1 252 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.639 0.051 17919 103417 1 252 . 1 1 46 46 ALA C C 46 177.290 177.290 177.597 -0.307 17919 103418 1 252 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.825 -0.285 17919 103419 1 252 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.358 0.212 17919 103420 1 252 . 1 1 46 46 ALA H H 46 8.810 8.810 8.917 -0.107 17919 103421 1 252 . 1 1 47 47 GLY N N 47 102.340 102.340 103.630 -1.290 17919 103422 1 252 . 1 1 47 47 GLY C C 47 173.810 173.810 174.409 -0.599 17919 103423 1 252 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.370 -0.020 17919 103424 1 252 . 1 1 47 47 GLY H H 47 8.130 8.130 8.605 -0.475 17919 103425 1 252 . 1 1 48 48 LYS N N 48 121.570 121.570 121.123 0.447 17919 103426 1 252 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.596 0.026 17919 103427 1 252 . 1 1 48 48 LYS C C 48 174.700 174.700 175.489 -0.789 17919 103428 1 252 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.832 -0.282 17919 103429 1 252 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.346 0.184 17919 103430 1 252 . 1 1 48 48 LYS H H 48 7.980 7.980 7.918 0.062 17919 103431 1 252 . 1 1 49 49 GLN N N 49 122.410 122.410 124.673 -2.263 17919 103432 1 252 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.369 0.191 17919 103433 1 252 . 1 1 49 49 GLN C C 49 175.670 175.670 175.520 0.150 17919 103434 1 252 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.678 -0.938 17919 103435 1 252 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.263 -0.263 17919 103436 1 252 . 1 1 49 49 GLN H H 49 8.600 8.600 8.594 0.006 17919 103437 1 252 . 1 1 50 50 LEU N N 50 125.520 125.520 129.360 -3.840 17919 103438 1 252 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.288 -0.198 17919 103439 1 252 . 1 1 50 50 LEU C C 50 176.660 176.660 175.354 1.306 17919 103440 1 252 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.777 0.463 17919 103441 1 252 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.617 -1.047 17919 103442 1 252 . 1 1 50 50 LEU H H 50 8.530 8.530 8.825 -0.295 17919 103443 1 252 . 1 1 51 51 GLU N N 51 122.940 122.940 122.416 0.524 17919 103444 1 252 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.603 -0.115 17919 103445 1 252 . 1 1 51 51 GLU C C 51 175.870 175.870 176.790 -0.920 17919 103446 1 252 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.143 0.817 17919 103447 1 252 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.464 -0.894 17919 103448 1 252 . 1 1 51 51 GLU H H 51 8.400 8.400 8.461 -0.061 17919 103449 1 252 . 1 1 52 52 ASP N N 52 120.030 120.030 123.728 -3.698 17919 103450 1 252 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.397 -0.038 17919 103451 1 252 . 1 1 52 52 ASP C C 52 177.330 177.330 177.978 -0.648 17919 103452 1 252 . 1 1 52 52 ASP CA C 52 56.960 56.960 58.232 -1.272 17919 103453 1 252 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.764 0.086 17919 103454 1 252 . 1 1 52 52 ASP H H 52 8.160 8.160 8.854 -0.694 17919 103455 1 252 . 1 1 53 53 GLY N N 53 106.660 106.660 105.154 1.506 17919 103456 1 252 . 1 1 53 53 GLY C C 53 174.870 174.870 174.203 0.667 17919 103457 1 252 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.714 0.456 17919 103458 1 252 . 1 1 53 53 GLY H H 53 9.390 9.390 8.381 1.009 17919 103459 1 252 . 1 1 54 54 ARG N N 54 119.050 119.050 121.208 -2.158 17919 103460 1 252 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.700 -0.005 17919 103461 1 252 . 1 1 54 54 ARG C C 54 175.350 175.350 175.364 -0.014 17919 103462 1 252 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.845 -0.455 17919 103463 1 252 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.216 -0.566 17919 103464 1 252 . 1 1 54 54 ARG H H 54 7.460 7.460 7.584 -0.124 17919 103465 1 252 . 1 1 55 55 THR N N 55 108.400 108.400 111.053 -2.653 17919 103466 1 252 . 1 1 55 55 THR HA H 55 5.240 5.240 5.112 0.128 17919 103467 1 252 . 1 1 55 55 THR C C 55 176.560 176.560 176.122 0.438 17919 103468 1 252 . 1 1 55 55 THR CA C 55 59.690 59.690 59.818 -0.128 17919 103469 1 252 . 1 1 55 55 THR CB C 55 72.260 72.260 71.490 0.770 17919 103470 1 252 . 1 1 55 55 THR H H 55 8.730 8.730 8.871 -0.141 17919 103471 1 252 . 1 1 56 56 LEU N N 56 117.920 117.920 121.821 -3.901 17919 103472 1 252 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.989 0.071 17919 103473 1 252 . 1 1 56 56 LEU C C 56 180.810 180.810 179.054 1.756 17919 103474 1 252 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.336 0.374 17919 103475 1 252 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.656 -1.286 17919 103476 1 252 . 1 1 56 56 LEU H H 56 8.140 8.140 8.490 -0.350 17919 103477 1 252 . 1 1 57 57 SER N N 57 113.330 113.330 115.078 -1.748 17919 103478 1 252 . 1 1 57 57 SER HA H 57 4.370 4.370 4.079 0.291 17919 103479 1 252 . 1 1 57 57 SER C C 57 178.310 178.310 176.776 1.534 17919 103480 1 252 . 1 1 57 57 SER CA C 57 61.080 61.080 62.337 -1.257 17919 103481 1 252 . 1 1 57 57 SER CB C 57 62.530 62.530 62.613 -0.083 17919 103482 1 252 . 1 1 57 57 SER H H 57 8.470 8.470 8.493 -0.023 17919 103483 1 252 . 1 1 58 58 ASP N N 58 124.190 124.190 121.205 2.985 17919 103484 1 252 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.315 -0.019 17919 103485 1 252 . 1 1 58 58 ASP C C 58 177.400 177.400 177.100 0.300 17919 103486 1 252 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.700 0.480 17919 103487 1 252 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.420 -0.320 17919 103488 1 252 . 1 1 58 58 ASP H H 58 7.930 7.930 7.765 0.165 17919 103489 1 252 . 1 1 59 59 TYR N N 59 115.510 115.510 115.495 0.015 17919 103490 1 252 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.706 -0.036 17919 103491 1 252 . 1 1 59 59 TYR C C 59 174.700 174.700 174.937 -0.237 17919 103492 1 252 . 1 1 59 59 TYR CA C 59 58.250 58.250 56.934 1.316 17919 103493 1 252 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.284 1.786 17919 103494 1 252 . 1 1 59 59 TYR H H 59 7.250 7.250 7.384 -0.134 17919 103495 1 252 . 1 1 60 60 ASN N N 60 115.900 115.900 117.695 -1.795 17919 103496 1 252 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.364 -0.009 17919 103497 1 252 . 1 1 60 60 ASN C C 60 174.340 174.340 174.567 -0.227 17919 103498 1 252 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.212 -0.092 17919 103499 1 252 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.597 -0.188 17919 103500 1 252 . 1 1 60 60 ASN H H 60 8.150 8.150 7.928 0.222 17919 103501 1 252 . 1 1 61 61 ILE N N 61 118.600 118.600 119.901 -1.301 17919 103502 1 252 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.541 -0.148 17919 103503 1 252 . 1 1 61 61 ILE C C 61 174.610 174.610 174.794 -0.184 17919 103504 1 252 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.256 0.164 17919 103505 1 252 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.634 -0.894 17919 103506 1 252 . 1 1 61 61 ILE H H 61 7.250 7.250 7.954 -0.704 17919 103507 1 252 . 1 1 62 62 GLN N N 62 124.740 124.740 124.877 -0.137 17919 103508 1 252 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.631 -0.125 17919 103509 1 252 . 1 1 62 62 GLN C C 62 175.970 175.970 174.299 1.671 17919 103510 1 252 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.196 0.465 17919 103511 1 252 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.714 -0.064 17919 103512 1 252 . 1 1 62 62 GLN H H 62 7.610 7.610 7.748 -0.138 17919 103513 1 252 . 1 1 63 63 LYS N N 63 120.300 120.300 119.896 0.404 17919 103514 1 252 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.101 -0.100 17919 103515 1 252 . 1 1 63 63 LYS C C 63 175.810 175.810 177.058 -1.248 17919 103516 1 252 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.159 -0.369 17919 103517 1 252 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.950 0.700 17919 103518 1 252 . 1 1 63 63 LYS H H 63 8.490 8.490 8.579 -0.089 17919 103519 1 252 . 1 1 64 64 GLU N N 64 113.950 113.950 118.736 -4.786 17919 103520 1 252 . 1 1 64 64 GLU HA H 64 3.465 3.465 4.071 -0.606 17919 103521 1 252 . 1 1 64 64 GLU C C 64 175.250 175.250 175.774 -0.524 17919 103522 1 252 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.863 0.027 17919 103523 1 252 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.748 -2.848 17919 103524 1 252 . 1 1 64 64 GLU H H 64 9.280 9.280 8.958 0.322 17919 103525 1 252 . 1 1 65 65 SER N N 65 114.730 114.730 116.044 -1.314 17919 103526 1 252 . 1 1 65 65 SER HA H 65 4.640 4.640 4.442 0.198 17919 103527 1 252 . 1 1 65 65 SER C C 65 172.160 172.160 173.968 -1.808 17919 103528 1 252 . 1 1 65 65 SER CA C 65 60.890 60.890 60.476 0.414 17919 103529 1 252 . 1 1 65 65 SER CB C 65 64.910 64.910 63.672 1.238 17919 103530 1 252 . 1 1 65 65 SER H H 65 7.670 7.670 7.743 -0.073 17919 103531 1 252 . 1 1 66 66 THR N N 66 117.110 117.110 121.250 -4.140 17919 103532 1 252 . 1 1 66 66 THR HA H 66 5.270 5.270 4.989 0.281 17919 103533 1 252 . 1 1 66 66 THR C C 66 173.950 173.950 174.052 -0.102 17919 103534 1 252 . 1 1 66 66 THR CA C 66 62.340 62.340 62.392 -0.052 17919 103535 1 252 . 1 1 66 66 THR CB C 66 70.080 70.080 70.184 -0.104 17919 103536 1 252 . 1 1 66 66 THR H H 66 8.730 8.730 8.467 0.263 17919 103537 1 252 . 1 1 67 67 LEU N N 67 127.110 127.110 127.231 -0.121 17919 103538 1 252 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.768 0.292 17919 103539 1 252 . 1 1 67 67 LEU C C 67 175.770 175.770 175.496 0.274 17919 103540 1 252 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.395 0.505 17919 103541 1 252 . 1 1 67 67 LEU CB C 67 44.260 44.260 45.090 -0.830 17919 103542 1 252 . 1 1 67 67 LEU H H 67 9.410 9.410 9.073 0.337 17919 103543 1 252 . 1 1 68 68 HIS N N 68 118.380 118.380 119.198 -0.818 17919 103544 1 252 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.375 -0.135 17919 103545 1 252 . 1 1 68 68 HIS C C 68 173.150 173.150 174.556 -1.406 17919 103546 1 252 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.743 0.257 17919 103547 1 252 . 1 1 68 68 HIS CB C 68 30.530 30.530 31.545 -1.015 17919 103548 1 252 . 1 1 68 68 HIS H H 68 9.230 9.230 9.292 -0.062 17919 103549 1 252 . 1 1 69 69 LEU N N 69 124.460 124.460 125.745 -1.285 17919 103550 1 252 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.001 0.189 17919 103551 1 252 . 1 1 69 69 LEU C C 69 175.270 175.270 174.602 0.668 17919 103552 1 252 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.846 0.044 17919 103553 1 252 . 1 1 69 69 LEU CB C 69 44.380 44.380 43.958 0.422 17919 103554 1 252 . 1 1 69 69 LEU H H 69 8.340 8.340 8.724 -0.384 17919 103555 1 252 . 1 1 70 70 VAL N N 70 126.940 126.940 127.264 -0.324 17919 103556 1 252 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.275 0.075 17919 103557 1 252 . 1 1 70 70 VAL C C 70 174.000 174.000 174.601 -0.601 17919 103558 1 252 . 1 1 70 70 VAL CA C 70 60.800 60.800 62.211 -1.411 17919 103559 1 252 . 1 1 70 70 VAL CB C 70 34.910 34.910 32.763 2.147 17919 103560 1 252 . 1 1 70 70 VAL H H 70 9.200 9.200 8.945 0.255 17919 103561 1 252 . 1 1 71 71 LEU N N 71 123.130 123.130 126.649 -3.519 17919 103562 1 252 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.657 -0.597 17919 103563 1 252 . 1 1 71 71 LEU C C 71 177.830 177.830 176.836 0.994 17919 103564 1 252 . 1 1 71 71 LEU CA C 71 53.940 53.940 52.864 1.077 17919 103565 1 252 . 1 1 71 71 LEU CB C 71 42.850 42.850 45.272 -2.422 17919 103566 1 252 . 1 1 71 71 LEU H H 71 8.120 8.120 8.446 -0.326 17919 103567 1 252 . 1 1 72 72 ARG N N 72 123.490 123.490 122.205 1.285 17919 103568 1 252 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.683 -0.382 17919 103569 1 252 . 1 1 72 72 ARG C C 72 175.350 175.350 175.069 0.281 17919 103570 1 252 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.104 0.506 17919 103571 1 252 . 1 1 72 72 ARG CB C 72 31.350 31.350 32.797 -1.446 17919 103572 1 252 . 1 1 72 72 ARG H H 72 8.580 8.580 8.158 0.422 17919 103573 1 253 . 1 1 2 2 GLN N N 2 123.220 123.220 123.047 0.173 17919 103574 1 253 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.407 -0.158 17919 103575 1 253 . 1 1 2 2 GLN C C 2 175.920 175.920 175.619 0.301 17919 103576 1 253 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.669 0.412 17919 103577 1 253 . 1 1 2 2 GLN CB C 2 30.760 30.760 29.904 0.856 17919 103578 1 253 . 1 1 2 2 GLN H H 2 8.900 8.900 8.408 0.492 17919 103579 1 253 . 1 1 3 3 ILE N N 3 115.340 115.340 116.055 -0.715 17919 103580 1 253 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.458 -0.245 17919 103581 1 253 . 1 1 3 3 ILE C C 3 172.450 172.450 173.758 -1.308 17919 103582 1 253 . 1 1 3 3 ILE CA C 3 59.570 59.570 58.873 0.697 17919 103583 1 253 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.925 0.285 17919 103584 1 253 . 1 1 3 3 ILE H H 3 8.320 8.320 8.404 -0.084 17919 103585 1 253 . 1 1 4 4 PHE N N 4 118.110 118.110 118.973 -0.863 17919 103586 1 253 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.605 0.025 17919 103587 1 253 . 1 1 4 4 PHE C C 4 175.320 175.320 175.366 -0.046 17919 103588 1 253 . 1 1 4 4 PHE CA C 4 55.210 55.210 54.965 0.245 17919 103589 1 253 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.493 -0.013 17919 103590 1 253 . 1 1 4 4 PHE H H 4 8.610 8.610 8.420 0.190 17919 103591 1 253 . 1 1 5 5 VAL N N 5 121.000 121.000 122.315 -1.315 17919 103592 1 253 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.675 0.050 17919 103593 1 253 . 1 1 5 5 VAL C C 5 174.870 174.870 174.542 0.328 17919 103594 1 253 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.408 -0.788 17919 103595 1 253 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.804 0.426 17919 103596 1 253 . 1 1 5 5 VAL H H 5 9.300 9.300 9.264 0.036 17919 103597 1 253 . 1 1 6 6 LYS N N 6 127.520 127.520 126.851 0.669 17919 103598 1 253 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.556 -0.189 17919 103599 1 253 . 1 1 6 6 LYS C C 6 177.140 177.140 176.323 0.817 17919 103600 1 253 . 1 1 6 6 LYS CA C 6 54.520 54.520 53.945 0.575 17919 103601 1 253 . 1 1 6 6 LYS CB C 6 35.050 35.050 36.271 -1.221 17919 103602 1 253 . 1 1 6 6 LYS H H 6 8.820 8.820 9.330 -0.510 17919 103603 1 253 . 1 1 7 7 THR N N 7 115.400 115.400 114.225 1.175 17919 103604 1 253 . 1 1 7 7 THR HA H 7 4.970 4.970 4.878 0.092 17919 103605 1 253 . 1 1 7 7 THR C C 7 176.910 176.910 176.346 0.564 17919 103606 1 253 . 1 1 7 7 THR CA C 7 60.470 60.470 60.711 -0.241 17919 103607 1 253 . 1 1 7 7 THR CB C 7 70.630 70.630 71.141 -0.511 17919 103608 1 253 . 1 1 7 7 THR H H 7 8.730 8.730 8.943 -0.213 17919 103609 1 253 . 1 1 8 8 LEU N N 8 121.330 121.330 122.363 -1.033 17919 103610 1 253 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.388 -0.078 17919 103611 1 253 . 1 1 8 8 LEU C C 8 178.800 178.800 177.285 1.515 17919 103612 1 253 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.351 0.229 17919 103613 1 253 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.862 0.108 17919 103614 1 253 . 1 1 8 8 LEU H H 8 9.100 9.100 8.742 0.358 17919 103615 1 253 . 1 1 9 9 THR N N 9 105.590 105.590 108.254 -2.664 17919 103616 1 253 . 1 1 9 9 THR HA H 9 4.428 4.428 4.383 0.045 17919 103617 1 253 . 1 1 9 9 THR C C 9 175.520 175.520 175.644 -0.124 17919 103618 1 253 . 1 1 9 9 THR CA C 9 61.400 61.400 61.096 0.304 17919 103619 1 253 . 1 1 9 9 THR CB C 9 69.140 69.140 68.607 0.533 17919 103620 1 253 . 1 1 9 9 THR H H 9 7.630 7.630 7.429 0.201 17919 103621 1 253 . 1 1 10 10 GLY N N 10 108.890 108.890 109.338 -0.448 17919 103622 1 253 . 1 1 10 10 GLY C C 10 174.070 174.070 174.757 -0.687 17919 103623 1 253 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.617 -0.157 17919 103624 1 253 . 1 1 10 10 GLY H H 10 7.810 7.810 7.757 0.053 17919 103625 1 253 . 1 1 11 11 LYS N N 11 121.600 121.600 121.544 0.056 17919 103626 1 253 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.611 -0.250 17919 103627 1 253 . 1 1 11 11 LYS C C 11 175.940 175.940 175.526 0.414 17919 103628 1 253 . 1 1 11 11 LYS CA C 11 56.280 56.280 55.505 0.775 17919 103629 1 253 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.643 -0.443 17919 103630 1 253 . 1 1 11 11 LYS H H 11 7.280 7.280 7.909 -0.629 17919 103631 1 253 . 1 1 12 12 THR N N 12 120.440 120.440 117.380 3.060 17919 103632 1 253 . 1 1 12 12 THR HA H 12 5.046 5.046 5.369 -0.323 17919 103633 1 253 . 1 1 12 12 THR C C 12 174.320 174.320 174.293 0.027 17919 103634 1 253 . 1 1 12 12 THR CA C 12 62.390 62.390 61.062 1.328 17919 103635 1 253 . 1 1 12 12 THR CB C 12 69.910 69.910 70.190 -0.280 17919 103636 1 253 . 1 1 12 12 THR H H 12 8.650 8.650 8.217 0.433 17919 103637 1 253 . 1 1 13 13 ILE N N 13 127.110 127.110 122.534 4.576 17919 103638 1 253 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.770 -0.226 17919 103639 1 253 . 1 1 13 13 ILE C C 13 175.220 175.220 174.445 0.775 17919 103640 1 253 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.235 0.745 17919 103641 1 253 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.636 -0.686 17919 103642 1 253 . 1 1 13 13 ILE H H 13 9.450 9.450 9.163 0.287 17919 103643 1 253 . 1 1 14 14 THR N N 14 121.520 121.520 121.906 -0.386 17919 103644 1 253 . 1 1 14 14 THR HA H 14 4.964 4.964 5.130 -0.166 17919 103645 1 253 . 1 1 14 14 THR C C 14 173.790 173.790 173.639 0.151 17919 103646 1 253 . 1 1 14 14 THR CA C 14 61.940 61.940 61.982 -0.042 17919 103647 1 253 . 1 1 14 14 THR CB C 14 69.650 69.650 70.140 -0.490 17919 103648 1 253 . 1 1 14 14 THR H H 14 8.710 8.710 8.576 0.134 17919 103649 1 253 . 1 1 15 15 LEU N N 15 124.800 124.800 126.782 -1.982 17919 103650 1 253 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.757 0.023 17919 103651 1 253 . 1 1 15 15 LEU C C 15 174.670 174.670 175.432 -0.762 17919 103652 1 253 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.860 -1.030 17919 103653 1 253 . 1 1 15 15 LEU CB C 15 47.070 47.070 43.867 3.203 17919 103654 1 253 . 1 1 15 15 LEU H H 15 8.710 8.710 8.840 -0.130 17919 103655 1 253 . 1 1 16 16 GLU N N 16 122.160 122.160 124.295 -2.135 17919 103656 1 253 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.418 -0.500 17919 103657 1 253 . 1 1 16 16 GLU C C 16 175.860 175.860 175.924 -0.064 17919 103658 1 253 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.679 -0.859 17919 103659 1 253 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.893 -1.443 17919 103660 1 253 . 1 1 16 16 GLU H H 16 8.140 8.140 8.794 -0.654 17919 103661 1 253 . 1 1 17 17 VAL N N 17 117.210 117.210 119.956 -2.746 17919 103662 1 253 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.465 0.249 17919 103663 1 253 . 1 1 17 17 VAL C C 17 174.160 174.160 174.396 -0.236 17919 103664 1 253 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.345 -0.915 17919 103665 1 253 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.495 0.905 17919 103666 1 253 . 1 1 17 17 VAL H H 17 8.900 8.900 8.576 0.324 17919 103667 1 253 . 1 1 18 18 GLU N N 18 118.990 118.990 120.752 -1.762 17919 103668 1 253 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.826 0.253 17919 103669 1 253 . 1 1 18 18 GLU C C 18 176.160 176.160 175.147 1.013 17919 103670 1 253 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.916 -0.196 17919 103671 1 253 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.410 -0.100 17919 103672 1 253 . 1 1 18 18 GLU H H 18 8.640 8.640 8.246 0.394 17919 103673 1 253 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.230 -0.089 17919 103674 1 253 . 1 1 19 19 PRO C C 19 175.310 175.310 178.032 -2.722 17919 103675 1 253 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.761 -0.291 17919 103676 1 253 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.756 0.194 17919 103677 1 253 . 1 1 20 20 SER N N 20 103.400 103.400 111.441 -8.041 17919 103678 1 253 . 1 1 20 20 SER HA H 20 4.370 4.370 4.395 -0.025 17919 103679 1 253 . 1 1 20 20 SER C C 20 174.660 174.660 173.985 0.675 17919 103680 1 253 . 1 1 20 20 SER CA C 20 57.400 57.400 58.922 -1.522 17919 103681 1 253 . 1 1 20 20 SER CB C 20 63.370 63.370 63.093 0.277 17919 103682 1 253 . 1 1 20 20 SER H H 20 7.040 7.040 8.288 -1.248 17919 103683 1 253 . 1 1 21 21 ASP N N 21 123.480 123.480 122.836 0.644 17919 103684 1 253 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.812 -0.117 17919 103685 1 253 . 1 1 21 21 ASP C C 21 176.360 176.360 175.055 1.305 17919 103686 1 253 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.183 1.517 17919 103687 1 253 . 1 1 21 21 ASP CB C 21 40.800 40.800 42.353 -1.553 17919 103688 1 253 . 1 1 21 21 ASP H H 21 8.030 8.030 7.692 0.338 17919 103689 1 253 . 1 1 22 22 THR N N 22 108.800 108.800 112.524 -3.724 17919 103690 1 253 . 1 1 22 22 THR HA H 22 4.920 4.920 4.700 0.220 17919 103691 1 253 . 1 1 22 22 THR C C 22 176.750 176.750 175.857 0.893 17919 103692 1 253 . 1 1 22 22 THR CA C 22 59.690 59.690 60.855 -1.165 17919 103693 1 253 . 1 1 22 22 THR CB C 22 71.200 71.200 71.009 0.191 17919 103694 1 253 . 1 1 22 22 THR H H 22 7.900 7.900 8.204 -0.304 17919 103695 1 253 . 1 1 23 23 ILE N N 23 121.190 121.190 121.156 0.034 17919 103696 1 253 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.855 -0.198 17919 103697 1 253 . 1 1 23 23 ILE C C 23 179.040 179.040 177.533 1.507 17919 103698 1 253 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.224 0.036 17919 103699 1 253 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.725 -2.375 17919 103700 1 253 . 1 1 23 23 ILE H H 23 8.560 8.560 8.304 0.256 17919 103701 1 253 . 1 1 24 24 GLU N N 24 120.830 120.830 121.457 -0.627 17919 103702 1 253 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.841 0.076 17919 103703 1 253 . 1 1 24 24 GLU C C 24 178.640 178.640 178.538 0.102 17919 103704 1 253 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.246 -0.026 17919 103705 1 253 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.503 -1.223 17919 103706 1 253 . 1 1 24 24 GLU H H 24 9.760 9.760 7.937 1.823 17919 103707 1 253 . 1 1 25 25 ASN N N 25 120.570 120.570 117.473 3.097 17919 103708 1 253 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.503 0.022 17919 103709 1 253 . 1 1 25 25 ASN C C 25 178.380 178.380 178.247 0.133 17919 103710 1 253 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.758 0.302 17919 103711 1 253 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.249 0.201 17919 103712 1 253 . 1 1 25 25 ASN H H 25 7.920 7.920 7.651 0.269 17919 103713 1 253 . 1 1 26 26 VAL N N 26 121.710 121.710 119.583 2.127 17919 103714 1 253 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.613 -0.216 17919 103715 1 253 . 1 1 26 26 VAL C C 26 177.950 177.950 177.511 0.439 17919 103716 1 253 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.554 1.106 17919 103717 1 253 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.440 -0.600 17919 103718 1 253 . 1 1 26 26 VAL H H 26 8.070 8.070 7.583 0.487 17919 103719 1 253 . 1 1 27 27 LYS N N 27 118.860 118.860 120.144 -1.284 17919 103720 1 253 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.323 0.257 17919 103721 1 253 . 1 1 27 27 LYS C C 27 180.550 180.550 178.997 1.553 17919 103722 1 253 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.304 -0.054 17919 103723 1 253 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.350 1.380 17919 103724 1 253 . 1 1 27 27 LYS H H 27 8.560 8.560 7.932 0.628 17919 103725 1 253 . 1 1 28 28 ALA N N 28 123.440 123.440 121.747 1.693 17919 103726 1 253 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.072 0.088 17919 103727 1 253 . 1 1 28 28 ALA C C 28 180.300 180.300 179.167 1.133 17919 103728 1 253 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.347 0.023 17919 103729 1 253 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.430 -0.721 17919 103730 1 253 . 1 1 28 28 ALA H H 28 8.060 8.060 8.258 -0.198 17919 103731 1 253 . 1 1 29 29 LYS N N 29 119.940 119.940 118.779 1.161 17919 103732 1 253 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.065 0.142 17919 103733 1 253 . 1 1 29 29 LYS C C 29 180.320 180.320 179.018 1.302 17919 103734 1 253 . 1 1 29 29 LYS CA C 29 59.650 59.650 58.917 0.733 17919 103735 1 253 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.318 0.972 17919 103736 1 253 . 1 1 29 29 LYS H H 29 7.850 7.850 7.362 0.488 17919 103737 1 253 . 1 1 30 30 ILE N N 30 121.080 121.080 120.886 0.194 17919 103738 1 253 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.596 -0.089 17919 103739 1 253 . 1 1 30 30 ILE C C 30 178.310 178.310 177.187 1.123 17919 103740 1 253 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.681 0.469 17919 103741 1 253 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.833 -1.033 17919 103742 1 253 . 1 1 30 30 ILE H H 30 8.280 8.280 7.985 0.295 17919 103743 1 253 . 1 1 31 31 GLN N N 31 123.490 123.490 120.777 2.713 17919 103744 1 253 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.011 -0.182 17919 103745 1 253 . 1 1 31 31 GLN C C 31 178.890 178.890 177.919 0.971 17919 103746 1 253 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.135 0.865 17919 103747 1 253 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.703 -0.983 17919 103748 1 253 . 1 1 31 31 GLN H H 31 8.580 8.580 8.129 0.451 17919 103749 1 253 . 1 1 32 32 ASP N N 32 119.360 119.360 117.323 2.037 17919 103750 1 253 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.482 -0.128 17919 103751 1 253 . 1 1 32 32 ASP C C 32 177.250 177.250 177.724 -0.474 17919 103752 1 253 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.166 1.024 17919 103753 1 253 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.862 -0.282 17919 103754 1 253 . 1 1 32 32 ASP H H 32 8.010 8.010 7.830 0.179 17919 103755 1 253 . 1 1 33 33 LYS N N 33 115.130 115.130 118.510 -3.380 17919 103756 1 253 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.256 0.081 17919 103757 1 253 . 1 1 33 33 LYS C C 33 177.870 177.870 177.714 0.156 17919 103758 1 253 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.108 -0.058 17919 103759 1 253 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.562 0.608 17919 103760 1 253 . 1 1 33 33 LYS H H 33 7.430 7.430 7.291 0.139 17919 103761 1 253 . 1 1 34 34 GLU N N 34 113.870 113.870 116.142 -2.272 17919 103762 1 253 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.464 0.161 17919 103763 1 253 . 1 1 34 34 GLU C C 34 177.840 177.840 176.843 0.997 17919 103764 1 253 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.653 -0.483 17919 103765 1 253 . 1 1 34 34 GLU CB C 34 32.660 32.660 30.955 1.705 17919 103766 1 253 . 1 1 34 34 GLU H H 34 8.740 8.740 8.325 0.415 17919 103767 1 253 . 1 1 35 35 GLY N N 35 108.650 108.650 106.626 2.024 17919 103768 1 253 . 1 1 35 35 GLY C C 35 173.960 173.960 174.504 -0.544 17919 103769 1 253 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.254 0.826 17919 103770 1 253 . 1 1 35 35 GLY H H 35 8.530 8.530 7.798 0.732 17919 103771 1 253 . 1 1 36 36 ILE N N 36 119.880 119.880 123.566 -3.686 17919 103772 1 253 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.359 0.086 17919 103773 1 253 . 1 1 36 36 ILE C C 36 173.590 173.590 174.173 -0.583 17919 103774 1 253 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.386 -0.636 17919 103775 1 253 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.341 2.239 17919 103776 1 253 . 1 1 36 36 ILE H H 36 6.150 6.150 7.664 -1.514 17919 103777 1 253 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.808 -0.174 17919 103778 1 253 . 1 1 37 37 PRO C C 37 176.940 176.940 176.053 0.887 17919 103779 1 253 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.253 0.407 17919 103780 1 253 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.469 0.381 17919 103781 1 253 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.146 -0.029 17919 103782 1 253 . 1 1 38 38 PRO C C 38 178.320 178.320 178.715 -0.395 17919 103783 1 253 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.796 0.464 17919 103784 1 253 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.838 1.052 17919 103785 1 253 . 1 1 39 39 ASP N N 39 113.380 113.380 115.987 -2.607 17919 103786 1 253 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.404 0.026 17919 103787 1 253 . 1 1 39 39 ASP C C 39 177.090 177.090 177.464 -0.374 17919 103788 1 253 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.555 -0.915 17919 103789 1 253 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.553 -1.012 17919 103790 1 253 . 1 1 39 39 ASP H H 39 8.550 8.550 8.646 -0.096 17919 103791 1 253 . 1 1 40 40 GLN N N 40 116.780 116.780 116.812 -0.032 17919 103792 1 253 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.323 0.141 17919 103793 1 253 . 1 1 40 40 GLN C C 40 175.380 175.380 175.862 -0.482 17919 103794 1 253 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.195 -0.555 17919 103795 1 253 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.906 0.234 17919 103796 1 253 . 1 1 40 40 GLN H H 40 7.820 7.820 7.674 0.146 17919 103797 1 253 . 1 1 41 41 GLN N N 41 117.720 117.720 119.880 -2.160 17919 103798 1 253 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.421 -0.177 17919 103799 1 253 . 1 1 41 41 GLN C C 41 176.300 176.300 175.224 1.076 17919 103800 1 253 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.146 0.324 17919 103801 1 253 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.732 1.918 17919 103802 1 253 . 1 1 41 41 GLN H H 41 7.480 7.480 7.373 0.107 17919 103803 1 253 . 1 1 42 42 ARG N N 42 122.680 122.680 123.659 -0.979 17919 103804 1 253 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.681 -0.181 17919 103805 1 253 . 1 1 42 42 ARG C C 42 174.050 174.050 174.614 -0.564 17919 103806 1 253 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.658 0.392 17919 103807 1 253 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.233 -1.483 17919 103808 1 253 . 1 1 42 42 ARG H H 42 8.530 8.530 8.332 0.198 17919 103809 1 253 . 1 1 43 43 LEU N N 43 124.040 124.040 124.883 -0.843 17919 103810 1 253 . 1 1 43 43 LEU C C 43 175.290 175.290 175.795 -0.505 17919 103811 1 253 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.988 -1.008 17919 103812 1 253 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.802 1.988 17919 103813 1 253 . 1 1 43 43 LEU H H 43 8.820 8.820 8.709 0.111 17919 103814 1 253 . 1 1 44 44 ILE N N 44 121.920 121.920 120.221 1.699 17919 103815 1 253 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.858 0.134 17919 103816 1 253 . 1 1 44 44 ILE C C 44 176.060 176.060 174.379 1.681 17919 103817 1 253 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.320 -1.340 17919 103818 1 253 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.894 -0.474 17919 103819 1 253 . 1 1 44 44 ILE H H 44 9.030 9.030 7.998 1.032 17919 103820 1 253 . 1 1 45 45 PHE N N 45 125.390 125.390 127.161 -1.771 17919 103821 1 253 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.003 0.042 17919 103822 1 253 . 1 1 45 45 PHE C C 45 174.470 174.470 174.505 -0.035 17919 103823 1 253 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.376 0.644 17919 103824 1 253 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.819 0.941 17919 103825 1 253 . 1 1 45 45 PHE H H 45 8.830 8.830 8.035 0.795 17919 103826 1 253 . 1 1 46 46 ALA N N 46 132.200 132.200 128.863 3.337 17919 103827 1 253 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.630 0.060 17919 103828 1 253 . 1 1 46 46 ALA C C 46 177.290 177.290 177.660 -0.370 17919 103829 1 253 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.363 0.177 17919 103830 1 253 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.562 0.008 17919 103831 1 253 . 1 1 46 46 ALA H H 46 8.810 8.810 8.733 0.077 17919 103832 1 253 . 1 1 47 47 GLY N N 47 102.340 102.340 104.793 -2.453 17919 103833 1 253 . 1 1 47 47 GLY C C 47 173.810 173.810 174.526 -0.716 17919 103834 1 253 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.883 0.467 17919 103835 1 253 . 1 1 47 47 GLY H H 47 8.130 8.130 8.389 -0.259 17919 103836 1 253 . 1 1 48 48 LYS N N 48 121.570 121.570 122.294 -0.724 17919 103837 1 253 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.654 -0.032 17919 103838 1 253 . 1 1 48 48 LYS C C 48 174.700 174.700 175.931 -1.231 17919 103839 1 253 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.355 0.195 17919 103840 1 253 . 1 1 48 48 LYS CB C 48 34.530 34.530 33.611 0.919 17919 103841 1 253 . 1 1 48 48 LYS H H 48 7.980 7.980 7.596 0.384 17919 103842 1 253 . 1 1 49 49 GLN N N 49 122.410 122.410 120.423 1.987 17919 103843 1 253 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.499 0.061 17919 103844 1 253 . 1 1 49 49 GLN C C 49 175.670 175.670 176.353 -0.683 17919 103845 1 253 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.035 -0.295 17919 103846 1 253 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.241 -0.241 17919 103847 1 253 . 1 1 49 49 GLN H H 49 8.600 8.600 8.430 0.170 17919 103848 1 253 . 1 1 50 50 LEU N N 50 125.520 125.520 125.215 0.305 17919 103849 1 253 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.017 0.073 17919 103850 1 253 . 1 1 50 50 LEU C C 50 176.660 176.660 176.648 0.012 17919 103851 1 253 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.611 -0.371 17919 103852 1 253 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.737 -0.167 17919 103853 1 253 . 1 1 50 50 LEU H H 50 8.530 8.530 8.082 0.448 17919 103854 1 253 . 1 1 51 51 GLU N N 51 122.940 122.940 124.696 -1.756 17919 103855 1 253 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.357 0.131 17919 103856 1 253 . 1 1 51 51 GLU C C 51 175.870 175.870 177.193 -1.323 17919 103857 1 253 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.800 0.160 17919 103858 1 253 . 1 1 51 51 GLU CB C 51 31.570 31.570 30.610 0.960 17919 103859 1 253 . 1 1 51 51 GLU H H 51 8.400 8.400 8.719 -0.319 17919 103860 1 253 . 1 1 52 52 ASP N N 52 120.030 120.030 127.872 -7.842 17919 103861 1 253 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.397 -0.038 17919 103862 1 253 . 1 1 52 52 ASP C C 52 177.330 177.330 177.074 0.256 17919 103863 1 253 . 1 1 52 52 ASP CA C 52 56.960 56.960 56.892 0.067 17919 103864 1 253 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.900 -0.050 17919 103865 1 253 . 1 1 52 52 ASP H H 52 8.160 8.160 8.829 -0.669 17919 103866 1 253 . 1 1 53 53 GLY N N 53 106.660 106.660 104.697 1.963 17919 103867 1 253 . 1 1 53 53 GLY C C 53 174.870 174.870 173.888 0.982 17919 103868 1 253 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.765 0.405 17919 103869 1 253 . 1 1 53 53 GLY H H 53 9.390 9.390 8.460 0.930 17919 103870 1 253 . 1 1 54 54 ARG N N 54 119.050 119.050 121.002 -1.952 17919 103871 1 253 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.769 -0.074 17919 103872 1 253 . 1 1 54 54 ARG C C 54 175.350 175.350 175.428 -0.078 17919 103873 1 253 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.079 0.311 17919 103874 1 253 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.555 -0.905 17919 103875 1 253 . 1 1 54 54 ARG H H 54 7.460 7.460 7.622 -0.162 17919 103876 1 253 . 1 1 55 55 THR N N 55 108.400 108.400 113.283 -4.883 17919 103877 1 253 . 1 1 55 55 THR HA H 55 5.240 5.240 4.941 0.299 17919 103878 1 253 . 1 1 55 55 THR C C 55 176.560 176.560 175.915 0.645 17919 103879 1 253 . 1 1 55 55 THR CA C 55 59.690 59.690 60.804 -1.114 17919 103880 1 253 . 1 1 55 55 THR CB C 55 72.260 72.260 70.827 1.433 17919 103881 1 253 . 1 1 55 55 THR H H 55 8.730 8.730 8.843 -0.113 17919 103882 1 253 . 1 1 56 56 LEU N N 56 117.920 117.920 123.565 -5.645 17919 103883 1 253 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.925 0.135 17919 103884 1 253 . 1 1 56 56 LEU C C 56 180.810 180.810 179.072 1.738 17919 103885 1 253 . 1 1 56 56 LEU CA C 56 58.710 58.710 59.285 -0.575 17919 103886 1 253 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.332 -0.962 17919 103887 1 253 . 1 1 56 56 LEU H H 56 8.140 8.140 8.255 -0.115 17919 103888 1 253 . 1 1 57 57 SER N N 57 113.330 113.330 115.125 -1.795 17919 103889 1 253 . 1 1 57 57 SER HA H 57 4.370 4.370 4.012 0.358 17919 103890 1 253 . 1 1 57 57 SER C C 57 178.310 178.310 176.732 1.578 17919 103891 1 253 . 1 1 57 57 SER CA C 57 61.080 61.080 62.435 -1.355 17919 103892 1 253 . 1 1 57 57 SER CB C 57 62.530 62.530 62.633 -0.103 17919 103893 1 253 . 1 1 57 57 SER H H 57 8.470 8.470 8.114 0.356 17919 103894 1 253 . 1 1 58 58 ASP N N 58 124.190 124.190 122.081 2.109 17919 103895 1 253 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.225 0.071 17919 103896 1 253 . 1 1 58 58 ASP C C 58 177.400 177.400 178.317 -0.917 17919 103897 1 253 . 1 1 58 58 ASP CA C 58 57.180 57.180 57.067 0.113 17919 103898 1 253 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.517 -0.417 17919 103899 1 253 . 1 1 58 58 ASP H H 58 7.930 7.930 7.729 0.201 17919 103900 1 253 . 1 1 59 59 TYR N N 59 115.510 115.510 115.952 -0.442 17919 103901 1 253 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.565 0.105 17919 103902 1 253 . 1 1 59 59 TYR C C 59 174.700 174.700 175.137 -0.437 17919 103903 1 253 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.776 0.474 17919 103904 1 253 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.160 1.910 17919 103905 1 253 . 1 1 59 59 TYR H H 59 7.250 7.250 7.396 -0.146 17919 103906 1 253 . 1 1 60 60 ASN N N 60 115.900 115.900 115.044 0.856 17919 103907 1 253 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.378 -0.022 17919 103908 1 253 . 1 1 60 60 ASN C C 60 174.340 174.340 174.624 -0.284 17919 103909 1 253 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.795 -0.676 17919 103910 1 253 . 1 1 60 60 ASN CB C 60 37.410 37.410 36.658 0.752 17919 103911 1 253 . 1 1 60 60 ASN H H 60 8.150 8.150 8.160 -0.010 17919 103912 1 253 . 1 1 61 61 ILE N N 61 118.600 118.600 119.659 -1.059 17919 103913 1 253 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.381 0.012 17919 103914 1 253 . 1 1 61 61 ILE C C 61 174.610 174.610 175.378 -0.768 17919 103915 1 253 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.426 -0.006 17919 103916 1 253 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.852 -1.112 17919 103917 1 253 . 1 1 61 61 ILE H H 61 7.250 7.250 7.968 -0.718 17919 103918 1 253 . 1 1 62 62 GLN N N 62 124.740 124.740 126.470 -1.730 17919 103919 1 253 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.713 -0.207 17919 103920 1 253 . 1 1 62 62 GLN C C 62 175.970 175.970 175.433 0.537 17919 103921 1 253 . 1 1 62 62 GLN CA C 62 53.660 53.660 52.871 0.789 17919 103922 1 253 . 1 1 62 62 GLN CB C 62 31.650 31.650 32.460 -0.810 17919 103923 1 253 . 1 1 62 62 GLN H H 62 7.610 7.610 7.817 -0.207 17919 103924 1 253 . 1 1 63 63 LYS N N 63 120.300 120.300 120.789 -0.489 17919 103925 1 253 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.099 -0.098 17919 103926 1 253 . 1 1 63 63 LYS C C 63 175.810 175.810 177.596 -1.786 17919 103927 1 253 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.677 0.113 17919 103928 1 253 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.173 0.477 17919 103929 1 253 . 1 1 63 63 LYS H H 63 8.490 8.490 8.613 -0.123 17919 103930 1 253 . 1 1 64 64 GLU N N 64 113.950 113.950 118.009 -4.059 17919 103931 1 253 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.329 0.136 17919 103932 1 253 . 1 1 64 64 GLU C C 64 175.250 175.250 175.980 -0.730 17919 103933 1 253 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.856 0.034 17919 103934 1 253 . 1 1 64 64 GLU CB C 64 25.900 25.900 27.787 -1.887 17919 103935 1 253 . 1 1 64 64 GLU H H 64 9.280 9.280 8.712 0.568 17919 103936 1 253 . 1 1 65 65 SER N N 65 114.730 114.730 117.867 -3.137 17919 103937 1 253 . 1 1 65 65 SER HA H 65 4.640 4.640 4.276 0.364 17919 103938 1 253 . 1 1 65 65 SER C C 65 172.160 172.160 173.749 -1.589 17919 103939 1 253 . 1 1 65 65 SER CA C 65 60.890 60.890 60.691 0.199 17919 103940 1 253 . 1 1 65 65 SER CB C 65 64.910 64.910 63.696 1.214 17919 103941 1 253 . 1 1 65 65 SER H H 65 7.670 7.670 7.409 0.261 17919 103942 1 253 . 1 1 66 66 THR N N 66 117.110 117.110 119.933 -2.823 17919 103943 1 253 . 1 1 66 66 THR HA H 66 5.270 5.270 5.054 0.216 17919 103944 1 253 . 1 1 66 66 THR C C 66 173.950 173.950 174.444 -0.494 17919 103945 1 253 . 1 1 66 66 THR CA C 66 62.340 62.340 61.822 0.519 17919 103946 1 253 . 1 1 66 66 THR CB C 66 70.080 70.080 70.473 -0.393 17919 103947 1 253 . 1 1 66 66 THR H H 66 8.730 8.730 8.396 0.334 17919 103948 1 253 . 1 1 67 67 LEU N N 67 127.110 127.110 127.997 -0.887 17919 103949 1 253 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.822 0.238 17919 103950 1 253 . 1 1 67 67 LEU C C 67 175.770 175.770 175.734 0.036 17919 103951 1 253 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.856 0.044 17919 103952 1 253 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.099 0.161 17919 103953 1 253 . 1 1 67 67 LEU H H 67 9.410 9.410 9.185 0.225 17919 103954 1 253 . 1 1 68 68 HIS N N 68 118.380 118.380 121.249 -2.869 17919 103955 1 253 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.193 0.047 17919 103956 1 253 . 1 1 68 68 HIS C C 68 173.150 173.150 174.039 -0.889 17919 103957 1 253 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.307 0.693 17919 103958 1 253 . 1 1 68 68 HIS CB C 68 30.530 30.530 31.197 -0.667 17919 103959 1 253 . 1 1 68 68 HIS H H 68 9.230 9.230 8.435 0.795 17919 103960 1 253 . 1 1 69 69 LEU N N 69 124.460 124.460 130.826 -6.366 17919 103961 1 253 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.026 0.164 17919 103962 1 253 . 1 1 69 69 LEU C C 69 175.270 175.270 174.387 0.883 17919 103963 1 253 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.456 0.434 17919 103964 1 253 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.214 0.167 17919 103965 1 253 . 1 1 69 69 LEU H H 69 8.340 8.340 8.738 -0.398 17919 103966 1 253 . 1 1 70 70 VAL N N 70 126.940 126.940 122.499 4.441 17919 103967 1 253 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.452 -0.102 17919 103968 1 253 . 1 1 70 70 VAL C C 70 174.000 174.000 173.920 0.080 17919 103969 1 253 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.838 0.962 17919 103970 1 253 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.508 -0.598 17919 103971 1 253 . 1 1 70 70 VAL H H 70 9.200 9.200 8.810 0.390 17919 103972 1 253 . 1 1 71 71 LEU N N 71 123.130 123.130 125.059 -1.929 17919 103973 1 253 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.927 0.133 17919 103974 1 253 . 1 1 71 71 LEU C C 71 177.830 177.830 176.965 0.865 17919 103975 1 253 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.682 0.258 17919 103976 1 253 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.625 0.225 17919 103977 1 253 . 1 1 71 71 LEU H H 71 8.120 8.120 8.453 -0.333 17919 103978 1 253 . 1 1 72 72 ARG N N 72 123.490 123.490 125.657 -2.167 17919 103979 1 253 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.409 -0.108 17919 103980 1 253 . 1 1 72 72 ARG C C 72 175.350 175.350 176.700 -1.350 17919 103981 1 253 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.882 -0.272 17919 103982 1 253 . 1 1 72 72 ARG CB C 72 31.350 31.350 29.712 1.638 17919 103983 1 253 . 1 1 72 72 ARG H H 72 8.580 8.580 8.798 -0.218 17919 103984 1 254 . 1 1 2 2 GLN N N 2 123.220 123.220 125.193 -1.973 17919 103985 1 254 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.411 -0.162 17919 103986 1 254 . 1 1 2 2 GLN C C 2 175.920 175.920 174.880 1.040 17919 103987 1 254 . 1 1 2 2 GLN CA C 2 55.080 55.080 55.223 -0.143 17919 103988 1 254 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.610 0.150 17919 103989 1 254 . 1 1 2 2 GLN H H 2 8.900 8.900 8.478 0.422 17919 103990 1 254 . 1 1 3 3 ILE N N 3 115.340 115.340 118.282 -2.942 17919 103991 1 254 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.906 -0.693 17919 103992 1 254 . 1 1 3 3 ILE C C 3 172.450 172.450 173.888 -1.438 17919 103993 1 254 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.065 0.505 17919 103994 1 254 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.939 0.271 17919 103995 1 254 . 1 1 3 3 ILE H H 3 8.320 8.320 8.733 -0.413 17919 103996 1 254 . 1 1 4 4 PHE N N 4 118.110 118.110 120.462 -2.352 17919 103997 1 254 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.412 0.218 17919 103998 1 254 . 1 1 4 4 PHE C C 4 175.320 175.320 175.715 -0.395 17919 103999 1 254 . 1 1 4 4 PHE CA C 4 55.210 55.210 56.282 -1.073 17919 104000 1 254 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.453 0.027 17919 104001 1 254 . 1 1 4 4 PHE H H 4 8.610 8.610 8.944 -0.334 17919 104002 1 254 . 1 1 5 5 VAL N N 5 121.000 121.000 122.391 -1.391 17919 104003 1 254 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.737 -0.012 17919 104004 1 254 . 1 1 5 5 VAL C C 5 174.870 174.870 174.394 0.476 17919 104005 1 254 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.416 -0.796 17919 104006 1 254 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.778 0.452 17919 104007 1 254 . 1 1 5 5 VAL H H 5 9.300 9.300 9.343 -0.043 17919 104008 1 254 . 1 1 6 6 LYS N N 6 127.520 127.520 129.248 -1.728 17919 104009 1 254 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.402 -0.035 17919 104010 1 254 . 1 1 6 6 LYS C C 6 177.140 177.140 176.724 0.416 17919 104011 1 254 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.127 0.393 17919 104012 1 254 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.769 -0.719 17919 104013 1 254 . 1 1 6 6 LYS H H 6 8.820 8.820 9.246 -0.426 17919 104014 1 254 . 1 1 7 7 THR N N 7 115.400 115.400 118.711 -3.311 17919 104015 1 254 . 1 1 7 7 THR HA H 7 4.970 4.970 4.600 0.370 17919 104016 1 254 . 1 1 7 7 THR C C 7 176.910 176.910 176.260 0.650 17919 104017 1 254 . 1 1 7 7 THR CA C 7 60.470 60.470 61.249 -0.779 17919 104018 1 254 . 1 1 7 7 THR CB C 7 70.630 70.630 70.175 0.455 17919 104019 1 254 . 1 1 7 7 THR H H 7 8.730 8.730 8.769 -0.039 17919 104020 1 254 . 1 1 8 8 LEU N N 8 121.330 121.330 122.330 -1.000 17919 104021 1 254 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.413 -0.103 17919 104022 1 254 . 1 1 8 8 LEU C C 8 178.800 178.800 177.014 1.786 17919 104023 1 254 . 1 1 8 8 LEU CA C 8 57.580 57.580 56.842 0.738 17919 104024 1 254 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.156 -0.186 17919 104025 1 254 . 1 1 8 8 LEU H H 8 9.100 9.100 8.195 0.904 17919 104026 1 254 . 1 1 9 9 THR N N 9 105.590 105.590 108.701 -3.111 17919 104027 1 254 . 1 1 9 9 THR HA H 9 4.428 4.428 4.365 0.063 17919 104028 1 254 . 1 1 9 9 THR C C 9 175.520 175.520 175.537 -0.017 17919 104029 1 254 . 1 1 9 9 THR CA C 9 61.400 61.400 61.933 -0.533 17919 104030 1 254 . 1 1 9 9 THR CB C 9 69.140 69.140 69.437 -0.297 17919 104031 1 254 . 1 1 9 9 THR H H 9 7.630 7.630 7.581 0.049 17919 104032 1 254 . 1 1 10 10 GLY N N 10 108.890 108.890 110.605 -1.715 17919 104033 1 254 . 1 1 10 10 GLY C C 10 174.070 174.070 174.143 -0.073 17919 104034 1 254 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.072 0.388 17919 104035 1 254 . 1 1 10 10 GLY H H 10 7.810 7.810 7.570 0.240 17919 104036 1 254 . 1 1 11 11 LYS N N 11 121.600 121.600 122.053 -0.453 17919 104037 1 254 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.272 0.089 17919 104038 1 254 . 1 1 11 11 LYS C C 11 175.940 175.940 175.520 0.420 17919 104039 1 254 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.643 -0.363 17919 104040 1 254 . 1 1 11 11 LYS CB C 11 33.200 33.200 32.901 0.299 17919 104041 1 254 . 1 1 11 11 LYS H H 11 7.280 7.280 7.761 -0.481 17919 104042 1 254 . 1 1 12 12 THR N N 12 120.440 120.440 120.195 0.245 17919 104043 1 254 . 1 1 12 12 THR HA H 12 5.046 5.046 5.114 -0.068 17919 104044 1 254 . 1 1 12 12 THR C C 12 174.320 174.320 174.417 -0.097 17919 104045 1 254 . 1 1 12 12 THR CA C 12 62.390 62.390 61.412 0.978 17919 104046 1 254 . 1 1 12 12 THR CB C 12 69.910 69.910 69.930 -0.020 17919 104047 1 254 . 1 1 12 12 THR H H 12 8.650 8.650 8.427 0.223 17919 104048 1 254 . 1 1 13 13 ILE N N 13 127.110 127.110 126.531 0.579 17919 104049 1 254 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.659 -0.115 17919 104050 1 254 . 1 1 13 13 ILE C C 13 175.220 175.220 174.784 0.436 17919 104051 1 254 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.192 -0.212 17919 104052 1 254 . 1 1 13 13 ILE CB C 13 40.950 40.950 42.474 -1.524 17919 104053 1 254 . 1 1 13 13 ILE H H 13 9.450 9.450 8.949 0.501 17919 104054 1 254 . 1 1 14 14 THR N N 14 121.520 121.520 118.522 2.998 17919 104055 1 254 . 1 1 14 14 THR HA H 14 4.964 4.964 5.268 -0.304 17919 104056 1 254 . 1 1 14 14 THR C C 14 173.790 173.790 174.052 -0.262 17919 104057 1 254 . 1 1 14 14 THR CA C 14 61.940 61.940 60.524 1.416 17919 104058 1 254 . 1 1 14 14 THR CB C 14 69.650 69.650 70.073 -0.423 17919 104059 1 254 . 1 1 14 14 THR H H 14 8.710 8.710 8.331 0.379 17919 104060 1 254 . 1 1 15 15 LEU N N 15 124.800 124.800 124.803 -0.003 17919 104061 1 254 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.757 0.023 17919 104062 1 254 . 1 1 15 15 LEU C C 15 174.670 174.670 175.106 -0.436 17919 104063 1 254 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.741 -0.911 17919 104064 1 254 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.700 1.370 17919 104065 1 254 . 1 1 15 15 LEU H H 15 8.710 8.710 9.113 -0.403 17919 104066 1 254 . 1 1 16 16 GLU N N 16 122.160 122.160 123.470 -1.310 17919 104067 1 254 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.914 0.003 17919 104068 1 254 . 1 1 16 16 GLU C C 16 175.860 175.860 175.973 -0.113 17919 104069 1 254 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.467 -0.647 17919 104070 1 254 . 1 1 16 16 GLU CB C 16 29.450 29.450 29.738 -0.288 17919 104071 1 254 . 1 1 16 16 GLU H H 16 8.140 8.140 8.632 -0.492 17919 104072 1 254 . 1 1 17 17 VAL N N 17 117.210 117.210 120.484 -3.274 17919 104073 1 254 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.754 -0.040 17919 104074 1 254 . 1 1 17 17 VAL C C 17 174.160 174.160 174.509 -0.349 17919 104075 1 254 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.150 -0.720 17919 104076 1 254 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.924 0.476 17919 104077 1 254 . 1 1 17 17 VAL H H 17 8.900 8.900 9.032 -0.132 17919 104078 1 254 . 1 1 18 18 GLU N N 18 118.990 118.990 119.629 -0.639 17919 104079 1 254 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.675 0.404 17919 104080 1 254 . 1 1 18 18 GLU C C 18 176.160 176.160 174.885 1.275 17919 104081 1 254 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.546 -0.826 17919 104082 1 254 . 1 1 18 18 GLU CB C 18 30.310 30.310 31.124 -0.814 17919 104083 1 254 . 1 1 18 18 GLU H H 18 8.640 8.640 8.552 0.088 17919 104084 1 254 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.299 -0.158 17919 104085 1 254 . 1 1 19 19 PRO C C 19 175.310 175.310 177.434 -2.124 17919 104086 1 254 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.247 0.223 17919 104087 1 254 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.998 -0.048 17919 104088 1 254 . 1 1 20 20 SER N N 20 103.400 103.400 109.052 -5.652 17919 104089 1 254 . 1 1 20 20 SER HA H 20 4.370 4.370 4.388 -0.018 17919 104090 1 254 . 1 1 20 20 SER C C 20 174.660 174.660 174.577 0.083 17919 104091 1 254 . 1 1 20 20 SER CA C 20 57.400 57.400 58.188 -0.788 17919 104092 1 254 . 1 1 20 20 SER CB C 20 63.370 63.370 62.812 0.557 17919 104093 1 254 . 1 1 20 20 SER H H 20 7.040 7.040 7.992 -0.952 17919 104094 1 254 . 1 1 21 21 ASP N N 21 123.480 123.480 123.647 -0.167 17919 104095 1 254 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.660 0.035 17919 104096 1 254 . 1 1 21 21 ASP C C 21 176.360 176.360 175.988 0.372 17919 104097 1 254 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.510 1.190 17919 104098 1 254 . 1 1 21 21 ASP CB C 21 40.800 40.800 42.321 -1.521 17919 104099 1 254 . 1 1 21 21 ASP H H 21 8.030 8.030 7.555 0.475 17919 104100 1 254 . 1 1 22 22 THR N N 22 108.800 108.800 114.537 -5.737 17919 104101 1 254 . 1 1 22 22 THR HA H 22 4.920 4.920 5.095 -0.175 17919 104102 1 254 . 1 1 22 22 THR C C 22 176.750 176.750 176.170 0.580 17919 104103 1 254 . 1 1 22 22 THR CA C 22 59.690 59.690 60.046 -0.356 17919 104104 1 254 . 1 1 22 22 THR CB C 22 71.200 71.200 71.714 -0.514 17919 104105 1 254 . 1 1 22 22 THR H H 22 7.900 7.900 8.107 -0.207 17919 104106 1 254 . 1 1 23 23 ILE N N 23 121.190 121.190 122.908 -1.718 17919 104107 1 254 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.796 -0.139 17919 104108 1 254 . 1 1 23 23 ILE C C 23 179.040 179.040 177.672 1.368 17919 104109 1 254 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.894 -0.634 17919 104110 1 254 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.419 -2.069 17919 104111 1 254 . 1 1 23 23 ILE H H 23 8.560 8.560 8.534 0.026 17919 104112 1 254 . 1 1 24 24 GLU N N 24 120.830 120.830 120.871 -0.041 17919 104113 1 254 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.897 0.020 17919 104114 1 254 . 1 1 24 24 GLU C C 24 178.640 178.640 178.823 -0.183 17919 104115 1 254 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.944 0.276 17919 104116 1 254 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.449 -1.169 17919 104117 1 254 . 1 1 24 24 GLU H H 24 9.760 9.760 8.273 1.487 17919 104118 1 254 . 1 1 25 25 ASN N N 25 120.570 120.570 117.321 3.249 17919 104119 1 254 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.518 0.007 17919 104120 1 254 . 1 1 25 25 ASN C C 25 178.380 178.380 178.015 0.365 17919 104121 1 254 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.787 0.273 17919 104122 1 254 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.469 -0.020 17919 104123 1 254 . 1 1 25 25 ASN H H 25 7.920 7.920 7.699 0.221 17919 104124 1 254 . 1 1 26 26 VAL N N 26 121.710 121.710 120.246 1.464 17919 104125 1 254 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.672 -0.275 17919 104126 1 254 . 1 1 26 26 VAL C C 26 177.950 177.950 177.662 0.288 17919 104127 1 254 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.127 1.533 17919 104128 1 254 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.691 -0.851 17919 104129 1 254 . 1 1 26 26 VAL H H 26 8.070 8.070 8.130 -0.060 17919 104130 1 254 . 1 1 27 27 LYS N N 27 118.860 118.860 120.794 -1.934 17919 104131 1 254 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.133 0.447 17919 104132 1 254 . 1 1 27 27 LYS C C 27 180.550 180.550 178.866 1.684 17919 104133 1 254 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.715 -0.465 17919 104134 1 254 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.206 1.524 17919 104135 1 254 . 1 1 27 27 LYS H H 27 8.560 8.560 8.316 0.244 17919 104136 1 254 . 1 1 28 28 ALA N N 28 123.440 123.440 122.218 1.222 17919 104137 1 254 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.011 0.149 17919 104138 1 254 . 1 1 28 28 ALA C C 28 180.300 180.300 179.437 0.863 17919 104139 1 254 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.338 0.032 17919 104140 1 254 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.187 -0.477 17919 104141 1 254 . 1 1 28 28 ALA H H 28 8.060 8.060 7.733 0.327 17919 104142 1 254 . 1 1 29 29 LYS N N 29 119.940 119.940 118.520 1.420 17919 104143 1 254 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.054 0.153 17919 104144 1 254 . 1 1 29 29 LYS C C 29 180.320 180.320 179.148 1.172 17919 104145 1 254 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.251 0.399 17919 104146 1 254 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.346 0.944 17919 104147 1 254 . 1 1 29 29 LYS H H 29 7.850 7.850 7.437 0.413 17919 104148 1 254 . 1 1 30 30 ILE N N 30 121.080 121.080 120.204 0.876 17919 104149 1 254 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.677 -0.170 17919 104150 1 254 . 1 1 30 30 ILE C C 30 178.310 178.310 177.255 1.055 17919 104151 1 254 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.251 0.899 17919 104152 1 254 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.883 -1.083 17919 104153 1 254 . 1 1 30 30 ILE H H 30 8.280 8.280 7.910 0.370 17919 104154 1 254 . 1 1 31 31 GLN N N 31 123.490 123.490 120.534 2.956 17919 104155 1 254 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.025 -0.196 17919 104156 1 254 . 1 1 31 31 GLN C C 31 178.890 178.890 178.286 0.604 17919 104157 1 254 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.529 0.471 17919 104158 1 254 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.459 -0.740 17919 104159 1 254 . 1 1 31 31 GLN H H 31 8.580 8.580 8.297 0.283 17919 104160 1 254 . 1 1 32 32 ASP N N 32 119.360 119.360 120.019 -0.659 17919 104161 1 254 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.388 -0.034 17919 104162 1 254 . 1 1 32 32 ASP C C 32 177.250 177.250 177.901 -0.651 17919 104163 1 254 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.961 0.229 17919 104164 1 254 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.703 -0.122 17919 104165 1 254 . 1 1 32 32 ASP H H 32 8.010 8.010 8.270 -0.260 17919 104166 1 254 . 1 1 33 33 LYS N N 33 115.130 115.130 117.778 -2.648 17919 104167 1 254 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.269 0.068 17919 104168 1 254 . 1 1 33 33 LYS C C 33 177.870 177.870 177.707 0.163 17919 104169 1 254 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.100 -0.050 17919 104170 1 254 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.335 0.835 17919 104171 1 254 . 1 1 33 33 LYS H H 33 7.430 7.430 7.791 -0.361 17919 104172 1 254 . 1 1 34 34 GLU N N 34 113.870 113.870 115.374 -1.504 17919 104173 1 254 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.462 0.163 17919 104174 1 254 . 1 1 34 34 GLU C C 34 177.840 177.840 177.121 0.719 17919 104175 1 254 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.218 -1.048 17919 104176 1 254 . 1 1 34 34 GLU CB C 34 32.660 32.660 30.855 1.805 17919 104177 1 254 . 1 1 34 34 GLU H H 34 8.740 8.740 8.130 0.610 17919 104178 1 254 . 1 1 35 35 GLY N N 35 108.650 108.650 108.931 -0.281 17919 104179 1 254 . 1 1 35 35 GLY C C 35 173.960 173.960 174.365 -0.405 17919 104180 1 254 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.703 0.377 17919 104181 1 254 . 1 1 35 35 GLY H H 35 8.530 8.530 8.199 0.331 17919 104182 1 254 . 1 1 36 36 ILE N N 36 119.880 119.880 121.031 -1.151 17919 104183 1 254 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.241 0.204 17919 104184 1 254 . 1 1 36 36 ILE C C 36 173.590 173.590 174.378 -0.788 17919 104185 1 254 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.059 0.690 17919 104186 1 254 . 1 1 36 36 ILE CB C 36 40.580 40.580 37.044 3.536 17919 104187 1 254 . 1 1 36 36 ILE H H 36 6.150 6.150 7.587 -1.437 17919 104188 1 254 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.581 0.053 17919 104189 1 254 . 1 1 37 37 PRO C C 37 176.940 176.940 176.659 0.281 17919 104190 1 254 . 1 1 37 37 PRO CA C 37 61.660 61.660 62.001 -0.341 17919 104191 1 254 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.396 0.454 17919 104192 1 254 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.221 -0.104 17919 104193 1 254 . 1 1 38 38 PRO C C 38 178.320 178.320 177.746 0.574 17919 104194 1 254 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.690 0.570 17919 104195 1 254 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.851 1.039 17919 104196 1 254 . 1 1 39 39 ASP N N 39 113.380 113.380 116.082 -2.702 17919 104197 1 254 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.459 -0.029 17919 104198 1 254 . 1 1 39 39 ASP C C 39 177.090 177.090 176.913 0.177 17919 104199 1 254 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.133 -0.493 17919 104200 1 254 . 1 1 39 39 ASP CB C 39 39.540 39.540 39.148 0.392 17919 104201 1 254 . 1 1 39 39 ASP H H 39 8.550 8.550 8.807 -0.257 17919 104202 1 254 . 1 1 40 40 GLN N N 40 116.780 116.780 119.167 -2.387 17919 104203 1 254 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.272 0.192 17919 104204 1 254 . 1 1 40 40 GLN C C 40 175.380 175.380 174.612 0.768 17919 104205 1 254 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.765 -0.125 17919 104206 1 254 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.404 0.736 17919 104207 1 254 . 1 1 40 40 GLN H H 40 7.820 7.820 7.668 0.152 17919 104208 1 254 . 1 1 41 41 GLN N N 41 117.720 117.720 116.984 0.736 17919 104209 1 254 . 1 1 41 41 GLN HA H 41 4.244 4.244 5.162 -0.918 17919 104210 1 254 . 1 1 41 41 GLN C C 41 176.300 176.300 175.428 0.872 17919 104211 1 254 . 1 1 41 41 GLN CA C 41 56.470 56.470 54.163 2.307 17919 104212 1 254 . 1 1 41 41 GLN CB C 41 31.650 31.650 31.555 0.095 17919 104213 1 254 . 1 1 41 41 GLN H H 41 7.480 7.480 7.452 0.028 17919 104214 1 254 . 1 1 42 42 ARG N N 42 122.680 122.680 124.587 -1.907 17919 104215 1 254 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.662 -0.162 17919 104216 1 254 . 1 1 42 42 ARG C C 42 174.050 174.050 174.530 -0.480 17919 104217 1 254 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.216 -0.166 17919 104218 1 254 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.639 -0.889 17919 104219 1 254 . 1 1 42 42 ARG H H 42 8.530 8.530 8.779 -0.249 17919 104220 1 254 . 1 1 43 43 LEU N N 43 124.040 124.040 125.343 -1.303 17919 104221 1 254 . 1 1 43 43 LEU C C 43 175.290 175.290 175.668 -0.378 17919 104222 1 254 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.519 -0.539 17919 104223 1 254 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.747 1.043 17919 104224 1 254 . 1 1 43 43 LEU H H 43 8.820 8.820 8.759 0.061 17919 104225 1 254 . 1 1 44 44 ILE N N 44 121.920 121.920 120.470 1.450 17919 104226 1 254 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.132 -0.140 17919 104227 1 254 . 1 1 44 44 ILE C C 44 176.060 176.060 174.297 1.763 17919 104228 1 254 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.929 -0.949 17919 104229 1 254 . 1 1 44 44 ILE CB C 44 41.420 41.420 42.162 -0.742 17919 104230 1 254 . 1 1 44 44 ILE H H 44 9.030 9.030 8.922 0.108 17919 104231 1 254 . 1 1 45 45 PHE N N 45 125.390 125.390 126.123 -0.733 17919 104232 1 254 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.073 -0.028 17919 104233 1 254 . 1 1 45 45 PHE C C 45 174.470 174.470 174.596 -0.126 17919 104234 1 254 . 1 1 45 45 PHE CA C 45 57.020 57.020 55.578 1.442 17919 104235 1 254 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.938 0.822 17919 104236 1 254 . 1 1 45 45 PHE H H 45 8.830 8.830 9.000 -0.170 17919 104237 1 254 . 1 1 46 46 ALA N N 46 132.200 132.200 129.770 2.430 17919 104238 1 254 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.691 -0.001 17919 104239 1 254 . 1 1 46 46 ALA C C 46 177.290 177.290 177.763 -0.473 17919 104240 1 254 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.319 0.221 17919 104241 1 254 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.364 0.206 17919 104242 1 254 . 1 1 46 46 ALA H H 46 8.810 8.810 8.888 -0.078 17919 104243 1 254 . 1 1 47 47 GLY N N 47 102.340 102.340 104.670 -2.330 17919 104244 1 254 . 1 1 47 47 GLY C C 47 173.810 173.810 174.424 -0.614 17919 104245 1 254 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.987 0.363 17919 104246 1 254 . 1 1 47 47 GLY H H 47 8.130 8.130 8.505 -0.375 17919 104247 1 254 . 1 1 48 48 LYS N N 48 121.570 121.570 121.904 -0.334 17919 104248 1 254 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.672 -0.050 17919 104249 1 254 . 1 1 48 48 LYS C C 48 174.700 174.700 175.340 -0.640 17919 104250 1 254 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.911 -0.361 17919 104251 1 254 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.558 -0.028 17919 104252 1 254 . 1 1 48 48 LYS H H 48 7.980 7.980 8.095 -0.115 17919 104253 1 254 . 1 1 49 49 GLN N N 49 122.410 122.410 122.485 -0.075 17919 104254 1 254 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.325 0.235 17919 104255 1 254 . 1 1 49 49 GLN C C 49 175.670 175.670 175.303 0.367 17919 104256 1 254 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.360 -0.620 17919 104257 1 254 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.213 -0.213 17919 104258 1 254 . 1 1 49 49 GLN H H 49 8.600 8.600 8.584 0.016 17919 104259 1 254 . 1 1 50 50 LEU N N 50 125.520 125.520 127.443 -1.923 17919 104260 1 254 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.250 -0.160 17919 104261 1 254 . 1 1 50 50 LEU C C 50 176.660 176.660 175.968 0.692 17919 104262 1 254 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.735 0.505 17919 104263 1 254 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.129 -0.559 17919 104264 1 254 . 1 1 50 50 LEU H H 50 8.530 8.530 8.352 0.178 17919 104265 1 254 . 1 1 51 51 GLU N N 51 122.940 122.940 123.397 -0.457 17919 104266 1 254 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.531 -0.043 17919 104267 1 254 . 1 1 51 51 GLU C C 51 175.870 175.870 177.390 -1.520 17919 104268 1 254 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.459 0.501 17919 104269 1 254 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.829 -0.259 17919 104270 1 254 . 1 1 51 51 GLU H H 51 8.400 8.400 8.293 0.107 17919 104271 1 254 . 1 1 52 52 ASP N N 52 120.030 120.030 125.610 -5.580 17919 104272 1 254 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.285 0.074 17919 104273 1 254 . 1 1 52 52 ASP C C 52 177.330 177.330 177.618 -0.288 17919 104274 1 254 . 1 1 52 52 ASP CA C 52 56.960 56.960 58.306 -1.346 17919 104275 1 254 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.691 0.159 17919 104276 1 254 . 1 1 52 52 ASP H H 52 8.160 8.160 8.882 -0.722 17919 104277 1 254 . 1 1 53 53 GLY N N 53 106.660 106.660 105.941 0.719 17919 104278 1 254 . 1 1 53 53 GLY C C 53 174.870 174.870 174.168 0.702 17919 104279 1 254 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.971 0.199 17919 104280 1 254 . 1 1 53 53 GLY H H 53 9.390 9.390 8.624 0.766 17919 104281 1 254 . 1 1 54 54 ARG N N 54 119.050 119.050 120.895 -1.845 17919 104282 1 254 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.785 -0.090 17919 104283 1 254 . 1 1 54 54 ARG C C 54 175.350 175.350 175.322 0.028 17919 104284 1 254 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.314 0.076 17919 104285 1 254 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.384 -0.734 17919 104286 1 254 . 1 1 54 54 ARG H H 54 7.460 7.460 7.481 -0.021 17919 104287 1 254 . 1 1 55 55 THR N N 55 108.400 108.400 112.692 -4.292 17919 104288 1 254 . 1 1 55 55 THR HA H 55 5.240 5.240 5.192 0.048 17919 104289 1 254 . 1 1 55 55 THR C C 55 176.560 176.560 176.704 -0.144 17919 104290 1 254 . 1 1 55 55 THR CA C 55 59.690 59.690 59.580 0.110 17919 104291 1 254 . 1 1 55 55 THR CB C 55 72.260 72.260 70.947 1.313 17919 104292 1 254 . 1 1 55 55 THR H H 55 8.730 8.730 9.087 -0.357 17919 104293 1 254 . 1 1 56 56 LEU N N 56 117.920 117.920 122.414 -4.494 17919 104294 1 254 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.030 0.030 17919 104295 1 254 . 1 1 56 56 LEU C C 56 180.810 180.810 178.909 1.901 17919 104296 1 254 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.296 0.414 17919 104297 1 254 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.072 -0.702 17919 104298 1 254 . 1 1 56 56 LEU H H 56 8.140 8.140 8.406 -0.266 17919 104299 1 254 . 1 1 57 57 SER N N 57 113.330 113.330 114.267 -0.937 17919 104300 1 254 . 1 1 57 57 SER HA H 57 4.370 4.370 4.138 0.232 17919 104301 1 254 . 1 1 57 57 SER C C 57 178.310 178.310 176.016 2.294 17919 104302 1 254 . 1 1 57 57 SER CA C 57 61.080 61.080 62.169 -1.089 17919 104303 1 254 . 1 1 57 57 SER CB C 57 62.530 62.530 62.879 -0.349 17919 104304 1 254 . 1 1 57 57 SER H H 57 8.470 8.470 8.347 0.123 17919 104305 1 254 . 1 1 58 58 ASP N N 58 124.190 124.190 120.202 3.988 17919 104306 1 254 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.468 -0.172 17919 104307 1 254 . 1 1 58 58 ASP C C 58 177.400 177.400 177.484 -0.084 17919 104308 1 254 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.343 0.837 17919 104309 1 254 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.681 -0.581 17919 104310 1 254 . 1 1 58 58 ASP H H 58 7.930 7.930 7.896 0.034 17919 104311 1 254 . 1 1 59 59 TYR N N 59 115.510 115.510 117.602 -2.092 17919 104312 1 254 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.612 0.058 17919 104313 1 254 . 1 1 59 59 TYR C C 59 174.700 174.700 175.098 -0.398 17919 104314 1 254 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.455 0.795 17919 104315 1 254 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.900 1.170 17919 104316 1 254 . 1 1 59 59 TYR H H 59 7.250 7.250 7.406 -0.156 17919 104317 1 254 . 1 1 60 60 ASN N N 60 115.900 115.900 114.761 1.139 17919 104318 1 254 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.352 0.003 17919 104319 1 254 . 1 1 60 60 ASN C C 60 174.340 174.340 174.082 0.258 17919 104320 1 254 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.259 -0.139 17919 104321 1 254 . 1 1 60 60 ASN CB C 60 37.410 37.410 36.218 1.192 17919 104322 1 254 . 1 1 60 60 ASN H H 60 8.150 8.150 7.830 0.320 17919 104323 1 254 . 1 1 61 61 ILE N N 61 118.600 118.600 120.331 -1.731 17919 104324 1 254 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.767 -0.374 17919 104325 1 254 . 1 1 61 61 ILE C C 61 174.610 174.610 174.889 -0.279 17919 104326 1 254 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.526 0.893 17919 104327 1 254 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.918 -1.178 17919 104328 1 254 . 1 1 61 61 ILE H H 61 7.250 7.250 7.811 -0.561 17919 104329 1 254 . 1 1 62 62 GLN N N 62 124.740 124.740 125.534 -0.794 17919 104330 1 254 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.766 -0.260 17919 104331 1 254 . 1 1 62 62 GLN C C 62 175.970 175.970 175.532 0.438 17919 104332 1 254 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.255 0.405 17919 104333 1 254 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.675 -0.025 17919 104334 1 254 . 1 1 62 62 GLN H H 62 7.610 7.610 7.945 -0.335 17919 104335 1 254 . 1 1 63 63 LYS N N 63 120.300 120.300 121.607 -1.307 17919 104336 1 254 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.028 -0.027 17919 104337 1 254 . 1 1 63 63 LYS C C 63 175.810 175.810 177.115 -1.305 17919 104338 1 254 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.757 0.033 17919 104339 1 254 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.895 0.755 17919 104340 1 254 . 1 1 63 63 LYS H H 63 8.490 8.490 8.715 -0.225 17919 104341 1 254 . 1 1 64 64 GLU N N 64 113.950 113.950 121.347 -7.397 17919 104342 1 254 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.851 -0.386 17919 104343 1 254 . 1 1 64 64 GLU C C 64 175.250 175.250 175.749 -0.499 17919 104344 1 254 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.551 0.339 17919 104345 1 254 . 1 1 64 64 GLU CB C 64 25.900 25.900 29.343 -3.443 17919 104346 1 254 . 1 1 64 64 GLU H H 64 9.280 9.280 9.100 0.180 17919 104347 1 254 . 1 1 65 65 SER N N 65 114.730 114.730 115.457 -0.727 17919 104348 1 254 . 1 1 65 65 SER HA H 65 4.640 4.640 4.478 0.162 17919 104349 1 254 . 1 1 65 65 SER C C 65 172.160 172.160 174.332 -2.172 17919 104350 1 254 . 1 1 65 65 SER CA C 65 60.890 60.890 60.617 0.273 17919 104351 1 254 . 1 1 65 65 SER CB C 65 64.910 64.910 64.122 0.788 17919 104352 1 254 . 1 1 65 65 SER H H 65 7.670 7.670 7.649 0.021 17919 104353 1 254 . 1 1 66 66 THR N N 66 117.110 117.110 119.872 -2.762 17919 104354 1 254 . 1 1 66 66 THR HA H 66 5.270 5.270 4.953 0.317 17919 104355 1 254 . 1 1 66 66 THR C C 66 173.950 173.950 174.476 -0.526 17919 104356 1 254 . 1 1 66 66 THR CA C 66 62.340 62.340 62.286 0.054 17919 104357 1 254 . 1 1 66 66 THR CB C 66 70.080 70.080 69.897 0.183 17919 104358 1 254 . 1 1 66 66 THR H H 66 8.730 8.730 8.662 0.068 17919 104359 1 254 . 1 1 67 67 LEU N N 67 127.110 127.110 127.892 -0.782 17919 104360 1 254 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.889 0.171 17919 104361 1 254 . 1 1 67 67 LEU C C 67 175.770 175.770 175.364 0.406 17919 104362 1 254 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.051 -0.151 17919 104363 1 254 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.304 -0.044 17919 104364 1 254 . 1 1 67 67 LEU H H 67 9.410 9.410 9.261 0.149 17919 104365 1 254 . 1 1 68 68 HIS N N 68 118.380 118.380 121.897 -3.517 17919 104366 1 254 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.296 -0.056 17919 104367 1 254 . 1 1 68 68 HIS C C 68 173.150 173.150 173.513 -0.363 17919 104368 1 254 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.194 0.806 17919 104369 1 254 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.670 -2.140 17919 104370 1 254 . 1 1 68 68 HIS H H 68 9.230 9.230 9.072 0.158 17919 104371 1 254 . 1 1 69 69 LEU N N 69 124.460 124.460 129.575 -5.115 17919 104372 1 254 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.057 0.133 17919 104373 1 254 . 1 1 69 69 LEU C C 69 175.270 175.270 174.461 0.809 17919 104374 1 254 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.286 0.604 17919 104375 1 254 . 1 1 69 69 LEU CB C 69 44.380 44.380 43.907 0.473 17919 104376 1 254 . 1 1 69 69 LEU H H 69 8.340 8.340 7.506 0.834 17919 104377 1 254 . 1 1 70 70 VAL N N 70 126.940 126.940 124.407 2.533 17919 104378 1 254 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.568 -0.218 17919 104379 1 254 . 1 1 70 70 VAL C C 70 174.000 174.000 174.569 -0.569 17919 104380 1 254 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.245 0.555 17919 104381 1 254 . 1 1 70 70 VAL CB C 70 34.910 34.910 34.830 0.080 17919 104382 1 254 . 1 1 70 70 VAL H H 70 9.200 9.200 9.003 0.197 17919 104383 1 254 . 1 1 71 71 LEU N N 71 123.130 123.130 121.858 1.272 17919 104384 1 254 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.331 -0.271 17919 104385 1 254 . 1 1 71 71 LEU C C 71 177.830 177.830 177.918 -0.088 17919 104386 1 254 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.092 0.848 17919 104387 1 254 . 1 1 71 71 LEU CB C 71 42.850 42.850 44.267 -1.417 17919 104388 1 254 . 1 1 71 71 LEU H H 71 8.120 8.120 8.425 -0.305 17919 104389 1 254 . 1 1 72 72 ARG N N 72 123.490 123.490 122.046 1.444 17919 104390 1 254 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.282 0.019 17919 104391 1 254 . 1 1 72 72 ARG C C 72 175.350 175.350 175.794 -0.444 17919 104392 1 254 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.916 -1.306 17919 104393 1 254 . 1 1 72 72 ARG CB C 72 31.350 31.350 28.583 2.767 17919 104394 1 254 . 1 1 72 72 ARG H H 72 8.580 8.580 8.489 0.091 17919 104395 1 255 . 1 1 2 2 GLN N N 2 123.220 123.220 122.231 0.989 17919 104396 1 255 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.021 0.228 17919 104397 1 255 . 1 1 2 2 GLN C C 2 175.920 175.920 175.639 0.281 17919 104398 1 255 . 1 1 2 2 GLN CA C 2 55.080 55.080 55.170 -0.090 17919 104399 1 255 . 1 1 2 2 GLN CB C 2 30.760 30.760 29.401 1.359 17919 104400 1 255 . 1 1 2 2 GLN H H 2 8.900 8.900 8.395 0.505 17919 104401 1 255 . 1 1 3 3 ILE N N 3 115.340 115.340 117.115 -1.775 17919 104402 1 255 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.633 -0.420 17919 104403 1 255 . 1 1 3 3 ILE C C 3 172.450 172.450 173.709 -1.259 17919 104404 1 255 . 1 1 3 3 ILE CA C 3 59.570 59.570 58.897 0.673 17919 104405 1 255 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.821 0.389 17919 104406 1 255 . 1 1 3 3 ILE H H 3 8.320 8.320 7.813 0.507 17919 104407 1 255 . 1 1 4 4 PHE N N 4 118.110 118.110 119.296 -1.186 17919 104408 1 255 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.386 0.244 17919 104409 1 255 . 1 1 4 4 PHE C C 4 175.320 175.320 175.076 0.244 17919 104410 1 255 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.476 -0.266 17919 104411 1 255 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.585 -0.105 17919 104412 1 255 . 1 1 4 4 PHE H H 4 8.610 8.610 8.877 -0.267 17919 104413 1 255 . 1 1 5 5 VAL N N 5 121.000 121.000 122.402 -1.402 17919 104414 1 255 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.837 -0.112 17919 104415 1 255 . 1 1 5 5 VAL C C 5 174.870 174.870 174.722 0.148 17919 104416 1 255 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.562 -0.942 17919 104417 1 255 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.317 0.913 17919 104418 1 255 . 1 1 5 5 VAL H H 5 9.300 9.300 9.275 0.025 17919 104419 1 255 . 1 1 6 6 LYS N N 6 127.520 127.520 128.932 -1.412 17919 104420 1 255 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.235 0.132 17919 104421 1 255 . 1 1 6 6 LYS C C 6 177.140 177.140 176.293 0.847 17919 104422 1 255 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.273 0.247 17919 104423 1 255 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.537 -0.487 17919 104424 1 255 . 1 1 6 6 LYS H H 6 8.820 8.820 9.076 -0.256 17919 104425 1 255 . 1 1 7 7 THR N N 7 115.400 115.400 118.613 -3.213 17919 104426 1 255 . 1 1 7 7 THR HA H 7 4.970 4.970 4.552 0.418 17919 104427 1 255 . 1 1 7 7 THR C C 7 176.910 176.910 176.482 0.428 17919 104428 1 255 . 1 1 7 7 THR CA C 7 60.470 60.470 60.328 0.142 17919 104429 1 255 . 1 1 7 7 THR CB C 7 70.630 70.630 69.982 0.648 17919 104430 1 255 . 1 1 7 7 THR H H 7 8.730 8.730 8.515 0.215 17919 104431 1 255 . 1 1 8 8 LEU N N 8 121.330 121.330 121.583 -0.253 17919 104432 1 255 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.137 0.173 17919 104433 1 255 . 1 1 8 8 LEU C C 8 178.800 178.800 177.961 0.839 17919 104434 1 255 . 1 1 8 8 LEU CA C 8 57.580 57.580 58.008 -0.428 17919 104435 1 255 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.110 -0.140 17919 104436 1 255 . 1 1 8 8 LEU H H 8 9.100 9.100 8.863 0.237 17919 104437 1 255 . 1 1 9 9 THR N N 9 105.590 105.590 107.741 -2.151 17919 104438 1 255 . 1 1 9 9 THR HA H 9 4.428 4.428 4.293 0.135 17919 104439 1 255 . 1 1 9 9 THR C C 9 175.520 175.520 175.335 0.185 17919 104440 1 255 . 1 1 9 9 THR CA C 9 61.400 61.400 61.632 -0.232 17919 104441 1 255 . 1 1 9 9 THR CB C 9 69.140 69.140 69.395 -0.255 17919 104442 1 255 . 1 1 9 9 THR H H 9 7.630 7.630 7.682 -0.052 17919 104443 1 255 . 1 1 10 10 GLY N N 10 108.890 108.890 110.074 -1.184 17919 104444 1 255 . 1 1 10 10 GLY C C 10 174.070 174.070 174.555 -0.485 17919 104445 1 255 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.454 0.006 17919 104446 1 255 . 1 1 10 10 GLY H H 10 7.810 7.810 7.850 -0.040 17919 104447 1 255 . 1 1 11 11 LYS N N 11 121.600 121.600 120.993 0.607 17919 104448 1 255 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.665 -0.304 17919 104449 1 255 . 1 1 11 11 LYS C C 11 175.940 175.940 175.906 0.034 17919 104450 1 255 . 1 1 11 11 LYS CA C 11 56.280 56.280 54.385 1.895 17919 104451 1 255 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.754 -0.554 17919 104452 1 255 . 1 1 11 11 LYS H H 11 7.280 7.280 8.109 -0.829 17919 104453 1 255 . 1 1 12 12 THR N N 12 120.440 120.440 114.262 6.178 17919 104454 1 255 . 1 1 12 12 THR HA H 12 5.046 5.046 5.268 -0.222 17919 104455 1 255 . 1 1 12 12 THR C C 12 174.320 174.320 174.699 -0.379 17919 104456 1 255 . 1 1 12 12 THR CA C 12 62.390 62.390 60.493 1.897 17919 104457 1 255 . 1 1 12 12 THR CB C 12 69.910 69.910 70.322 -0.412 17919 104458 1 255 . 1 1 12 12 THR H H 12 8.650 8.650 8.169 0.480 17919 104459 1 255 . 1 1 13 13 ILE N N 13 127.110 127.110 126.187 0.923 17919 104460 1 255 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.389 0.155 17919 104461 1 255 . 1 1 13 13 ILE C C 13 175.220 175.220 175.572 -0.352 17919 104462 1 255 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.441 -0.461 17919 104463 1 255 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.719 0.231 17919 104464 1 255 . 1 1 13 13 ILE H H 13 9.450 9.450 8.813 0.637 17919 104465 1 255 . 1 1 14 14 THR N N 14 121.520 121.520 121.846 -0.326 17919 104466 1 255 . 1 1 14 14 THR HA H 14 4.964 4.964 5.018 -0.053 17919 104467 1 255 . 1 1 14 14 THR C C 14 173.790 173.790 174.132 -0.342 17919 104468 1 255 . 1 1 14 14 THR CA C 14 61.940 61.940 62.285 -0.345 17919 104469 1 255 . 1 1 14 14 THR CB C 14 69.650 69.650 69.507 0.143 17919 104470 1 255 . 1 1 14 14 THR H H 14 8.710 8.710 8.539 0.171 17919 104471 1 255 . 1 1 15 15 LEU N N 15 124.800 124.800 128.935 -4.135 17919 104472 1 255 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.629 0.151 17919 104473 1 255 . 1 1 15 15 LEU C C 15 174.670 174.670 175.370 -0.700 17919 104474 1 255 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.747 -0.917 17919 104475 1 255 . 1 1 15 15 LEU CB C 15 47.070 47.070 44.291 2.779 17919 104476 1 255 . 1 1 15 15 LEU H H 15 8.710 8.710 8.239 0.471 17919 104477 1 255 . 1 1 16 16 GLU N N 16 122.160 122.160 124.271 -2.111 17919 104478 1 255 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.796 0.121 17919 104479 1 255 . 1 1 16 16 GLU C C 16 175.860 175.860 176.012 -0.152 17919 104480 1 255 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.695 -0.875 17919 104481 1 255 . 1 1 16 16 GLU CB C 16 29.450 29.450 29.645 -0.195 17919 104482 1 255 . 1 1 16 16 GLU H H 16 8.140 8.140 8.696 -0.556 17919 104483 1 255 . 1 1 17 17 VAL N N 17 117.210 117.210 118.924 -1.714 17919 104484 1 255 . 1 1 17 17 VAL HA H 17 4.714 4.714 5.031 -0.317 17919 104485 1 255 . 1 1 17 17 VAL C C 17 174.160 174.160 174.629 -0.469 17919 104486 1 255 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.927 -0.497 17919 104487 1 255 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.935 0.465 17919 104488 1 255 . 1 1 17 17 VAL H H 17 8.900 8.900 8.763 0.137 17919 104489 1 255 . 1 1 18 18 GLU N N 18 118.990 118.990 121.776 -2.786 17919 104490 1 255 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.873 0.206 17919 104491 1 255 . 1 1 18 18 GLU C C 18 176.160 176.160 175.738 0.422 17919 104492 1 255 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.273 0.447 17919 104493 1 255 . 1 1 18 18 GLU CB C 18 30.310 30.310 31.843 -1.532 17919 104494 1 255 . 1 1 18 18 GLU H H 18 8.640 8.640 9.071 -0.431 17919 104495 1 255 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.262 -0.121 17919 104496 1 255 . 1 1 19 19 PRO C C 19 175.310 175.310 177.378 -2.068 17919 104497 1 255 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.360 0.110 17919 104498 1 255 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.974 -0.023 17919 104499 1 255 . 1 1 20 20 SER N N 20 103.400 103.400 109.787 -6.387 17919 104500 1 255 . 1 1 20 20 SER HA H 20 4.370 4.370 4.358 0.012 17919 104501 1 255 . 1 1 20 20 SER C C 20 174.660 174.660 173.740 0.920 17919 104502 1 255 . 1 1 20 20 SER CA C 20 57.400 57.400 58.078 -0.678 17919 104503 1 255 . 1 1 20 20 SER CB C 20 63.370 63.370 63.141 0.229 17919 104504 1 255 . 1 1 20 20 SER H H 20 7.040 7.040 7.969 -0.929 17919 104505 1 255 . 1 1 21 21 ASP N N 21 123.480 123.480 123.594 -0.114 17919 104506 1 255 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.763 -0.068 17919 104507 1 255 . 1 1 21 21 ASP C C 21 176.360 176.360 176.134 0.226 17919 104508 1 255 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.137 0.563 17919 104509 1 255 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.340 -0.540 17919 104510 1 255 . 1 1 21 21 ASP H H 21 8.030 8.030 7.640 0.390 17919 104511 1 255 . 1 1 22 22 THR N N 22 108.800 108.800 112.584 -3.784 17919 104512 1 255 . 1 1 22 22 THR HA H 22 4.920 4.920 4.822 0.098 17919 104513 1 255 . 1 1 22 22 THR C C 22 176.750 176.750 176.218 0.532 17919 104514 1 255 . 1 1 22 22 THR CA C 22 59.690 59.690 61.684 -1.994 17919 104515 1 255 . 1 1 22 22 THR CB C 22 71.200 71.200 70.132 1.068 17919 104516 1 255 . 1 1 22 22 THR H H 22 7.900 7.900 8.182 -0.282 17919 104517 1 255 . 1 1 23 23 ILE N N 23 121.190 121.190 122.028 -0.838 17919 104518 1 255 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.731 -0.074 17919 104519 1 255 . 1 1 23 23 ILE C C 23 179.040 179.040 177.583 1.457 17919 104520 1 255 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.144 0.116 17919 104521 1 255 . 1 1 23 23 ILE CB C 23 34.350 34.350 35.938 -1.588 17919 104522 1 255 . 1 1 23 23 ILE H H 23 8.560 8.560 8.688 -0.128 17919 104523 1 255 . 1 1 24 24 GLU N N 24 120.830 120.830 120.844 -0.014 17919 104524 1 255 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.859 0.058 17919 104525 1 255 . 1 1 24 24 GLU C C 24 178.640 178.640 178.593 0.047 17919 104526 1 255 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.254 -0.034 17919 104527 1 255 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.309 -1.029 17919 104528 1 255 . 1 1 24 24 GLU H H 24 9.760 9.760 7.973 1.787 17919 104529 1 255 . 1 1 25 25 ASN N N 25 120.570 120.570 116.787 3.783 17919 104530 1 255 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.574 -0.049 17919 104531 1 255 . 1 1 25 25 ASN C C 25 178.380 178.380 177.791 0.589 17919 104532 1 255 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.730 0.330 17919 104533 1 255 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.556 -0.105 17919 104534 1 255 . 1 1 25 25 ASN H H 25 7.920 7.920 7.691 0.229 17919 104535 1 255 . 1 1 26 26 VAL N N 26 121.710 121.710 120.919 0.791 17919 104536 1 255 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.576 -0.179 17919 104537 1 255 . 1 1 26 26 VAL C C 26 177.950 177.950 177.478 0.472 17919 104538 1 255 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.691 0.969 17919 104539 1 255 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.782 -0.942 17919 104540 1 255 . 1 1 26 26 VAL H H 26 8.070 8.070 7.261 0.809 17919 104541 1 255 . 1 1 27 27 LYS N N 27 118.860 118.860 119.555 -0.695 17919 104542 1 255 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.162 0.418 17919 104543 1 255 . 1 1 27 27 LYS C C 27 180.550 180.550 179.220 1.330 17919 104544 1 255 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.544 -0.294 17919 104545 1 255 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.197 1.533 17919 104546 1 255 . 1 1 27 27 LYS H H 27 8.560 8.560 8.308 0.252 17919 104547 1 255 . 1 1 28 28 ALA N N 28 123.440 123.440 121.107 2.333 17919 104548 1 255 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.121 0.039 17919 104549 1 255 . 1 1 28 28 ALA C C 28 180.300 180.300 178.843 1.457 17919 104550 1 255 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.867 0.503 17919 104551 1 255 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.409 -0.699 17919 104552 1 255 . 1 1 28 28 ALA H H 28 8.060 8.060 8.363 -0.303 17919 104553 1 255 . 1 1 29 29 LYS N N 29 119.940 119.940 118.979 0.961 17919 104554 1 255 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.058 0.149 17919 104555 1 255 . 1 1 29 29 LYS C C 29 180.320 180.320 178.456 1.864 17919 104556 1 255 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.312 0.338 17919 104557 1 255 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.352 0.938 17919 104558 1 255 . 1 1 29 29 LYS H H 29 7.850 7.850 7.607 0.243 17919 104559 1 255 . 1 1 30 30 ILE N N 30 121.080 121.080 119.336 1.744 17919 104560 1 255 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.725 -0.218 17919 104561 1 255 . 1 1 30 30 ILE C C 30 178.310 178.310 177.171 1.139 17919 104562 1 255 . 1 1 30 30 ILE CA C 30 66.150 66.150 64.938 1.212 17919 104563 1 255 . 1 1 30 30 ILE CB C 30 36.800 36.800 38.014 -1.214 17919 104564 1 255 . 1 1 30 30 ILE H H 30 8.280 8.280 7.817 0.463 17919 104565 1 255 . 1 1 31 31 GLN N N 31 123.490 123.490 121.309 2.181 17919 104566 1 255 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.180 -0.351 17919 104567 1 255 . 1 1 31 31 GLN C C 31 178.890 178.890 178.566 0.324 17919 104568 1 255 . 1 1 31 31 GLN CA C 31 60.000 60.000 58.814 1.186 17919 104569 1 255 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.253 -0.533 17919 104570 1 255 . 1 1 31 31 GLN H H 31 8.580 8.580 7.957 0.623 17919 104571 1 255 . 1 1 32 32 ASP N N 32 119.360 119.360 119.502 -0.142 17919 104572 1 255 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.408 -0.054 17919 104573 1 255 . 1 1 32 32 ASP C C 32 177.250 177.250 177.822 -0.572 17919 104574 1 255 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.820 0.370 17919 104575 1 255 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.842 -0.262 17919 104576 1 255 . 1 1 32 32 ASP H H 32 8.010 8.010 8.069 -0.059 17919 104577 1 255 . 1 1 33 33 LYS N N 33 115.130 115.130 118.651 -3.521 17919 104578 1 255 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.229 0.108 17919 104579 1 255 . 1 1 33 33 LYS C C 33 177.870 177.870 178.254 -0.384 17919 104580 1 255 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.992 0.058 17919 104581 1 255 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.090 1.080 17919 104582 1 255 . 1 1 33 33 LYS H H 33 7.430 7.430 7.497 -0.067 17919 104583 1 255 . 1 1 34 34 GLU N N 34 113.870 113.870 115.056 -1.186 17919 104584 1 255 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.494 0.131 17919 104585 1 255 . 1 1 34 34 GLU C C 34 177.840 177.840 177.247 0.593 17919 104586 1 255 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.026 -0.856 17919 104587 1 255 . 1 1 34 34 GLU CB C 34 32.660 32.660 30.881 1.779 17919 104588 1 255 . 1 1 34 34 GLU H H 34 8.740 8.740 7.833 0.907 17919 104589 1 255 . 1 1 35 35 GLY N N 35 108.650 108.650 108.839 -0.189 17919 104590 1 255 . 1 1 35 35 GLY C C 35 173.960 173.960 174.320 -0.360 17919 104591 1 255 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.989 0.091 17919 104592 1 255 . 1 1 35 35 GLY H H 35 8.530 8.530 7.966 0.564 17919 104593 1 255 . 1 1 36 36 ILE N N 36 119.880 119.880 122.002 -2.122 17919 104594 1 255 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.438 0.007 17919 104595 1 255 . 1 1 36 36 ILE C C 36 173.590 173.590 174.718 -1.128 17919 104596 1 255 . 1 1 36 36 ILE CA C 36 57.750 57.750 56.530 1.220 17919 104597 1 255 . 1 1 36 36 ILE CB C 36 40.580 40.580 37.261 3.319 17919 104598 1 255 . 1 1 36 36 ILE H H 36 6.150 6.150 7.875 -1.725 17919 104599 1 255 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.825 -0.191 17919 104600 1 255 . 1 1 37 37 PRO C C 37 176.940 176.940 176.262 0.678 17919 104601 1 255 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.341 0.319 17919 104602 1 255 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.747 0.103 17919 104603 1 255 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.128 -0.011 17919 104604 1 255 . 1 1 38 38 PRO C C 38 178.320 178.320 178.518 -0.198 17919 104605 1 255 . 1 1 38 38 PRO CA C 38 66.260 66.260 66.272 -0.012 17919 104606 1 255 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.881 1.009 17919 104607 1 255 . 1 1 39 39 ASP N N 39 113.380 113.380 113.790 -0.410 17919 104608 1 255 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.395 0.035 17919 104609 1 255 . 1 1 39 39 ASP C C 39 177.090 177.090 177.273 -0.183 17919 104610 1 255 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.395 -0.755 17919 104611 1 255 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.617 -1.077 17919 104612 1 255 . 1 1 39 39 ASP H H 39 8.550 8.550 8.602 -0.052 17919 104613 1 255 . 1 1 40 40 GLN N N 40 116.780 116.780 118.012 -1.232 17919 104614 1 255 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.269 0.195 17919 104615 1 255 . 1 1 40 40 GLN C C 40 175.380 175.380 176.155 -0.775 17919 104616 1 255 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.308 -0.668 17919 104617 1 255 . 1 1 40 40 GLN CB C 40 30.140 30.140 30.144 -0.004 17919 104618 1 255 . 1 1 40 40 GLN H H 40 7.820 7.820 7.806 0.014 17919 104619 1 255 . 1 1 41 41 GLN N N 41 117.720 117.720 120.057 -2.337 17919 104620 1 255 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.129 0.115 17919 104621 1 255 . 1 1 41 41 GLN C C 41 176.300 176.300 175.678 0.622 17919 104622 1 255 . 1 1 41 41 GLN CA C 41 56.470 56.470 57.551 -1.081 17919 104623 1 255 . 1 1 41 41 GLN CB C 41 31.650 31.650 28.880 2.770 17919 104624 1 255 . 1 1 41 41 GLN H H 41 7.480 7.480 7.651 -0.171 17919 104625 1 255 . 1 1 42 42 ARG N N 42 122.680 122.680 124.525 -1.845 17919 104626 1 255 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.679 -0.179 17919 104627 1 255 . 1 1 42 42 ARG C C 42 174.050 174.050 174.543 -0.493 17919 104628 1 255 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.891 0.159 17919 104629 1 255 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.753 -1.003 17919 104630 1 255 . 1 1 42 42 ARG H H 42 8.530 8.530 9.168 -0.638 17919 104631 1 255 . 1 1 43 43 LEU N N 43 124.040 124.040 125.388 -1.348 17919 104632 1 255 . 1 1 43 43 LEU C C 43 175.290 175.290 175.766 -0.476 17919 104633 1 255 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.395 -0.415 17919 104634 1 255 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.625 1.165 17919 104635 1 255 . 1 1 43 43 LEU H H 43 8.820 8.820 8.830 -0.010 17919 104636 1 255 . 1 1 44 44 ILE N N 44 121.920 121.920 121.538 0.382 17919 104637 1 255 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.961 0.031 17919 104638 1 255 . 1 1 44 44 ILE C C 44 176.060 176.060 174.306 1.754 17919 104639 1 255 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.149 -1.169 17919 104640 1 255 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.579 -0.159 17919 104641 1 255 . 1 1 44 44 ILE H H 44 9.030 9.030 8.813 0.217 17919 104642 1 255 . 1 1 45 45 PHE N N 45 125.390 125.390 126.215 -0.825 17919 104643 1 255 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.048 -0.003 17919 104644 1 255 . 1 1 45 45 PHE C C 45 174.470 174.470 174.175 0.295 17919 104645 1 255 . 1 1 45 45 PHE CA C 45 57.020 57.020 57.373 -0.353 17919 104646 1 255 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.397 0.363 17919 104647 1 255 . 1 1 45 45 PHE H H 45 8.830 8.830 9.167 -0.337 17919 104648 1 255 . 1 1 46 46 ALA N N 46 132.200 132.200 129.879 2.321 17919 104649 1 255 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.588 0.102 17919 104650 1 255 . 1 1 46 46 ALA C C 46 177.290 177.290 177.632 -0.342 17919 104651 1 255 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.657 -0.117 17919 104652 1 255 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.420 0.150 17919 104653 1 255 . 1 1 46 46 ALA H H 46 8.810 8.810 8.295 0.515 17919 104654 1 255 . 1 1 47 47 GLY N N 47 102.340 102.340 103.992 -1.652 17919 104655 1 255 . 1 1 47 47 GLY C C 47 173.810 173.810 174.604 -0.794 17919 104656 1 255 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.555 -0.205 17919 104657 1 255 . 1 1 47 47 GLY H H 47 8.130 8.130 8.481 -0.351 17919 104658 1 255 . 1 1 48 48 LYS N N 48 121.570 121.570 121.498 0.072 17919 104659 1 255 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.565 0.057 17919 104660 1 255 . 1 1 48 48 LYS C C 48 174.700 174.700 175.251 -0.551 17919 104661 1 255 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.135 -0.585 17919 104662 1 255 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.275 0.255 17919 104663 1 255 . 1 1 48 48 LYS H H 48 7.980 7.980 7.861 0.119 17919 104664 1 255 . 1 1 49 49 GLN N N 49 122.410 122.410 123.965 -1.555 17919 104665 1 255 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.642 -0.082 17919 104666 1 255 . 1 1 49 49 GLN C C 49 175.670 175.670 175.623 0.047 17919 104667 1 255 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.755 -0.015 17919 104668 1 255 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.643 -0.643 17919 104669 1 255 . 1 1 49 49 GLN H H 49 8.600 8.600 8.652 -0.052 17919 104670 1 255 . 1 1 50 50 LEU N N 50 125.520 125.520 127.853 -2.333 17919 104671 1 255 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.237 -0.147 17919 104672 1 255 . 1 1 50 50 LEU C C 50 176.660 176.660 176.458 0.202 17919 104673 1 255 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.087 0.153 17919 104674 1 255 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.836 -0.266 17919 104675 1 255 . 1 1 50 50 LEU H H 50 8.530 8.530 8.622 -0.092 17919 104676 1 255 . 1 1 51 51 GLU N N 51 122.940 122.940 123.669 -0.729 17919 104677 1 255 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.514 -0.026 17919 104678 1 255 . 1 1 51 51 GLU C C 51 175.870 175.870 176.637 -0.767 17919 104679 1 255 . 1 1 51 51 GLU CA C 51 55.960 55.960 54.372 1.588 17919 104680 1 255 . 1 1 51 51 GLU CB C 51 31.570 31.570 33.057 -1.487 17919 104681 1 255 . 1 1 51 51 GLU H H 51 8.400 8.400 8.694 -0.294 17919 104682 1 255 . 1 1 52 52 ASP N N 52 120.030 120.030 125.578 -5.548 17919 104683 1 255 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.543 -0.184 17919 104684 1 255 . 1 1 52 52 ASP C C 52 177.330 177.330 177.580 -0.250 17919 104685 1 255 . 1 1 52 52 ASP CA C 52 56.960 56.960 56.623 0.337 17919 104686 1 255 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.888 -0.038 17919 104687 1 255 . 1 1 52 52 ASP H H 52 8.160 8.160 8.854 -0.694 17919 104688 1 255 . 1 1 53 53 GLY N N 53 106.660 106.660 106.399 0.261 17919 104689 1 255 . 1 1 53 53 GLY C C 53 174.870 174.870 174.704 0.166 17919 104690 1 255 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.106 0.064 17919 104691 1 255 . 1 1 53 53 GLY H H 53 9.390 9.390 8.400 0.990 17919 104692 1 255 . 1 1 54 54 ARG N N 54 119.050 119.050 120.052 -1.002 17919 104693 1 255 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.613 0.082 17919 104694 1 255 . 1 1 54 54 ARG C C 54 175.350 175.350 175.821 -0.471 17919 104695 1 255 . 1 1 54 54 ARG CA C 54 54.390 54.390 53.742 0.648 17919 104696 1 255 . 1 1 54 54 ARG CB C 54 32.650 32.650 31.922 0.728 17919 104697 1 255 . 1 1 54 54 ARG H H 54 7.460 7.460 7.590 -0.130 17919 104698 1 255 . 1 1 55 55 THR N N 55 108.400 108.400 110.812 -2.412 17919 104699 1 255 . 1 1 55 55 THR HA H 55 5.240 5.240 5.102 0.138 17919 104700 1 255 . 1 1 55 55 THR C C 55 176.560 176.560 176.362 0.198 17919 104701 1 255 . 1 1 55 55 THR CA C 55 59.690 59.690 59.800 -0.110 17919 104702 1 255 . 1 1 55 55 THR CB C 55 72.260 72.260 71.804 0.456 17919 104703 1 255 . 1 1 55 55 THR H H 55 8.730 8.730 8.879 -0.149 17919 104704 1 255 . 1 1 56 56 LEU N N 56 117.920 117.920 121.588 -3.668 17919 104705 1 255 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.966 0.094 17919 104706 1 255 . 1 1 56 56 LEU C C 56 180.810 180.810 178.987 1.823 17919 104707 1 255 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.374 0.336 17919 104708 1 255 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.486 -1.115 17919 104709 1 255 . 1 1 56 56 LEU H H 56 8.140 8.140 8.769 -0.629 17919 104710 1 255 . 1 1 57 57 SER N N 57 113.330 113.330 114.353 -1.023 17919 104711 1 255 . 1 1 57 57 SER HA H 57 4.370 4.370 4.229 0.141 17919 104712 1 255 . 1 1 57 57 SER C C 57 178.310 178.310 177.117 1.193 17919 104713 1 255 . 1 1 57 57 SER CA C 57 61.080 61.080 61.567 -0.487 17919 104714 1 255 . 1 1 57 57 SER CB C 57 62.530 62.530 62.481 0.049 17919 104715 1 255 . 1 1 57 57 SER H H 57 8.470 8.470 8.334 0.136 17919 104716 1 255 . 1 1 58 58 ASP N N 58 124.190 124.190 124.144 0.046 17919 104717 1 255 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.269 0.027 17919 104718 1 255 . 1 1 58 58 ASP C C 58 177.400 177.400 177.592 -0.192 17919 104719 1 255 . 1 1 58 58 ASP CA C 58 57.180 57.180 57.113 0.067 17919 104720 1 255 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.467 -0.367 17919 104721 1 255 . 1 1 58 58 ASP H H 58 7.930 7.930 7.759 0.171 17919 104722 1 255 . 1 1 59 59 TYR N N 59 115.510 115.510 115.376 0.134 17919 104723 1 255 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.607 0.063 17919 104724 1 255 . 1 1 59 59 TYR C C 59 174.700 174.700 174.971 -0.271 17919 104725 1 255 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.995 0.255 17919 104726 1 255 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.610 1.460 17919 104727 1 255 . 1 1 59 59 TYR H H 59 7.250 7.250 7.560 -0.310 17919 104728 1 255 . 1 1 60 60 ASN N N 60 115.900 115.900 116.738 -0.838 17919 104729 1 255 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.407 -0.052 17919 104730 1 255 . 1 1 60 60 ASN C C 60 174.340 174.340 175.102 -0.762 17919 104731 1 255 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.278 -0.158 17919 104732 1 255 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.207 0.203 17919 104733 1 255 . 1 1 60 60 ASN H H 60 8.150 8.150 7.800 0.350 17919 104734 1 255 . 1 1 61 61 ILE N N 61 118.600 118.600 117.787 0.813 17919 104735 1 255 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.819 -0.426 17919 104736 1 255 . 1 1 61 61 ILE C C 61 174.610 174.610 175.738 -1.128 17919 104737 1 255 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.131 0.289 17919 104738 1 255 . 1 1 61 61 ILE CB C 61 36.740 36.740 38.036 -1.296 17919 104739 1 255 . 1 1 61 61 ILE H H 61 7.250 7.250 7.699 -0.449 17919 104740 1 255 . 1 1 62 62 GLN N N 62 124.740 124.740 122.872 1.868 17919 104741 1 255 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.795 -0.289 17919 104742 1 255 . 1 1 62 62 GLN C C 62 175.970 175.970 175.214 0.756 17919 104743 1 255 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.803 -0.143 17919 104744 1 255 . 1 1 62 62 GLN CB C 62 31.650 31.650 32.209 -0.559 17919 104745 1 255 . 1 1 62 62 GLN H H 62 7.610 7.610 8.072 -0.462 17919 104746 1 255 . 1 1 63 63 LYS N N 63 120.300 120.300 120.656 -0.356 17919 104747 1 255 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.126 -0.125 17919 104748 1 255 . 1 1 63 63 LYS C C 63 175.810 175.810 177.268 -1.458 17919 104749 1 255 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.485 0.305 17919 104750 1 255 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.216 0.434 17919 104751 1 255 . 1 1 63 63 LYS H H 63 8.490 8.490 8.607 -0.117 17919 104752 1 255 . 1 1 64 64 GLU N N 64 113.950 113.950 117.710 -3.760 17919 104753 1 255 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.300 0.165 17919 104754 1 255 . 1 1 64 64 GLU C C 64 175.250 175.250 176.186 -0.936 17919 104755 1 255 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.440 0.450 17919 104756 1 255 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.166 -2.266 17919 104757 1 255 . 1 1 64 64 GLU H H 64 9.280 9.280 8.393 0.887 17919 104758 1 255 . 1 1 65 65 SER N N 65 114.730 114.730 115.440 -0.710 17919 104759 1 255 . 1 1 65 65 SER HA H 65 4.640 4.640 4.433 0.207 17919 104760 1 255 . 1 1 65 65 SER C C 65 172.160 172.160 173.865 -1.705 17919 104761 1 255 . 1 1 65 65 SER CA C 65 60.890 60.890 60.414 0.476 17919 104762 1 255 . 1 1 65 65 SER CB C 65 64.910 64.910 64.027 0.883 17919 104763 1 255 . 1 1 65 65 SER H H 65 7.670 7.670 7.534 0.136 17919 104764 1 255 . 1 1 66 66 THR N N 66 117.110 117.110 119.953 -2.843 17919 104765 1 255 . 1 1 66 66 THR HA H 66 5.270 5.270 4.982 0.288 17919 104766 1 255 . 1 1 66 66 THR C C 66 173.950 173.950 173.940 0.010 17919 104767 1 255 . 1 1 66 66 THR CA C 66 62.340 62.340 62.257 0.083 17919 104768 1 255 . 1 1 66 66 THR CB C 66 70.080 70.080 70.445 -0.365 17919 104769 1 255 . 1 1 66 66 THR H H 66 8.730 8.730 8.582 0.148 17919 104770 1 255 . 1 1 67 67 LEU N N 67 127.110 127.110 127.883 -0.773 17919 104771 1 255 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.930 0.130 17919 104772 1 255 . 1 1 67 67 LEU C C 67 175.770 175.770 175.301 0.469 17919 104773 1 255 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.572 0.328 17919 104774 1 255 . 1 1 67 67 LEU CB C 67 44.260 44.260 45.218 -0.958 17919 104775 1 255 . 1 1 67 67 LEU H H 67 9.410 9.410 9.265 0.145 17919 104776 1 255 . 1 1 68 68 HIS N N 68 118.380 118.380 120.925 -2.545 17919 104777 1 255 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.366 -0.126 17919 104778 1 255 . 1 1 68 68 HIS C C 68 173.150 173.150 174.379 -1.229 17919 104779 1 255 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.863 0.137 17919 104780 1 255 . 1 1 68 68 HIS CB C 68 30.530 30.530 31.909 -1.379 17919 104781 1 255 . 1 1 68 68 HIS H H 68 9.230 9.230 8.977 0.253 17919 104782 1 255 . 1 1 69 69 LEU N N 69 124.460 124.460 126.739 -2.279 17919 104783 1 255 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.609 0.581 17919 104784 1 255 . 1 1 69 69 LEU C C 69 175.270 175.270 175.033 0.237 17919 104785 1 255 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.418 -0.528 17919 104786 1 255 . 1 1 69 69 LEU CB C 69 44.380 44.380 43.373 1.007 17919 104787 1 255 . 1 1 69 69 LEU H H 69 8.340 8.340 8.463 -0.123 17919 104788 1 255 . 1 1 70 70 VAL N N 70 126.940 126.940 126.074 0.866 17919 104789 1 255 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.400 -0.050 17919 104790 1 255 . 1 1 70 70 VAL C C 70 174.000 174.000 174.081 -0.081 17919 104791 1 255 . 1 1 70 70 VAL CA C 70 60.800 60.800 61.361 -0.561 17919 104792 1 255 . 1 1 70 70 VAL CB C 70 34.910 34.910 36.345 -1.435 17919 104793 1 255 . 1 1 70 70 VAL H H 70 9.200 9.200 8.945 0.255 17919 104794 1 255 . 1 1 71 71 LEU N N 71 123.130 123.130 123.317 -0.187 17919 104795 1 255 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.088 -0.028 17919 104796 1 255 . 1 1 71 71 LEU C C 71 177.830 177.830 176.945 0.885 17919 104797 1 255 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.080 0.860 17919 104798 1 255 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.583 -0.733 17919 104799 1 255 . 1 1 71 71 LEU H H 71 8.120 8.120 8.366 -0.246 17919 104800 1 255 . 1 1 72 72 ARG N N 72 123.490 123.490 123.289 0.201 17919 104801 1 255 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.135 0.166 17919 104802 1 255 . 1 1 72 72 ARG C C 72 175.350 175.350 175.639 -0.289 17919 104803 1 255 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.942 -1.332 17919 104804 1 255 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.706 0.644 17919 104805 1 255 . 1 1 72 72 ARG H H 72 8.580 8.580 8.307 0.273 17919 104806 1 256 . 1 1 2 2 GLN N N 2 123.220 123.220 120.598 2.622 17919 104807 1 256 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.483 -0.234 17919 104808 1 256 . 1 1 2 2 GLN C C 2 175.920 175.920 175.132 0.788 17919 104809 1 256 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.508 0.572 17919 104810 1 256 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.414 0.346 17919 104811 1 256 . 1 1 2 2 GLN H H 2 8.900 8.900 8.418 0.482 17919 104812 1 256 . 1 1 3 3 ILE N N 3 115.340 115.340 117.204 -1.864 17919 104813 1 256 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.347 -0.134 17919 104814 1 256 . 1 1 3 3 ILE C C 3 172.450 172.450 174.085 -1.635 17919 104815 1 256 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.212 0.358 17919 104816 1 256 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.769 0.441 17919 104817 1 256 . 1 1 3 3 ILE H H 3 8.320 8.320 8.425 -0.105 17919 104818 1 256 . 1 1 4 4 PHE N N 4 118.110 118.110 119.128 -1.018 17919 104819 1 256 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.582 0.048 17919 104820 1 256 . 1 1 4 4 PHE C C 4 175.320 175.320 175.378 -0.058 17919 104821 1 256 . 1 1 4 4 PHE CA C 4 55.210 55.210 54.734 0.476 17919 104822 1 256 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.160 0.320 17919 104823 1 256 . 1 1 4 4 PHE H H 4 8.610 8.610 8.889 -0.279 17919 104824 1 256 . 1 1 5 5 VAL N N 5 121.000 121.000 123.587 -2.587 17919 104825 1 256 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.888 -0.163 17919 104826 1 256 . 1 1 5 5 VAL C C 5 174.870 174.870 174.775 0.095 17919 104827 1 256 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.282 -0.662 17919 104828 1 256 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.965 0.265 17919 104829 1 256 . 1 1 5 5 VAL H H 5 9.300 9.300 9.121 0.179 17919 104830 1 256 . 1 1 6 6 LYS N N 6 127.520 127.520 129.786 -2.266 17919 104831 1 256 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.161 0.206 17919 104832 1 256 . 1 1 6 6 LYS C C 6 177.140 177.140 176.208 0.932 17919 104833 1 256 . 1 1 6 6 LYS CA C 6 54.520 54.520 53.609 0.911 17919 104834 1 256 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.845 0.205 17919 104835 1 256 . 1 1 6 6 LYS H H 6 8.820 8.820 9.075 -0.255 17919 104836 1 256 . 1 1 7 7 THR N N 7 115.400 115.400 118.837 -3.437 17919 104837 1 256 . 1 1 7 7 THR HA H 7 4.970 4.970 4.914 0.056 17919 104838 1 256 . 1 1 7 7 THR C C 7 176.910 176.910 176.764 0.146 17919 104839 1 256 . 1 1 7 7 THR CA C 7 60.470 60.470 60.519 -0.049 17919 104840 1 256 . 1 1 7 7 THR CB C 7 70.630 70.630 70.361 0.269 17919 104841 1 256 . 1 1 7 7 THR H H 7 8.730 8.730 8.830 -0.100 17919 104842 1 256 . 1 1 8 8 LEU N N 8 121.330 121.330 122.117 -0.787 17919 104843 1 256 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.050 0.260 17919 104844 1 256 . 1 1 8 8 LEU C C 8 178.800 178.800 177.566 1.234 17919 104845 1 256 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.796 -0.216 17919 104846 1 256 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.342 0.629 17919 104847 1 256 . 1 1 8 8 LEU H H 8 9.100 9.100 8.585 0.515 17919 104848 1 256 . 1 1 9 9 THR N N 9 105.590 105.590 107.040 -1.450 17919 104849 1 256 . 1 1 9 9 THR HA H 9 4.428 4.428 4.318 0.110 17919 104850 1 256 . 1 1 9 9 THR C C 9 175.520 175.520 175.638 -0.118 17919 104851 1 256 . 1 1 9 9 THR CA C 9 61.400 61.400 61.741 -0.341 17919 104852 1 256 . 1 1 9 9 THR CB C 9 69.140 69.140 68.813 0.327 17919 104853 1 256 . 1 1 9 9 THR H H 9 7.630 7.630 7.537 0.093 17919 104854 1 256 . 1 1 10 10 GLY N N 10 108.890 108.890 111.500 -2.610 17919 104855 1 256 . 1 1 10 10 GLY C C 10 174.070 174.070 173.821 0.249 17919 104856 1 256 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.176 0.284 17919 104857 1 256 . 1 1 10 10 GLY H H 10 7.810 7.810 7.800 0.010 17919 104858 1 256 . 1 1 11 11 LYS N N 11 121.600 121.600 121.477 0.123 17919 104859 1 256 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.394 -0.033 17919 104860 1 256 . 1 1 11 11 LYS C C 11 175.940 175.940 175.367 0.573 17919 104861 1 256 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.441 -0.161 17919 104862 1 256 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.669 -0.469 17919 104863 1 256 . 1 1 11 11 LYS H H 11 7.280 7.280 8.105 -0.825 17919 104864 1 256 . 1 1 12 12 THR N N 12 120.440 120.440 119.522 0.918 17919 104865 1 256 . 1 1 12 12 THR HA H 12 5.046 5.046 5.003 0.043 17919 104866 1 256 . 1 1 12 12 THR C C 12 174.320 174.320 174.017 0.303 17919 104867 1 256 . 1 1 12 12 THR CA C 12 62.390 62.390 61.806 0.584 17919 104868 1 256 . 1 1 12 12 THR CB C 12 69.910 69.910 70.224 -0.313 17919 104869 1 256 . 1 1 12 12 THR H H 12 8.650 8.650 8.269 0.381 17919 104870 1 256 . 1 1 13 13 ILE N N 13 127.110 127.110 126.511 0.599 17919 104871 1 256 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.388 0.156 17919 104872 1 256 . 1 1 13 13 ILE C C 13 175.220 175.220 174.916 0.304 17919 104873 1 256 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.135 -0.155 17919 104874 1 256 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.588 -0.638 17919 104875 1 256 . 1 1 13 13 ILE H H 13 9.450 9.450 8.787 0.663 17919 104876 1 256 . 1 1 14 14 THR N N 14 121.520 121.520 122.111 -0.591 17919 104877 1 256 . 1 1 14 14 THR HA H 14 4.964 4.964 5.329 -0.365 17919 104878 1 256 . 1 1 14 14 THR C C 14 173.790 173.790 173.569 0.221 17919 104879 1 256 . 1 1 14 14 THR CA C 14 61.940 61.940 61.860 0.080 17919 104880 1 256 . 1 1 14 14 THR CB C 14 69.650 69.650 70.017 -0.367 17919 104881 1 256 . 1 1 14 14 THR H H 14 8.710 8.710 8.573 0.137 17919 104882 1 256 . 1 1 15 15 LEU N N 15 124.800 124.800 124.643 0.157 17919 104883 1 256 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.797 -0.017 17919 104884 1 256 . 1 1 15 15 LEU C C 15 174.670 174.670 174.966 -0.296 17919 104885 1 256 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.858 -1.028 17919 104886 1 256 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.537 1.533 17919 104887 1 256 . 1 1 15 15 LEU H H 15 8.710 8.710 8.219 0.491 17919 104888 1 256 . 1 1 16 16 GLU N N 16 122.160 122.160 124.658 -2.498 17919 104889 1 256 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.946 -0.029 17919 104890 1 256 . 1 1 16 16 GLU C C 16 175.860 175.860 176.160 -0.300 17919 104891 1 256 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.419 -0.599 17919 104892 1 256 . 1 1 16 16 GLU CB C 16 29.450 29.450 29.346 0.104 17919 104893 1 256 . 1 1 16 16 GLU H H 16 8.140 8.140 8.692 -0.552 17919 104894 1 256 . 1 1 17 17 VAL N N 17 117.210 117.210 120.246 -3.036 17919 104895 1 256 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.978 -0.264 17919 104896 1 256 . 1 1 17 17 VAL C C 17 174.160 174.160 175.092 -0.932 17919 104897 1 256 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.606 -0.176 17919 104898 1 256 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.941 0.459 17919 104899 1 256 . 1 1 17 17 VAL H H 17 8.900 8.900 9.119 -0.219 17919 104900 1 256 . 1 1 18 18 GLU N N 18 118.990 118.990 121.805 -2.815 17919 104901 1 256 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.916 0.163 17919 104902 1 256 . 1 1 18 18 GLU C C 18 176.160 176.160 175.712 0.448 17919 104903 1 256 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.860 -0.140 17919 104904 1 256 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.948 -0.638 17919 104905 1 256 . 1 1 18 18 GLU H H 18 8.640 8.640 8.178 0.462 17919 104906 1 256 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.328 -0.187 17919 104907 1 256 . 1 1 19 19 PRO C C 19 175.310 175.310 176.907 -1.597 17919 104908 1 256 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.236 0.234 17919 104909 1 256 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.935 0.015 17919 104910 1 256 . 1 1 20 20 SER N N 20 103.400 103.400 109.062 -5.662 17919 104911 1 256 . 1 1 20 20 SER HA H 20 4.370 4.370 4.280 0.090 17919 104912 1 256 . 1 1 20 20 SER C C 20 174.660 174.660 174.394 0.266 17919 104913 1 256 . 1 1 20 20 SER CA C 20 57.400 57.400 58.375 -0.975 17919 104914 1 256 . 1 1 20 20 SER CB C 20 63.370 63.370 62.596 0.774 17919 104915 1 256 . 1 1 20 20 SER H H 20 7.040 7.040 8.264 -1.224 17919 104916 1 256 . 1 1 21 21 ASP N N 21 123.480 123.480 124.448 -0.968 17919 104917 1 256 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.674 0.021 17919 104918 1 256 . 1 1 21 21 ASP C C 21 176.360 176.360 176.240 0.120 17919 104919 1 256 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.209 0.491 17919 104920 1 256 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.624 -0.824 17919 104921 1 256 . 1 1 21 21 ASP H H 21 8.030 8.030 7.616 0.414 17919 104922 1 256 . 1 1 22 22 THR N N 22 108.800 108.800 114.506 -5.706 17919 104923 1 256 . 1 1 22 22 THR HA H 22 4.920 4.920 4.812 0.108 17919 104924 1 256 . 1 1 22 22 THR C C 22 176.750 176.750 176.625 0.125 17919 104925 1 256 . 1 1 22 22 THR CA C 22 59.690 59.690 60.714 -1.024 17919 104926 1 256 . 1 1 22 22 THR CB C 22 71.200 71.200 70.392 0.808 17919 104927 1 256 . 1 1 22 22 THR H H 22 7.900 7.900 8.816 -0.916 17919 104928 1 256 . 1 1 23 23 ILE N N 23 121.190 121.190 122.111 -0.921 17919 104929 1 256 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.714 -0.057 17919 104930 1 256 . 1 1 23 23 ILE C C 23 179.040 179.040 178.028 1.012 17919 104931 1 256 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.384 -1.124 17919 104932 1 256 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.035 -1.685 17919 104933 1 256 . 1 1 23 23 ILE H H 23 8.560 8.560 8.722 -0.162 17919 104934 1 256 . 1 1 24 24 GLU N N 24 120.830 120.830 120.881 -0.051 17919 104935 1 256 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.979 -0.062 17919 104936 1 256 . 1 1 24 24 GLU C C 24 178.640 178.640 178.632 0.008 17919 104937 1 256 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.827 0.393 17919 104938 1 256 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.171 -0.891 17919 104939 1 256 . 1 1 24 24 GLU H H 24 9.760 9.760 8.297 1.463 17919 104940 1 256 . 1 1 25 25 ASN N N 25 120.570 120.570 118.356 2.214 17919 104941 1 256 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.468 0.057 17919 104942 1 256 . 1 1 25 25 ASN C C 25 178.380 178.380 177.961 0.419 17919 104943 1 256 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.123 -0.063 17919 104944 1 256 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.517 -0.067 17919 104945 1 256 . 1 1 25 25 ASN H H 25 7.920 7.920 7.700 0.220 17919 104946 1 256 . 1 1 26 26 VAL N N 26 121.710 121.710 121.587 0.123 17919 104947 1 256 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.557 -0.160 17919 104948 1 256 . 1 1 26 26 VAL C C 26 177.950 177.950 177.570 0.380 17919 104949 1 256 . 1 1 26 26 VAL CA C 26 67.660 67.660 67.233 0.427 17919 104950 1 256 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.370 -0.530 17919 104951 1 256 . 1 1 26 26 VAL H H 26 8.070 8.070 8.381 -0.311 17919 104952 1 256 . 1 1 27 27 LYS N N 27 118.860 118.860 120.064 -1.204 17919 104953 1 256 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.171 0.409 17919 104954 1 256 . 1 1 27 27 LYS C C 27 180.550 180.550 178.933 1.617 17919 104955 1 256 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.889 -0.639 17919 104956 1 256 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.321 1.409 17919 104957 1 256 . 1 1 27 27 LYS H H 27 8.560 8.560 8.295 0.265 17919 104958 1 256 . 1 1 28 28 ALA N N 28 123.440 123.440 120.734 2.706 17919 104959 1 256 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.206 -0.046 17919 104960 1 256 . 1 1 28 28 ALA C C 28 180.300 180.300 179.259 1.041 17919 104961 1 256 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.566 0.804 17919 104962 1 256 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.451 -0.741 17919 104963 1 256 . 1 1 28 28 ALA H H 28 8.060 8.060 7.955 0.105 17919 104964 1 256 . 1 1 29 29 LYS N N 29 119.940 119.940 120.016 -0.076 17919 104965 1 256 . 1 1 29 29 LYS HA H 29 4.207 4.207 3.981 0.226 17919 104966 1 256 . 1 1 29 29 LYS C C 29 180.320 180.320 179.042 1.278 17919 104967 1 256 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.468 0.182 17919 104968 1 256 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.277 1.013 17919 104969 1 256 . 1 1 29 29 LYS H H 29 7.850 7.850 7.668 0.182 17919 104970 1 256 . 1 1 30 30 ILE N N 30 121.080 121.080 120.361 0.719 17919 104971 1 256 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.617 -0.110 17919 104972 1 256 . 1 1 30 30 ILE C C 30 178.310 178.310 177.507 0.803 17919 104973 1 256 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.175 0.975 17919 104974 1 256 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.636 -0.837 17919 104975 1 256 . 1 1 30 30 ILE H H 30 8.280 8.280 8.154 0.126 17919 104976 1 256 . 1 1 31 31 GLN N N 31 123.490 123.490 121.173 2.317 17919 104977 1 256 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.057 -0.228 17919 104978 1 256 . 1 1 31 31 GLN C C 31 178.890 178.890 177.682 1.208 17919 104979 1 256 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.142 0.858 17919 104980 1 256 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.670 -0.950 17919 104981 1 256 . 1 1 31 31 GLN H H 31 8.580 8.580 7.927 0.653 17919 104982 1 256 . 1 1 32 32 ASP N N 32 119.360 119.360 116.805 2.555 17919 104983 1 256 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.506 -0.152 17919 104984 1 256 . 1 1 32 32 ASP C C 32 177.250 177.250 177.922 -0.672 17919 104985 1 256 . 1 1 32 32 ASP CA C 32 57.190 57.190 55.760 1.430 17919 104986 1 256 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.899 -0.319 17919 104987 1 256 . 1 1 32 32 ASP H H 32 8.010 8.010 7.790 0.220 17919 104988 1 256 . 1 1 33 33 LYS N N 33 115.130 115.130 119.683 -4.553 17919 104989 1 256 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.317 0.020 17919 104990 1 256 . 1 1 33 33 LYS C C 33 177.870 177.870 178.053 -0.183 17919 104991 1 256 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.877 0.173 17919 104992 1 256 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.232 0.938 17919 104993 1 256 . 1 1 33 33 LYS H H 33 7.430 7.430 7.593 -0.163 17919 104994 1 256 . 1 1 34 34 GLU N N 34 113.870 113.870 115.799 -1.929 17919 104995 1 256 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.393 0.232 17919 104996 1 256 . 1 1 34 34 GLU C C 34 177.840 177.840 177.207 0.633 17919 104997 1 256 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.832 -0.662 17919 104998 1 256 . 1 1 34 34 GLU CB C 34 32.660 32.660 30.808 1.852 17919 104999 1 256 . 1 1 34 34 GLU H H 34 8.740 8.740 8.138 0.602 17919 105000 1 256 . 1 1 35 35 GLY N N 35 108.650 108.650 107.363 1.287 17919 105001 1 256 . 1 1 35 35 GLY C C 35 173.960 173.960 174.725 -0.765 17919 105002 1 256 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.333 0.747 17919 105003 1 256 . 1 1 35 35 GLY H H 35 8.530 8.530 7.824 0.706 17919 105004 1 256 . 1 1 36 36 ILE N N 36 119.880 119.880 122.847 -2.967 17919 105005 1 256 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.419 0.026 17919 105006 1 256 . 1 1 36 36 ILE C C 36 173.590 173.590 174.240 -0.650 17919 105007 1 256 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.061 -0.311 17919 105008 1 256 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.532 2.048 17919 105009 1 256 . 1 1 36 36 ILE H H 36 6.150 6.150 7.480 -1.330 17919 105010 1 256 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.917 -0.283 17919 105011 1 256 . 1 1 37 37 PRO C C 37 176.940 176.940 175.982 0.958 17919 105012 1 256 . 1 1 37 37 PRO CA C 37 61.660 61.660 60.878 0.782 17919 105013 1 256 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.395 0.455 17919 105014 1 256 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.162 -0.045 17919 105015 1 256 . 1 1 38 38 PRO C C 38 178.320 178.320 178.129 0.191 17919 105016 1 256 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.572 0.688 17919 105017 1 256 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.691 1.199 17919 105018 1 256 . 1 1 39 39 ASP N N 39 113.380 113.380 116.045 -2.665 17919 105019 1 256 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.371 0.059 17919 105020 1 256 . 1 1 39 39 ASP C C 39 177.090 177.090 177.648 -0.558 17919 105021 1 256 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.912 -1.272 17919 105022 1 256 . 1 1 39 39 ASP CB C 39 39.540 39.540 39.319 0.221 17919 105023 1 256 . 1 1 39 39 ASP H H 39 8.550 8.550 8.923 -0.373 17919 105024 1 256 . 1 1 40 40 GLN N N 40 116.780 116.780 117.941 -1.161 17919 105025 1 256 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.276 0.188 17919 105026 1 256 . 1 1 40 40 GLN C C 40 175.380 175.380 175.758 -0.378 17919 105027 1 256 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.697 -1.057 17919 105028 1 256 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.546 0.594 17919 105029 1 256 . 1 1 40 40 GLN H H 40 7.820 7.820 7.895 -0.075 17919 105030 1 256 . 1 1 41 41 GLN N N 41 117.720 117.720 118.278 -0.558 17919 105031 1 256 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.478 -0.234 17919 105032 1 256 . 1 1 41 41 GLN C C 41 176.300 176.300 175.488 0.812 17919 105033 1 256 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.881 0.589 17919 105034 1 256 . 1 1 41 41 GLN CB C 41 31.650 31.650 30.424 1.226 17919 105035 1 256 . 1 1 41 41 GLN H H 41 7.480 7.480 7.255 0.225 17919 105036 1 256 . 1 1 42 42 ARG N N 42 122.680 122.680 124.141 -1.461 17919 105037 1 256 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.666 -0.166 17919 105038 1 256 . 1 1 42 42 ARG C C 42 174.050 174.050 173.807 0.243 17919 105039 1 256 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.475 0.575 17919 105040 1 256 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.900 -2.150 17919 105041 1 256 . 1 1 42 42 ARG H H 42 8.530 8.530 8.504 0.026 17919 105042 1 256 . 1 1 43 43 LEU N N 43 124.040 124.040 127.076 -3.036 17919 105043 1 256 . 1 1 43 43 LEU C C 43 175.290 175.290 176.072 -0.782 17919 105044 1 256 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.779 -0.799 17919 105045 1 256 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.621 2.169 17919 105046 1 256 . 1 1 43 43 LEU H H 43 8.820 8.820 8.703 0.117 17919 105047 1 256 . 1 1 44 44 ILE N N 44 121.920 121.920 116.848 5.072 17919 105048 1 256 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.910 0.083 17919 105049 1 256 . 1 1 44 44 ILE C C 44 176.060 176.060 173.652 2.408 17919 105050 1 256 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.318 -0.338 17919 105051 1 256 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.912 -0.492 17919 105052 1 256 . 1 1 44 44 ILE H H 44 9.030 9.030 8.962 0.068 17919 105053 1 256 . 1 1 45 45 PHE N N 45 125.390 125.390 126.387 -0.997 17919 105054 1 256 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.084 -0.039 17919 105055 1 256 . 1 1 45 45 PHE C C 45 174.470 174.470 175.013 -0.543 17919 105056 1 256 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.246 0.774 17919 105057 1 256 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.445 1.315 17919 105058 1 256 . 1 1 45 45 PHE H H 45 8.830 8.830 8.271 0.559 17919 105059 1 256 . 1 1 46 46 ALA N N 46 132.200 132.200 130.174 2.026 17919 105060 1 256 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.678 0.012 17919 105061 1 256 . 1 1 46 46 ALA C C 46 177.290 177.290 177.292 -0.002 17919 105062 1 256 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.159 0.381 17919 105063 1 256 . 1 1 46 46 ALA CB C 46 16.570 16.570 15.937 0.633 17919 105064 1 256 . 1 1 46 46 ALA H H 46 8.810 8.810 8.791 0.019 17919 105065 1 256 . 1 1 47 47 GLY N N 47 102.340 102.340 104.026 -1.686 17919 105066 1 256 . 1 1 47 47 GLY C C 47 173.810 173.810 174.133 -0.323 17919 105067 1 256 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.336 0.014 17919 105068 1 256 . 1 1 47 47 GLY H H 47 8.130 8.130 8.502 -0.372 17919 105069 1 256 . 1 1 48 48 LYS N N 48 121.570 121.570 120.267 1.303 17919 105070 1 256 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.541 0.081 17919 105071 1 256 . 1 1 48 48 LYS C C 48 174.700 174.700 175.413 -0.713 17919 105072 1 256 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.639 -0.089 17919 105073 1 256 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.148 0.382 17919 105074 1 256 . 1 1 48 48 LYS H H 48 7.980 7.980 7.953 0.027 17919 105075 1 256 . 1 1 49 49 GLN N N 49 122.410 122.410 126.277 -3.867 17919 105076 1 256 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.149 0.411 17919 105077 1 256 . 1 1 49 49 GLN C C 49 175.670 175.670 175.746 -0.076 17919 105078 1 256 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.735 0.005 17919 105079 1 256 . 1 1 49 49 GLN CB C 49 29.000 29.000 28.393 0.607 17919 105080 1 256 . 1 1 49 49 GLN H H 49 8.600 8.600 8.625 -0.025 17919 105081 1 256 . 1 1 50 50 LEU N N 50 125.520 125.520 127.438 -1.918 17919 105082 1 256 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.241 -0.151 17919 105083 1 256 . 1 1 50 50 LEU C C 50 176.660 176.660 177.382 -0.722 17919 105084 1 256 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.646 -0.406 17919 105085 1 256 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.809 -0.239 17919 105086 1 256 . 1 1 50 50 LEU H H 50 8.530 8.530 8.102 0.428 17919 105087 1 256 . 1 1 51 51 GLU N N 51 122.940 122.940 124.892 -1.952 17919 105088 1 256 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.412 0.076 17919 105089 1 256 . 1 1 51 51 GLU C C 51 175.870 175.870 176.753 -0.883 17919 105090 1 256 . 1 1 51 51 GLU CA C 51 55.960 55.960 56.050 -0.090 17919 105091 1 256 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.076 0.494 17919 105092 1 256 . 1 1 51 51 GLU H H 51 8.400 8.400 8.637 -0.237 17919 105093 1 256 . 1 1 52 52 ASP N N 52 120.030 120.030 128.020 -7.990 17919 105094 1 256 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.512 -0.153 17919 105095 1 256 . 1 1 52 52 ASP C C 52 177.330 177.330 177.084 0.246 17919 105096 1 256 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.087 -0.126 17919 105097 1 256 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.743 0.107 17919 105098 1 256 . 1 1 52 52 ASP H H 52 8.160 8.160 8.846 -0.686 17919 105099 1 256 . 1 1 53 53 GLY N N 53 106.660 106.660 105.399 1.261 17919 105100 1 256 . 1 1 53 53 GLY C C 53 174.870 174.870 174.129 0.741 17919 105101 1 256 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.785 0.385 17919 105102 1 256 . 1 1 53 53 GLY H H 53 9.390 9.390 8.425 0.965 17919 105103 1 256 . 1 1 54 54 ARG N N 54 119.050 119.050 121.151 -2.101 17919 105104 1 256 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.661 0.034 17919 105105 1 256 . 1 1 54 54 ARG C C 54 175.350 175.350 175.233 0.117 17919 105106 1 256 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.785 -0.395 17919 105107 1 256 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.437 -0.787 17919 105108 1 256 . 1 1 54 54 ARG H H 54 7.460 7.460 7.446 0.014 17919 105109 1 256 . 1 1 55 55 THR N N 55 108.400 108.400 111.491 -3.091 17919 105110 1 256 . 1 1 55 55 THR HA H 55 5.240 5.240 5.376 -0.136 17919 105111 1 256 . 1 1 55 55 THR C C 55 176.560 176.560 176.033 0.527 17919 105112 1 256 . 1 1 55 55 THR CA C 55 59.690 59.690 59.440 0.251 17919 105113 1 256 . 1 1 55 55 THR CB C 55 72.260 72.260 71.881 0.379 17919 105114 1 256 . 1 1 55 55 THR H H 55 8.730 8.730 9.110 -0.380 17919 105115 1 256 . 1 1 56 56 LEU N N 56 117.920 117.920 121.184 -3.264 17919 105116 1 256 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.119 -0.059 17919 105117 1 256 . 1 1 56 56 LEU C C 56 180.810 180.810 178.915 1.895 17919 105118 1 256 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.320 0.390 17919 105119 1 256 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.639 -1.269 17919 105120 1 256 . 1 1 56 56 LEU H H 56 8.140 8.140 8.370 -0.230 17919 105121 1 256 . 1 1 57 57 SER N N 57 113.330 113.330 114.552 -1.222 17919 105122 1 256 . 1 1 57 57 SER HA H 57 4.370 4.370 4.143 0.227 17919 105123 1 256 . 1 1 57 57 SER C C 57 178.310 178.310 176.998 1.312 17919 105124 1 256 . 1 1 57 57 SER CA C 57 61.080 61.080 61.341 -0.261 17919 105125 1 256 . 1 1 57 57 SER CB C 57 62.530 62.530 62.670 -0.140 17919 105126 1 256 . 1 1 57 57 SER H H 57 8.470 8.470 8.365 0.105 17919 105127 1 256 . 1 1 58 58 ASP N N 58 124.190 124.190 123.657 0.533 17919 105128 1 256 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.286 0.010 17919 105129 1 256 . 1 1 58 58 ASP C C 58 177.400 177.400 177.129 0.271 17919 105130 1 256 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.657 0.522 17919 105131 1 256 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.326 -0.226 17919 105132 1 256 . 1 1 58 58 ASP H H 58 7.930 7.930 7.815 0.115 17919 105133 1 256 . 1 1 59 59 TYR N N 59 115.510 115.510 115.393 0.117 17919 105134 1 256 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.554 0.116 17919 105135 1 256 . 1 1 59 59 TYR C C 59 174.700 174.700 175.145 -0.445 17919 105136 1 256 . 1 1 59 59 TYR CA C 59 58.250 58.250 56.790 1.460 17919 105137 1 256 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.097 1.973 17919 105138 1 256 . 1 1 59 59 TYR H H 59 7.250 7.250 7.094 0.156 17919 105139 1 256 . 1 1 60 60 ASN N N 60 115.900 115.900 117.662 -1.762 17919 105140 1 256 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.370 -0.015 17919 105141 1 256 . 1 1 60 60 ASN C C 60 174.340 174.340 174.378 -0.038 17919 105142 1 256 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.464 -0.344 17919 105143 1 256 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.503 -0.093 17919 105144 1 256 . 1 1 60 60 ASN H H 60 8.150 8.150 7.557 0.593 17919 105145 1 256 . 1 1 61 61 ILE N N 61 118.600 118.600 120.041 -1.441 17919 105146 1 256 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.923 -0.530 17919 105147 1 256 . 1 1 61 61 ILE C C 61 174.610 174.610 175.236 -0.626 17919 105148 1 256 . 1 1 61 61 ILE CA C 61 62.420 62.420 60.375 2.045 17919 105149 1 256 . 1 1 61 61 ILE CB C 61 36.740 36.740 36.858 -0.118 17919 105150 1 256 . 1 1 61 61 ILE H H 61 7.250 7.250 7.780 -0.530 17919 105151 1 256 . 1 1 62 62 GLN N N 62 124.740 124.740 126.641 -1.901 17919 105152 1 256 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.673 -0.167 17919 105153 1 256 . 1 1 62 62 GLN C C 62 175.970 175.970 175.964 0.006 17919 105154 1 256 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.175 0.485 17919 105155 1 256 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.201 0.449 17919 105156 1 256 . 1 1 62 62 GLN H H 62 7.610 7.610 8.140 -0.530 17919 105157 1 256 . 1 1 63 63 LYS N N 63 120.300 120.300 120.204 0.096 17919 105158 1 256 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.147 -0.146 17919 105159 1 256 . 1 1 63 63 LYS C C 63 175.810 175.810 176.920 -1.110 17919 105160 1 256 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.300 0.490 17919 105161 1 256 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.280 0.370 17919 105162 1 256 . 1 1 63 63 LYS H H 63 8.490 8.490 8.610 -0.120 17919 105163 1 256 . 1 1 64 64 GLU N N 64 113.950 113.950 117.631 -3.681 17919 105164 1 256 . 1 1 64 64 GLU HA H 64 3.465 3.465 2.903 0.562 17919 105165 1 256 . 1 1 64 64 GLU C C 64 175.250 175.250 175.740 -0.490 17919 105166 1 256 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.673 0.217 17919 105167 1 256 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.866 -2.966 17919 105168 1 256 . 1 1 64 64 GLU H H 64 9.280 9.280 8.469 0.811 17919 105169 1 256 . 1 1 65 65 SER N N 65 114.730 114.730 115.564 -0.834 17919 105170 1 256 . 1 1 65 65 SER HA H 65 4.640 4.640 4.432 0.208 17919 105171 1 256 . 1 1 65 65 SER C C 65 172.160 172.160 173.455 -1.295 17919 105172 1 256 . 1 1 65 65 SER CA C 65 60.890 60.890 59.959 0.931 17919 105173 1 256 . 1 1 65 65 SER CB C 65 64.910 64.910 64.415 0.495 17919 105174 1 256 . 1 1 65 65 SER H H 65 7.670 7.670 7.262 0.408 17919 105175 1 256 . 1 1 66 66 THR N N 66 117.110 117.110 120.350 -3.240 17919 105176 1 256 . 1 1 66 66 THR HA H 66 5.270 5.270 5.020 0.250 17919 105177 1 256 . 1 1 66 66 THR C C 66 173.950 173.950 174.261 -0.311 17919 105178 1 256 . 1 1 66 66 THR CA C 66 62.340 62.340 62.077 0.263 17919 105179 1 256 . 1 1 66 66 THR CB C 66 70.080 70.080 70.388 -0.307 17919 105180 1 256 . 1 1 66 66 THR H H 66 8.730 8.730 8.613 0.117 17919 105181 1 256 . 1 1 67 67 LEU N N 67 127.110 127.110 127.008 0.102 17919 105182 1 256 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.967 0.093 17919 105183 1 256 . 1 1 67 67 LEU C C 67 175.770 175.770 175.550 0.220 17919 105184 1 256 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.203 -0.303 17919 105185 1 256 . 1 1 67 67 LEU CB C 67 44.260 44.260 45.293 -1.033 17919 105186 1 256 . 1 1 67 67 LEU H H 67 9.410 9.410 9.201 0.209 17919 105187 1 256 . 1 1 68 68 HIS N N 68 118.380 118.380 119.758 -1.378 17919 105188 1 256 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.531 -0.291 17919 105189 1 256 . 1 1 68 68 HIS C C 68 173.150 173.150 174.730 -1.580 17919 105190 1 256 . 1 1 68 68 HIS CA C 68 55.000 55.000 55.223 -0.223 17919 105191 1 256 . 1 1 68 68 HIS CB C 68 30.530 30.530 31.154 -0.624 17919 105192 1 256 . 1 1 68 68 HIS H H 68 9.230 9.230 9.502 -0.272 17919 105193 1 256 . 1 1 69 69 LEU N N 69 124.460 124.460 126.315 -1.855 17919 105194 1 256 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.160 0.030 17919 105195 1 256 . 1 1 69 69 LEU C C 69 175.270 175.270 174.807 0.463 17919 105196 1 256 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.109 -0.219 17919 105197 1 256 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.047 0.333 17919 105198 1 256 . 1 1 69 69 LEU H H 69 8.340 8.340 8.893 -0.553 17919 105199 1 256 . 1 1 70 70 VAL N N 70 126.940 126.940 126.162 0.778 17919 105200 1 256 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.358 -0.008 17919 105201 1 256 . 1 1 70 70 VAL C C 70 174.000 174.000 174.837 -0.837 17919 105202 1 256 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.618 0.182 17919 105203 1 256 . 1 1 70 70 VAL CB C 70 34.910 34.910 34.881 0.029 17919 105204 1 256 . 1 1 70 70 VAL H H 70 9.200 9.200 9.049 0.151 17919 105205 1 256 . 1 1 71 71 LEU N N 71 123.130 123.130 126.630 -3.500 17919 105206 1 256 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.798 0.262 17919 105207 1 256 . 1 1 71 71 LEU C C 71 177.830 177.830 177.274 0.556 17919 105208 1 256 . 1 1 71 71 LEU CA C 71 53.940 53.940 55.267 -1.327 17919 105209 1 256 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.411 0.439 17919 105210 1 256 . 1 1 71 71 LEU H H 71 8.120 8.120 8.528 -0.408 17919 105211 1 256 . 1 1 72 72 ARG N N 72 123.490 123.490 124.839 -1.349 17919 105212 1 256 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.449 -0.148 17919 105213 1 256 . 1 1 72 72 ARG C C 72 175.350 175.350 175.180 0.170 17919 105214 1 256 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.647 -0.037 17919 105215 1 256 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.607 0.743 17919 105216 1 256 . 1 1 72 72 ARG H H 72 8.580 8.580 8.794 -0.214 17919 105217 1 257 . 1 1 2 2 GLN N N 2 123.220 123.220 122.546 0.674 17919 105218 1 257 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.264 -0.015 17919 105219 1 257 . 1 1 2 2 GLN C C 2 175.920 175.920 174.959 0.961 17919 105220 1 257 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.765 0.315 17919 105221 1 257 . 1 1 2 2 GLN CB C 2 30.760 30.760 31.082 -0.322 17919 105222 1 257 . 1 1 2 2 GLN H H 2 8.900 8.900 8.443 0.457 17919 105223 1 257 . 1 1 3 3 ILE N N 3 115.340 115.340 117.217 -1.877 17919 105224 1 257 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.743 -0.530 17919 105225 1 257 . 1 1 3 3 ILE C C 3 172.450 172.450 173.292 -0.842 17919 105226 1 257 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.384 0.186 17919 105227 1 257 . 1 1 3 3 ILE CB C 3 42.210 42.210 42.120 0.090 17919 105228 1 257 . 1 1 3 3 ILE H H 3 8.320 8.320 8.599 -0.279 17919 105229 1 257 . 1 1 4 4 PHE N N 4 118.110 118.110 118.919 -0.809 17919 105230 1 257 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.563 0.067 17919 105231 1 257 . 1 1 4 4 PHE C C 4 175.320 175.320 175.500 -0.180 17919 105232 1 257 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.820 -0.610 17919 105233 1 257 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.947 -0.466 17919 105234 1 257 . 1 1 4 4 PHE H H 4 8.610 8.610 8.949 -0.339 17919 105235 1 257 . 1 1 5 5 VAL N N 5 121.000 121.000 122.030 -1.030 17919 105236 1 257 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.707 0.018 17919 105237 1 257 . 1 1 5 5 VAL C C 5 174.870 174.870 174.724 0.146 17919 105238 1 257 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.555 -0.935 17919 105239 1 257 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.751 0.479 17919 105240 1 257 . 1 1 5 5 VAL H H 5 9.300 9.300 9.072 0.228 17919 105241 1 257 . 1 1 6 6 LYS N N 6 127.520 127.520 128.518 -0.998 17919 105242 1 257 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.323 0.044 17919 105243 1 257 . 1 1 6 6 LYS C C 6 177.140 177.140 175.947 1.193 17919 105244 1 257 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.190 0.330 17919 105245 1 257 . 1 1 6 6 LYS CB C 6 35.050 35.050 36.269 -1.219 17919 105246 1 257 . 1 1 6 6 LYS H H 6 8.820 8.820 9.213 -0.393 17919 105247 1 257 . 1 1 7 7 THR N N 7 115.400 115.400 117.444 -2.044 17919 105248 1 257 . 1 1 7 7 THR HA H 7 4.970 4.970 4.613 0.357 17919 105249 1 257 . 1 1 7 7 THR C C 7 176.910 176.910 176.204 0.706 17919 105250 1 257 . 1 1 7 7 THR CA C 7 60.470 60.470 60.721 -0.251 17919 105251 1 257 . 1 1 7 7 THR CB C 7 70.630 70.630 70.449 0.181 17919 105252 1 257 . 1 1 7 7 THR H H 7 8.730 8.730 8.889 -0.159 17919 105253 1 257 . 1 1 8 8 LEU N N 8 121.330 121.330 122.436 -1.106 17919 105254 1 257 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.197 0.113 17919 105255 1 257 . 1 1 8 8 LEU C C 8 178.800 178.800 177.247 1.553 17919 105256 1 257 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.818 -0.238 17919 105257 1 257 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.980 -0.010 17919 105258 1 257 . 1 1 8 8 LEU H H 8 9.100 9.100 8.563 0.537 17919 105259 1 257 . 1 1 9 9 THR N N 9 105.590 105.590 110.013 -4.423 17919 105260 1 257 . 1 1 9 9 THR HA H 9 4.428 4.428 4.336 0.092 17919 105261 1 257 . 1 1 9 9 THR C C 9 175.520 175.520 175.412 0.108 17919 105262 1 257 . 1 1 9 9 THR CA C 9 61.400 61.400 61.496 -0.096 17919 105263 1 257 . 1 1 9 9 THR CB C 9 69.140 69.140 69.114 0.026 17919 105264 1 257 . 1 1 9 9 THR H H 9 7.630 7.630 7.563 0.067 17919 105265 1 257 . 1 1 10 10 GLY N N 10 108.890 108.890 110.556 -1.666 17919 105266 1 257 . 1 1 10 10 GLY C C 10 174.070 174.070 173.762 0.308 17919 105267 1 257 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.012 0.448 17919 105268 1 257 . 1 1 10 10 GLY H H 10 7.810 7.810 7.794 0.016 17919 105269 1 257 . 1 1 11 11 LYS N N 11 121.600 121.600 121.459 0.141 17919 105270 1 257 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.424 -0.063 17919 105271 1 257 . 1 1 11 11 LYS C C 11 175.940 175.940 175.725 0.215 17919 105272 1 257 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.188 0.091 17919 105273 1 257 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.520 -0.320 17919 105274 1 257 . 1 1 11 11 LYS H H 11 7.280 7.280 7.921 -0.641 17919 105275 1 257 . 1 1 12 12 THR N N 12 120.440 120.440 122.195 -1.755 17919 105276 1 257 . 1 1 12 12 THR HA H 12 5.046 5.046 4.629 0.417 17919 105277 1 257 . 1 1 12 12 THR C C 12 174.320 174.320 173.995 0.325 17919 105278 1 257 . 1 1 12 12 THR CA C 12 62.390 62.390 62.188 0.202 17919 105279 1 257 . 1 1 12 12 THR CB C 12 69.910 69.910 69.504 0.406 17919 105280 1 257 . 1 1 12 12 THR H H 12 8.650 8.650 8.398 0.252 17919 105281 1 257 . 1 1 13 13 ILE N N 13 127.110 127.110 127.388 -0.278 17919 105282 1 257 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.490 0.054 17919 105283 1 257 . 1 1 13 13 ILE C C 13 175.220 175.220 175.295 -0.075 17919 105284 1 257 . 1 1 13 13 ILE CA C 13 59.980 59.980 58.876 1.105 17919 105285 1 257 . 1 1 13 13 ILE CB C 13 40.950 40.950 39.988 0.962 17919 105286 1 257 . 1 1 13 13 ILE H H 13 9.450 9.450 9.038 0.412 17919 105287 1 257 . 1 1 14 14 THR N N 14 121.520 121.520 122.545 -1.025 17919 105288 1 257 . 1 1 14 14 THR HA H 14 4.964 4.964 4.653 0.311 17919 105289 1 257 . 1 1 14 14 THR C C 14 173.790 173.790 173.676 0.114 17919 105290 1 257 . 1 1 14 14 THR CA C 14 61.940 61.940 62.184 -0.244 17919 105291 1 257 . 1 1 14 14 THR CB C 14 69.650 69.650 69.863 -0.213 17919 105292 1 257 . 1 1 14 14 THR H H 14 8.710 8.710 8.514 0.196 17919 105293 1 257 . 1 1 15 15 LEU N N 15 124.800 124.800 127.954 -3.154 17919 105294 1 257 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.708 0.072 17919 105295 1 257 . 1 1 15 15 LEU C C 15 174.670 174.670 174.652 0.018 17919 105296 1 257 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.798 -0.968 17919 105297 1 257 . 1 1 15 15 LEU CB C 15 47.070 47.070 46.185 0.885 17919 105298 1 257 . 1 1 15 15 LEU H H 15 8.710 8.710 8.855 -0.145 17919 105299 1 257 . 1 1 16 16 GLU N N 16 122.160 122.160 123.338 -1.178 17919 105300 1 257 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.340 -0.423 17919 105301 1 257 . 1 1 16 16 GLU C C 16 175.860 175.860 175.320 0.540 17919 105302 1 257 . 1 1 16 16 GLU CA C 16 54.820 54.820 54.918 -0.098 17919 105303 1 257 . 1 1 16 16 GLU CB C 16 29.450 29.450 31.727 -2.277 17919 105304 1 257 . 1 1 16 16 GLU H H 16 8.140 8.140 8.577 -0.437 17919 105305 1 257 . 1 1 17 17 VAL N N 17 117.210 117.210 119.160 -1.950 17919 105306 1 257 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.945 -0.231 17919 105307 1 257 . 1 1 17 17 VAL C C 17 174.160 174.160 174.316 -0.156 17919 105308 1 257 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.959 -0.529 17919 105309 1 257 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.573 0.827 17919 105310 1 257 . 1 1 17 17 VAL H H 17 8.900 8.900 8.853 0.047 17919 105311 1 257 . 1 1 18 18 GLU N N 18 118.990 118.990 119.994 -1.004 17919 105312 1 257 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.880 0.199 17919 105313 1 257 . 1 1 18 18 GLU C C 18 176.160 176.160 175.268 0.892 17919 105314 1 257 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.627 0.093 17919 105315 1 257 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.761 -0.451 17919 105316 1 257 . 1 1 18 18 GLU H H 18 8.640 8.640 9.168 -0.528 17919 105317 1 257 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.274 -0.133 17919 105318 1 257 . 1 1 19 19 PRO C C 19 175.310 175.310 177.831 -2.521 17919 105319 1 257 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.482 -0.012 17919 105320 1 257 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.044 -0.094 17919 105321 1 257 . 1 1 20 20 SER N N 20 103.400 103.400 109.974 -6.574 17919 105322 1 257 . 1 1 20 20 SER HA H 20 4.370 4.370 4.330 0.040 17919 105323 1 257 . 1 1 20 20 SER C C 20 174.660 174.660 173.873 0.787 17919 105324 1 257 . 1 1 20 20 SER CA C 20 57.400 57.400 58.632 -1.232 17919 105325 1 257 . 1 1 20 20 SER CB C 20 63.370 63.370 63.352 0.018 17919 105326 1 257 . 1 1 20 20 SER H H 20 7.040 7.040 7.933 -0.893 17919 105327 1 257 . 1 1 21 21 ASP N N 21 123.480 123.480 122.405 1.075 17919 105328 1 257 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.844 -0.149 17919 105329 1 257 . 1 1 21 21 ASP C C 21 176.360 176.360 175.679 0.681 17919 105330 1 257 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.347 1.353 17919 105331 1 257 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.839 -1.039 17919 105332 1 257 . 1 1 21 21 ASP H H 21 8.030 8.030 7.836 0.194 17919 105333 1 257 . 1 1 22 22 THR N N 22 108.800 108.800 112.987 -4.187 17919 105334 1 257 . 1 1 22 22 THR HA H 22 4.920 4.920 4.705 0.215 17919 105335 1 257 . 1 1 22 22 THR C C 22 176.750 176.750 176.012 0.738 17919 105336 1 257 . 1 1 22 22 THR CA C 22 59.690 59.690 61.322 -1.632 17919 105337 1 257 . 1 1 22 22 THR CB C 22 71.200 71.200 70.742 0.458 17919 105338 1 257 . 1 1 22 22 THR H H 22 7.900 7.900 8.355 -0.455 17919 105339 1 257 . 1 1 23 23 ILE N N 23 121.190 121.190 122.680 -1.490 17919 105340 1 257 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.742 -0.085 17919 105341 1 257 . 1 1 23 23 ILE C C 23 179.040 179.040 177.621 1.419 17919 105342 1 257 . 1 1 23 23 ILE CA C 23 62.260 62.260 61.682 0.578 17919 105343 1 257 . 1 1 23 23 ILE CB C 23 34.350 34.350 35.887 -1.537 17919 105344 1 257 . 1 1 23 23 ILE H H 23 8.560 8.560 8.725 -0.165 17919 105345 1 257 . 1 1 24 24 GLU N N 24 120.830 120.830 121.017 -0.187 17919 105346 1 257 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.853 0.064 17919 105347 1 257 . 1 1 24 24 GLU C C 24 178.640 178.640 178.319 0.321 17919 105348 1 257 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.171 0.049 17919 105349 1 257 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.414 -1.134 17919 105350 1 257 . 1 1 24 24 GLU H H 24 9.760 9.760 8.455 1.305 17919 105351 1 257 . 1 1 25 25 ASN N N 25 120.570 120.570 117.804 2.766 17919 105352 1 257 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.479 0.046 17919 105353 1 257 . 1 1 25 25 ASN C C 25 178.380 178.380 177.837 0.543 17919 105354 1 257 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.022 0.038 17919 105355 1 257 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.556 -0.106 17919 105356 1 257 . 1 1 25 25 ASN H H 25 7.920 7.920 7.539 0.381 17919 105357 1 257 . 1 1 26 26 VAL N N 26 121.710 121.710 120.889 0.821 17919 105358 1 257 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.551 -0.154 17919 105359 1 257 . 1 1 26 26 VAL C C 26 177.950 177.950 177.676 0.274 17919 105360 1 257 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.703 0.957 17919 105361 1 257 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.726 -0.886 17919 105362 1 257 . 1 1 26 26 VAL H H 26 8.070 8.070 7.691 0.379 17919 105363 1 257 . 1 1 27 27 LYS N N 27 118.860 118.860 119.553 -0.693 17919 105364 1 257 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.303 0.277 17919 105365 1 257 . 1 1 27 27 LYS C C 27 180.550 180.550 179.135 1.415 17919 105366 1 257 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.242 0.008 17919 105367 1 257 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.468 1.262 17919 105368 1 257 . 1 1 27 27 LYS H H 27 8.560 8.560 8.227 0.333 17919 105369 1 257 . 1 1 28 28 ALA N N 28 123.440 123.440 122.642 0.798 17919 105370 1 257 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.195 -0.035 17919 105371 1 257 . 1 1 28 28 ALA C C 28 180.300 180.300 179.288 1.012 17919 105372 1 257 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.818 0.552 17919 105373 1 257 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.456 -0.746 17919 105374 1 257 . 1 1 28 28 ALA H H 28 8.060 8.060 8.526 -0.466 17919 105375 1 257 . 1 1 29 29 LYS N N 29 119.940 119.940 119.184 0.756 17919 105376 1 257 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.090 0.117 17919 105377 1 257 . 1 1 29 29 LYS C C 29 180.320 180.320 179.133 1.187 17919 105378 1 257 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.198 0.452 17919 105379 1 257 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.407 0.883 17919 105380 1 257 . 1 1 29 29 LYS H H 29 7.850 7.850 7.674 0.176 17919 105381 1 257 . 1 1 30 30 ILE N N 30 121.080 121.080 120.144 0.936 17919 105382 1 257 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.827 -0.320 17919 105383 1 257 . 1 1 30 30 ILE C C 30 178.310 178.310 177.294 1.016 17919 105384 1 257 . 1 1 30 30 ILE CA C 30 66.150 66.150 63.234 2.916 17919 105385 1 257 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.109 -0.309 17919 105386 1 257 . 1 1 30 30 ILE H H 30 8.280 8.280 8.057 0.223 17919 105387 1 257 . 1 1 31 31 GLN N N 31 123.490 123.490 120.855 2.635 17919 105388 1 257 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.977 -0.148 17919 105389 1 257 . 1 1 31 31 GLN C C 31 178.890 178.890 178.565 0.325 17919 105390 1 257 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.107 0.893 17919 105391 1 257 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.450 -0.730 17919 105392 1 257 . 1 1 31 31 GLN H H 31 8.580 8.580 8.115 0.465 17919 105393 1 257 . 1 1 32 32 ASP N N 32 119.360 119.360 120.396 -1.036 17919 105394 1 257 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.376 -0.022 17919 105395 1 257 . 1 1 32 32 ASP C C 32 177.250 177.250 177.710 -0.460 17919 105396 1 257 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.965 0.225 17919 105397 1 257 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.835 -0.255 17919 105398 1 257 . 1 1 32 32 ASP H H 32 8.010 8.010 7.977 0.033 17919 105399 1 257 . 1 1 33 33 LYS N N 33 115.130 115.130 116.542 -1.412 17919 105400 1 257 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.301 0.036 17919 105401 1 257 . 1 1 33 33 LYS C C 33 177.870 177.870 177.992 -0.122 17919 105402 1 257 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.418 -0.368 17919 105403 1 257 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.515 0.655 17919 105404 1 257 . 1 1 33 33 LYS H H 33 7.430 7.430 7.311 0.119 17919 105405 1 257 . 1 1 34 34 GLU N N 34 113.870 113.870 114.797 -0.927 17919 105406 1 257 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.452 0.173 17919 105407 1 257 . 1 1 34 34 GLU C C 34 177.840 177.840 177.203 0.637 17919 105408 1 257 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.794 -0.624 17919 105409 1 257 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.295 1.365 17919 105410 1 257 . 1 1 34 34 GLU H H 34 8.740 8.740 8.338 0.402 17919 105411 1 257 . 1 1 35 35 GLY N N 35 108.650 108.650 109.486 -0.836 17919 105412 1 257 . 1 1 35 35 GLY C C 35 173.960 173.960 174.230 -0.270 17919 105413 1 257 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.880 0.200 17919 105414 1 257 . 1 1 35 35 GLY H H 35 8.530 8.530 7.915 0.615 17919 105415 1 257 . 1 1 36 36 ILE N N 36 119.880 119.880 121.567 -1.687 17919 105416 1 257 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.383 0.062 17919 105417 1 257 . 1 1 36 36 ILE C C 36 173.590 173.590 174.488 -0.898 17919 105418 1 257 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.794 -0.044 17919 105419 1 257 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.857 1.723 17919 105420 1 257 . 1 1 36 36 ILE H H 36 6.150 6.150 7.720 -1.570 17919 105421 1 257 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.658 -0.024 17919 105422 1 257 . 1 1 37 37 PRO C C 37 176.940 176.940 176.001 0.939 17919 105423 1 257 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.223 0.437 17919 105424 1 257 . 1 1 37 37 PRO CB C 37 31.850 31.850 30.952 0.898 17919 105425 1 257 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.143 -0.026 17919 105426 1 257 . 1 1 38 38 PRO C C 38 178.320 178.320 178.738 -0.418 17919 105427 1 257 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.802 0.458 17919 105428 1 257 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.816 1.074 17919 105429 1 257 . 1 1 39 39 ASP N N 39 113.380 113.380 116.109 -2.729 17919 105430 1 257 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.360 0.070 17919 105431 1 257 . 1 1 39 39 ASP C C 39 177.090 177.090 177.389 -0.299 17919 105432 1 257 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.754 -1.114 17919 105433 1 257 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.331 -0.791 17919 105434 1 257 . 1 1 39 39 ASP H H 39 8.550 8.550 8.605 -0.055 17919 105435 1 257 . 1 1 40 40 GLN N N 40 116.780 116.780 115.351 1.429 17919 105436 1 257 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.440 0.024 17919 105437 1 257 . 1 1 40 40 GLN C C 40 175.380 175.380 176.072 -0.692 17919 105438 1 257 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.077 0.563 17919 105439 1 257 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.310 0.830 17919 105440 1 257 . 1 1 40 40 GLN H H 40 7.820 7.820 7.877 -0.057 17919 105441 1 257 . 1 1 41 41 GLN N N 41 117.720 117.720 120.356 -2.636 17919 105442 1 257 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.466 -0.222 17919 105443 1 257 . 1 1 41 41 GLN C C 41 176.300 176.300 174.784 1.516 17919 105444 1 257 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.047 0.423 17919 105445 1 257 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.711 1.939 17919 105446 1 257 . 1 1 41 41 GLN H H 41 7.480 7.480 7.504 -0.024 17919 105447 1 257 . 1 1 42 42 ARG N N 42 122.680 122.680 126.062 -3.382 17919 105448 1 257 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.643 -0.143 17919 105449 1 257 . 1 1 42 42 ARG C C 42 174.050 174.050 173.840 0.210 17919 105450 1 257 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.102 -0.052 17919 105451 1 257 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.722 -0.972 17919 105452 1 257 . 1 1 42 42 ARG H H 42 8.530 8.530 8.752 -0.222 17919 105453 1 257 . 1 1 43 43 LEU N N 43 124.040 124.040 127.819 -3.779 17919 105454 1 257 . 1 1 43 43 LEU C C 43 175.290 175.290 175.787 -0.497 17919 105455 1 257 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.297 -0.318 17919 105456 1 257 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.270 1.520 17919 105457 1 257 . 1 1 43 43 LEU H H 43 8.820 8.820 8.838 -0.018 17919 105458 1 257 . 1 1 44 44 ILE N N 44 121.920 121.920 117.504 4.416 17919 105459 1 257 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.317 -0.325 17919 105460 1 257 . 1 1 44 44 ILE C C 44 176.060 176.060 173.712 2.348 17919 105461 1 257 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.193 -0.213 17919 105462 1 257 . 1 1 44 44 ILE CB C 44 41.420 41.420 42.427 -1.007 17919 105463 1 257 . 1 1 44 44 ILE H H 44 9.030 9.030 8.823 0.207 17919 105464 1 257 . 1 1 45 45 PHE N N 45 125.390 125.390 126.037 -0.647 17919 105465 1 257 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.869 0.176 17919 105466 1 257 . 1 1 45 45 PHE C C 45 174.470 174.470 174.414 0.056 17919 105467 1 257 . 1 1 45 45 PHE CA C 45 57.020 57.020 58.067 -1.047 17919 105468 1 257 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.903 0.857 17919 105469 1 257 . 1 1 45 45 PHE H H 45 8.830 8.830 8.561 0.269 17919 105470 1 257 . 1 1 46 46 ALA N N 46 132.200 132.200 128.193 4.007 17919 105471 1 257 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.568 0.122 17919 105472 1 257 . 1 1 46 46 ALA C C 46 177.290 177.290 177.949 -0.659 17919 105473 1 257 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.775 -0.235 17919 105474 1 257 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.979 -0.409 17919 105475 1 257 . 1 1 46 46 ALA H H 46 8.810 8.810 8.414 0.396 17919 105476 1 257 . 1 1 47 47 GLY N N 47 102.340 102.340 104.120 -1.780 17919 105477 1 257 . 1 1 47 47 GLY C C 47 173.810 173.810 174.255 -0.445 17919 105478 1 257 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.803 0.547 17919 105479 1 257 . 1 1 47 47 GLY H H 47 8.130 8.130 8.309 -0.179 17919 105480 1 257 . 1 1 48 48 LYS N N 48 121.570 121.570 121.834 -0.264 17919 105481 1 257 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.615 0.007 17919 105482 1 257 . 1 1 48 48 LYS C C 48 174.700 174.700 175.430 -0.730 17919 105483 1 257 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.144 -0.594 17919 105484 1 257 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.171 0.359 17919 105485 1 257 . 1 1 48 48 LYS H H 48 7.980 7.980 7.645 0.335 17919 105486 1 257 . 1 1 49 49 GLN N N 49 122.410 122.410 123.066 -0.656 17919 105487 1 257 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.644 -0.084 17919 105488 1 257 . 1 1 49 49 GLN C C 49 175.670 175.670 175.253 0.417 17919 105489 1 257 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.469 0.271 17919 105490 1 257 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.947 -0.947 17919 105491 1 257 . 1 1 49 49 GLN H H 49 8.600 8.600 8.508 0.092 17919 105492 1 257 . 1 1 50 50 LEU N N 50 125.520 125.520 122.511 3.009 17919 105493 1 257 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.381 -0.291 17919 105494 1 257 . 1 1 50 50 LEU C C 50 176.660 176.660 175.804 0.856 17919 105495 1 257 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.729 0.511 17919 105496 1 257 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.448 -0.878 17919 105497 1 257 . 1 1 50 50 LEU H H 50 8.530 8.530 8.522 0.008 17919 105498 1 257 . 1 1 51 51 GLU N N 51 122.940 122.940 123.004 -0.064 17919 105499 1 257 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.563 -0.075 17919 105500 1 257 . 1 1 51 51 GLU C C 51 175.870 175.870 176.878 -1.008 17919 105501 1 257 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.226 0.734 17919 105502 1 257 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.840 -0.270 17919 105503 1 257 . 1 1 51 51 GLU H H 51 8.400 8.400 8.435 -0.035 17919 105504 1 257 . 1 1 52 52 ASP N N 52 120.030 120.030 125.160 -5.130 17919 105505 1 257 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.391 -0.032 17919 105506 1 257 . 1 1 52 52 ASP C C 52 177.330 177.330 178.246 -0.916 17919 105507 1 257 . 1 1 52 52 ASP CA C 52 56.960 56.960 58.112 -1.153 17919 105508 1 257 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.565 0.285 17919 105509 1 257 . 1 1 52 52 ASP H H 52 8.160 8.160 8.871 -0.711 17919 105510 1 257 . 1 1 53 53 GLY N N 53 106.660 106.660 105.079 1.581 17919 105511 1 257 . 1 1 53 53 GLY C C 53 174.870 174.870 174.189 0.681 17919 105512 1 257 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.982 0.188 17919 105513 1 257 . 1 1 53 53 GLY H H 53 9.390 9.390 8.464 0.926 17919 105514 1 257 . 1 1 54 54 ARG N N 54 119.050 119.050 119.526 -0.476 17919 105515 1 257 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.855 -0.160 17919 105516 1 257 . 1 1 54 54 ARG C C 54 175.350 175.350 175.247 0.103 17919 105517 1 257 . 1 1 54 54 ARG CA C 54 54.390 54.390 53.794 0.597 17919 105518 1 257 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.625 -0.975 17919 105519 1 257 . 1 1 54 54 ARG H H 54 7.460 7.460 7.654 -0.194 17919 105520 1 257 . 1 1 55 55 THR N N 55 108.400 108.400 113.016 -4.616 17919 105521 1 257 . 1 1 55 55 THR HA H 55 5.240 5.240 4.911 0.329 17919 105522 1 257 . 1 1 55 55 THR C C 55 176.560 176.560 176.580 -0.020 17919 105523 1 257 . 1 1 55 55 THR CA C 55 59.690 59.690 60.511 -0.821 17919 105524 1 257 . 1 1 55 55 THR CB C 55 72.260 72.260 70.724 1.536 17919 105525 1 257 . 1 1 55 55 THR H H 55 8.730 8.730 8.378 0.352 17919 105526 1 257 . 1 1 56 56 LEU N N 56 117.920 117.920 122.430 -4.510 17919 105527 1 257 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.110 -0.050 17919 105528 1 257 . 1 1 56 56 LEU C C 56 180.810 180.810 178.816 1.994 17919 105529 1 257 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.351 0.359 17919 105530 1 257 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.347 -0.977 17919 105531 1 257 . 1 1 56 56 LEU H H 56 8.140 8.140 9.204 -1.064 17919 105532 1 257 . 1 1 57 57 SER N N 57 113.330 113.330 113.547 -0.217 17919 105533 1 257 . 1 1 57 57 SER HA H 57 4.370 4.370 4.219 0.151 17919 105534 1 257 . 1 1 57 57 SER C C 57 178.310 178.310 176.908 1.402 17919 105535 1 257 . 1 1 57 57 SER CA C 57 61.080 61.080 61.219 -0.139 17919 105536 1 257 . 1 1 57 57 SER CB C 57 62.530 62.530 62.641 -0.111 17919 105537 1 257 . 1 1 57 57 SER H H 57 8.470 8.470 8.583 -0.113 17919 105538 1 257 . 1 1 58 58 ASP N N 58 124.190 124.190 122.620 1.570 17919 105539 1 257 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.389 -0.093 17919 105540 1 257 . 1 1 58 58 ASP C C 58 177.400 177.400 176.784 0.616 17919 105541 1 257 . 1 1 58 58 ASP CA C 58 57.180 57.180 55.811 1.369 17919 105542 1 257 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.382 -0.282 17919 105543 1 257 . 1 1 58 58 ASP H H 58 7.930 7.930 7.798 0.132 17919 105544 1 257 . 1 1 59 59 TYR N N 59 115.510 115.510 116.008 -0.498 17919 105545 1 257 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.606 0.064 17919 105546 1 257 . 1 1 59 59 TYR C C 59 174.700 174.700 174.948 -0.248 17919 105547 1 257 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.808 0.442 17919 105548 1 257 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.657 1.413 17919 105549 1 257 . 1 1 59 59 TYR H H 59 7.250 7.250 7.359 -0.109 17919 105550 1 257 . 1 1 60 60 ASN N N 60 115.900 115.900 114.989 0.911 17919 105551 1 257 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.371 -0.016 17919 105552 1 257 . 1 1 60 60 ASN C C 60 174.340 174.340 174.499 -0.159 17919 105553 1 257 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.658 -0.538 17919 105554 1 257 . 1 1 60 60 ASN CB C 60 37.410 37.410 36.763 0.647 17919 105555 1 257 . 1 1 60 60 ASN H H 60 8.150 8.150 7.793 0.357 17919 105556 1 257 . 1 1 61 61 ILE N N 61 118.600 118.600 120.060 -1.460 17919 105557 1 257 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.865 -0.472 17919 105558 1 257 . 1 1 61 61 ILE C C 61 174.610 174.610 175.294 -0.684 17919 105559 1 257 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.981 0.439 17919 105560 1 257 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.923 -1.183 17919 105561 1 257 . 1 1 61 61 ILE H H 61 7.250 7.250 7.901 -0.651 17919 105562 1 257 . 1 1 62 62 GLN N N 62 124.740 124.740 126.925 -2.185 17919 105563 1 257 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.806 -0.300 17919 105564 1 257 . 1 1 62 62 GLN C C 62 175.970 175.970 175.187 0.783 17919 105565 1 257 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.573 0.087 17919 105566 1 257 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.317 0.333 17919 105567 1 257 . 1 1 62 62 GLN H H 62 7.610 7.610 8.009 -0.399 17919 105568 1 257 . 1 1 63 63 LYS N N 63 120.300 120.300 120.346 -0.046 17919 105569 1 257 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.105 -0.104 17919 105570 1 257 . 1 1 63 63 LYS C C 63 175.810 175.810 176.625 -0.815 17919 105571 1 257 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.991 -0.201 17919 105572 1 257 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.127 0.523 17919 105573 1 257 . 1 1 63 63 LYS H H 63 8.490 8.490 8.438 0.052 17919 105574 1 257 . 1 1 64 64 GLU N N 64 113.950 113.950 118.139 -4.189 17919 105575 1 257 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.837 -0.372 17919 105576 1 257 . 1 1 64 64 GLU C C 64 175.250 175.250 175.881 -0.631 17919 105577 1 257 . 1 1 64 64 GLU CA C 64 57.890 57.890 58.197 -0.307 17919 105578 1 257 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.959 -3.059 17919 105579 1 257 . 1 1 64 64 GLU H H 64 9.280 9.280 9.056 0.224 17919 105580 1 257 . 1 1 65 65 SER N N 65 114.730 114.730 116.522 -1.792 17919 105581 1 257 . 1 1 65 65 SER HA H 65 4.640 4.640 4.357 0.283 17919 105582 1 257 . 1 1 65 65 SER C C 65 172.160 172.160 173.870 -1.710 17919 105583 1 257 . 1 1 65 65 SER CA C 65 60.890 60.890 60.844 0.046 17919 105584 1 257 . 1 1 65 65 SER CB C 65 64.910 64.910 63.544 1.366 17919 105585 1 257 . 1 1 65 65 SER H H 65 7.670 7.670 7.668 0.002 17919 105586 1 257 . 1 1 66 66 THR N N 66 117.110 117.110 121.065 -3.955 17919 105587 1 257 . 1 1 66 66 THR HA H 66 5.270 5.270 5.102 0.168 17919 105588 1 257 . 1 1 66 66 THR C C 66 173.950 173.950 174.161 -0.211 17919 105589 1 257 . 1 1 66 66 THR CA C 66 62.340 62.340 62.210 0.130 17919 105590 1 257 . 1 1 66 66 THR CB C 66 70.080 70.080 69.986 0.094 17919 105591 1 257 . 1 1 66 66 THR H H 66 8.730 8.730 8.276 0.454 17919 105592 1 257 . 1 1 67 67 LEU N N 67 127.110 127.110 126.961 0.149 17919 105593 1 257 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.698 0.362 17919 105594 1 257 . 1 1 67 67 LEU C C 67 175.770 175.770 175.620 0.150 17919 105595 1 257 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.726 0.174 17919 105596 1 257 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.354 -0.094 17919 105597 1 257 . 1 1 67 67 LEU H H 67 9.410 9.410 8.999 0.411 17919 105598 1 257 . 1 1 68 68 HIS N N 68 118.380 118.380 118.907 -0.527 17919 105599 1 257 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.182 0.058 17919 105600 1 257 . 1 1 68 68 HIS C C 68 173.150 173.150 174.202 -1.052 17919 105601 1 257 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.398 0.602 17919 105602 1 257 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.342 -1.812 17919 105603 1 257 . 1 1 68 68 HIS H H 68 9.230 9.230 8.857 0.373 17919 105604 1 257 . 1 1 69 69 LEU N N 69 124.460 124.460 127.386 -2.926 17919 105605 1 257 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.968 0.222 17919 105606 1 257 . 1 1 69 69 LEU C C 69 175.270 175.270 174.227 1.043 17919 105607 1 257 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.874 0.016 17919 105608 1 257 . 1 1 69 69 LEU CB C 69 44.380 44.380 43.614 0.766 17919 105609 1 257 . 1 1 69 69 LEU H H 69 8.340 8.340 8.866 -0.526 17919 105610 1 257 . 1 1 70 70 VAL N N 70 126.940 126.940 125.589 1.351 17919 105611 1 257 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.500 -0.150 17919 105612 1 257 . 1 1 70 70 VAL C C 70 174.000 174.000 173.984 0.016 17919 105613 1 257 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.481 1.319 17919 105614 1 257 . 1 1 70 70 VAL CB C 70 34.910 34.910 36.491 -1.581 17919 105615 1 257 . 1 1 70 70 VAL H H 70 9.200 9.200 9.103 0.097 17919 105616 1 257 . 1 1 71 71 LEU N N 71 123.130 123.130 125.844 -2.714 17919 105617 1 257 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.858 0.202 17919 105618 1 257 . 1 1 71 71 LEU C C 71 177.830 177.830 177.410 0.420 17919 105619 1 257 . 1 1 71 71 LEU CA C 71 53.940 53.940 54.388 -0.448 17919 105620 1 257 . 1 1 71 71 LEU CB C 71 42.850 42.850 41.728 1.122 17919 105621 1 257 . 1 1 71 71 LEU H H 71 8.120 8.120 8.490 -0.370 17919 105622 1 257 . 1 1 72 72 ARG N N 72 123.490 123.490 127.338 -3.848 17919 105623 1 257 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.401 -0.100 17919 105624 1 257 . 1 1 72 72 ARG C C 72 175.350 175.350 175.306 0.044 17919 105625 1 257 . 1 1 72 72 ARG CA C 72 55.610 55.610 54.912 0.698 17919 105626 1 257 . 1 1 72 72 ARG CB C 72 31.350 31.350 29.312 2.038 17919 105627 1 257 . 1 1 72 72 ARG H H 72 8.580 8.580 8.485 0.095 17919 105628 1 258 . 1 1 2 2 GLN N N 2 123.220 123.220 120.841 2.379 17919 105629 1 258 . 1 1 2 2 GLN HA H 2 5.249 5.249 4.940 0.309 17919 105630 1 258 . 1 1 2 2 GLN C C 2 175.920 175.920 174.924 0.996 17919 105631 1 258 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.920 0.160 17919 105632 1 258 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.431 0.329 17919 105633 1 258 . 1 1 2 2 GLN H H 2 8.900 8.900 8.316 0.584 17919 105634 1 258 . 1 1 3 3 ILE N N 3 115.340 115.340 119.181 -3.841 17919 105635 1 258 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.304 -0.091 17919 105636 1 258 . 1 1 3 3 ILE C C 3 172.450 172.450 173.625 -1.175 17919 105637 1 258 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.191 0.379 17919 105638 1 258 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.731 0.479 17919 105639 1 258 . 1 1 3 3 ILE H H 3 8.320 8.320 8.731 -0.411 17919 105640 1 258 . 1 1 4 4 PHE N N 4 118.110 118.110 117.628 0.482 17919 105641 1 258 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.173 0.457 17919 105642 1 258 . 1 1 4 4 PHE C C 4 175.320 175.320 174.682 0.638 17919 105643 1 258 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.969 -0.760 17919 105644 1 258 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.224 -0.744 17919 105645 1 258 . 1 1 4 4 PHE H H 4 8.610 8.610 8.110 0.500 17919 105646 1 258 . 1 1 5 5 VAL N N 5 121.000 121.000 121.833 -0.833 17919 105647 1 258 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.790 -0.065 17919 105648 1 258 . 1 1 5 5 VAL C C 5 174.870 174.870 175.383 -0.513 17919 105649 1 258 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.088 -0.468 17919 105650 1 258 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.231 -0.001 17919 105651 1 258 . 1 1 5 5 VAL H H 5 9.300 9.300 9.129 0.171 17919 105652 1 258 . 1 1 6 6 LYS N N 6 127.520 127.520 128.059 -0.539 17919 105653 1 258 . 1 1 6 6 LYS HA H 6 5.367 5.367 4.894 0.473 17919 105654 1 258 . 1 1 6 6 LYS C C 6 177.140 177.140 176.244 0.896 17919 105655 1 258 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.024 0.496 17919 105656 1 258 . 1 1 6 6 LYS CB C 6 35.050 35.050 33.280 1.770 17919 105657 1 258 . 1 1 6 6 LYS H H 6 8.820 8.820 8.949 -0.129 17919 105658 1 258 . 1 1 7 7 THR N N 7 115.400 115.400 116.250 -0.850 17919 105659 1 258 . 1 1 7 7 THR HA H 7 4.970 4.970 4.669 0.301 17919 105660 1 258 . 1 1 7 7 THR C C 7 176.910 176.910 175.592 1.318 17919 105661 1 258 . 1 1 7 7 THR CA C 7 60.470 60.470 59.950 0.520 17919 105662 1 258 . 1 1 7 7 THR CB C 7 70.630 70.630 70.685 -0.055 17919 105663 1 258 . 1 1 7 7 THR H H 7 8.730 8.730 8.308 0.422 17919 105664 1 258 . 1 1 8 8 LEU N N 8 121.330 121.330 119.693 1.637 17919 105665 1 258 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.152 0.158 17919 105666 1 258 . 1 1 8 8 LEU C C 8 178.800 178.800 178.247 0.553 17919 105667 1 258 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.961 -0.381 17919 105668 1 258 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.387 0.583 17919 105669 1 258 . 1 1 8 8 LEU H H 8 9.100 9.100 8.883 0.217 17919 105670 1 258 . 1 1 9 9 THR N N 9 105.590 105.590 105.924 -0.334 17919 105671 1 258 . 1 1 9 9 THR HA H 9 4.428 4.428 4.202 0.226 17919 105672 1 258 . 1 1 9 9 THR C C 9 175.520 175.520 176.164 -0.644 17919 105673 1 258 . 1 1 9 9 THR CA C 9 61.400 61.400 62.373 -0.973 17919 105674 1 258 . 1 1 9 9 THR CB C 9 69.140 69.140 68.934 0.206 17919 105675 1 258 . 1 1 9 9 THR H H 9 7.630 7.630 7.952 -0.322 17919 105676 1 258 . 1 1 10 10 GLY N N 10 108.890 108.890 110.129 -1.239 17919 105677 1 258 . 1 1 10 10 GLY C C 10 174.070 174.070 173.217 0.853 17919 105678 1 258 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.963 0.497 17919 105679 1 258 . 1 1 10 10 GLY H H 10 7.810 7.810 8.331 -0.521 17919 105680 1 258 . 1 1 11 11 LYS N N 11 121.600 121.600 124.016 -2.416 17919 105681 1 258 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.028 0.333 17919 105682 1 258 . 1 1 11 11 LYS C C 11 175.940 175.940 176.036 -0.096 17919 105683 1 258 . 1 1 11 11 LYS CA C 11 56.280 56.280 57.014 -0.734 17919 105684 1 258 . 1 1 11 11 LYS CB C 11 33.200 33.200 32.166 1.034 17919 105685 1 258 . 1 1 11 11 LYS H H 11 7.280 7.280 7.711 -0.431 17919 105686 1 258 . 1 1 12 12 THR N N 12 120.440 120.440 120.549 -0.109 17919 105687 1 258 . 1 1 12 12 THR HA H 12 5.046 5.046 4.538 0.508 17919 105688 1 258 . 1 1 12 12 THR C C 12 174.320 174.320 174.973 -0.653 17919 105689 1 258 . 1 1 12 12 THR CA C 12 62.390 62.390 63.401 -1.010 17919 105690 1 258 . 1 1 12 12 THR CB C 12 69.910 69.910 69.073 0.837 17919 105691 1 258 . 1 1 12 12 THR H H 12 8.650 8.650 8.506 0.144 17919 105692 1 258 . 1 1 13 13 ILE N N 13 127.110 127.110 122.744 4.366 17919 105693 1 258 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.678 -0.134 17919 105694 1 258 . 1 1 13 13 ILE C C 13 175.220 175.220 174.800 0.420 17919 105695 1 258 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.617 0.363 17919 105696 1 258 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.133 -0.182 17919 105697 1 258 . 1 1 13 13 ILE H H 13 9.450 9.450 8.906 0.544 17919 105698 1 258 . 1 1 14 14 THR N N 14 121.520 121.520 123.675 -2.155 17919 105699 1 258 . 1 1 14 14 THR HA H 14 4.964 4.964 5.128 -0.164 17919 105700 1 258 . 1 1 14 14 THR C C 14 173.790 173.790 174.035 -0.245 17919 105701 1 258 . 1 1 14 14 THR CA C 14 61.940 61.940 62.280 -0.340 17919 105702 1 258 . 1 1 14 14 THR CB C 14 69.650 69.650 70.159 -0.509 17919 105703 1 258 . 1 1 14 14 THR H H 14 8.710 8.710 8.366 0.344 17919 105704 1 258 . 1 1 15 15 LEU N N 15 124.800 124.800 126.597 -1.797 17919 105705 1 258 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.766 0.014 17919 105706 1 258 . 1 1 15 15 LEU C C 15 174.670 174.670 174.744 -0.074 17919 105707 1 258 . 1 1 15 15 LEU CA C 15 52.830 52.830 54.108 -1.278 17919 105708 1 258 . 1 1 15 15 LEU CB C 15 47.070 47.070 46.228 0.842 17919 105709 1 258 . 1 1 15 15 LEU H H 15 8.710 8.710 8.952 -0.242 17919 105710 1 258 . 1 1 16 16 GLU N N 16 122.160 122.160 121.923 0.237 17919 105711 1 258 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.438 -0.521 17919 105712 1 258 . 1 1 16 16 GLU C C 16 175.860 175.860 175.983 -0.123 17919 105713 1 258 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.171 -0.351 17919 105714 1 258 . 1 1 16 16 GLU CB C 16 29.450 29.450 31.320 -1.871 17919 105715 1 258 . 1 1 16 16 GLU H H 16 8.140 8.140 8.644 -0.504 17919 105716 1 258 . 1 1 17 17 VAL N N 17 117.210 117.210 118.034 -0.824 17919 105717 1 258 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.990 -0.276 17919 105718 1 258 . 1 1 17 17 VAL C C 17 174.160 174.160 174.255 -0.095 17919 105719 1 258 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.273 -0.843 17919 105720 1 258 . 1 1 17 17 VAL CB C 17 36.400 36.400 36.000 0.400 17919 105721 1 258 . 1 1 17 17 VAL H H 17 8.900 8.900 8.447 0.453 17919 105722 1 258 . 1 1 18 18 GLU N N 18 118.990 118.990 120.045 -1.055 17919 105723 1 258 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.877 0.202 17919 105724 1 258 . 1 1 18 18 GLU C C 18 176.160 176.160 175.018 1.142 17919 105725 1 258 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.752 -0.032 17919 105726 1 258 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.972 -0.662 17919 105727 1 258 . 1 1 18 18 GLU H H 18 8.640 8.640 9.458 -0.818 17919 105728 1 258 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.196 -0.055 17919 105729 1 258 . 1 1 19 19 PRO C C 19 175.310 175.310 177.647 -2.337 17919 105730 1 258 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.914 -0.444 17919 105731 1 258 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.855 0.095 17919 105732 1 258 . 1 1 20 20 SER N N 20 103.400 103.400 109.250 -5.850 17919 105733 1 258 . 1 1 20 20 SER HA H 20 4.370 4.370 4.283 0.087 17919 105734 1 258 . 1 1 20 20 SER C C 20 174.660 174.660 174.553 0.107 17919 105735 1 258 . 1 1 20 20 SER CA C 20 57.400 57.400 59.246 -1.847 17919 105736 1 258 . 1 1 20 20 SER CB C 20 63.370 63.370 62.428 0.942 17919 105737 1 258 . 1 1 20 20 SER H H 20 7.040 7.040 8.087 -1.047 17919 105738 1 258 . 1 1 21 21 ASP N N 21 123.480 123.480 124.035 -0.555 17919 105739 1 258 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.867 -0.172 17919 105740 1 258 . 1 1 21 21 ASP C C 21 176.360 176.360 175.491 0.869 17919 105741 1 258 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.512 1.188 17919 105742 1 258 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.739 -0.939 17919 105743 1 258 . 1 1 21 21 ASP H H 21 8.030 8.030 8.091 -0.061 17919 105744 1 258 . 1 1 22 22 THR N N 22 108.800 108.800 111.896 -3.096 17919 105745 1 258 . 1 1 22 22 THR HA H 22 4.920 4.920 4.850 0.070 17919 105746 1 258 . 1 1 22 22 THR C C 22 176.750 176.750 176.025 0.725 17919 105747 1 258 . 1 1 22 22 THR CA C 22 59.690 59.690 61.272 -1.582 17919 105748 1 258 . 1 1 22 22 THR CB C 22 71.200 71.200 70.296 0.903 17919 105749 1 258 . 1 1 22 22 THR H H 22 7.900 7.900 8.288 -0.388 17919 105750 1 258 . 1 1 23 23 ILE N N 23 121.190 121.190 121.086 0.104 17919 105751 1 258 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.798 -0.141 17919 105752 1 258 . 1 1 23 23 ILE C C 23 179.040 179.040 177.579 1.461 17919 105753 1 258 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.078 -0.818 17919 105754 1 258 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.780 -2.430 17919 105755 1 258 . 1 1 23 23 ILE H H 23 8.560 8.560 8.453 0.107 17919 105756 1 258 . 1 1 24 24 GLU N N 24 120.830 120.830 120.805 0.025 17919 105757 1 258 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.809 0.108 17919 105758 1 258 . 1 1 24 24 GLU C C 24 178.640 178.640 178.393 0.247 17919 105759 1 258 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.281 -0.061 17919 105760 1 258 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.429 -1.149 17919 105761 1 258 . 1 1 24 24 GLU H H 24 9.760 9.760 8.136 1.624 17919 105762 1 258 . 1 1 25 25 ASN N N 25 120.570 120.570 116.632 3.938 17919 105763 1 258 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.527 -0.002 17919 105764 1 258 . 1 1 25 25 ASN C C 25 178.380 178.380 177.879 0.501 17919 105765 1 258 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.743 0.317 17919 105766 1 258 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.067 0.383 17919 105767 1 258 . 1 1 25 25 ASN H H 25 7.920 7.920 7.773 0.147 17919 105768 1 258 . 1 1 26 26 VAL N N 26 121.710 121.710 120.740 0.970 17919 105769 1 258 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.607 -0.210 17919 105770 1 258 . 1 1 26 26 VAL C C 26 177.950 177.950 177.497 0.453 17919 105771 1 258 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.679 0.981 17919 105772 1 258 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.448 -0.608 17919 105773 1 258 . 1 1 26 26 VAL H H 26 8.070 8.070 7.895 0.175 17919 105774 1 258 . 1 1 27 27 LYS N N 27 118.860 118.860 120.412 -1.552 17919 105775 1 258 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.092 0.488 17919 105776 1 258 . 1 1 27 27 LYS C C 27 180.550 180.550 179.185 1.365 17919 105777 1 258 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.616 -0.366 17919 105778 1 258 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.100 1.630 17919 105779 1 258 . 1 1 27 27 LYS H H 27 8.560 8.560 7.654 0.906 17919 105780 1 258 . 1 1 28 28 ALA N N 28 123.440 123.440 120.982 2.458 17919 105781 1 258 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.099 0.061 17919 105782 1 258 . 1 1 28 28 ALA C C 28 180.300 180.300 179.315 0.985 17919 105783 1 258 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.971 0.399 17919 105784 1 258 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.370 -0.660 17919 105785 1 258 . 1 1 28 28 ALA H H 28 8.060 8.060 8.449 -0.389 17919 105786 1 258 . 1 1 29 29 LYS N N 29 119.940 119.940 119.049 0.891 17919 105787 1 258 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.066 0.141 17919 105788 1 258 . 1 1 29 29 LYS C C 29 180.320 180.320 179.021 1.299 17919 105789 1 258 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.231 0.419 17919 105790 1 258 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.377 0.913 17919 105791 1 258 . 1 1 29 29 LYS H H 29 7.850 7.850 7.600 0.250 17919 105792 1 258 . 1 1 30 30 ILE N N 30 121.080 121.080 120.269 0.811 17919 105793 1 258 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.667 -0.160 17919 105794 1 258 . 1 1 30 30 ILE C C 30 178.310 178.310 177.155 1.155 17919 105795 1 258 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.088 1.062 17919 105796 1 258 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.691 -0.891 17919 105797 1 258 . 1 1 30 30 ILE H H 30 8.280 8.280 7.863 0.417 17919 105798 1 258 . 1 1 31 31 GLN N N 31 123.490 123.490 120.858 2.632 17919 105799 1 258 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.105 -0.276 17919 105800 1 258 . 1 1 31 31 GLN C C 31 178.890 178.890 178.640 0.250 17919 105801 1 258 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.336 0.665 17919 105802 1 258 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.430 -0.710 17919 105803 1 258 . 1 1 31 31 GLN H H 31 8.580 8.580 8.094 0.486 17919 105804 1 258 . 1 1 32 32 ASP N N 32 119.360 119.360 119.330 0.030 17919 105805 1 258 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.408 -0.054 17919 105806 1 258 . 1 1 32 32 ASP C C 32 177.250 177.250 178.021 -0.771 17919 105807 1 258 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.789 0.401 17919 105808 1 258 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.912 -0.332 17919 105809 1 258 . 1 1 32 32 ASP H H 32 8.010 8.010 7.842 0.168 17919 105810 1 258 . 1 1 33 33 LYS N N 33 115.130 115.130 118.105 -2.975 17919 105811 1 258 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.288 0.049 17919 105812 1 258 . 1 1 33 33 LYS C C 33 177.870 177.870 177.969 -0.099 17919 105813 1 258 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.872 0.178 17919 105814 1 258 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.400 0.770 17919 105815 1 258 . 1 1 33 33 LYS H H 33 7.430 7.430 7.610 -0.180 17919 105816 1 258 . 1 1 34 34 GLU N N 34 113.870 113.870 114.266 -0.396 17919 105817 1 258 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.511 0.114 17919 105818 1 258 . 1 1 34 34 GLU C C 34 177.840 177.840 176.872 0.968 17919 105819 1 258 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.947 -0.777 17919 105820 1 258 . 1 1 34 34 GLU CB C 34 32.660 32.660 32.436 0.224 17919 105821 1 258 . 1 1 34 34 GLU H H 34 8.740 8.740 8.271 0.469 17919 105822 1 258 . 1 1 35 35 GLY N N 35 108.650 108.650 108.521 0.129 17919 105823 1 258 . 1 1 35 35 GLY C C 35 173.960 173.960 174.441 -0.481 17919 105824 1 258 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.744 0.336 17919 105825 1 258 . 1 1 35 35 GLY H H 35 8.530 8.530 8.176 0.354 17919 105826 1 258 . 1 1 36 36 ILE N N 36 119.880 119.880 122.363 -2.483 17919 105827 1 258 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.265 0.180 17919 105828 1 258 . 1 1 36 36 ILE C C 36 173.590 173.590 174.123 -0.533 17919 105829 1 258 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.301 -0.551 17919 105830 1 258 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.025 2.555 17919 105831 1 258 . 1 1 36 36 ILE H H 36 6.150 6.150 7.634 -1.484 17919 105832 1 258 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.608 0.026 17919 105833 1 258 . 1 1 37 37 PRO C C 37 176.940 176.940 175.958 0.982 17919 105834 1 258 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.700 -0.040 17919 105835 1 258 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.150 0.700 17919 105836 1 258 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.167 -0.050 17919 105837 1 258 . 1 1 38 38 PRO C C 38 178.320 178.320 177.759 0.561 17919 105838 1 258 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.578 0.682 17919 105839 1 258 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.963 0.927 17919 105840 1 258 . 1 1 39 39 ASP N N 39 113.380 113.380 114.419 -1.039 17919 105841 1 258 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.478 -0.048 17919 105842 1 258 . 1 1 39 39 ASP C C 39 177.090 177.090 177.185 -0.095 17919 105843 1 258 . 1 1 39 39 ASP CA C 39 55.640 55.640 55.562 0.078 17919 105844 1 258 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.602 -1.062 17919 105845 1 258 . 1 1 39 39 ASP H H 39 8.550 8.550 8.456 0.094 17919 105846 1 258 . 1 1 40 40 GLN N N 40 116.780 116.780 115.434 1.346 17919 105847 1 258 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.284 0.180 17919 105848 1 258 . 1 1 40 40 GLN C C 40 175.380 175.380 174.986 0.394 17919 105849 1 258 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.476 -0.836 17919 105850 1 258 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.919 0.221 17919 105851 1 258 . 1 1 40 40 GLN H H 40 7.820 7.820 7.718 0.102 17919 105852 1 258 . 1 1 41 41 GLN N N 41 117.720 117.720 116.498 1.222 17919 105853 1 258 . 1 1 41 41 GLN HA H 41 4.244 4.244 5.190 -0.946 17919 105854 1 258 . 1 1 41 41 GLN C C 41 176.300 176.300 175.266 1.034 17919 105855 1 258 . 1 1 41 41 GLN CA C 41 56.470 56.470 54.233 2.237 17919 105856 1 258 . 1 1 41 41 GLN CB C 41 31.650 31.650 31.833 -0.183 17919 105857 1 258 . 1 1 41 41 GLN H H 41 7.480 7.480 7.198 0.282 17919 105858 1 258 . 1 1 42 42 ARG N N 42 122.680 122.680 121.306 1.374 17919 105859 1 258 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.779 -0.279 17919 105860 1 258 . 1 1 42 42 ARG C C 42 174.050 174.050 174.844 -0.794 17919 105861 1 258 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.459 0.591 17919 105862 1 258 . 1 1 42 42 ARG CB C 42 31.750 31.750 34.217 -2.467 17919 105863 1 258 . 1 1 42 42 ARG H H 42 8.530 8.530 8.869 -0.339 17919 105864 1 258 . 1 1 43 43 LEU N N 43 124.040 124.040 121.306 2.734 17919 105865 1 258 . 1 1 43 43 LEU C C 43 175.290 175.290 175.624 -0.334 17919 105866 1 258 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.750 -0.770 17919 105867 1 258 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.753 1.037 17919 105868 1 258 . 1 1 43 43 LEU H H 43 8.820 8.820 8.692 0.128 17919 105869 1 258 . 1 1 44 44 ILE N N 44 121.920 121.920 120.844 1.076 17919 105870 1 258 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.073 -0.081 17919 105871 1 258 . 1 1 44 44 ILE C C 44 176.060 176.060 174.348 1.712 17919 105872 1 258 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.188 -1.208 17919 105873 1 258 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.711 -0.291 17919 105874 1 258 . 1 1 44 44 ILE H H 44 9.030 9.030 8.638 0.392 17919 105875 1 258 . 1 1 45 45 PHE N N 45 125.390 125.390 127.265 -1.875 17919 105876 1 258 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.089 -0.044 17919 105877 1 258 . 1 1 45 45 PHE C C 45 174.470 174.470 174.730 -0.260 17919 105878 1 258 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.232 0.788 17919 105879 1 258 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.255 0.505 17919 105880 1 258 . 1 1 45 45 PHE H H 45 8.830 8.830 8.811 0.019 17919 105881 1 258 . 1 1 46 46 ALA N N 46 132.200 132.200 130.493 1.707 17919 105882 1 258 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.624 0.066 17919 105883 1 258 . 1 1 46 46 ALA C C 46 177.290 177.290 177.595 -0.305 17919 105884 1 258 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.767 -0.227 17919 105885 1 258 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.297 0.273 17919 105886 1 258 . 1 1 46 46 ALA H H 46 8.810 8.810 8.800 0.010 17919 105887 1 258 . 1 1 47 47 GLY N N 47 102.340 102.340 103.986 -1.646 17919 105888 1 258 . 1 1 47 47 GLY C C 47 173.810 173.810 174.456 -0.646 17919 105889 1 258 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.260 0.090 17919 105890 1 258 . 1 1 47 47 GLY H H 47 8.130 8.130 8.590 -0.460 17919 105891 1 258 . 1 1 48 48 LYS N N 48 121.570 121.570 120.508 1.062 17919 105892 1 258 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.550 0.072 17919 105893 1 258 . 1 1 48 48 LYS C C 48 174.700 174.700 175.317 -0.617 17919 105894 1 258 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.906 -0.356 17919 105895 1 258 . 1 1 48 48 LYS CB C 48 34.530 34.530 33.751 0.779 17919 105896 1 258 . 1 1 48 48 LYS H H 48 7.980 7.980 7.677 0.303 17919 105897 1 258 . 1 1 49 49 GLN N N 49 122.410 122.410 123.709 -1.299 17919 105898 1 258 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.591 -0.031 17919 105899 1 258 . 1 1 49 49 GLN C C 49 175.670 175.670 175.875 -0.205 17919 105900 1 258 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.254 0.486 17919 105901 1 258 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.499 -0.499 17919 105902 1 258 . 1 1 49 49 GLN H H 49 8.600 8.600 8.499 0.101 17919 105903 1 258 . 1 1 50 50 LEU N N 50 125.520 125.520 128.003 -2.483 17919 105904 1 258 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.253 -0.163 17919 105905 1 258 . 1 1 50 50 LEU C C 50 176.660 176.660 177.155 -0.495 17919 105906 1 258 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.369 -0.129 17919 105907 1 258 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.942 -0.372 17919 105908 1 258 . 1 1 50 50 LEU H H 50 8.530 8.530 7.981 0.549 17919 105909 1 258 . 1 1 51 51 GLU N N 51 122.940 122.940 122.723 0.217 17919 105910 1 258 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.398 0.090 17919 105911 1 258 . 1 1 51 51 GLU C C 51 175.870 175.870 176.950 -1.080 17919 105912 1 258 . 1 1 51 51 GLU CA C 51 55.960 55.960 56.125 -0.165 17919 105913 1 258 . 1 1 51 51 GLU CB C 51 31.570 31.570 30.272 1.298 17919 105914 1 258 . 1 1 51 51 GLU H H 51 8.400 8.400 8.330 0.070 17919 105915 1 258 . 1 1 52 52 ASP N N 52 120.030 120.030 126.087 -6.057 17919 105916 1 258 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.482 -0.123 17919 105917 1 258 . 1 1 52 52 ASP C C 52 177.330 177.330 177.153 0.177 17919 105918 1 258 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.234 -0.274 17919 105919 1 258 . 1 1 52 52 ASP CB C 52 40.850 40.850 41.177 -0.327 17919 105920 1 258 . 1 1 52 52 ASP H H 52 8.160 8.160 8.823 -0.663 17919 105921 1 258 . 1 1 53 53 GLY N N 53 106.660 106.660 106.132 0.528 17919 105922 1 258 . 1 1 53 53 GLY C C 53 174.870 174.870 174.049 0.821 17919 105923 1 258 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.652 0.518 17919 105924 1 258 . 1 1 53 53 GLY H H 53 9.390 9.390 8.505 0.885 17919 105925 1 258 . 1 1 54 54 ARG N N 54 119.050 119.050 121.239 -2.189 17919 105926 1 258 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.624 0.071 17919 105927 1 258 . 1 1 54 54 ARG C C 54 175.350 175.350 175.218 0.132 17919 105928 1 258 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.139 0.251 17919 105929 1 258 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.740 -0.090 17919 105930 1 258 . 1 1 54 54 ARG H H 54 7.460 7.460 7.349 0.111 17919 105931 1 258 . 1 1 55 55 THR N N 55 108.400 108.400 117.060 -8.660 17919 105932 1 258 . 1 1 55 55 THR HA H 55 5.240 5.240 4.818 0.422 17919 105933 1 258 . 1 1 55 55 THR C C 55 176.560 176.560 176.043 0.517 17919 105934 1 258 . 1 1 55 55 THR CA C 55 59.690 59.690 61.465 -1.775 17919 105935 1 258 . 1 1 55 55 THR CB C 55 72.260 72.260 69.500 2.760 17919 105936 1 258 . 1 1 55 55 THR H H 55 8.730 8.730 8.203 0.527 17919 105937 1 258 . 1 1 56 56 LEU N N 56 117.920 117.920 125.703 -7.783 17919 105938 1 258 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.984 0.076 17919 105939 1 258 . 1 1 56 56 LEU C C 56 180.810 180.810 178.612 2.198 17919 105940 1 258 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.436 0.274 17919 105941 1 258 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.111 -0.741 17919 105942 1 258 . 1 1 56 56 LEU H H 56 8.140 8.140 8.966 -0.826 17919 105943 1 258 . 1 1 57 57 SER N N 57 113.330 113.330 114.241 -0.911 17919 105944 1 258 . 1 1 57 57 SER HA H 57 4.370 4.370 4.012 0.358 17919 105945 1 258 . 1 1 57 57 SER C C 57 178.310 178.310 176.624 1.686 17919 105946 1 258 . 1 1 57 57 SER CA C 57 61.080 61.080 61.211 -0.131 17919 105947 1 258 . 1 1 57 57 SER CB C 57 62.530 62.530 62.570 -0.040 17919 105948 1 258 . 1 1 57 57 SER H H 57 8.470 8.470 8.072 0.398 17919 105949 1 258 . 1 1 58 58 ASP N N 58 124.190 124.190 121.826 2.364 17919 105950 1 258 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.321 -0.025 17919 105951 1 258 . 1 1 58 58 ASP C C 58 177.400 177.400 176.870 0.530 17919 105952 1 258 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.193 0.987 17919 105953 1 258 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.513 -0.413 17919 105954 1 258 . 1 1 58 58 ASP H H 58 7.930 7.930 7.953 -0.023 17919 105955 1 258 . 1 1 59 59 TYR N N 59 115.510 115.510 115.757 -0.247 17919 105956 1 258 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.671 -0.001 17919 105957 1 258 . 1 1 59 59 TYR C C 59 174.700 174.700 175.280 -0.580 17919 105958 1 258 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.524 0.726 17919 105959 1 258 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.830 1.240 17919 105960 1 258 . 1 1 59 59 TYR H H 59 7.250 7.250 7.220 0.030 17919 105961 1 258 . 1 1 60 60 ASN N N 60 115.900 115.900 118.098 -2.198 17919 105962 1 258 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.328 0.027 17919 105963 1 258 . 1 1 60 60 ASN C C 60 174.340 174.340 174.477 -0.137 17919 105964 1 258 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.350 -0.230 17919 105965 1 258 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.469 -0.059 17919 105966 1 258 . 1 1 60 60 ASN H H 60 8.150 8.150 8.141 0.009 17919 105967 1 258 . 1 1 61 61 ILE N N 61 118.600 118.600 119.494 -0.894 17919 105968 1 258 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.733 -0.340 17919 105969 1 258 . 1 1 61 61 ILE C C 61 174.610 174.610 175.070 -0.460 17919 105970 1 258 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.163 0.257 17919 105971 1 258 . 1 1 61 61 ILE CB C 61 36.740 36.740 38.142 -1.402 17919 105972 1 258 . 1 1 61 61 ILE H H 61 7.250 7.250 7.341 -0.091 17919 105973 1 258 . 1 1 62 62 GLN N N 62 124.740 124.740 124.843 -0.103 17919 105974 1 258 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.807 -0.301 17919 105975 1 258 . 1 1 62 62 GLN C C 62 175.970 175.970 175.382 0.588 17919 105976 1 258 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.588 0.072 17919 105977 1 258 . 1 1 62 62 GLN CB C 62 31.650 31.650 32.626 -0.976 17919 105978 1 258 . 1 1 62 62 GLN H H 62 7.610 7.610 8.215 -0.605 17919 105979 1 258 . 1 1 63 63 LYS N N 63 120.300 120.300 120.319 -0.019 17919 105980 1 258 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.163 -0.162 17919 105981 1 258 . 1 1 63 63 LYS C C 63 175.810 175.810 176.860 -1.050 17919 105982 1 258 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.171 0.619 17919 105983 1 258 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.589 0.061 17919 105984 1 258 . 1 1 63 63 LYS H H 63 8.490 8.490 8.538 -0.048 17919 105985 1 258 . 1 1 64 64 GLU N N 64 113.950 113.950 116.612 -2.662 17919 105986 1 258 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.725 -0.260 17919 105987 1 258 . 1 1 64 64 GLU C C 64 175.250 175.250 176.507 -1.257 17919 105988 1 258 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.995 -0.105 17919 105989 1 258 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.643 -2.743 17919 105990 1 258 . 1 1 64 64 GLU H H 64 9.280 9.280 8.367 0.913 17919 105991 1 258 . 1 1 65 65 SER N N 65 114.730 114.730 116.848 -2.118 17919 105992 1 258 . 1 1 65 65 SER HA H 65 4.640 4.640 4.406 0.234 17919 105993 1 258 . 1 1 65 65 SER C C 65 172.160 172.160 173.854 -1.694 17919 105994 1 258 . 1 1 65 65 SER CA C 65 60.890 60.890 60.429 0.461 17919 105995 1 258 . 1 1 65 65 SER CB C 65 64.910 64.910 63.894 1.016 17919 105996 1 258 . 1 1 65 65 SER H H 65 7.670 7.670 7.336 0.334 17919 105997 1 258 . 1 1 66 66 THR N N 66 117.110 117.110 119.466 -2.356 17919 105998 1 258 . 1 1 66 66 THR HA H 66 5.270 5.270 5.162 0.108 17919 105999 1 258 . 1 1 66 66 THR C C 66 173.950 173.950 174.208 -0.258 17919 106000 1 258 . 1 1 66 66 THR CA C 66 62.340 62.340 61.910 0.430 17919 106001 1 258 . 1 1 66 66 THR CB C 66 70.080 70.080 70.612 -0.532 17919 106002 1 258 . 1 1 66 66 THR H H 66 8.730 8.730 8.466 0.264 17919 106003 1 258 . 1 1 67 67 LEU N N 67 127.110 127.110 127.664 -0.554 17919 106004 1 258 . 1 1 67 67 LEU HA H 67 5.060 5.060 5.117 -0.057 17919 106005 1 258 . 1 1 67 67 LEU C C 67 175.770 175.770 175.518 0.252 17919 106006 1 258 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.893 0.007 17919 106007 1 258 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.370 -0.110 17919 106008 1 258 . 1 1 67 67 LEU H H 67 9.410 9.410 9.141 0.269 17919 106009 1 258 . 1 1 68 68 HIS N N 68 118.380 118.380 119.697 -1.317 17919 106010 1 258 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.123 0.117 17919 106011 1 258 . 1 1 68 68 HIS C C 68 173.150 173.150 174.266 -1.116 17919 106012 1 258 . 1 1 68 68 HIS CA C 68 55.000 55.000 55.224 -0.224 17919 106013 1 258 . 1 1 68 68 HIS CB C 68 30.530 30.530 31.527 -0.997 17919 106014 1 258 . 1 1 68 68 HIS H H 68 9.230 9.230 9.201 0.029 17919 106015 1 258 . 1 1 69 69 LEU N N 69 124.460 124.460 126.945 -2.485 17919 106016 1 258 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.228 -0.038 17919 106017 1 258 . 1 1 69 69 LEU C C 69 175.270 175.270 175.471 -0.201 17919 106018 1 258 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.702 0.188 17919 106019 1 258 . 1 1 69 69 LEU CB C 69 44.380 44.380 43.780 0.600 17919 106020 1 258 . 1 1 69 69 LEU H H 69 8.340 8.340 8.076 0.264 17919 106021 1 258 . 1 1 70 70 VAL N N 70 126.940 126.940 122.775 4.165 17919 106022 1 258 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.587 -0.237 17919 106023 1 258 . 1 1 70 70 VAL C C 70 174.000 174.000 174.035 -0.035 17919 106024 1 258 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.623 1.177 17919 106025 1 258 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.435 -0.525 17919 106026 1 258 . 1 1 70 70 VAL H H 70 9.200 9.200 8.778 0.422 17919 106027 1 258 . 1 1 71 71 LEU N N 71 123.130 123.130 123.581 -0.451 17919 106028 1 258 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.285 -0.225 17919 106029 1 258 . 1 1 71 71 LEU C C 71 177.830 177.830 177.249 0.581 17919 106030 1 258 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.002 0.938 17919 106031 1 258 . 1 1 71 71 LEU CB C 71 42.850 42.850 44.316 -1.466 17919 106032 1 258 . 1 1 71 71 LEU H H 71 8.120 8.120 8.433 -0.313 17919 106033 1 258 . 1 1 72 72 ARG N N 72 123.490 123.490 123.467 0.023 17919 106034 1 258 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.458 -0.157 17919 106035 1 258 . 1 1 72 72 ARG C C 72 175.350 175.350 175.535 -0.185 17919 106036 1 258 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.436 -0.826 17919 106037 1 258 . 1 1 72 72 ARG CB C 72 31.350 31.350 29.746 1.604 17919 106038 1 258 . 1 1 72 72 ARG H H 72 8.580 8.580 8.365 0.215 17919 106039 1 259 . 1 1 2 2 GLN N N 2 123.220 123.220 120.998 2.222 17919 106040 1 259 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.127 0.122 17919 106041 1 259 . 1 1 2 2 GLN C C 2 175.920 175.920 175.263 0.657 17919 106042 1 259 . 1 1 2 2 GLN CA C 2 55.080 55.080 55.422 -0.342 17919 106043 1 259 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.143 0.617 17919 106044 1 259 . 1 1 2 2 GLN H H 2 8.900 8.900 8.390 0.510 17919 106045 1 259 . 1 1 3 3 ILE N N 3 115.340 115.340 118.500 -3.160 17919 106046 1 259 . 1 1 3 3 ILE HA H 3 4.213 4.213 5.023 -0.810 17919 106047 1 259 . 1 1 3 3 ILE C C 3 172.450 172.450 173.539 -1.089 17919 106048 1 259 . 1 1 3 3 ILE CA C 3 59.570 59.570 58.618 0.952 17919 106049 1 259 . 1 1 3 3 ILE CB C 3 42.210 42.210 42.050 0.160 17919 106050 1 259 . 1 1 3 3 ILE H H 3 8.320 8.320 8.261 0.059 17919 106051 1 259 . 1 1 4 4 PHE N N 4 118.110 118.110 119.649 -1.539 17919 106052 1 259 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.028 0.602 17919 106053 1 259 . 1 1 4 4 PHE C C 4 175.320 175.320 174.777 0.543 17919 106054 1 259 . 1 1 4 4 PHE CA C 4 55.210 55.210 56.158 -0.949 17919 106055 1 259 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.405 -0.925 17919 106056 1 259 . 1 1 4 4 PHE H H 4 8.610 8.610 8.691 -0.081 17919 106057 1 259 . 1 1 5 5 VAL N N 5 121.000 121.000 121.933 -0.933 17919 106058 1 259 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.625 0.100 17919 106059 1 259 . 1 1 5 5 VAL C C 5 174.870 174.870 174.503 0.367 17919 106060 1 259 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.399 -0.779 17919 106061 1 259 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.764 0.466 17919 106062 1 259 . 1 1 5 5 VAL H H 5 9.300 9.300 9.341 -0.041 17919 106063 1 259 . 1 1 6 6 LYS N N 6 127.520 127.520 128.875 -1.355 17919 106064 1 259 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.285 0.082 17919 106065 1 259 . 1 1 6 6 LYS C C 6 177.140 177.140 176.466 0.674 17919 106066 1 259 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.125 0.395 17919 106067 1 259 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.894 -0.844 17919 106068 1 259 . 1 1 6 6 LYS H H 6 8.820 8.820 8.883 -0.063 17919 106069 1 259 . 1 1 7 7 THR N N 7 115.400 115.400 118.402 -3.002 17919 106070 1 259 . 1 1 7 7 THR HA H 7 4.970 4.970 4.383 0.587 17919 106071 1 259 . 1 1 7 7 THR C C 7 176.910 176.910 175.801 1.109 17919 106072 1 259 . 1 1 7 7 THR CA C 7 60.470 60.470 62.004 -1.534 17919 106073 1 259 . 1 1 7 7 THR CB C 7 70.630 70.630 69.970 0.660 17919 106074 1 259 . 1 1 7 7 THR H H 7 8.730 8.730 9.039 -0.309 17919 106075 1 259 . 1 1 8 8 LEU N N 8 121.330 121.330 122.415 -1.085 17919 106076 1 259 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.167 0.143 17919 106077 1 259 . 1 1 8 8 LEU C C 8 178.800 178.800 177.618 1.182 17919 106078 1 259 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.468 0.112 17919 106079 1 259 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.974 -0.004 17919 106080 1 259 . 1 1 8 8 LEU H H 8 9.100 9.100 8.740 0.360 17919 106081 1 259 . 1 1 9 9 THR N N 9 105.590 105.590 110.298 -4.708 17919 106082 1 259 . 1 1 9 9 THR HA H 9 4.428 4.428 4.296 0.132 17919 106083 1 259 . 1 1 9 9 THR C C 9 175.520 175.520 175.736 -0.216 17919 106084 1 259 . 1 1 9 9 THR CA C 9 61.400 61.400 61.380 0.020 17919 106085 1 259 . 1 1 9 9 THR CB C 9 69.140 69.140 68.676 0.464 17919 106086 1 259 . 1 1 9 9 THR H H 9 7.630 7.630 7.523 0.107 17919 106087 1 259 . 1 1 10 10 GLY N N 10 108.890 108.890 111.752 -2.862 17919 106088 1 259 . 1 1 10 10 GLY C C 10 174.070 174.070 173.315 0.755 17919 106089 1 259 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.598 -0.138 17919 106090 1 259 . 1 1 10 10 GLY H H 10 7.810 7.810 8.608 -0.798 17919 106091 1 259 . 1 1 11 11 LYS N N 11 121.600 121.600 120.367 1.233 17919 106092 1 259 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.633 -0.272 17919 106093 1 259 . 1 1 11 11 LYS C C 11 175.940 175.940 175.318 0.622 17919 106094 1 259 . 1 1 11 11 LYS CA C 11 56.280 56.280 55.041 1.239 17919 106095 1 259 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.903 -0.703 17919 106096 1 259 . 1 1 11 11 LYS H H 11 7.280 7.280 7.468 -0.188 17919 106097 1 259 . 1 1 12 12 THR N N 12 120.440 120.440 117.963 2.477 17919 106098 1 259 . 1 1 12 12 THR HA H 12 5.046 5.046 5.520 -0.474 17919 106099 1 259 . 1 1 12 12 THR C C 12 174.320 174.320 174.550 -0.230 17919 106100 1 259 . 1 1 12 12 THR CA C 12 62.390 62.390 61.328 1.062 17919 106101 1 259 . 1 1 12 12 THR CB C 12 69.910 69.910 70.268 -0.358 17919 106102 1 259 . 1 1 12 12 THR H H 12 8.650 8.650 8.269 0.381 17919 106103 1 259 . 1 1 13 13 ILE N N 13 127.110 127.110 123.906 3.204 17919 106104 1 259 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.697 -0.153 17919 106105 1 259 . 1 1 13 13 ILE C C 13 175.220 175.220 175.512 -0.292 17919 106106 1 259 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.576 0.404 17919 106107 1 259 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.852 0.098 17919 106108 1 259 . 1 1 13 13 ILE H H 13 9.450 9.450 9.072 0.378 17919 106109 1 259 . 1 1 14 14 THR N N 14 121.520 121.520 122.102 -0.582 17919 106110 1 259 . 1 1 14 14 THR HA H 14 4.964 4.964 4.810 0.154 17919 106111 1 259 . 1 1 14 14 THR C C 14 173.790 173.790 173.909 -0.119 17919 106112 1 259 . 1 1 14 14 THR CA C 14 61.940 61.940 62.226 -0.286 17919 106113 1 259 . 1 1 14 14 THR CB C 14 69.650 69.650 69.954 -0.304 17919 106114 1 259 . 1 1 14 14 THR H H 14 8.710 8.710 8.414 0.296 17919 106115 1 259 . 1 1 15 15 LEU N N 15 124.800 124.800 124.887 -0.087 17919 106116 1 259 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.745 0.035 17919 106117 1 259 . 1 1 15 15 LEU C C 15 174.670 174.670 175.037 -0.367 17919 106118 1 259 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.306 -0.476 17919 106119 1 259 . 1 1 15 15 LEU CB C 15 47.070 47.070 44.730 2.340 17919 106120 1 259 . 1 1 15 15 LEU H H 15 8.710 8.710 8.147 0.563 17919 106121 1 259 . 1 1 16 16 GLU N N 16 122.160 122.160 122.453 -0.293 17919 106122 1 259 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.397 -0.480 17919 106123 1 259 . 1 1 16 16 GLU C C 16 175.860 175.860 175.858 0.002 17919 106124 1 259 . 1 1 16 16 GLU CA C 16 54.820 54.820 54.105 0.715 17919 106125 1 259 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.091 -0.641 17919 106126 1 259 . 1 1 16 16 GLU H H 16 8.140 8.140 8.513 -0.373 17919 106127 1 259 . 1 1 17 17 VAL N N 17 117.210 117.210 118.821 -1.611 17919 106128 1 259 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.762 -0.048 17919 106129 1 259 . 1 1 17 17 VAL C C 17 174.160 174.160 174.701 -0.541 17919 106130 1 259 . 1 1 17 17 VAL CA C 17 58.430 58.430 60.113 -1.683 17919 106131 1 259 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.887 0.513 17919 106132 1 259 . 1 1 17 17 VAL H H 17 8.900 8.900 8.689 0.211 17919 106133 1 259 . 1 1 18 18 GLU N N 18 118.990 118.990 122.132 -3.142 17919 106134 1 259 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.678 0.401 17919 106135 1 259 . 1 1 18 18 GLU C C 18 176.160 176.160 176.183 -0.023 17919 106136 1 259 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.835 -1.115 17919 106137 1 259 . 1 1 18 18 GLU CB C 18 30.310 30.310 29.850 0.460 17919 106138 1 259 . 1 1 18 18 GLU H H 18 8.640 8.640 8.182 0.458 17919 106139 1 259 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.228 -0.087 17919 106140 1 259 . 1 1 19 19 PRO C C 19 175.310 175.310 177.877 -2.567 17919 106141 1 259 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.688 -0.218 17919 106142 1 259 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.876 0.074 17919 106143 1 259 . 1 1 20 20 SER N N 20 103.400 103.400 109.719 -6.319 17919 106144 1 259 . 1 1 20 20 SER HA H 20 4.370 4.370 4.338 0.032 17919 106145 1 259 . 1 1 20 20 SER C C 20 174.660 174.660 174.012 0.648 17919 106146 1 259 . 1 1 20 20 SER CA C 20 57.400 57.400 58.633 -1.233 17919 106147 1 259 . 1 1 20 20 SER CB C 20 63.370 63.370 63.128 0.242 17919 106148 1 259 . 1 1 20 20 SER H H 20 7.040 7.040 8.071 -1.031 17919 106149 1 259 . 1 1 21 21 ASP N N 21 123.480 123.480 123.028 0.452 17919 106150 1 259 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.552 0.143 17919 106151 1 259 . 1 1 21 21 ASP C C 21 176.360 176.360 176.069 0.291 17919 106152 1 259 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.089 0.611 17919 106153 1 259 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.355 -0.555 17919 106154 1 259 . 1 1 21 21 ASP H H 21 8.030 8.030 7.430 0.600 17919 106155 1 259 . 1 1 22 22 THR N N 22 108.800 108.800 112.842 -4.042 17919 106156 1 259 . 1 1 22 22 THR HA H 22 4.920 4.920 4.799 0.121 17919 106157 1 259 . 1 1 22 22 THR C C 22 176.750 176.750 176.175 0.575 17919 106158 1 259 . 1 1 22 22 THR CA C 22 59.690 59.690 60.754 -1.064 17919 106159 1 259 . 1 1 22 22 THR CB C 22 71.200 71.200 70.740 0.460 17919 106160 1 259 . 1 1 22 22 THR H H 22 7.900 7.900 8.195 -0.295 17919 106161 1 259 . 1 1 23 23 ILE N N 23 121.190 121.190 122.372 -1.182 17919 106162 1 259 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.771 -0.114 17919 106163 1 259 . 1 1 23 23 ILE C C 23 179.040 179.040 177.659 1.381 17919 106164 1 259 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.256 -0.996 17919 106165 1 259 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.400 -2.050 17919 106166 1 259 . 1 1 23 23 ILE H H 23 8.560 8.560 8.922 -0.362 17919 106167 1 259 . 1 1 24 24 GLU N N 24 120.830 120.830 121.358 -0.528 17919 106168 1 259 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.834 0.083 17919 106169 1 259 . 1 1 24 24 GLU C C 24 178.640 178.640 178.388 0.252 17919 106170 1 259 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.283 -0.063 17919 106171 1 259 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.429 -1.149 17919 106172 1 259 . 1 1 24 24 GLU H H 24 9.760 9.760 8.327 1.433 17919 106173 1 259 . 1 1 25 25 ASN N N 25 120.570 120.570 117.699 2.871 17919 106174 1 259 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.519 0.006 17919 106175 1 259 . 1 1 25 25 ASN C C 25 178.380 178.380 177.950 0.430 17919 106176 1 259 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.169 -0.109 17919 106177 1 259 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.764 -0.314 17919 106178 1 259 . 1 1 25 25 ASN H H 25 7.920 7.920 7.957 -0.037 17919 106179 1 259 . 1 1 26 26 VAL N N 26 121.710 121.710 120.264 1.446 17919 106180 1 259 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.661 -0.264 17919 106181 1 259 . 1 1 26 26 VAL C C 26 177.950 177.950 178.061 -0.111 17919 106182 1 259 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.421 1.239 17919 106183 1 259 . 1 1 26 26 VAL CB C 26 30.840 30.840 30.905 -0.065 17919 106184 1 259 . 1 1 26 26 VAL H H 26 8.070 8.070 8.333 -0.263 17919 106185 1 259 . 1 1 27 27 LYS N N 27 118.860 118.860 120.128 -1.268 17919 106186 1 259 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.252 0.328 17919 106187 1 259 . 1 1 27 27 LYS C C 27 180.550 180.550 179.291 1.259 17919 106188 1 259 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.544 -0.294 17919 106189 1 259 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.195 1.535 17919 106190 1 259 . 1 1 27 27 LYS H H 27 8.560 8.560 8.364 0.196 17919 106191 1 259 . 1 1 28 28 ALA N N 28 123.440 123.440 122.714 0.726 17919 106192 1 259 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.144 0.016 17919 106193 1 259 . 1 1 28 28 ALA C C 28 180.300 180.300 179.409 0.891 17919 106194 1 259 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.034 0.336 17919 106195 1 259 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.427 -0.717 17919 106196 1 259 . 1 1 28 28 ALA H H 28 8.060 8.060 8.570 -0.510 17919 106197 1 259 . 1 1 29 29 LYS N N 29 119.940 119.940 118.292 1.648 17919 106198 1 259 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.096 0.111 17919 106199 1 259 . 1 1 29 29 LYS C C 29 180.320 180.320 178.661 1.659 17919 106200 1 259 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.030 0.620 17919 106201 1 259 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.497 0.793 17919 106202 1 259 . 1 1 29 29 LYS H H 29 7.850 7.850 7.977 -0.127 17919 106203 1 259 . 1 1 30 30 ILE N N 30 121.080 121.080 119.593 1.487 17919 106204 1 259 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.749 -0.242 17919 106205 1 259 . 1 1 30 30 ILE C C 30 178.310 178.310 177.317 0.993 17919 106206 1 259 . 1 1 30 30 ILE CA C 30 66.150 66.150 64.523 1.627 17919 106207 1 259 . 1 1 30 30 ILE CB C 30 36.800 36.800 38.073 -1.273 17919 106208 1 259 . 1 1 30 30 ILE H H 30 8.280 8.280 8.017 0.263 17919 106209 1 259 . 1 1 31 31 GLN N N 31 123.490 123.490 121.357 2.133 17919 106210 1 259 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.036 -0.207 17919 106211 1 259 . 1 1 31 31 GLN C C 31 178.890 178.890 178.253 0.637 17919 106212 1 259 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.295 0.705 17919 106213 1 259 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.515 -0.795 17919 106214 1 259 . 1 1 31 31 GLN H H 31 8.580 8.580 8.313 0.267 17919 106215 1 259 . 1 1 32 32 ASP N N 32 119.360 119.360 118.217 1.143 17919 106216 1 259 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.436 -0.082 17919 106217 1 259 . 1 1 32 32 ASP C C 32 177.250 177.250 177.631 -0.381 17919 106218 1 259 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.504 0.686 17919 106219 1 259 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.781 -0.201 17919 106220 1 259 . 1 1 32 32 ASP H H 32 8.010 8.010 7.842 0.168 17919 106221 1 259 . 1 1 33 33 LYS N N 33 115.130 115.130 117.491 -2.361 17919 106222 1 259 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.369 -0.032 17919 106223 1 259 . 1 1 33 33 LYS C C 33 177.870 177.870 177.903 -0.033 17919 106224 1 259 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.514 0.536 17919 106225 1 259 . 1 1 33 33 LYS CB C 33 34.170 34.170 34.407 -0.238 17919 106226 1 259 . 1 1 33 33 LYS H H 33 7.430 7.430 7.560 -0.130 17919 106227 1 259 . 1 1 34 34 GLU N N 34 113.870 113.870 117.022 -3.152 17919 106228 1 259 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.434 0.191 17919 106229 1 259 . 1 1 34 34 GLU C C 34 177.840 177.840 177.636 0.204 17919 106230 1 259 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.555 -1.385 17919 106231 1 259 . 1 1 34 34 GLU CB C 34 32.660 32.660 30.793 1.867 17919 106232 1 259 . 1 1 34 34 GLU H H 34 8.740 8.740 8.185 0.555 17919 106233 1 259 . 1 1 35 35 GLY N N 35 108.650 108.650 109.323 -0.673 17919 106234 1 259 . 1 1 35 35 GLY C C 35 173.960 173.960 173.977 -0.017 17919 106235 1 259 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.832 0.248 17919 106236 1 259 . 1 1 35 35 GLY H H 35 8.530 8.530 8.342 0.188 17919 106237 1 259 . 1 1 36 36 ILE N N 36 119.880 119.880 121.787 -1.907 17919 106238 1 259 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.393 0.052 17919 106239 1 259 . 1 1 36 36 ILE C C 36 173.590 173.590 174.019 -0.429 17919 106240 1 259 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.502 0.248 17919 106241 1 259 . 1 1 36 36 ILE CB C 36 40.580 40.580 39.704 0.876 17919 106242 1 259 . 1 1 36 36 ILE H H 36 6.150 6.150 7.601 -1.451 17919 106243 1 259 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.489 0.145 17919 106244 1 259 . 1 1 37 37 PRO C C 37 176.940 176.940 176.132 0.808 17919 106245 1 259 . 1 1 37 37 PRO CA C 37 61.660 61.660 62.419 -0.759 17919 106246 1 259 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.001 0.849 17919 106247 1 259 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.107 0.010 17919 106248 1 259 . 1 1 38 38 PRO C C 38 178.320 178.320 178.633 -0.313 17919 106249 1 259 . 1 1 38 38 PRO CA C 38 66.260 66.260 66.070 0.190 17919 106250 1 259 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.787 1.103 17919 106251 1 259 . 1 1 39 39 ASP N N 39 113.380 113.380 115.210 -1.830 17919 106252 1 259 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.429 0.001 17919 106253 1 259 . 1 1 39 39 ASP C C 39 177.090 177.090 177.199 -0.109 17919 106254 1 259 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.529 -0.888 17919 106255 1 259 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.465 -0.925 17919 106256 1 259 . 1 1 39 39 ASP H H 39 8.550 8.550 8.564 -0.014 17919 106257 1 259 . 1 1 40 40 GLN N N 40 116.780 116.780 115.364 1.416 17919 106258 1 259 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.500 -0.036 17919 106259 1 259 . 1 1 40 40 GLN C C 40 175.380 175.380 175.412 -0.032 17919 106260 1 259 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.128 0.512 17919 106261 1 259 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.481 0.659 17919 106262 1 259 . 1 1 40 40 GLN H H 40 7.820 7.820 7.750 0.070 17919 106263 1 259 . 1 1 41 41 GLN N N 41 117.720 117.720 119.534 -1.814 17919 106264 1 259 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.745 -0.501 17919 106265 1 259 . 1 1 41 41 GLN C C 41 176.300 176.300 174.858 1.442 17919 106266 1 259 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.661 0.809 17919 106267 1 259 . 1 1 41 41 GLN CB C 41 31.650 31.650 30.465 1.185 17919 106268 1 259 . 1 1 41 41 GLN H H 41 7.480 7.480 7.376 0.104 17919 106269 1 259 . 1 1 42 42 ARG N N 42 122.680 122.680 122.591 0.089 17919 106270 1 259 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.675 -0.175 17919 106271 1 259 . 1 1 42 42 ARG C C 42 174.050 174.050 174.541 -0.491 17919 106272 1 259 . 1 1 42 42 ARG CA C 42 55.050 55.050 53.577 1.473 17919 106273 1 259 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.201 -0.451 17919 106274 1 259 . 1 1 42 42 ARG H H 42 8.530 8.530 8.775 -0.245 17919 106275 1 259 . 1 1 43 43 LEU N N 43 124.040 124.040 126.474 -2.434 17919 106276 1 259 . 1 1 43 43 LEU C C 43 175.290 175.290 175.761 -0.471 17919 106277 1 259 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.703 -1.723 17919 106278 1 259 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.151 2.639 17919 106279 1 259 . 1 1 43 43 LEU H H 43 8.820 8.820 8.945 -0.125 17919 106280 1 259 . 1 1 44 44 ILE N N 44 121.920 121.920 123.245 -1.325 17919 106281 1 259 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.115 -0.123 17919 106282 1 259 . 1 1 44 44 ILE C C 44 176.060 176.060 174.435 1.625 17919 106283 1 259 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.197 -1.217 17919 106284 1 259 . 1 1 44 44 ILE CB C 44 41.420 41.420 40.826 0.594 17919 106285 1 259 . 1 1 44 44 ILE H H 44 9.030 9.030 9.066 -0.036 17919 106286 1 259 . 1 1 45 45 PHE N N 45 125.390 125.390 127.089 -1.699 17919 106287 1 259 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.855 0.190 17919 106288 1 259 . 1 1 45 45 PHE C C 45 174.470 174.470 174.509 -0.039 17919 106289 1 259 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.370 0.650 17919 106290 1 259 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.915 0.845 17919 106291 1 259 . 1 1 45 45 PHE H H 45 8.830 8.830 8.729 0.101 17919 106292 1 259 . 1 1 46 46 ALA N N 46 132.200 132.200 130.177 2.023 17919 106293 1 259 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.605 0.085 17919 106294 1 259 . 1 1 46 46 ALA C C 46 177.290 177.290 177.384 -0.094 17919 106295 1 259 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.716 -0.176 17919 106296 1 259 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.479 0.091 17919 106297 1 259 . 1 1 46 46 ALA H H 46 8.810 8.810 8.434 0.376 17919 106298 1 259 . 1 1 47 47 GLY N N 47 102.340 102.340 104.134 -1.794 17919 106299 1 259 . 1 1 47 47 GLY C C 47 173.810 173.810 174.510 -0.700 17919 106300 1 259 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.495 -0.145 17919 106301 1 259 . 1 1 47 47 GLY H H 47 8.130 8.130 8.560 -0.430 17919 106302 1 259 . 1 1 48 48 LYS N N 48 121.570 121.570 120.838 0.732 17919 106303 1 259 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.575 0.047 17919 106304 1 259 . 1 1 48 48 LYS C C 48 174.700 174.700 175.241 -0.541 17919 106305 1 259 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.945 -0.395 17919 106306 1 259 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.499 0.031 17919 106307 1 259 . 1 1 48 48 LYS H H 48 7.980 7.980 7.490 0.490 17919 106308 1 259 . 1 1 49 49 GLN N N 49 122.410 122.410 121.975 0.435 17919 106309 1 259 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.822 -0.262 17919 106310 1 259 . 1 1 49 49 GLN C C 49 175.670 175.670 175.919 -0.249 17919 106311 1 259 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.460 0.280 17919 106312 1 259 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.473 -0.473 17919 106313 1 259 . 1 1 49 49 GLN H H 49 8.600 8.600 8.433 0.167 17919 106314 1 259 . 1 1 50 50 LEU N N 50 125.520 125.520 128.258 -2.738 17919 106315 1 259 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.099 -0.009 17919 106316 1 259 . 1 1 50 50 LEU C C 50 176.660 176.660 175.948 0.712 17919 106317 1 259 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.012 0.228 17919 106318 1 259 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.399 -0.829 17919 106319 1 259 . 1 1 50 50 LEU H H 50 8.530 8.530 8.854 -0.324 17919 106320 1 259 . 1 1 51 51 GLU N N 51 122.940 122.940 121.519 1.421 17919 106321 1 259 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.542 -0.054 17919 106322 1 259 . 1 1 51 51 GLU C C 51 175.870 175.870 177.192 -1.322 17919 106323 1 259 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.024 0.936 17919 106324 1 259 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.915 -0.345 17919 106325 1 259 . 1 1 51 51 GLU H H 51 8.400 8.400 7.768 0.632 17919 106326 1 259 . 1 1 52 52 ASP N N 52 120.030 120.030 123.084 -3.054 17919 106327 1 259 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.435 -0.076 17919 106328 1 259 . 1 1 52 52 ASP C C 52 177.330 177.330 177.876 -0.546 17919 106329 1 259 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.359 -0.399 17919 106330 1 259 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.588 0.262 17919 106331 1 259 . 1 1 52 52 ASP H H 52 8.160 8.160 8.837 -0.677 17919 106332 1 259 . 1 1 53 53 GLY N N 53 106.660 106.660 105.059 1.601 17919 106333 1 259 . 1 1 53 53 GLY C C 53 174.870 174.870 174.711 0.159 17919 106334 1 259 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.275 -0.105 17919 106335 1 259 . 1 1 53 53 GLY H H 53 9.390 9.390 8.604 0.786 17919 106336 1 259 . 1 1 54 54 ARG N N 54 119.050 119.050 118.893 0.157 17919 106337 1 259 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.672 0.023 17919 106338 1 259 . 1 1 54 54 ARG C C 54 175.350 175.350 174.742 0.608 17919 106339 1 259 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.477 -0.088 17919 106340 1 259 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.677 -1.027 17919 106341 1 259 . 1 1 54 54 ARG H H 54 7.460 7.460 7.343 0.117 17919 106342 1 259 . 1 1 55 55 THR N N 55 108.400 108.400 110.990 -2.590 17919 106343 1 259 . 1 1 55 55 THR HA H 55 5.240 5.240 5.291 -0.051 17919 106344 1 259 . 1 1 55 55 THR C C 55 176.560 176.560 175.968 0.592 17919 106345 1 259 . 1 1 55 55 THR CA C 55 59.690 59.690 59.641 0.049 17919 106346 1 259 . 1 1 55 55 THR CB C 55 72.260 72.260 71.240 1.020 17919 106347 1 259 . 1 1 55 55 THR H H 55 8.730 8.730 8.815 -0.085 17919 106348 1 259 . 1 1 56 56 LEU N N 56 117.920 117.920 121.990 -4.070 17919 106349 1 259 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.916 0.144 17919 106350 1 259 . 1 1 56 56 LEU C C 56 180.810 180.810 178.654 2.156 17919 106351 1 259 . 1 1 56 56 LEU CA C 56 58.710 58.710 59.325 -0.615 17919 106352 1 259 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.642 -1.272 17919 106353 1 259 . 1 1 56 56 LEU H H 56 8.140 8.140 8.362 -0.222 17919 106354 1 259 . 1 1 57 57 SER N N 57 113.330 113.330 114.606 -1.276 17919 106355 1 259 . 1 1 57 57 SER HA H 57 4.370 4.370 4.078 0.292 17919 106356 1 259 . 1 1 57 57 SER C C 57 178.310 178.310 176.988 1.322 17919 106357 1 259 . 1 1 57 57 SER CA C 57 61.080 61.080 61.763 -0.683 17919 106358 1 259 . 1 1 57 57 SER CB C 57 62.530 62.530 62.845 -0.315 17919 106359 1 259 . 1 1 57 57 SER H H 57 8.470 8.470 8.086 0.384 17919 106360 1 259 . 1 1 58 58 ASP N N 58 124.190 124.190 123.021 1.169 17919 106361 1 259 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.371 -0.075 17919 106362 1 259 . 1 1 58 58 ASP C C 58 177.400 177.400 177.479 -0.079 17919 106363 1 259 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.546 0.634 17919 106364 1 259 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.477 -0.377 17919 106365 1 259 . 1 1 58 58 ASP H H 58 7.930 7.930 7.663 0.267 17919 106366 1 259 . 1 1 59 59 TYR N N 59 115.510 115.510 116.186 -0.676 17919 106367 1 259 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.568 0.102 17919 106368 1 259 . 1 1 59 59 TYR C C 59 174.700 174.700 175.099 -0.399 17919 106369 1 259 . 1 1 59 59 TYR CA C 59 58.250 58.250 56.824 1.426 17919 106370 1 259 . 1 1 59 59 TYR CB C 59 40.070 40.070 37.797 2.273 17919 106371 1 259 . 1 1 59 59 TYR H H 59 7.250 7.250 7.493 -0.243 17919 106372 1 259 . 1 1 60 60 ASN N N 60 115.900 115.900 116.824 -0.924 17919 106373 1 259 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.362 -0.007 17919 106374 1 259 . 1 1 60 60 ASN C C 60 174.340 174.340 174.916 -0.576 17919 106375 1 259 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.299 -0.179 17919 106376 1 259 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.607 -0.197 17919 106377 1 259 . 1 1 60 60 ASN H H 60 8.150 8.150 7.755 0.395 17919 106378 1 259 . 1 1 61 61 ILE N N 61 118.600 118.600 119.188 -0.588 17919 106379 1 259 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.883 -0.490 17919 106380 1 259 . 1 1 61 61 ILE C C 61 174.610 174.610 175.741 -1.131 17919 106381 1 259 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.953 0.467 17919 106382 1 259 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.595 -0.855 17919 106383 1 259 . 1 1 61 61 ILE H H 61 7.250 7.250 8.007 -0.757 17919 106384 1 259 . 1 1 62 62 GLN N N 62 124.740 124.740 125.398 -0.658 17919 106385 1 259 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.643 -0.137 17919 106386 1 259 . 1 1 62 62 GLN C C 62 175.970 175.970 175.767 0.203 17919 106387 1 259 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.783 -0.123 17919 106388 1 259 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.104 0.546 17919 106389 1 259 . 1 1 62 62 GLN H H 62 7.610 7.610 8.097 -0.487 17919 106390 1 259 . 1 1 63 63 LYS N N 63 120.300 120.300 123.813 -3.513 17919 106391 1 259 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.749 0.252 17919 106392 1 259 . 1 1 63 63 LYS C C 63 175.810 175.810 176.610 -0.800 17919 106393 1 259 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.257 -0.467 17919 106394 1 259 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.043 0.607 17919 106395 1 259 . 1 1 63 63 LYS H H 63 8.490 8.490 8.672 -0.182 17919 106396 1 259 . 1 1 64 64 GLU N N 64 113.950 113.950 119.896 -5.946 17919 106397 1 259 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.738 -0.273 17919 106398 1 259 . 1 1 64 64 GLU C C 64 175.250 175.250 175.289 -0.039 17919 106399 1 259 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.721 0.169 17919 106400 1 259 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.933 -3.033 17919 106401 1 259 . 1 1 64 64 GLU H H 64 9.280 9.280 8.943 0.337 17919 106402 1 259 . 1 1 65 65 SER N N 65 114.730 114.730 115.510 -0.780 17919 106403 1 259 . 1 1 65 65 SER HA H 65 4.640 4.640 4.306 0.334 17919 106404 1 259 . 1 1 65 65 SER C C 65 172.160 172.160 173.640 -1.480 17919 106405 1 259 . 1 1 65 65 SER CA C 65 60.890 60.890 60.848 0.042 17919 106406 1 259 . 1 1 65 65 SER CB C 65 64.910 64.910 63.535 1.375 17919 106407 1 259 . 1 1 65 65 SER H H 65 7.670 7.670 7.764 -0.094 17919 106408 1 259 . 1 1 66 66 THR N N 66 117.110 117.110 118.564 -1.454 17919 106409 1 259 . 1 1 66 66 THR HA H 66 5.270 5.270 5.010 0.260 17919 106410 1 259 . 1 1 66 66 THR C C 66 173.950 173.950 173.678 0.272 17919 106411 1 259 . 1 1 66 66 THR CA C 66 62.340 62.340 61.992 0.348 17919 106412 1 259 . 1 1 66 66 THR CB C 66 70.080 70.080 69.892 0.188 17919 106413 1 259 . 1 1 66 66 THR H H 66 8.730 8.730 8.211 0.519 17919 106414 1 259 . 1 1 67 67 LEU N N 67 127.110 127.110 126.794 0.316 17919 106415 1 259 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.842 0.218 17919 106416 1 259 . 1 1 67 67 LEU C C 67 175.770 175.770 175.996 -0.226 17919 106417 1 259 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.782 0.118 17919 106418 1 259 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.976 0.284 17919 106419 1 259 . 1 1 67 67 LEU H H 67 9.410 9.410 9.318 0.092 17919 106420 1 259 . 1 1 68 68 HIS N N 68 118.380 118.380 118.328 0.052 17919 106421 1 259 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.034 0.206 17919 106422 1 259 . 1 1 68 68 HIS C C 68 173.150 173.150 173.782 -0.632 17919 106423 1 259 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.527 0.473 17919 106424 1 259 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.184 -1.654 17919 106425 1 259 . 1 1 68 68 HIS H H 68 9.230 9.230 8.842 0.388 17919 106426 1 259 . 1 1 69 69 LEU N N 69 124.460 124.460 127.396 -2.936 17919 106427 1 259 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.236 -0.046 17919 106428 1 259 . 1 1 69 69 LEU C C 69 175.270 175.270 174.500 0.770 17919 106429 1 259 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.413 0.477 17919 106430 1 259 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.397 -0.017 17919 106431 1 259 . 1 1 69 69 LEU H H 69 8.340 8.340 9.021 -0.681 17919 106432 1 259 . 1 1 70 70 VAL N N 70 126.940 126.940 126.925 0.015 17919 106433 1 259 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.418 -0.068 17919 106434 1 259 . 1 1 70 70 VAL C C 70 174.000 174.000 174.477 -0.477 17919 106435 1 259 . 1 1 70 70 VAL CA C 70 60.800 60.800 61.108 -0.309 17919 106436 1 259 . 1 1 70 70 VAL CB C 70 34.910 34.910 34.255 0.655 17919 106437 1 259 . 1 1 70 70 VAL H H 70 9.200 9.200 9.116 0.084 17919 106438 1 259 . 1 1 71 71 LEU N N 71 123.130 123.130 126.044 -2.914 17919 106439 1 259 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.190 -0.130 17919 106440 1 259 . 1 1 71 71 LEU C C 71 177.830 177.830 177.078 0.752 17919 106441 1 259 . 1 1 71 71 LEU CA C 71 53.940 53.940 52.717 1.223 17919 106442 1 259 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.365 -0.515 17919 106443 1 259 . 1 1 71 71 LEU H H 71 8.120 8.120 8.416 -0.296 17919 106444 1 259 . 1 1 72 72 ARG N N 72 123.490 123.490 123.398 0.092 17919 106445 1 259 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.562 -0.261 17919 106446 1 259 . 1 1 72 72 ARG C C 72 175.350 175.350 174.963 0.387 17919 106447 1 259 . 1 1 72 72 ARG CA C 72 55.610 55.610 54.442 1.168 17919 106448 1 259 . 1 1 72 72 ARG CB C 72 31.350 31.350 32.247 -0.897 17919 106449 1 259 . 1 1 72 72 ARG H H 72 8.580 8.580 8.346 0.234 17919 106450 1 260 . 1 1 2 2 GLN N N 2 123.220 123.220 120.081 3.139 17919 106451 1 260 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.631 -0.382 17919 106452 1 260 . 1 1 2 2 GLN C C 2 175.920 175.920 175.839 0.081 17919 106453 1 260 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.257 0.823 17919 106454 1 260 . 1 1 2 2 GLN CB C 2 30.760 30.760 31.444 -0.684 17919 106455 1 260 . 1 1 2 2 GLN H H 2 8.900 8.900 8.378 0.522 17919 106456 1 260 . 1 1 3 3 ILE N N 3 115.340 115.340 114.032 1.308 17919 106457 1 260 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.420 -0.207 17919 106458 1 260 . 1 1 3 3 ILE C C 3 172.450 172.450 173.453 -1.003 17919 106459 1 260 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.331 0.239 17919 106460 1 260 . 1 1 3 3 ILE CB C 3 42.210 42.210 42.077 0.133 17919 106461 1 260 . 1 1 3 3 ILE H H 3 8.320 8.320 8.139 0.181 17919 106462 1 260 . 1 1 4 4 PHE N N 4 118.110 118.110 119.076 -0.966 17919 106463 1 260 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.701 -0.071 17919 106464 1 260 . 1 1 4 4 PHE C C 4 175.320 175.320 175.186 0.134 17919 106465 1 260 . 1 1 4 4 PHE CA C 4 55.210 55.210 54.616 0.594 17919 106466 1 260 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.786 -0.306 17919 106467 1 260 . 1 1 4 4 PHE H H 4 8.610 8.610 8.246 0.364 17919 106468 1 260 . 1 1 5 5 VAL N N 5 121.000 121.000 121.077 -0.077 17919 106469 1 260 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.952 -0.227 17919 106470 1 260 . 1 1 5 5 VAL C C 5 174.870 174.870 175.162 -0.292 17919 106471 1 260 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.364 -0.744 17919 106472 1 260 . 1 1 5 5 VAL CB C 5 34.230 34.230 35.039 -0.809 17919 106473 1 260 . 1 1 5 5 VAL H H 5 9.300 9.300 9.402 -0.102 17919 106474 1 260 . 1 1 6 6 LYS N N 6 127.520 127.520 127.966 -0.446 17919 106475 1 260 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.421 -0.054 17919 106476 1 260 . 1 1 6 6 LYS C C 6 177.140 177.140 176.833 0.307 17919 106477 1 260 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.801 -0.281 17919 106478 1 260 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.019 0.031 17919 106479 1 260 . 1 1 6 6 LYS H H 6 8.820 8.820 9.289 -0.469 17919 106480 1 260 . 1 1 7 7 THR N N 7 115.400 115.400 116.037 -0.637 17919 106481 1 260 . 1 1 7 7 THR HA H 7 4.970 4.970 4.588 0.382 17919 106482 1 260 . 1 1 7 7 THR C C 7 176.910 176.910 176.819 0.091 17919 106483 1 260 . 1 1 7 7 THR CA C 7 60.470 60.470 61.089 -0.619 17919 106484 1 260 . 1 1 7 7 THR CB C 7 70.630 70.630 70.072 0.558 17919 106485 1 260 . 1 1 7 7 THR H H 7 8.730 8.730 8.622 0.108 17919 106486 1 260 . 1 1 8 8 LEU N N 8 121.330 121.330 121.467 -0.137 17919 106487 1 260 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.359 -0.049 17919 106488 1 260 . 1 1 8 8 LEU C C 8 178.800 178.800 178.055 0.745 17919 106489 1 260 . 1 1 8 8 LEU CA C 8 57.580 57.580 56.884 0.696 17919 106490 1 260 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.582 0.388 17919 106491 1 260 . 1 1 8 8 LEU H H 8 9.100 9.100 9.005 0.095 17919 106492 1 260 . 1 1 9 9 THR N N 9 105.590 105.590 109.720 -4.130 17919 106493 1 260 . 1 1 9 9 THR HA H 9 4.428 4.428 4.355 0.073 17919 106494 1 260 . 1 1 9 9 THR C C 9 175.520 175.520 175.471 0.049 17919 106495 1 260 . 1 1 9 9 THR CA C 9 61.400 61.400 61.793 -0.393 17919 106496 1 260 . 1 1 9 9 THR CB C 9 69.140 69.140 68.953 0.187 17919 106497 1 260 . 1 1 9 9 THR H H 9 7.630 7.630 7.602 0.028 17919 106498 1 260 . 1 1 10 10 GLY N N 10 108.890 108.890 110.906 -2.016 17919 106499 1 260 . 1 1 10 10 GLY C C 10 174.070 174.070 173.508 0.562 17919 106500 1 260 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.919 0.541 17919 106501 1 260 . 1 1 10 10 GLY H H 10 7.810 7.810 7.687 0.123 17919 106502 1 260 . 1 1 11 11 LYS N N 11 121.600 121.600 121.007 0.593 17919 106503 1 260 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.675 -0.314 17919 106504 1 260 . 1 1 11 11 LYS C C 11 175.940 175.940 175.174 0.766 17919 106505 1 260 . 1 1 11 11 LYS CA C 11 56.280 56.280 55.129 1.151 17919 106506 1 260 . 1 1 11 11 LYS CB C 11 33.200 33.200 34.650 -1.450 17919 106507 1 260 . 1 1 11 11 LYS H H 11 7.280 7.280 8.048 -0.768 17919 106508 1 260 . 1 1 12 12 THR N N 12 120.440 120.440 119.797 0.643 17919 106509 1 260 . 1 1 12 12 THR HA H 12 5.046 5.046 5.252 -0.206 17919 106510 1 260 . 1 1 12 12 THR C C 12 174.320 174.320 174.215 0.105 17919 106511 1 260 . 1 1 12 12 THR CA C 12 62.390 62.390 61.638 0.752 17919 106512 1 260 . 1 1 12 12 THR CB C 12 69.910 69.910 70.183 -0.273 17919 106513 1 260 . 1 1 12 12 THR H H 12 8.650 8.650 8.418 0.232 17919 106514 1 260 . 1 1 13 13 ILE N N 13 127.110 127.110 122.546 4.564 17919 106515 1 260 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.666 -0.122 17919 106516 1 260 . 1 1 13 13 ILE C C 13 175.220 175.220 174.465 0.755 17919 106517 1 260 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.540 0.440 17919 106518 1 260 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.673 -0.723 17919 106519 1 260 . 1 1 13 13 ILE H H 13 9.450 9.450 9.111 0.339 17919 106520 1 260 . 1 1 14 14 THR N N 14 121.520 121.520 120.750 0.770 17919 106521 1 260 . 1 1 14 14 THR HA H 14 4.964 4.964 5.492 -0.528 17919 106522 1 260 . 1 1 14 14 THR C C 14 173.790 173.790 173.566 0.224 17919 106523 1 260 . 1 1 14 14 THR CA C 14 61.940 61.940 61.828 0.112 17919 106524 1 260 . 1 1 14 14 THR CB C 14 69.650 69.650 70.541 -0.891 17919 106525 1 260 . 1 1 14 14 THR H H 14 8.710 8.710 8.512 0.198 17919 106526 1 260 . 1 1 15 15 LEU N N 15 124.800 124.800 123.044 1.756 17919 106527 1 260 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.754 0.026 17919 106528 1 260 . 1 1 15 15 LEU C C 15 174.670 174.670 174.993 -0.323 17919 106529 1 260 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.599 -0.768 17919 106530 1 260 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.767 1.303 17919 106531 1 260 . 1 1 15 15 LEU H H 15 8.710 8.710 8.920 -0.210 17919 106532 1 260 . 1 1 16 16 GLU N N 16 122.160 122.160 123.454 -1.294 17919 106533 1 260 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.680 0.237 17919 106534 1 260 . 1 1 16 16 GLU C C 16 175.860 175.860 176.062 -0.202 17919 106535 1 260 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.561 -0.741 17919 106536 1 260 . 1 1 16 16 GLU CB C 16 29.450 29.450 29.673 -0.223 17919 106537 1 260 . 1 1 16 16 GLU H H 16 8.140 8.140 8.734 -0.594 17919 106538 1 260 . 1 1 17 17 VAL N N 17 117.210 117.210 120.277 -3.067 17919 106539 1 260 . 1 1 17 17 VAL HA H 17 4.714 4.714 5.053 -0.339 17919 106540 1 260 . 1 1 17 17 VAL C C 17 174.160 174.160 174.972 -0.812 17919 106541 1 260 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.083 -0.653 17919 106542 1 260 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.882 0.518 17919 106543 1 260 . 1 1 17 17 VAL H H 17 8.900 8.900 8.963 -0.063 17919 106544 1 260 . 1 1 18 18 GLU N N 18 118.990 118.990 123.440 -4.450 17919 106545 1 260 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.795 0.284 17919 106546 1 260 . 1 1 18 18 GLU C C 18 176.160 176.160 175.221 0.939 17919 106547 1 260 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.807 -0.087 17919 106548 1 260 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.443 -0.133 17919 106549 1 260 . 1 1 18 18 GLU H H 18 8.640 8.640 8.879 -0.239 17919 106550 1 260 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.149 -0.008 17919 106551 1 260 . 1 1 19 19 PRO C C 19 175.310 175.310 177.762 -2.452 17919 106552 1 260 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.817 -0.346 17919 106553 1 260 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.933 0.017 17919 106554 1 260 . 1 1 20 20 SER N N 20 103.400 103.400 108.827 -5.427 17919 106555 1 260 . 1 1 20 20 SER HA H 20 4.370 4.370 4.301 0.069 17919 106556 1 260 . 1 1 20 20 SER C C 20 174.660 174.660 174.589 0.071 17919 106557 1 260 . 1 1 20 20 SER CA C 20 57.400 57.400 58.235 -0.835 17919 106558 1 260 . 1 1 20 20 SER CB C 20 63.370 63.370 62.768 0.602 17919 106559 1 260 . 1 1 20 20 SER H H 20 7.040 7.040 7.982 -0.942 17919 106560 1 260 . 1 1 21 21 ASP N N 21 123.480 123.480 124.868 -1.388 17919 106561 1 260 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.660 0.035 17919 106562 1 260 . 1 1 21 21 ASP C C 21 176.360 176.360 176.096 0.264 17919 106563 1 260 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.611 0.089 17919 106564 1 260 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.365 -0.565 17919 106565 1 260 . 1 1 21 21 ASP H H 21 8.030 8.030 7.734 0.296 17919 106566 1 260 . 1 1 22 22 THR N N 22 108.800 108.800 113.646 -4.846 17919 106567 1 260 . 1 1 22 22 THR HA H 22 4.920 4.920 4.623 0.297 17919 106568 1 260 . 1 1 22 22 THR C C 22 176.750 176.750 176.235 0.515 17919 106569 1 260 . 1 1 22 22 THR CA C 22 59.690 59.690 61.759 -2.069 17919 106570 1 260 . 1 1 22 22 THR CB C 22 71.200 71.200 70.787 0.412 17919 106571 1 260 . 1 1 22 22 THR H H 22 7.900 7.900 8.216 -0.316 17919 106572 1 260 . 1 1 23 23 ILE N N 23 121.190 121.190 122.909 -1.719 17919 106573 1 260 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.806 -0.149 17919 106574 1 260 . 1 1 23 23 ILE C C 23 179.040 179.040 178.063 0.977 17919 106575 1 260 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.088 -0.828 17919 106576 1 260 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.284 -1.934 17919 106577 1 260 . 1 1 23 23 ILE H H 23 8.560 8.560 9.115 -0.555 17919 106578 1 260 . 1 1 24 24 GLU N N 24 120.830 120.830 121.564 -0.734 17919 106579 1 260 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.906 0.011 17919 106580 1 260 . 1 1 24 24 GLU C C 24 178.640 178.640 178.564 0.076 17919 106581 1 260 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.880 0.341 17919 106582 1 260 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.475 -1.195 17919 106583 1 260 . 1 1 24 24 GLU H H 24 9.760 9.760 8.336 1.424 17919 106584 1 260 . 1 1 25 25 ASN N N 25 120.570 120.570 118.167 2.403 17919 106585 1 260 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.489 0.036 17919 106586 1 260 . 1 1 25 25 ASN C C 25 178.380 178.380 177.800 0.580 17919 106587 1 260 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.332 -0.272 17919 106588 1 260 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.895 -0.445 17919 106589 1 260 . 1 1 25 25 ASN H H 25 7.920 7.920 7.801 0.119 17919 106590 1 260 . 1 1 26 26 VAL N N 26 121.710 121.710 120.099 1.611 17919 106591 1 260 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.598 -0.201 17919 106592 1 260 . 1 1 26 26 VAL C C 26 177.950 177.950 177.901 0.049 17919 106593 1 260 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.862 0.798 17919 106594 1 260 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.564 -0.724 17919 106595 1 260 . 1 1 26 26 VAL H H 26 8.070 8.070 8.568 -0.498 17919 106596 1 260 . 1 1 27 27 LYS N N 27 118.860 118.860 119.200 -0.340 17919 106597 1 260 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.299 0.281 17919 106598 1 260 . 1 1 27 27 LYS C C 27 180.550 180.550 178.688 1.862 17919 106599 1 260 . 1 1 27 27 LYS CA C 27 59.250 59.250 58.996 0.254 17919 106600 1 260 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.139 1.591 17919 106601 1 260 . 1 1 27 27 LYS H H 27 8.560 8.560 8.239 0.321 17919 106602 1 260 . 1 1 28 28 ALA N N 28 123.440 123.440 123.487 -0.047 17919 106603 1 260 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.252 -0.092 17919 106604 1 260 . 1 1 28 28 ALA C C 28 180.300 180.300 178.891 1.409 17919 106605 1 260 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.708 0.662 17919 106606 1 260 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.538 -0.829 17919 106607 1 260 . 1 1 28 28 ALA H H 28 8.060 8.060 8.272 -0.212 17919 106608 1 260 . 1 1 29 29 LYS N N 29 119.940 119.940 120.022 -0.082 17919 106609 1 260 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.016 0.191 17919 106610 1 260 . 1 1 29 29 LYS C C 29 180.320 180.320 178.947 1.373 17919 106611 1 260 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.501 0.149 17919 106612 1 260 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.357 0.933 17919 106613 1 260 . 1 1 29 29 LYS H H 29 7.850 7.850 8.139 -0.289 17919 106614 1 260 . 1 1 30 30 ILE N N 30 121.080 121.080 120.413 0.667 17919 106615 1 260 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.590 -0.083 17919 106616 1 260 . 1 1 30 30 ILE C C 30 178.310 178.310 177.207 1.103 17919 106617 1 260 . 1 1 30 30 ILE CA C 30 66.150 66.150 66.100 0.050 17919 106618 1 260 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.843 -1.043 17919 106619 1 260 . 1 1 30 30 ILE H H 30 8.280 8.280 8.597 -0.317 17919 106620 1 260 . 1 1 31 31 GLN N N 31 123.490 123.490 119.845 3.645 17919 106621 1 260 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.938 -0.109 17919 106622 1 260 . 1 1 31 31 GLN C C 31 178.890 178.890 178.028 0.862 17919 106623 1 260 . 1 1 31 31 GLN CA C 31 60.000 60.000 58.886 1.115 17919 106624 1 260 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.503 -0.783 17919 106625 1 260 . 1 1 31 31 GLN H H 31 8.580 8.580 7.781 0.799 17919 106626 1 260 . 1 1 32 32 ASP N N 32 119.360 119.360 119.788 -0.428 17919 106627 1 260 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.369 -0.015 17919 106628 1 260 . 1 1 32 32 ASP C C 32 177.250 177.250 178.278 -1.028 17919 106629 1 260 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.880 0.310 17919 106630 1 260 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.967 -0.387 17919 106631 1 260 . 1 1 32 32 ASP H H 32 8.010 8.010 8.187 -0.177 17919 106632 1 260 . 1 1 33 33 LYS N N 33 115.130 115.130 119.154 -4.024 17919 106633 1 260 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.164 0.173 17919 106634 1 260 . 1 1 33 33 LYS C C 33 177.870 177.870 178.439 -0.569 17919 106635 1 260 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.392 -0.342 17919 106636 1 260 . 1 1 33 33 LYS CB C 33 34.170 34.170 32.973 1.197 17919 106637 1 260 . 1 1 33 33 LYS H H 33 7.430 7.430 7.763 -0.333 17919 106638 1 260 . 1 1 34 34 GLU N N 34 113.870 113.870 113.817 0.053 17919 106639 1 260 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.498 0.127 17919 106640 1 260 . 1 1 34 34 GLU C C 34 177.840 177.840 176.860 0.980 17919 106641 1 260 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.886 -0.716 17919 106642 1 260 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.584 1.076 17919 106643 1 260 . 1 1 34 34 GLU H H 34 8.740 8.740 8.443 0.297 17919 106644 1 260 . 1 1 35 35 GLY N N 35 108.650 108.650 108.467 0.183 17919 106645 1 260 . 1 1 35 35 GLY C C 35 173.960 173.960 174.545 -0.585 17919 106646 1 260 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.672 0.408 17919 106647 1 260 . 1 1 35 35 GLY H H 35 8.530 8.530 7.741 0.789 17919 106648 1 260 . 1 1 36 36 ILE N N 36 119.880 119.880 121.505 -1.625 17919 106649 1 260 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.390 0.055 17919 106650 1 260 . 1 1 36 36 ILE C C 36 173.590 173.590 174.259 -0.669 17919 106651 1 260 . 1 1 36 36 ILE CA C 36 57.750 57.750 56.511 1.239 17919 106652 1 260 . 1 1 36 36 ILE CB C 36 40.580 40.580 36.757 3.823 17919 106653 1 260 . 1 1 36 36 ILE H H 36 6.150 6.150 7.713 -1.563 17919 106654 1 260 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.547 0.087 17919 106655 1 260 . 1 1 37 37 PRO C C 37 176.940 176.940 176.422 0.518 17919 106656 1 260 . 1 1 37 37 PRO CA C 37 61.660 61.660 62.230 -0.570 17919 106657 1 260 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.476 0.374 17919 106658 1 260 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.323 -0.206 17919 106659 1 260 . 1 1 38 38 PRO C C 38 178.320 178.320 178.357 -0.037 17919 106660 1 260 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.098 1.162 17919 106661 1 260 . 1 1 38 38 PRO CB C 38 32.890 32.890 32.052 0.838 17919 106662 1 260 . 1 1 39 39 ASP N N 39 113.380 113.380 118.464 -5.084 17919 106663 1 260 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.365 0.065 17919 106664 1 260 . 1 1 39 39 ASP C C 39 177.090 177.090 177.724 -0.634 17919 106665 1 260 . 1 1 39 39 ASP CA C 39 55.640 55.640 57.126 -1.486 17919 106666 1 260 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.483 -0.942 17919 106667 1 260 . 1 1 39 39 ASP H H 39 8.550 8.550 8.804 -0.254 17919 106668 1 260 . 1 1 40 40 GLN N N 40 116.780 116.780 117.788 -1.008 17919 106669 1 260 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.264 0.200 17919 106670 1 260 . 1 1 40 40 GLN C C 40 175.380 175.380 176.179 -0.799 17919 106671 1 260 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.717 -1.077 17919 106672 1 260 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.759 0.381 17919 106673 1 260 . 1 1 40 40 GLN H H 40 7.820 7.820 7.863 -0.043 17919 106674 1 260 . 1 1 41 41 GLN N N 41 117.720 117.720 119.572 -1.852 17919 106675 1 260 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.146 0.098 17919 106676 1 260 . 1 1 41 41 GLN C C 41 176.300 176.300 174.862 1.438 17919 106677 1 260 . 1 1 41 41 GLN CA C 41 56.470 56.470 57.188 -0.718 17919 106678 1 260 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.404 2.246 17919 106679 1 260 . 1 1 41 41 GLN H H 41 7.480 7.480 7.501 -0.021 17919 106680 1 260 . 1 1 42 42 ARG N N 42 122.680 122.680 121.168 1.512 17919 106681 1 260 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.642 -0.142 17919 106682 1 260 . 1 1 42 42 ARG C C 42 174.050 174.050 174.354 -0.304 17919 106683 1 260 . 1 1 42 42 ARG CA C 42 55.050 55.050 53.809 1.241 17919 106684 1 260 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.240 -1.490 17919 106685 1 260 . 1 1 42 42 ARG H H 42 8.530 8.530 8.519 0.011 17919 106686 1 260 . 1 1 43 43 LEU N N 43 124.040 124.040 124.487 -0.447 17919 106687 1 260 . 1 1 43 43 LEU C C 43 175.290 175.290 176.198 -0.908 17919 106688 1 260 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.762 -0.782 17919 106689 1 260 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.599 1.191 17919 106690 1 260 . 1 1 43 43 LEU H H 43 8.820 8.820 8.773 0.047 17919 106691 1 260 . 1 1 44 44 ILE N N 44 121.920 121.920 119.971 1.949 17919 106692 1 260 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.950 0.042 17919 106693 1 260 . 1 1 44 44 ILE C C 44 176.060 176.060 174.315 1.745 17919 106694 1 260 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.262 -1.282 17919 106695 1 260 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.740 -0.320 17919 106696 1 260 . 1 1 44 44 ILE H H 44 9.030 9.030 8.865 0.165 17919 106697 1 260 . 1 1 45 45 PHE N N 45 125.390 125.390 125.207 0.183 17919 106698 1 260 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.943 0.102 17919 106699 1 260 . 1 1 45 45 PHE C C 45 174.470 174.470 174.307 0.163 17919 106700 1 260 . 1 1 45 45 PHE CA C 45 57.020 57.020 57.431 -0.411 17919 106701 1 260 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.708 0.052 17919 106702 1 260 . 1 1 45 45 PHE H H 45 8.830 8.830 9.247 -0.417 17919 106703 1 260 . 1 1 46 46 ALA N N 46 132.200 132.200 128.172 4.028 17919 106704 1 260 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.639 0.051 17919 106705 1 260 . 1 1 46 46 ALA C C 46 177.290 177.290 178.496 -1.206 17919 106706 1 260 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.294 0.246 17919 106707 1 260 . 1 1 46 46 ALA CB C 46 16.570 16.570 17.008 -0.438 17919 106708 1 260 . 1 1 46 46 ALA H H 46 8.810 8.810 8.465 0.345 17919 106709 1 260 . 1 1 47 47 GLY N N 47 102.340 102.340 102.840 -0.500 17919 106710 1 260 . 1 1 47 47 GLY C C 47 173.810 173.810 174.446 -0.636 17919 106711 1 260 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.321 0.029 17919 106712 1 260 . 1 1 47 47 GLY H H 47 8.130 8.130 8.590 -0.460 17919 106713 1 260 . 1 1 48 48 LYS N N 48 121.570 121.570 121.138 0.432 17919 106714 1 260 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.573 0.049 17919 106715 1 260 . 1 1 48 48 LYS C C 48 174.700 174.700 175.362 -0.662 17919 106716 1 260 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.975 -0.425 17919 106717 1 260 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.401 0.129 17919 106718 1 260 . 1 1 48 48 LYS H H 48 7.980 7.980 7.915 0.065 17919 106719 1 260 . 1 1 49 49 GLN N N 49 122.410 122.410 123.281 -0.871 17919 106720 1 260 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.423 0.137 17919 106721 1 260 . 1 1 49 49 GLN C C 49 175.670 175.670 175.840 -0.170 17919 106722 1 260 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.995 -0.255 17919 106723 1 260 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.515 -0.515 17919 106724 1 260 . 1 1 49 49 GLN H H 49 8.600 8.600 8.587 0.013 17919 106725 1 260 . 1 1 50 50 LEU N N 50 125.520 125.520 128.618 -3.098 17919 106726 1 260 . 1 1 50 50 LEU HA H 50 4.090 4.090 3.926 0.164 17919 106727 1 260 . 1 1 50 50 LEU C C 50 176.660 176.660 176.152 0.508 17919 106728 1 260 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.487 -0.247 17919 106729 1 260 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.215 -0.645 17919 106730 1 260 . 1 1 50 50 LEU H H 50 8.530 8.530 8.166 0.364 17919 106731 1 260 . 1 1 51 51 GLU N N 51 122.940 122.940 122.601 0.339 17919 106732 1 260 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.515 -0.027 17919 106733 1 260 . 1 1 51 51 GLU C C 51 175.870 175.870 177.059 -1.189 17919 106734 1 260 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.519 0.441 17919 106735 1 260 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.494 0.076 17919 106736 1 260 . 1 1 51 51 GLU H H 51 8.400 8.400 8.313 0.087 17919 106737 1 260 . 1 1 52 52 ASP N N 52 120.030 120.030 124.671 -4.641 17919 106738 1 260 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.384 -0.025 17919 106739 1 260 . 1 1 52 52 ASP C C 52 177.330 177.330 177.902 -0.572 17919 106740 1 260 . 1 1 52 52 ASP CA C 52 56.960 56.960 58.086 -1.126 17919 106741 1 260 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.718 0.132 17919 106742 1 260 . 1 1 52 52 ASP H H 52 8.160 8.160 8.921 -0.761 17919 106743 1 260 . 1 1 53 53 GLY N N 53 106.660 106.660 104.482 2.178 17919 106744 1 260 . 1 1 53 53 GLY C C 53 174.870 174.870 174.080 0.790 17919 106745 1 260 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.880 0.290 17919 106746 1 260 . 1 1 53 53 GLY H H 53 9.390 9.390 8.435 0.955 17919 106747 1 260 . 1 1 54 54 ARG N N 54 119.050 119.050 119.800 -0.750 17919 106748 1 260 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.740 -0.045 17919 106749 1 260 . 1 1 54 54 ARG C C 54 175.350 175.350 175.094 0.256 17919 106750 1 260 . 1 1 54 54 ARG CA C 54 54.390 54.390 53.899 0.491 17919 106751 1 260 . 1 1 54 54 ARG CB C 54 32.650 32.650 34.122 -1.472 17919 106752 1 260 . 1 1 54 54 ARG H H 54 7.460 7.460 7.454 0.006 17919 106753 1 260 . 1 1 55 55 THR N N 55 108.400 108.400 111.348 -2.948 17919 106754 1 260 . 1 1 55 55 THR HA H 55 5.240 5.240 5.050 0.190 17919 106755 1 260 . 1 1 55 55 THR C C 55 176.560 176.560 176.472 0.088 17919 106756 1 260 . 1 1 55 55 THR CA C 55 59.690 59.690 60.266 -0.576 17919 106757 1 260 . 1 1 55 55 THR CB C 55 72.260 72.260 71.169 1.091 17919 106758 1 260 . 1 1 55 55 THR H H 55 8.730 8.730 8.965 -0.235 17919 106759 1 260 . 1 1 56 56 LEU N N 56 117.920 117.920 122.113 -4.193 17919 106760 1 260 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.950 0.110 17919 106761 1 260 . 1 1 56 56 LEU C C 56 180.810 180.810 178.900 1.910 17919 106762 1 260 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.387 0.323 17919 106763 1 260 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.447 -1.077 17919 106764 1 260 . 1 1 56 56 LEU H H 56 8.140 8.140 8.863 -0.723 17919 106765 1 260 . 1 1 57 57 SER N N 57 113.330 113.330 113.811 -0.481 17919 106766 1 260 . 1 1 57 57 SER HA H 57 4.370 4.370 4.234 0.136 17919 106767 1 260 . 1 1 57 57 SER C C 57 178.310 178.310 177.093 1.217 17919 106768 1 260 . 1 1 57 57 SER CA C 57 61.080 61.080 61.017 0.063 17919 106769 1 260 . 1 1 57 57 SER CB C 57 62.530 62.530 62.569 -0.039 17919 106770 1 260 . 1 1 57 57 SER H H 57 8.470 8.470 7.919 0.551 17919 106771 1 260 . 1 1 58 58 ASP N N 58 124.190 124.190 123.206 0.984 17919 106772 1 260 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.221 0.075 17919 106773 1 260 . 1 1 58 58 ASP C C 58 177.400 177.400 177.602 -0.202 17919 106774 1 260 . 1 1 58 58 ASP CA C 58 57.180 57.180 57.072 0.108 17919 106775 1 260 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.571 -0.471 17919 106776 1 260 . 1 1 58 58 ASP H H 58 7.930 7.930 7.901 0.029 17919 106777 1 260 . 1 1 59 59 TYR N N 59 115.510 115.510 115.155 0.355 17919 106778 1 260 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.573 0.097 17919 106779 1 260 . 1 1 59 59 TYR C C 59 174.700 174.700 174.623 0.077 17919 106780 1 260 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.731 0.519 17919 106781 1 260 . 1 1 59 59 TYR CB C 59 40.070 40.070 37.960 2.110 17919 106782 1 260 . 1 1 59 59 TYR H H 59 7.250 7.250 7.543 -0.293 17919 106783 1 260 . 1 1 60 60 ASN N N 60 115.900 115.900 114.206 1.694 17919 106784 1 260 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.401 -0.046 17919 106785 1 260 . 1 1 60 60 ASN C C 60 174.340 174.340 174.492 -0.152 17919 106786 1 260 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.604 -0.484 17919 106787 1 260 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.204 0.206 17919 106788 1 260 . 1 1 60 60 ASN H H 60 8.150 8.150 7.685 0.465 17919 106789 1 260 . 1 1 61 61 ILE N N 61 118.600 118.600 119.690 -1.090 17919 106790 1 260 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.861 -0.468 17919 106791 1 260 . 1 1 61 61 ILE C C 61 174.610 174.610 175.503 -0.893 17919 106792 1 260 . 1 1 61 61 ILE CA C 61 62.420 62.420 60.687 1.734 17919 106793 1 260 . 1 1 61 61 ILE CB C 61 36.740 36.740 36.509 0.231 17919 106794 1 260 . 1 1 61 61 ILE H H 61 7.250 7.250 7.944 -0.694 17919 106795 1 260 . 1 1 62 62 GLN N N 62 124.740 124.740 124.707 0.033 17919 106796 1 260 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.519 -0.013 17919 106797 1 260 . 1 1 62 62 GLN C C 62 175.970 175.970 175.870 0.100 17919 106798 1 260 . 1 1 62 62 GLN CA C 62 53.660 53.660 54.274 -0.614 17919 106799 1 260 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.010 0.640 17919 106800 1 260 . 1 1 62 62 GLN H H 62 7.610 7.610 8.222 -0.612 17919 106801 1 260 . 1 1 63 63 LYS N N 63 120.300 120.300 121.387 -1.087 17919 106802 1 260 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.967 0.034 17919 106803 1 260 . 1 1 63 63 LYS C C 63 175.810 175.810 176.651 -0.841 17919 106804 1 260 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.369 0.421 17919 106805 1 260 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.315 0.335 17919 106806 1 260 . 1 1 63 63 LYS H H 63 8.490 8.490 8.526 -0.036 17919 106807 1 260 . 1 1 64 64 GLU N N 64 113.950 113.950 116.565 -2.615 17919 106808 1 260 . 1 1 64 64 GLU HA H 64 3.465 3.465 2.986 0.479 17919 106809 1 260 . 1 1 64 64 GLU C C 64 175.250 175.250 175.162 0.088 17919 106810 1 260 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.896 -0.006 17919 106811 1 260 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.592 -2.692 17919 106812 1 260 . 1 1 64 64 GLU H H 64 9.280 9.280 8.815 0.465 17919 106813 1 260 . 1 1 65 65 SER N N 65 114.730 114.730 114.564 0.166 17919 106814 1 260 . 1 1 65 65 SER HA H 65 4.640 4.640 4.419 0.221 17919 106815 1 260 . 1 1 65 65 SER C C 65 172.160 172.160 173.630 -1.470 17919 106816 1 260 . 1 1 65 65 SER CA C 65 60.890 60.890 58.836 2.054 17919 106817 1 260 . 1 1 65 65 SER CB C 65 64.910 64.910 64.035 0.875 17919 106818 1 260 . 1 1 65 65 SER H H 65 7.670 7.670 7.398 0.272 17919 106819 1 260 . 1 1 66 66 THR N N 66 117.110 117.110 119.876 -2.766 17919 106820 1 260 . 1 1 66 66 THR HA H 66 5.270 5.270 5.182 0.088 17919 106821 1 260 . 1 1 66 66 THR C C 66 173.950 173.950 173.904 0.046 17919 106822 1 260 . 1 1 66 66 THR CA C 66 62.340 62.340 61.920 0.420 17919 106823 1 260 . 1 1 66 66 THR CB C 66 70.080 70.080 70.064 0.016 17919 106824 1 260 . 1 1 66 66 THR H H 66 8.730 8.730 8.369 0.361 17919 106825 1 260 . 1 1 67 67 LEU N N 67 127.110 127.110 126.272 0.838 17919 106826 1 260 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.921 0.139 17919 106827 1 260 . 1 1 67 67 LEU C C 67 175.770 175.770 175.166 0.604 17919 106828 1 260 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.630 0.270 17919 106829 1 260 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.448 -0.188 17919 106830 1 260 . 1 1 67 67 LEU H H 67 9.410 9.410 8.959 0.451 17919 106831 1 260 . 1 1 68 68 HIS N N 68 118.380 118.380 120.679 -2.299 17919 106832 1 260 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.170 0.070 17919 106833 1 260 . 1 1 68 68 HIS C C 68 173.150 173.150 173.667 -0.517 17919 106834 1 260 . 1 1 68 68 HIS CA C 68 55.000 55.000 53.741 1.259 17919 106835 1 260 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.689 -2.159 17919 106836 1 260 . 1 1 68 68 HIS H H 68 9.230 9.230 8.549 0.681 17919 106837 1 260 . 1 1 69 69 LEU N N 69 124.460 124.460 129.895 -5.435 17919 106838 1 260 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.117 0.073 17919 106839 1 260 . 1 1 69 69 LEU C C 69 175.270 175.270 174.595 0.675 17919 106840 1 260 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.494 0.396 17919 106841 1 260 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.515 -0.135 17919 106842 1 260 . 1 1 69 69 LEU H H 69 8.340 8.340 8.301 0.039 17919 106843 1 260 . 1 1 70 70 VAL N N 70 126.940 126.940 122.623 4.317 17919 106844 1 260 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.498 -0.148 17919 106845 1 260 . 1 1 70 70 VAL C C 70 174.000 174.000 173.475 0.525 17919 106846 1 260 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.672 0.128 17919 106847 1 260 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.441 -0.531 17919 106848 1 260 . 1 1 70 70 VAL H H 70 9.200 9.200 8.945 0.255 17919 106849 1 260 . 1 1 71 71 LEU N N 71 123.130 123.130 124.471 -1.341 17919 106850 1 260 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.162 -0.102 17919 106851 1 260 . 1 1 71 71 LEU C C 71 177.830 177.830 177.140 0.690 17919 106852 1 260 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.148 0.792 17919 106853 1 260 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.722 -0.872 17919 106854 1 260 . 1 1 71 71 LEU H H 71 8.120 8.120 8.309 -0.189 17919 106855 1 260 . 1 1 72 72 ARG N N 72 123.490 123.490 122.605 0.885 17919 106856 1 260 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.309 -0.008 17919 106857 1 260 . 1 1 72 72 ARG C C 72 175.350 175.350 175.940 -0.590 17919 106858 1 260 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.231 -0.621 17919 106859 1 260 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.822 0.528 17919 106860 1 260 . 1 1 72 72 ARG H H 72 8.580 8.580 8.323 0.257 17919 106861 1 261 . 1 1 2 2 GLN N N 2 123.220 123.220 123.302 -0.082 17919 106862 1 261 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.284 -0.035 17919 106863 1 261 . 1 1 2 2 GLN C C 2 175.920 175.920 174.412 1.508 17919 106864 1 261 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.471 0.609 17919 106865 1 261 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.774 -0.014 17919 106866 1 261 . 1 1 2 2 GLN H H 2 8.900 8.900 8.671 0.229 17919 106867 1 261 . 1 1 3 3 ILE N N 3 115.340 115.340 120.293 -4.953 17919 106868 1 261 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.668 -0.455 17919 106869 1 261 . 1 1 3 3 ILE C C 3 172.450 172.450 173.636 -1.186 17919 106870 1 261 . 1 1 3 3 ILE CA C 3 59.570 59.570 58.755 0.815 17919 106871 1 261 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.494 0.716 17919 106872 1 261 . 1 1 3 3 ILE H H 3 8.320 8.320 8.156 0.164 17919 106873 1 261 . 1 1 4 4 PHE N N 4 118.110 118.110 120.575 -2.465 17919 106874 1 261 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.288 0.342 17919 106875 1 261 . 1 1 4 4 PHE C C 4 175.320 175.320 175.198 0.122 17919 106876 1 261 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.637 -0.427 17919 106877 1 261 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.604 -0.124 17919 106878 1 261 . 1 1 4 4 PHE H H 4 8.610 8.610 8.631 -0.021 17919 106879 1 261 . 1 1 5 5 VAL N N 5 121.000 121.000 122.739 -1.739 17919 106880 1 261 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.786 -0.061 17919 106881 1 261 . 1 1 5 5 VAL C C 5 174.870 174.870 175.143 -0.273 17919 106882 1 261 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.248 -0.628 17919 106883 1 261 . 1 1 5 5 VAL CB C 5 34.230 34.230 32.792 1.438 17919 106884 1 261 . 1 1 5 5 VAL H H 5 9.300 9.300 9.355 -0.055 17919 106885 1 261 . 1 1 6 6 LYS N N 6 127.520 127.520 130.299 -2.779 17919 106886 1 261 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.062 0.305 17919 106887 1 261 . 1 1 6 6 LYS C C 6 177.140 177.140 176.554 0.586 17919 106888 1 261 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.311 0.209 17919 106889 1 261 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.020 1.030 17919 106890 1 261 . 1 1 6 6 LYS H H 6 8.820 8.820 9.244 -0.424 17919 106891 1 261 . 1 1 7 7 THR N N 7 115.400 115.400 119.320 -3.920 17919 106892 1 261 . 1 1 7 7 THR HA H 7 4.970 4.970 4.710 0.260 17919 106893 1 261 . 1 1 7 7 THR C C 7 176.910 176.910 176.081 0.829 17919 106894 1 261 . 1 1 7 7 THR CA C 7 60.470 60.470 61.119 -0.649 17919 106895 1 261 . 1 1 7 7 THR CB C 7 70.630 70.630 70.246 0.384 17919 106896 1 261 . 1 1 7 7 THR H H 7 8.730 8.730 8.984 -0.254 17919 106897 1 261 . 1 1 8 8 LEU N N 8 121.330 121.330 122.351 -1.021 17919 106898 1 261 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.267 0.043 17919 106899 1 261 . 1 1 8 8 LEU C C 8 178.800 178.800 177.403 1.397 17919 106900 1 261 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.618 -0.038 17919 106901 1 261 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.025 -0.055 17919 106902 1 261 . 1 1 8 8 LEU H H 8 9.100 9.100 8.559 0.541 17919 106903 1 261 . 1 1 9 9 THR N N 9 105.590 105.590 109.209 -3.619 17919 106904 1 261 . 1 1 9 9 THR HA H 9 4.428 4.428 4.394 0.034 17919 106905 1 261 . 1 1 9 9 THR C C 9 175.520 175.520 175.432 0.088 17919 106906 1 261 . 1 1 9 9 THR CA C 9 61.400 61.400 61.128 0.272 17919 106907 1 261 . 1 1 9 9 THR CB C 9 69.140 69.140 68.919 0.221 17919 106908 1 261 . 1 1 9 9 THR H H 9 7.630 7.630 7.467 0.163 17919 106909 1 261 . 1 1 10 10 GLY N N 10 108.890 108.890 110.259 -1.369 17919 106910 1 261 . 1 1 10 10 GLY C C 10 174.070 174.070 174.442 -0.372 17919 106911 1 261 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.580 -0.120 17919 106912 1 261 . 1 1 10 10 GLY H H 10 7.810 7.810 8.125 -0.315 17919 106913 1 261 . 1 1 11 11 LYS N N 11 121.600 121.600 121.143 0.457 17919 106914 1 261 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.473 -0.112 17919 106915 1 261 . 1 1 11 11 LYS C C 11 175.940 175.940 175.636 0.304 17919 106916 1 261 . 1 1 11 11 LYS CA C 11 56.280 56.280 54.790 1.490 17919 106917 1 261 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.032 0.168 17919 106918 1 261 . 1 1 11 11 LYS H H 11 7.280 7.280 7.669 -0.389 17919 106919 1 261 . 1 1 12 12 THR N N 12 120.440 120.440 119.705 0.735 17919 106920 1 261 . 1 1 12 12 THR HA H 12 5.046 5.046 4.955 0.091 17919 106921 1 261 . 1 1 12 12 THR C C 12 174.320 174.320 174.635 -0.315 17919 106922 1 261 . 1 1 12 12 THR CA C 12 62.390 62.390 62.158 0.231 17919 106923 1 261 . 1 1 12 12 THR CB C 12 69.910 69.910 69.628 0.282 17919 106924 1 261 . 1 1 12 12 THR H H 12 8.650 8.650 8.280 0.370 17919 106925 1 261 . 1 1 13 13 ILE N N 13 127.110 127.110 128.399 -1.289 17919 106926 1 261 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.446 0.098 17919 106927 1 261 . 1 1 13 13 ILE C C 13 175.220 175.220 175.385 -0.165 17919 106928 1 261 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.516 -0.536 17919 106929 1 261 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.873 0.077 17919 106930 1 261 . 1 1 13 13 ILE H H 13 9.450 9.450 9.235 0.215 17919 106931 1 261 . 1 1 14 14 THR N N 14 121.520 121.520 123.229 -1.709 17919 106932 1 261 . 1 1 14 14 THR HA H 14 4.964 4.964 4.830 0.134 17919 106933 1 261 . 1 1 14 14 THR C C 14 173.790 173.790 174.026 -0.236 17919 106934 1 261 . 1 1 14 14 THR CA C 14 61.940 61.940 62.554 -0.614 17919 106935 1 261 . 1 1 14 14 THR CB C 14 69.650 69.650 69.486 0.164 17919 106936 1 261 . 1 1 14 14 THR H H 14 8.710 8.710 8.486 0.224 17919 106937 1 261 . 1 1 15 15 LEU N N 15 124.800 124.800 127.445 -2.645 17919 106938 1 261 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.665 0.115 17919 106939 1 261 . 1 1 15 15 LEU C C 15 174.670 174.670 175.569 -0.899 17919 106940 1 261 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.362 -0.532 17919 106941 1 261 . 1 1 15 15 LEU CB C 15 47.070 47.070 44.951 2.119 17919 106942 1 261 . 1 1 15 15 LEU H H 15 8.710 8.710 8.392 0.318 17919 106943 1 261 . 1 1 16 16 GLU N N 16 122.160 122.160 121.310 0.850 17919 106944 1 261 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.152 -0.235 17919 106945 1 261 . 1 1 16 16 GLU C C 16 175.860 175.860 175.515 0.345 17919 106946 1 261 . 1 1 16 16 GLU CA C 16 54.820 54.820 54.786 0.034 17919 106947 1 261 . 1 1 16 16 GLU CB C 16 29.450 29.450 31.297 -1.847 17919 106948 1 261 . 1 1 16 16 GLU H H 16 8.140 8.140 8.512 -0.372 17919 106949 1 261 . 1 1 17 17 VAL N N 17 117.210 117.210 119.207 -1.997 17919 106950 1 261 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.869 -0.155 17919 106951 1 261 . 1 1 17 17 VAL C C 17 174.160 174.160 175.042 -0.882 17919 106952 1 261 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.358 -0.928 17919 106953 1 261 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.362 1.038 17919 106954 1 261 . 1 1 17 17 VAL H H 17 8.900 8.900 8.752 0.148 17919 106955 1 261 . 1 1 18 18 GLU N N 18 118.990 118.990 122.890 -3.900 17919 106956 1 261 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.792 0.287 17919 106957 1 261 . 1 1 18 18 GLU C C 18 176.160 176.160 175.575 0.585 17919 106958 1 261 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.684 0.035 17919 106959 1 261 . 1 1 18 18 GLU CB C 18 30.310 30.310 29.700 0.610 17919 106960 1 261 . 1 1 18 18 GLU H H 18 8.640 8.640 9.028 -0.388 17919 106961 1 261 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.211 -0.070 17919 106962 1 261 . 1 1 19 19 PRO C C 19 175.310 175.310 177.381 -2.071 17919 106963 1 261 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.767 -0.297 17919 106964 1 261 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.811 0.139 17919 106965 1 261 . 1 1 20 20 SER N N 20 103.400 103.400 108.645 -5.245 17919 106966 1 261 . 1 1 20 20 SER HA H 20 4.370 4.370 4.233 0.137 17919 106967 1 261 . 1 1 20 20 SER C C 20 174.660 174.660 174.274 0.386 17919 106968 1 261 . 1 1 20 20 SER CA C 20 57.400 57.400 58.813 -1.413 17919 106969 1 261 . 1 1 20 20 SER CB C 20 63.370 63.370 62.548 0.822 17919 106970 1 261 . 1 1 20 20 SER H H 20 7.040 7.040 8.316 -1.276 17919 106971 1 261 . 1 1 21 21 ASP N N 21 123.480 123.480 124.229 -0.749 17919 106972 1 261 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.824 -0.129 17919 106973 1 261 . 1 1 21 21 ASP C C 21 176.360 176.360 175.836 0.524 17919 106974 1 261 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.752 0.949 17919 106975 1 261 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.933 -1.133 17919 106976 1 261 . 1 1 21 21 ASP H H 21 8.030 8.030 8.053 -0.023 17919 106977 1 261 . 1 1 22 22 THR N N 22 108.800 108.800 113.150 -4.350 17919 106978 1 261 . 1 1 22 22 THR HA H 22 4.920 4.920 4.684 0.236 17919 106979 1 261 . 1 1 22 22 THR C C 22 176.750 176.750 176.050 0.700 17919 106980 1 261 . 1 1 22 22 THR CA C 22 59.690 59.690 61.130 -1.440 17919 106981 1 261 . 1 1 22 22 THR CB C 22 71.200 71.200 70.348 0.852 17919 106982 1 261 . 1 1 22 22 THR H H 22 7.900 7.900 8.324 -0.424 17919 106983 1 261 . 1 1 23 23 ILE N N 23 121.190 121.190 121.883 -0.693 17919 106984 1 261 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.782 -0.125 17919 106985 1 261 . 1 1 23 23 ILE C C 23 179.040 179.040 177.914 1.126 17919 106986 1 261 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.344 -1.084 17919 106987 1 261 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.359 -2.009 17919 106988 1 261 . 1 1 23 23 ILE H H 23 8.560 8.560 8.524 0.036 17919 106989 1 261 . 1 1 24 24 GLU N N 24 120.830 120.830 120.629 0.201 17919 106990 1 261 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.973 -0.056 17919 106991 1 261 . 1 1 24 24 GLU C C 24 178.640 178.640 178.499 0.141 17919 106992 1 261 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.901 0.319 17919 106993 1 261 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.307 -1.027 17919 106994 1 261 . 1 1 24 24 GLU H H 24 9.760 9.760 8.326 1.434 17919 106995 1 261 . 1 1 25 25 ASN N N 25 120.570 120.570 117.168 3.402 17919 106996 1 261 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.549 -0.024 17919 106997 1 261 . 1 1 25 25 ASN C C 25 178.380 178.380 177.883 0.497 17919 106998 1 261 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.670 0.390 17919 106999 1 261 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.658 -0.208 17919 107000 1 261 . 1 1 25 25 ASN H H 25 7.920 7.920 7.614 0.306 17919 107001 1 261 . 1 1 26 26 VAL N N 26 121.710 121.710 121.169 0.541 17919 107002 1 261 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.671 -0.274 17919 107003 1 261 . 1 1 26 26 VAL C C 26 177.950 177.950 177.561 0.389 17919 107004 1 261 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.251 1.409 17919 107005 1 261 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.209 -0.369 17919 107006 1 261 . 1 1 26 26 VAL H H 26 8.070 8.070 7.988 0.082 17919 107007 1 261 . 1 1 27 27 LYS N N 27 118.860 118.860 120.637 -1.777 17919 107008 1 261 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.215 0.365 17919 107009 1 261 . 1 1 27 27 LYS C C 27 180.550 180.550 179.173 1.377 17919 107010 1 261 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.925 -0.675 17919 107011 1 261 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.193 1.537 17919 107012 1 261 . 1 1 27 27 LYS H H 27 8.560 8.560 8.242 0.318 17919 107013 1 261 . 1 1 28 28 ALA N N 28 123.440 123.440 120.285 3.155 17919 107014 1 261 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.214 -0.054 17919 107015 1 261 . 1 1 28 28 ALA C C 28 180.300 180.300 179.053 1.247 17919 107016 1 261 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.647 0.723 17919 107017 1 261 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.538 -0.828 17919 107018 1 261 . 1 1 28 28 ALA H H 28 8.060 8.060 8.364 -0.304 17919 107019 1 261 . 1 1 29 29 LYS N N 29 119.940 119.940 119.890 0.050 17919 107020 1 261 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.086 0.121 17919 107021 1 261 . 1 1 29 29 LYS C C 29 180.320 180.320 179.255 1.065 17919 107022 1 261 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.218 0.432 17919 107023 1 261 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.313 0.977 17919 107024 1 261 . 1 1 29 29 LYS H H 29 7.850 7.850 7.394 0.456 17919 107025 1 261 . 1 1 30 30 ILE N N 30 121.080 121.080 121.305 -0.225 17919 107026 1 261 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.592 -0.085 17919 107027 1 261 . 1 1 30 30 ILE C C 30 178.310 178.310 177.321 0.989 17919 107028 1 261 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.275 0.875 17919 107029 1 261 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.714 -0.914 17919 107030 1 261 . 1 1 30 30 ILE H H 30 8.280 8.280 8.332 -0.053 17919 107031 1 261 . 1 1 31 31 GLN N N 31 123.490 123.490 120.763 2.727 17919 107032 1 261 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.034 -0.205 17919 107033 1 261 . 1 1 31 31 GLN C C 31 178.890 178.890 178.379 0.511 17919 107034 1 261 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.197 0.803 17919 107035 1 261 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.576 -0.856 17919 107036 1 261 . 1 1 31 31 GLN H H 31 8.580 8.580 8.485 0.095 17919 107037 1 261 . 1 1 32 32 ASP N N 32 119.360 119.360 119.085 0.275 17919 107038 1 261 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.430 -0.076 17919 107039 1 261 . 1 1 32 32 ASP C C 32 177.250 177.250 178.048 -0.798 17919 107040 1 261 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.771 0.419 17919 107041 1 261 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.853 -0.273 17919 107042 1 261 . 1 1 32 32 ASP H H 32 8.010 8.010 8.305 -0.295 17919 107043 1 261 . 1 1 33 33 LYS N N 33 115.130 115.130 118.253 -3.123 17919 107044 1 261 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.239 0.098 17919 107045 1 261 . 1 1 33 33 LYS C C 33 177.870 177.870 178.417 -0.547 17919 107046 1 261 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.427 -0.377 17919 107047 1 261 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.512 0.658 17919 107048 1 261 . 1 1 33 33 LYS H H 33 7.430 7.430 7.426 0.004 17919 107049 1 261 . 1 1 34 34 GLU N N 34 113.870 113.870 115.446 -1.576 17919 107050 1 261 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.446 0.179 17919 107051 1 261 . 1 1 34 34 GLU C C 34 177.840 177.840 177.365 0.475 17919 107052 1 261 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.234 -1.064 17919 107053 1 261 . 1 1 34 34 GLU CB C 34 32.660 32.660 30.873 1.787 17919 107054 1 261 . 1 1 34 34 GLU H H 34 8.740 8.740 8.325 0.415 17919 107055 1 261 . 1 1 35 35 GLY N N 35 108.650 108.650 108.805 -0.155 17919 107056 1 261 . 1 1 35 35 GLY C C 35 173.960 173.960 174.220 -0.260 17919 107057 1 261 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.749 0.331 17919 107058 1 261 . 1 1 35 35 GLY H H 35 8.530 8.530 8.312 0.218 17919 107059 1 261 . 1 1 36 36 ILE N N 36 119.880 119.880 122.631 -2.751 17919 107060 1 261 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.357 0.088 17919 107061 1 261 . 1 1 36 36 ILE C C 36 173.590 173.590 174.573 -0.983 17919 107062 1 261 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.788 -0.038 17919 107063 1 261 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.864 1.716 17919 107064 1 261 . 1 1 36 36 ILE H H 36 6.150 6.150 7.659 -1.509 17919 107065 1 261 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.499 0.135 17919 107066 1 261 . 1 1 37 37 PRO C C 37 176.940 176.940 176.296 0.644 17919 107067 1 261 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.758 -0.098 17919 107068 1 261 . 1 1 37 37 PRO CB C 37 31.850 31.850 30.991 0.859 17919 107069 1 261 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.285 -0.168 17919 107070 1 261 . 1 1 38 38 PRO C C 38 178.320 178.320 177.970 0.350 17919 107071 1 261 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.313 0.947 17919 107072 1 261 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.891 0.999 17919 107073 1 261 . 1 1 39 39 ASP N N 39 113.380 113.380 116.158 -2.778 17919 107074 1 261 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.319 0.111 17919 107075 1 261 . 1 1 39 39 ASP C C 39 177.090 177.090 177.305 -0.215 17919 107076 1 261 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.673 -1.033 17919 107077 1 261 . 1 1 39 39 ASP CB C 39 39.540 39.540 39.156 0.384 17919 107078 1 261 . 1 1 39 39 ASP H H 39 8.550 8.550 8.855 -0.305 17919 107079 1 261 . 1 1 40 40 GLN N N 40 116.780 116.780 118.602 -1.822 17919 107080 1 261 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.308 0.156 17919 107081 1 261 . 1 1 40 40 GLN C C 40 175.380 175.380 175.647 -0.267 17919 107082 1 261 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.242 -0.602 17919 107083 1 261 . 1 1 40 40 GLN CB C 40 30.140 30.140 30.098 0.042 17919 107084 1 261 . 1 1 40 40 GLN H H 40 7.820 7.820 7.637 0.183 17919 107085 1 261 . 1 1 41 41 GLN N N 41 117.720 117.720 120.163 -2.443 17919 107086 1 261 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.088 0.156 17919 107087 1 261 . 1 1 41 41 GLN C C 41 176.300 176.300 175.288 1.012 17919 107088 1 261 . 1 1 41 41 GLN CA C 41 56.470 56.470 57.308 -0.838 17919 107089 1 261 . 1 1 41 41 GLN CB C 41 31.650 31.650 28.822 2.828 17919 107090 1 261 . 1 1 41 41 GLN H H 41 7.480 7.480 7.477 0.003 17919 107091 1 261 . 1 1 42 42 ARG N N 42 122.680 122.680 122.299 0.381 17919 107092 1 261 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.613 -0.113 17919 107093 1 261 . 1 1 42 42 ARG C C 42 174.050 174.050 174.386 -0.336 17919 107094 1 261 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.782 0.268 17919 107095 1 261 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.334 -1.584 17919 107096 1 261 . 1 1 42 42 ARG H H 42 8.530 8.530 8.498 0.032 17919 107097 1 261 . 1 1 43 43 LEU N N 43 124.040 124.040 124.824 -0.784 17919 107098 1 261 . 1 1 43 43 LEU C C 43 175.290 175.290 175.370 -0.080 17919 107099 1 261 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.928 -0.948 17919 107100 1 261 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.139 2.651 17919 107101 1 261 . 1 1 43 43 LEU H H 43 8.820 8.820 8.872 -0.052 17919 107102 1 261 . 1 1 44 44 ILE N N 44 121.920 121.920 123.577 -1.657 17919 107103 1 261 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.695 0.297 17919 107104 1 261 . 1 1 44 44 ILE C C 44 176.060 176.060 173.939 2.121 17919 107105 1 261 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.438 -0.458 17919 107106 1 261 . 1 1 44 44 ILE CB C 44 41.420 41.420 39.591 1.829 17919 107107 1 261 . 1 1 44 44 ILE H H 44 9.030 9.030 9.292 -0.262 17919 107108 1 261 . 1 1 45 45 PHE N N 45 125.390 125.390 127.559 -2.169 17919 107109 1 261 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.976 0.069 17919 107110 1 261 . 1 1 45 45 PHE C C 45 174.470 174.470 174.279 0.191 17919 107111 1 261 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.074 0.946 17919 107112 1 261 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.636 1.124 17919 107113 1 261 . 1 1 45 45 PHE H H 45 8.830 8.830 9.134 -0.304 17919 107114 1 261 . 1 1 46 46 ALA N N 46 132.200 132.200 131.130 1.070 17919 107115 1 261 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.703 -0.013 17919 107116 1 261 . 1 1 46 46 ALA C C 46 177.290 177.290 177.536 -0.246 17919 107117 1 261 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.489 0.051 17919 107118 1 261 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.370 0.199 17919 107119 1 261 . 1 1 46 46 ALA H H 46 8.810 8.810 8.823 -0.013 17919 107120 1 261 . 1 1 47 47 GLY N N 47 102.340 102.340 103.620 -1.280 17919 107121 1 261 . 1 1 47 47 GLY C C 47 173.810 173.810 173.986 -0.176 17919 107122 1 261 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.122 0.228 17919 107123 1 261 . 1 1 47 47 GLY H H 47 8.130 8.130 8.472 -0.342 17919 107124 1 261 . 1 1 48 48 LYS N N 48 121.570 121.570 120.022 1.548 17919 107125 1 261 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.621 0.001 17919 107126 1 261 . 1 1 48 48 LYS C C 48 174.700 174.700 174.959 -0.259 17919 107127 1 261 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.647 -0.097 17919 107128 1 261 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.334 0.196 17919 107129 1 261 . 1 1 48 48 LYS H H 48 7.980 7.980 7.597 0.383 17919 107130 1 261 . 1 1 49 49 GLN N N 49 122.410 122.410 125.344 -2.934 17919 107131 1 261 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.282 0.278 17919 107132 1 261 . 1 1 49 49 GLN C C 49 175.670 175.670 175.432 0.238 17919 107133 1 261 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.977 -0.237 17919 107134 1 261 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.231 -0.231 17919 107135 1 261 . 1 1 49 49 GLN H H 49 8.600 8.600 8.579 0.021 17919 107136 1 261 . 1 1 50 50 LEU N N 50 125.520 125.520 129.341 -3.821 17919 107137 1 261 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.311 -0.221 17919 107138 1 261 . 1 1 50 50 LEU C C 50 176.660 176.660 175.772 0.888 17919 107139 1 261 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.758 0.483 17919 107140 1 261 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.069 -0.499 17919 107141 1 261 . 1 1 50 50 LEU H H 50 8.530 8.530 8.887 -0.357 17919 107142 1 261 . 1 1 51 51 GLU N N 51 122.940 122.940 124.026 -1.086 17919 107143 1 261 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.337 0.151 17919 107144 1 261 . 1 1 51 51 GLU C C 51 175.870 175.870 177.436 -1.566 17919 107145 1 261 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.807 0.152 17919 107146 1 261 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.719 -0.149 17919 107147 1 261 . 1 1 51 51 GLU H H 51 8.400 8.400 8.483 -0.083 17919 107148 1 261 . 1 1 52 52 ASP N N 52 120.030 120.030 126.739 -6.709 17919 107149 1 261 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.456 -0.097 17919 107150 1 261 . 1 1 52 52 ASP C C 52 177.330 177.330 177.830 -0.500 17919 107151 1 261 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.392 -0.432 17919 107152 1 261 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.546 0.304 17919 107153 1 261 . 1 1 52 52 ASP H H 52 8.160 8.160 8.859 -0.699 17919 107154 1 261 . 1 1 53 53 GLY N N 53 106.660 106.660 105.045 1.615 17919 107155 1 261 . 1 1 53 53 GLY C C 53 174.870 174.870 173.900 0.970 17919 107156 1 261 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.636 0.534 17919 107157 1 261 . 1 1 53 53 GLY H H 53 9.390 9.390 8.452 0.938 17919 107158 1 261 . 1 1 54 54 ARG N N 54 119.050 119.050 120.257 -1.207 17919 107159 1 261 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.669 0.026 17919 107160 1 261 . 1 1 54 54 ARG C C 54 175.350 175.350 174.686 0.664 17919 107161 1 261 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.309 0.081 17919 107162 1 261 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.468 0.182 17919 107163 1 261 . 1 1 54 54 ARG H H 54 7.460 7.460 7.526 -0.066 17919 107164 1 261 . 1 1 55 55 THR N N 55 108.400 108.400 114.273 -5.873 17919 107165 1 261 . 1 1 55 55 THR HA H 55 5.240 5.240 5.050 0.190 17919 107166 1 261 . 1 1 55 55 THR C C 55 176.560 176.560 175.865 0.695 17919 107167 1 261 . 1 1 55 55 THR CA C 55 59.690 59.690 60.836 -1.146 17919 107168 1 261 . 1 1 55 55 THR CB C 55 72.260 72.260 70.391 1.869 17919 107169 1 261 . 1 1 55 55 THR H H 55 8.730 8.730 8.142 0.588 17919 107170 1 261 . 1 1 56 56 LEU N N 56 117.920 117.920 122.105 -4.185 17919 107171 1 261 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.027 0.033 17919 107172 1 261 . 1 1 56 56 LEU C C 56 180.810 180.810 178.692 2.118 17919 107173 1 261 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.467 0.243 17919 107174 1 261 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.207 -0.837 17919 107175 1 261 . 1 1 56 56 LEU H H 56 8.140 8.140 8.798 -0.658 17919 107176 1 261 . 1 1 57 57 SER N N 57 113.330 113.330 114.164 -0.834 17919 107177 1 261 . 1 1 57 57 SER HA H 57 4.370 4.370 4.123 0.247 17919 107178 1 261 . 1 1 57 57 SER C C 57 178.310 178.310 176.976 1.334 17919 107179 1 261 . 1 1 57 57 SER CA C 57 61.080 61.080 61.345 -0.265 17919 107180 1 261 . 1 1 57 57 SER CB C 57 62.530 62.530 62.650 -0.120 17919 107181 1 261 . 1 1 57 57 SER H H 57 8.470 8.470 8.677 -0.207 17919 107182 1 261 . 1 1 58 58 ASP N N 58 124.190 124.190 122.723 1.467 17919 107183 1 261 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.360 -0.064 17919 107184 1 261 . 1 1 58 58 ASP C C 58 177.400 177.400 177.074 0.326 17919 107185 1 261 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.327 0.853 17919 107186 1 261 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.520 -0.420 17919 107187 1 261 . 1 1 58 58 ASP H H 58 7.930 7.930 7.624 0.306 17919 107188 1 261 . 1 1 59 59 TYR N N 59 115.510 115.510 115.329 0.181 17919 107189 1 261 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.501 0.169 17919 107190 1 261 . 1 1 59 59 TYR C C 59 174.700 174.700 174.966 -0.266 17919 107191 1 261 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.790 0.460 17919 107192 1 261 . 1 1 59 59 TYR CB C 59 40.070 40.070 37.643 2.427 17919 107193 1 261 . 1 1 59 59 TYR H H 59 7.250 7.250 7.253 -0.003 17919 107194 1 261 . 1 1 60 60 ASN N N 60 115.900 115.900 114.281 1.619 17919 107195 1 261 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.418 -0.063 17919 107196 1 261 . 1 1 60 60 ASN C C 60 174.340 174.340 174.573 -0.233 17919 107197 1 261 . 1 1 60 60 ASN CA C 60 54.120 54.120 53.845 0.275 17919 107198 1 261 . 1 1 60 60 ASN CB C 60 37.410 37.410 36.756 0.654 17919 107199 1 261 . 1 1 60 60 ASN H H 60 8.150 8.150 7.928 0.222 17919 107200 1 261 . 1 1 61 61 ILE N N 61 118.600 118.600 120.230 -1.630 17919 107201 1 261 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.713 -0.320 17919 107202 1 261 . 1 1 61 61 ILE C C 61 174.610 174.610 175.320 -0.710 17919 107203 1 261 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.464 -0.044 17919 107204 1 261 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.516 -0.776 17919 107205 1 261 . 1 1 61 61 ILE H H 61 7.250 7.250 7.736 -0.486 17919 107206 1 261 . 1 1 62 62 GLN N N 62 124.740 124.740 125.239 -0.499 17919 107207 1 261 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.765 -0.259 17919 107208 1 261 . 1 1 62 62 GLN C C 62 175.970 175.970 175.699 0.271 17919 107209 1 261 . 1 1 62 62 GLN CA C 62 53.660 53.660 52.850 0.810 17919 107210 1 261 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.656 -0.006 17919 107211 1 261 . 1 1 62 62 GLN H H 62 7.610 7.610 7.876 -0.266 17919 107212 1 261 . 1 1 63 63 LYS N N 63 120.300 120.300 120.383 -0.083 17919 107213 1 261 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.136 -0.135 17919 107214 1 261 . 1 1 63 63 LYS C C 63 175.810 175.810 177.393 -1.583 17919 107215 1 261 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.949 -0.159 17919 107216 1 261 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.236 0.414 17919 107217 1 261 . 1 1 63 63 LYS H H 63 8.490 8.490 8.598 -0.108 17919 107218 1 261 . 1 1 64 64 GLU N N 64 113.950 113.950 118.554 -4.604 17919 107219 1 261 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.893 -0.428 17919 107220 1 261 . 1 1 64 64 GLU C C 64 175.250 175.250 175.890 -0.640 17919 107221 1 261 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.625 0.265 17919 107222 1 261 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.069 -2.169 17919 107223 1 261 . 1 1 64 64 GLU H H 64 9.280 9.280 9.057 0.223 17919 107224 1 261 . 1 1 65 65 SER N N 65 114.730 114.730 115.568 -0.838 17919 107225 1 261 . 1 1 65 65 SER HA H 65 4.640 4.640 4.640 0.000 17919 107226 1 261 . 1 1 65 65 SER C C 65 172.160 172.160 174.121 -1.961 17919 107227 1 261 . 1 1 65 65 SER CA C 65 60.890 60.890 59.991 0.899 17919 107228 1 261 . 1 1 65 65 SER CB C 65 64.910 64.910 64.005 0.905 17919 107229 1 261 . 1 1 65 65 SER H H 65 7.670 7.670 7.788 -0.118 17919 107230 1 261 . 1 1 66 66 THR N N 66 117.110 117.110 120.743 -3.633 17919 107231 1 261 . 1 1 66 66 THR HA H 66 5.270 5.270 5.100 0.170 17919 107232 1 261 . 1 1 66 66 THR C C 66 173.950 173.950 174.150 -0.200 17919 107233 1 261 . 1 1 66 66 THR CA C 66 62.340 62.340 62.117 0.223 17919 107234 1 261 . 1 1 66 66 THR CB C 66 70.080 70.080 70.028 0.052 17919 107235 1 261 . 1 1 66 66 THR H H 66 8.730 8.730 8.451 0.279 17919 107236 1 261 . 1 1 67 67 LEU N N 67 127.110 127.110 126.603 0.507 17919 107237 1 261 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.881 0.179 17919 107238 1 261 . 1 1 67 67 LEU C C 67 175.770 175.770 175.598 0.172 17919 107239 1 261 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.886 0.014 17919 107240 1 261 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.909 0.351 17919 107241 1 261 . 1 1 67 67 LEU H H 67 9.410 9.410 9.221 0.189 17919 107242 1 261 . 1 1 68 68 HIS N N 68 118.380 118.380 121.264 -2.884 17919 107243 1 261 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.162 0.078 17919 107244 1 261 . 1 1 68 68 HIS C C 68 173.150 173.150 174.049 -0.899 17919 107245 1 261 . 1 1 68 68 HIS CA C 68 55.000 55.000 55.268 -0.268 17919 107246 1 261 . 1 1 68 68 HIS CB C 68 30.530 30.530 31.591 -1.062 17919 107247 1 261 . 1 1 68 68 HIS H H 68 9.230 9.230 9.046 0.184 17919 107248 1 261 . 1 1 69 69 LEU N N 69 124.460 124.460 129.302 -4.842 17919 107249 1 261 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.946 0.244 17919 107250 1 261 . 1 1 69 69 LEU C C 69 175.270 175.270 174.464 0.806 17919 107251 1 261 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.912 -0.022 17919 107252 1 261 . 1 1 69 69 LEU CB C 69 44.380 44.380 43.397 0.983 17919 107253 1 261 . 1 1 69 69 LEU H H 69 8.340 8.340 9.052 -0.712 17919 107254 1 261 . 1 1 70 70 VAL N N 70 126.940 126.940 124.202 2.738 17919 107255 1 261 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.658 -0.308 17919 107256 1 261 . 1 1 70 70 VAL C C 70 174.000 174.000 173.452 0.548 17919 107257 1 261 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.849 0.951 17919 107258 1 261 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.346 -0.436 17919 107259 1 261 . 1 1 70 70 VAL H H 70 9.200 9.200 9.051 0.149 17919 107260 1 261 . 1 1 71 71 LEU N N 71 123.130 123.130 125.679 -2.549 17919 107261 1 261 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.008 0.051 17919 107262 1 261 . 1 1 71 71 LEU C C 71 177.830 177.830 177.520 0.310 17919 107263 1 261 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.311 0.629 17919 107264 1 261 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.622 -0.772 17919 107265 1 261 . 1 1 71 71 LEU H H 71 8.120 8.120 8.460 -0.340 17919 107266 1 261 . 1 1 72 72 ARG N N 72 123.490 123.490 123.564 -0.074 17919 107267 1 261 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.424 -0.123 17919 107268 1 261 . 1 1 72 72 ARG C C 72 175.350 175.350 176.017 -0.667 17919 107269 1 261 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.670 -1.060 17919 107270 1 261 . 1 1 72 72 ARG CB C 72 31.350 31.350 28.869 2.481 17919 107271 1 261 . 1 1 72 72 ARG H H 72 8.580 8.580 8.670 -0.090 17919 107272 1 262 . 1 1 2 2 GLN N N 2 123.220 123.220 122.482 0.738 17919 107273 1 262 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.445 -0.196 17919 107274 1 262 . 1 1 2 2 GLN C C 2 175.920 175.920 174.905 1.015 17919 107275 1 262 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.505 0.575 17919 107276 1 262 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.884 -0.124 17919 107277 1 262 . 1 1 2 2 GLN H H 2 8.900 8.900 8.430 0.470 17919 107278 1 262 . 1 1 3 3 ILE N N 3 115.340 115.340 119.195 -3.855 17919 107279 1 262 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.508 -0.295 17919 107280 1 262 . 1 1 3 3 ILE C C 3 172.450 172.450 173.219 -0.769 17919 107281 1 262 . 1 1 3 3 ILE CA C 3 59.570 59.570 58.995 0.575 17919 107282 1 262 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.924 0.286 17919 107283 1 262 . 1 1 3 3 ILE H H 3 8.320 8.320 8.491 -0.171 17919 107284 1 262 . 1 1 4 4 PHE N N 4 118.110 118.110 119.283 -1.173 17919 107285 1 262 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.586 0.044 17919 107286 1 262 . 1 1 4 4 PHE C C 4 175.320 175.320 175.655 -0.335 17919 107287 1 262 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.903 -0.693 17919 107288 1 262 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.785 -0.305 17919 107289 1 262 . 1 1 4 4 PHE H H 4 8.610 8.610 8.571 0.039 17919 107290 1 262 . 1 1 5 5 VAL N N 5 121.000 121.000 115.496 5.504 17919 107291 1 262 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.602 0.123 17919 107292 1 262 . 1 1 5 5 VAL C C 5 174.870 174.870 174.479 0.391 17919 107293 1 262 . 1 1 5 5 VAL CA C 5 60.620 60.620 60.589 0.031 17919 107294 1 262 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.526 -0.296 17919 107295 1 262 . 1 1 5 5 VAL H H 5 9.300 9.300 9.066 0.234 17919 107296 1 262 . 1 1 6 6 LYS N N 6 127.520 127.520 127.943 -0.423 17919 107297 1 262 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.245 0.122 17919 107298 1 262 . 1 1 6 6 LYS C C 6 177.140 177.140 176.750 0.390 17919 107299 1 262 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.136 0.384 17919 107300 1 262 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.509 -0.459 17919 107301 1 262 . 1 1 6 6 LYS H H 6 8.820 8.820 8.729 0.091 17919 107302 1 262 . 1 1 7 7 THR N N 7 115.400 115.400 119.065 -3.665 17919 107303 1 262 . 1 1 7 7 THR HA H 7 4.970 4.970 4.332 0.638 17919 107304 1 262 . 1 1 7 7 THR C C 7 176.910 176.910 176.354 0.556 17919 107305 1 262 . 1 1 7 7 THR CA C 7 60.470 60.470 62.079 -1.609 17919 107306 1 262 . 1 1 7 7 THR CB C 7 70.630 70.630 69.648 0.982 17919 107307 1 262 . 1 1 7 7 THR H H 7 8.730 8.730 8.534 0.196 17919 107308 1 262 . 1 1 8 8 LEU N N 8 121.330 121.330 122.213 -0.883 17919 107309 1 262 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.227 0.083 17919 107310 1 262 . 1 1 8 8 LEU C C 8 178.800 178.800 177.410 1.390 17919 107311 1 262 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.538 0.042 17919 107312 1 262 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.539 0.431 17919 107313 1 262 . 1 1 8 8 LEU H H 8 9.100 9.100 8.614 0.486 17919 107314 1 262 . 1 1 9 9 THR N N 9 105.590 105.590 108.914 -3.324 17919 107315 1 262 . 1 1 9 9 THR HA H 9 4.428 4.428 4.372 0.056 17919 107316 1 262 . 1 1 9 9 THR C C 9 175.520 175.520 174.745 0.775 17919 107317 1 262 . 1 1 9 9 THR CA C 9 61.400 61.400 61.847 -0.447 17919 107318 1 262 . 1 1 9 9 THR CB C 9 69.140 69.140 68.830 0.310 17919 107319 1 262 . 1 1 9 9 THR H H 9 7.630 7.630 7.900 -0.270 17919 107320 1 262 . 1 1 10 10 GLY N N 10 108.890 108.890 110.239 -1.349 17919 107321 1 262 . 1 1 10 10 GLY C C 10 174.070 174.070 174.435 -0.365 17919 107322 1 262 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.367 0.093 17919 107323 1 262 . 1 1 10 10 GLY H H 10 7.810 7.810 7.729 0.081 17919 107324 1 262 . 1 1 11 11 LYS N N 11 121.600 121.600 121.267 0.333 17919 107325 1 262 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.306 0.055 17919 107326 1 262 . 1 1 11 11 LYS C C 11 175.940 175.940 175.401 0.539 17919 107327 1 262 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.692 -0.412 17919 107328 1 262 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.329 -0.129 17919 107329 1 262 . 1 1 11 11 LYS H H 11 7.280 7.280 7.916 -0.636 17919 107330 1 262 . 1 1 12 12 THR N N 12 120.440 120.440 113.156 7.284 17919 107331 1 262 . 1 1 12 12 THR HA H 12 5.046 5.046 5.007 0.039 17919 107332 1 262 . 1 1 12 12 THR C C 12 174.320 174.320 174.194 0.126 17919 107333 1 262 . 1 1 12 12 THR CA C 12 62.390 62.390 60.693 1.697 17919 107334 1 262 . 1 1 12 12 THR CB C 12 69.910 69.910 70.225 -0.315 17919 107335 1 262 . 1 1 12 12 THR H H 12 8.650 8.650 8.134 0.516 17919 107336 1 262 . 1 1 13 13 ILE N N 13 127.110 127.110 124.517 2.593 17919 107337 1 262 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.449 0.095 17919 107338 1 262 . 1 1 13 13 ILE C C 13 175.220 175.220 175.383 -0.163 17919 107339 1 262 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.994 -0.014 17919 107340 1 262 . 1 1 13 13 ILE CB C 13 40.950 40.950 42.210 -1.260 17919 107341 1 262 . 1 1 13 13 ILE H H 13 9.450 9.450 8.610 0.840 17919 107342 1 262 . 1 1 14 14 THR N N 14 121.520 121.520 120.904 0.616 17919 107343 1 262 . 1 1 14 14 THR HA H 14 4.964 4.964 4.885 0.079 17919 107344 1 262 . 1 1 14 14 THR C C 14 173.790 173.790 173.589 0.201 17919 107345 1 262 . 1 1 14 14 THR CA C 14 61.940 61.940 62.454 -0.514 17919 107346 1 262 . 1 1 14 14 THR CB C 14 69.650 69.650 69.606 0.044 17919 107347 1 262 . 1 1 14 14 THR H H 14 8.710 8.710 8.416 0.294 17919 107348 1 262 . 1 1 15 15 LEU N N 15 124.800 124.800 127.218 -2.418 17919 107349 1 262 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.747 0.033 17919 107350 1 262 . 1 1 15 15 LEU C C 15 174.670 174.670 175.398 -0.728 17919 107351 1 262 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.547 -0.717 17919 107352 1 262 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.144 1.926 17919 107353 1 262 . 1 1 15 15 LEU H H 15 8.710 8.710 9.024 -0.314 17919 107354 1 262 . 1 1 16 16 GLU N N 16 122.160 122.160 121.811 0.349 17919 107355 1 262 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.196 -0.279 17919 107356 1 262 . 1 1 16 16 GLU C C 16 175.860 175.860 175.645 0.215 17919 107357 1 262 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.946 -1.126 17919 107358 1 262 . 1 1 16 16 GLU CB C 16 29.450 29.450 31.197 -1.747 17919 107359 1 262 . 1 1 16 16 GLU H H 16 8.140 8.140 8.538 -0.398 17919 107360 1 262 . 1 1 17 17 VAL N N 17 117.210 117.210 117.130 0.080 17919 107361 1 262 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.716 -0.002 17919 107362 1 262 . 1 1 17 17 VAL C C 17 174.160 174.160 174.740 -0.580 17919 107363 1 262 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.387 -0.957 17919 107364 1 262 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.465 0.935 17919 107365 1 262 . 1 1 17 17 VAL H H 17 8.900 8.900 8.777 0.123 17919 107366 1 262 . 1 1 18 18 GLU N N 18 118.990 118.990 121.837 -2.847 17919 107367 1 262 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.713 0.366 17919 107368 1 262 . 1 1 18 18 GLU C C 18 176.160 176.160 175.324 0.836 17919 107369 1 262 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.208 -0.488 17919 107370 1 262 . 1 1 18 18 GLU CB C 18 30.310 30.310 29.992 0.318 17919 107371 1 262 . 1 1 18 18 GLU H H 18 8.640 8.640 8.737 -0.097 17919 107372 1 262 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.339 -0.198 17919 107373 1 262 . 1 1 19 19 PRO C C 19 175.310 175.310 177.324 -2.014 17919 107374 1 262 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.192 0.278 17919 107375 1 262 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.913 0.037 17919 107376 1 262 . 1 1 20 20 SER N N 20 103.400 103.400 110.272 -6.872 17919 107377 1 262 . 1 1 20 20 SER HA H 20 4.370 4.370 4.311 0.059 17919 107378 1 262 . 1 1 20 20 SER C C 20 174.660 174.660 174.028 0.632 17919 107379 1 262 . 1 1 20 20 SER CA C 20 57.400 57.400 59.695 -2.295 17919 107380 1 262 . 1 1 20 20 SER CB C 20 63.370 63.370 62.759 0.611 17919 107381 1 262 . 1 1 20 20 SER H H 20 7.040 7.040 8.041 -1.001 17919 107382 1 262 . 1 1 21 21 ASP N N 21 123.480 123.480 123.212 0.268 17919 107383 1 262 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.706 -0.011 17919 107384 1 262 . 1 1 21 21 ASP C C 21 176.360 176.360 176.090 0.270 17919 107385 1 262 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.072 0.628 17919 107386 1 262 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.331 -0.531 17919 107387 1 262 . 1 1 21 21 ASP H H 21 8.030 8.030 7.550 0.480 17919 107388 1 262 . 1 1 22 22 THR N N 22 108.800 108.800 113.884 -5.084 17919 107389 1 262 . 1 1 22 22 THR HA H 22 4.920 4.920 4.619 0.301 17919 107390 1 262 . 1 1 22 22 THR C C 22 176.750 176.750 176.116 0.634 17919 107391 1 262 . 1 1 22 22 THR CA C 22 59.690 59.690 62.213 -2.523 17919 107392 1 262 . 1 1 22 22 THR CB C 22 71.200 71.200 70.289 0.911 17919 107393 1 262 . 1 1 22 22 THR H H 22 7.900 7.900 8.272 -0.372 17919 107394 1 262 . 1 1 23 23 ILE N N 23 121.190 121.190 122.190 -1.000 17919 107395 1 262 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.837 -0.180 17919 107396 1 262 . 1 1 23 23 ILE C C 23 179.040 179.040 177.640 1.400 17919 107397 1 262 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.718 -0.459 17919 107398 1 262 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.283 -1.933 17919 107399 1 262 . 1 1 23 23 ILE H H 23 8.560 8.560 8.459 0.101 17919 107400 1 262 . 1 1 24 24 GLU N N 24 120.830 120.830 121.134 -0.304 17919 107401 1 262 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.809 0.108 17919 107402 1 262 . 1 1 24 24 GLU C C 24 178.640 178.640 178.575 0.065 17919 107403 1 262 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.405 -0.185 17919 107404 1 262 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.319 -1.038 17919 107405 1 262 . 1 1 24 24 GLU H H 24 9.760 9.760 8.087 1.673 17919 107406 1 262 . 1 1 25 25 ASN N N 25 120.570 120.570 117.156 3.414 17919 107407 1 262 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.589 -0.064 17919 107408 1 262 . 1 1 25 25 ASN C C 25 178.380 178.380 177.974 0.406 17919 107409 1 262 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.594 0.466 17919 107410 1 262 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.770 -0.320 17919 107411 1 262 . 1 1 25 25 ASN H H 25 7.920 7.920 7.545 0.375 17919 107412 1 262 . 1 1 26 26 VAL N N 26 121.710 121.710 121.509 0.201 17919 107413 1 262 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.531 -0.134 17919 107414 1 262 . 1 1 26 26 VAL C C 26 177.950 177.950 177.755 0.195 17919 107415 1 262 . 1 1 26 26 VAL CA C 26 67.660 67.660 67.002 0.658 17919 107416 1 262 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.689 -0.849 17919 107417 1 262 . 1 1 26 26 VAL H H 26 8.070 8.070 7.829 0.241 17919 107418 1 262 . 1 1 27 27 LYS N N 27 118.860 118.860 119.909 -1.049 17919 107419 1 262 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.203 0.377 17919 107420 1 262 . 1 1 27 27 LYS C C 27 180.550 180.550 179.146 1.404 17919 107421 1 262 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.536 -0.286 17919 107422 1 262 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.322 1.409 17919 107423 1 262 . 1 1 27 27 LYS H H 27 8.560 8.560 8.463 0.097 17919 107424 1 262 . 1 1 28 28 ALA N N 28 123.440 123.440 122.543 0.897 17919 107425 1 262 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.120 0.040 17919 107426 1 262 . 1 1 28 28 ALA C C 28 180.300 180.300 179.180 1.120 17919 107427 1 262 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.974 0.396 17919 107428 1 262 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.361 -0.651 17919 107429 1 262 . 1 1 28 28 ALA H H 28 8.060 8.060 8.550 -0.490 17919 107430 1 262 . 1 1 29 29 LYS N N 29 119.940 119.940 119.485 0.455 17919 107431 1 262 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.021 0.186 17919 107432 1 262 . 1 1 29 29 LYS C C 29 180.320 180.320 179.159 1.161 17919 107433 1 262 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.431 0.219 17919 107434 1 262 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.348 0.942 17919 107435 1 262 . 1 1 29 29 LYS H H 29 7.850 7.850 8.021 -0.171 17919 107436 1 262 . 1 1 30 30 ILE N N 30 121.080 121.080 120.508 0.572 17919 107437 1 262 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.613 -0.106 17919 107438 1 262 . 1 1 30 30 ILE C C 30 178.310 178.310 177.400 0.910 17919 107439 1 262 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.203 0.947 17919 107440 1 262 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.655 -0.855 17919 107441 1 262 . 1 1 30 30 ILE H H 30 8.280 8.280 8.252 0.028 17919 107442 1 262 . 1 1 31 31 GLN N N 31 123.490 123.490 120.604 2.886 17919 107443 1 262 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.134 -0.305 17919 107444 1 262 . 1 1 31 31 GLN C C 31 178.890 178.890 178.568 0.322 17919 107445 1 262 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.014 0.986 17919 107446 1 262 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.503 -0.783 17919 107447 1 262 . 1 1 31 31 GLN H H 31 8.580 8.580 7.999 0.581 17919 107448 1 262 . 1 1 32 32 ASP N N 32 119.360 119.360 119.940 -0.580 17919 107449 1 262 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.408 -0.054 17919 107450 1 262 . 1 1 32 32 ASP C C 32 177.250 177.250 178.037 -0.787 17919 107451 1 262 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.799 0.391 17919 107452 1 262 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.831 -0.251 17919 107453 1 262 . 1 1 32 32 ASP H H 32 8.010 8.010 8.290 -0.280 17919 107454 1 262 . 1 1 33 33 LYS N N 33 115.130 115.130 118.047 -2.917 17919 107455 1 262 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.370 -0.033 17919 107456 1 262 . 1 1 33 33 LYS C C 33 177.870 177.870 177.998 -0.128 17919 107457 1 262 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.729 0.321 17919 107458 1 262 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.498 0.672 17919 107459 1 262 . 1 1 33 33 LYS H H 33 7.430 7.430 7.550 -0.120 17919 107460 1 262 . 1 1 34 34 GLU N N 34 113.870 113.870 115.103 -1.233 17919 107461 1 262 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.577 0.048 17919 107462 1 262 . 1 1 34 34 GLU C C 34 177.840 177.840 176.897 0.943 17919 107463 1 262 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.799 -0.629 17919 107464 1 262 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.009 1.651 17919 107465 1 262 . 1 1 34 34 GLU H H 34 8.740 8.740 8.214 0.526 17919 107466 1 262 . 1 1 35 35 GLY N N 35 108.650 108.650 108.845 -0.195 17919 107467 1 262 . 1 1 35 35 GLY C C 35 173.960 173.960 174.532 -0.572 17919 107468 1 262 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.938 0.142 17919 107469 1 262 . 1 1 35 35 GLY H H 35 8.530 8.530 7.966 0.564 17919 107470 1 262 . 1 1 36 36 ILE N N 36 119.880 119.880 121.976 -2.096 17919 107471 1 262 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.373 0.072 17919 107472 1 262 . 1 1 36 36 ILE C C 36 173.590 173.590 174.162 -0.572 17919 107473 1 262 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.926 -0.176 17919 107474 1 262 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.758 1.822 17919 107475 1 262 . 1 1 36 36 ILE H H 36 6.150 6.150 7.595 -1.445 17919 107476 1 262 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.607 0.027 17919 107477 1 262 . 1 1 37 37 PRO C C 37 176.940 176.940 175.927 1.013 17919 107478 1 262 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.483 0.177 17919 107479 1 262 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.166 0.684 17919 107480 1 262 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.197 -0.080 17919 107481 1 262 . 1 1 38 38 PRO C C 38 178.320 178.320 178.571 -0.251 17919 107482 1 262 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.509 0.751 17919 107483 1 262 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.898 0.992 17919 107484 1 262 . 1 1 39 39 ASP N N 39 113.380 113.380 117.533 -4.153 17919 107485 1 262 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.328 0.102 17919 107486 1 262 . 1 1 39 39 ASP C C 39 177.090 177.090 177.741 -0.651 17919 107487 1 262 . 1 1 39 39 ASP CA C 39 55.640 55.640 57.328 -1.688 17919 107488 1 262 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.553 -1.013 17919 107489 1 262 . 1 1 39 39 ASP H H 39 8.550 8.550 8.730 -0.180 17919 107490 1 262 . 1 1 40 40 GLN N N 40 116.780 116.780 117.043 -0.263 17919 107491 1 262 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.244 0.220 17919 107492 1 262 . 1 1 40 40 GLN C C 40 175.380 175.380 175.615 -0.235 17919 107493 1 262 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.300 -0.660 17919 107494 1 262 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.550 0.590 17919 107495 1 262 . 1 1 40 40 GLN H H 40 7.820 7.820 7.908 -0.088 17919 107496 1 262 . 1 1 41 41 GLN N N 41 117.720 117.720 118.154 -0.434 17919 107497 1 262 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.417 -0.173 17919 107498 1 262 . 1 1 41 41 GLN C C 41 176.300 176.300 175.145 1.155 17919 107499 1 262 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.536 0.934 17919 107500 1 262 . 1 1 41 41 GLN CB C 41 31.650 31.650 30.190 1.460 17919 107501 1 262 . 1 1 41 41 GLN H H 41 7.480 7.480 7.360 0.120 17919 107502 1 262 . 1 1 42 42 ARG N N 42 122.680 122.680 124.942 -2.262 17919 107503 1 262 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.612 -0.112 17919 107504 1 262 . 1 1 42 42 ARG C C 42 174.050 174.050 174.110 -0.060 17919 107505 1 262 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.078 -0.028 17919 107506 1 262 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.918 -1.168 17919 107507 1 262 . 1 1 42 42 ARG H H 42 8.530 8.530 8.507 0.023 17919 107508 1 262 . 1 1 43 43 LEU N N 43 124.040 124.040 127.659 -3.619 17919 107509 1 262 . 1 1 43 43 LEU C C 43 175.290 175.290 175.559 -0.269 17919 107510 1 262 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.866 -0.886 17919 107511 1 262 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.319 1.470 17919 107512 1 262 . 1 1 43 43 LEU H H 43 8.820 8.820 8.798 0.022 17919 107513 1 262 . 1 1 44 44 ILE N N 44 121.920 121.920 121.717 0.203 17919 107514 1 262 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.109 -0.117 17919 107515 1 262 . 1 1 44 44 ILE C C 44 176.060 176.060 174.210 1.850 17919 107516 1 262 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.941 -0.961 17919 107517 1 262 . 1 1 44 44 ILE CB C 44 41.420 41.420 42.274 -0.854 17919 107518 1 262 . 1 1 44 44 ILE H H 44 9.030 9.030 8.505 0.525 17919 107519 1 262 . 1 1 45 45 PHE N N 45 125.390 125.390 124.897 0.493 17919 107520 1 262 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.010 0.035 17919 107521 1 262 . 1 1 45 45 PHE C C 45 174.470 174.470 174.106 0.364 17919 107522 1 262 . 1 1 45 45 PHE CA C 45 57.020 57.020 57.440 -0.420 17919 107523 1 262 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.764 0.995 17919 107524 1 262 . 1 1 45 45 PHE H H 45 8.830 8.830 9.041 -0.211 17919 107525 1 262 . 1 1 46 46 ALA N N 46 132.200 132.200 128.639 3.561 17919 107526 1 262 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.602 0.088 17919 107527 1 262 . 1 1 46 46 ALA C C 46 177.290 177.290 177.886 -0.596 17919 107528 1 262 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.767 -0.227 17919 107529 1 262 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.945 -0.374 17919 107530 1 262 . 1 1 46 46 ALA H H 46 8.810 8.810 8.742 0.068 17919 107531 1 262 . 1 1 47 47 GLY N N 47 102.340 102.340 102.819 -0.479 17919 107532 1 262 . 1 1 47 47 GLY C C 47 173.810 173.810 174.079 -0.269 17919 107533 1 262 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.977 0.372 17919 107534 1 262 . 1 1 47 47 GLY H H 47 8.130 8.130 8.671 -0.541 17919 107535 1 262 . 1 1 48 48 LYS N N 48 121.570 121.570 119.915 1.655 17919 107536 1 262 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.563 0.059 17919 107537 1 262 . 1 1 48 48 LYS C C 48 174.700 174.700 175.680 -0.980 17919 107538 1 262 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.855 -0.305 17919 107539 1 262 . 1 1 48 48 LYS CB C 48 34.530 34.530 33.931 0.598 17919 107540 1 262 . 1 1 48 48 LYS H H 48 7.980 7.980 7.722 0.258 17919 107541 1 262 . 1 1 49 49 GLN N N 49 122.410 122.410 123.730 -1.320 17919 107542 1 262 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.477 0.083 17919 107543 1 262 . 1 1 49 49 GLN C C 49 175.670 175.670 175.689 -0.019 17919 107544 1 262 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.197 -0.457 17919 107545 1 262 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.449 -0.449 17919 107546 1 262 . 1 1 49 49 GLN H H 49 8.600 8.600 8.566 0.034 17919 107547 1 262 . 1 1 50 50 LEU N N 50 125.520 125.520 128.097 -2.577 17919 107548 1 262 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.266 -0.176 17919 107549 1 262 . 1 1 50 50 LEU C C 50 176.660 176.660 175.869 0.791 17919 107550 1 262 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.685 0.555 17919 107551 1 262 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.615 -0.045 17919 107552 1 262 . 1 1 50 50 LEU H H 50 8.530 8.530 8.717 -0.187 17919 107553 1 262 . 1 1 51 51 GLU N N 51 122.940 122.940 122.776 0.164 17919 107554 1 262 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.490 -0.002 17919 107555 1 262 . 1 1 51 51 GLU C C 51 175.870 175.870 176.535 -0.665 17919 107556 1 262 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.114 0.846 17919 107557 1 262 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.517 0.053 17919 107558 1 262 . 1 1 51 51 GLU H H 51 8.400 8.400 8.455 -0.055 17919 107559 1 262 . 1 1 52 52 ASP N N 52 120.030 120.030 124.853 -4.823 17919 107560 1 262 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.423 -0.064 17919 107561 1 262 . 1 1 52 52 ASP C C 52 177.330 177.330 178.144 -0.814 17919 107562 1 262 . 1 1 52 52 ASP CA C 52 56.960 56.960 58.055 -1.095 17919 107563 1 262 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.597 0.253 17919 107564 1 262 . 1 1 52 52 ASP H H 52 8.160 8.160 8.877 -0.717 17919 107565 1 262 . 1 1 53 53 GLY N N 53 106.660 106.660 105.508 1.152 17919 107566 1 262 . 1 1 53 53 GLY C C 53 174.870 174.870 175.051 -0.181 17919 107567 1 262 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.156 0.014 17919 107568 1 262 . 1 1 53 53 GLY H H 53 9.390 9.390 8.211 1.179 17919 107569 1 262 . 1 1 54 54 ARG N N 54 119.050 119.050 120.306 -1.256 17919 107570 1 262 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.821 -0.126 17919 107571 1 262 . 1 1 54 54 ARG C C 54 175.350 175.350 176.098 -0.748 17919 107572 1 262 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.543 -0.153 17919 107573 1 262 . 1 1 54 54 ARG CB C 54 32.650 32.650 31.704 0.946 17919 107574 1 262 . 1 1 54 54 ARG H H 54 7.460 7.460 7.605 -0.145 17919 107575 1 262 . 1 1 55 55 THR N N 55 108.400 108.400 111.039 -2.639 17919 107576 1 262 . 1 1 55 55 THR HA H 55 5.240 5.240 5.043 0.197 17919 107577 1 262 . 1 1 55 55 THR C C 55 176.560 176.560 176.318 0.242 17919 107578 1 262 . 1 1 55 55 THR CA C 55 59.690 59.690 60.033 -0.344 17919 107579 1 262 . 1 1 55 55 THR CB C 55 72.260 72.260 71.826 0.434 17919 107580 1 262 . 1 1 55 55 THR H H 55 8.730 8.730 9.086 -0.356 17919 107581 1 262 . 1 1 56 56 LEU N N 56 117.920 117.920 121.219 -3.299 17919 107582 1 262 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.951 0.109 17919 107583 1 262 . 1 1 56 56 LEU C C 56 180.810 180.810 179.169 1.641 17919 107584 1 262 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.522 0.188 17919 107585 1 262 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.522 -1.152 17919 107586 1 262 . 1 1 56 56 LEU H H 56 8.140 8.140 8.583 -0.443 17919 107587 1 262 . 1 1 57 57 SER N N 57 113.330 113.330 114.328 -0.998 17919 107588 1 262 . 1 1 57 57 SER HA H 57 4.370 4.370 4.215 0.155 17919 107589 1 262 . 1 1 57 57 SER C C 57 178.310 178.310 177.150 1.160 17919 107590 1 262 . 1 1 57 57 SER CA C 57 61.080 61.080 61.653 -0.573 17919 107591 1 262 . 1 1 57 57 SER CB C 57 62.530 62.530 62.523 0.007 17919 107592 1 262 . 1 1 57 57 SER H H 57 8.470 8.470 8.565 -0.095 17919 107593 1 262 . 1 1 58 58 ASP N N 58 124.190 124.190 123.592 0.598 17919 107594 1 262 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.402 -0.106 17919 107595 1 262 . 1 1 58 58 ASP C C 58 177.400 177.400 177.154 0.246 17919 107596 1 262 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.885 0.295 17919 107597 1 262 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.495 -0.395 17919 107598 1 262 . 1 1 58 58 ASP H H 58 7.930 7.930 7.959 -0.029 17919 107599 1 262 . 1 1 59 59 TYR N N 59 115.510 115.510 116.399 -0.889 17919 107600 1 262 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.621 0.049 17919 107601 1 262 . 1 1 59 59 TYR C C 59 174.700 174.700 174.433 0.267 17919 107602 1 262 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.926 0.324 17919 107603 1 262 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.317 1.753 17919 107604 1 262 . 1 1 59 59 TYR H H 59 7.250 7.250 7.524 -0.274 17919 107605 1 262 . 1 1 60 60 ASN N N 60 115.900 115.900 115.462 0.438 17919 107606 1 262 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.402 -0.047 17919 107607 1 262 . 1 1 60 60 ASN C C 60 174.340 174.340 174.626 -0.286 17919 107608 1 262 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.304 -0.184 17919 107609 1 262 . 1 1 60 60 ASN CB C 60 37.410 37.410 36.350 1.060 17919 107610 1 262 . 1 1 60 60 ASN H H 60 8.150 8.150 8.148 0.002 17919 107611 1 262 . 1 1 61 61 ILE N N 61 118.600 118.600 119.378 -0.778 17919 107612 1 262 . 1 1 61 61 ILE HA H 61 3.393 3.393 4.079 -0.686 17919 107613 1 262 . 1 1 61 61 ILE C C 61 174.610 174.610 175.568 -0.958 17919 107614 1 262 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.577 0.843 17919 107615 1 262 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.803 -1.063 17919 107616 1 262 . 1 1 61 61 ILE H H 61 7.250 7.250 7.949 -0.699 17919 107617 1 262 . 1 1 62 62 GLN N N 62 124.740 124.740 126.286 -1.546 17919 107618 1 262 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.710 -0.204 17919 107619 1 262 . 1 1 62 62 GLN C C 62 175.970 175.970 175.912 0.058 17919 107620 1 262 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.934 -0.274 17919 107621 1 262 . 1 1 62 62 GLN CB C 62 31.650 31.650 30.836 0.814 17919 107622 1 262 . 1 1 62 62 GLN H H 62 7.610 7.610 8.218 -0.608 17919 107623 1 262 . 1 1 63 63 LYS N N 63 120.300 120.300 122.066 -1.766 17919 107624 1 262 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.051 -0.050 17919 107625 1 262 . 1 1 63 63 LYS C C 63 175.810 175.810 176.790 -0.980 17919 107626 1 262 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.123 0.667 17919 107627 1 262 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.924 0.726 17919 107628 1 262 . 1 1 63 63 LYS H H 63 8.490 8.490 8.466 0.024 17919 107629 1 262 . 1 1 64 64 GLU N N 64 113.950 113.950 118.605 -4.655 17919 107630 1 262 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.442 0.023 17919 107631 1 262 . 1 1 64 64 GLU C C 64 175.250 175.250 176.118 -0.868 17919 107632 1 262 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.609 0.281 17919 107633 1 262 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.451 -2.550 17919 107634 1 262 . 1 1 64 64 GLU H H 64 9.280 9.280 8.873 0.407 17919 107635 1 262 . 1 1 65 65 SER N N 65 114.730 114.730 115.555 -0.825 17919 107636 1 262 . 1 1 65 65 SER HA H 65 4.640 4.640 4.409 0.231 17919 107637 1 262 . 1 1 65 65 SER C C 65 172.160 172.160 173.555 -1.395 17919 107638 1 262 . 1 1 65 65 SER CA C 65 60.890 60.890 60.517 0.373 17919 107639 1 262 . 1 1 65 65 SER CB C 65 64.910 64.910 63.918 0.992 17919 107640 1 262 . 1 1 65 65 SER H H 65 7.670 7.670 7.254 0.416 17919 107641 1 262 . 1 1 66 66 THR N N 66 117.110 117.110 120.383 -3.273 17919 107642 1 262 . 1 1 66 66 THR HA H 66 5.270 5.270 4.945 0.325 17919 107643 1 262 . 1 1 66 66 THR C C 66 173.950 173.950 174.199 -0.249 17919 107644 1 262 . 1 1 66 66 THR CA C 66 62.340 62.340 62.218 0.122 17919 107645 1 262 . 1 1 66 66 THR CB C 66 70.080 70.080 70.490 -0.410 17919 107646 1 262 . 1 1 66 66 THR H H 66 8.730 8.730 8.517 0.213 17919 107647 1 262 . 1 1 67 67 LEU N N 67 127.110 127.110 126.893 0.217 17919 107648 1 262 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.657 0.403 17919 107649 1 262 . 1 1 67 67 LEU C C 67 175.770 175.770 175.648 0.122 17919 107650 1 262 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.072 -0.172 17919 107651 1 262 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.061 0.199 17919 107652 1 262 . 1 1 67 67 LEU H H 67 9.410 9.410 8.316 1.094 17919 107653 1 262 . 1 1 68 68 HIS N N 68 118.380 118.380 119.452 -1.072 17919 107654 1 262 . 1 1 68 68 HIS HA H 68 5.240 5.240 4.907 0.333 17919 107655 1 262 . 1 1 68 68 HIS C C 68 173.150 173.150 173.817 -0.667 17919 107656 1 262 . 1 1 68 68 HIS CA C 68 55.000 55.000 55.129 -0.129 17919 107657 1 262 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.098 -1.568 17919 107658 1 262 . 1 1 68 68 HIS H H 68 9.230 9.230 8.526 0.704 17919 107659 1 262 . 1 1 69 69 LEU N N 69 124.460 124.460 127.143 -2.683 17919 107660 1 262 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.037 0.153 17919 107661 1 262 . 1 1 69 69 LEU C C 69 175.270 175.270 174.717 0.553 17919 107662 1 262 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.812 0.078 17919 107663 1 262 . 1 1 69 69 LEU CB C 69 44.380 44.380 43.923 0.457 17919 107664 1 262 . 1 1 69 69 LEU H H 69 8.340 8.340 8.034 0.306 17919 107665 1 262 . 1 1 70 70 VAL N N 70 126.940 126.940 120.795 6.145 17919 107666 1 262 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.596 -0.246 17919 107667 1 262 . 1 1 70 70 VAL C C 70 174.000 174.000 174.009 -0.009 17919 107668 1 262 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.998 0.802 17919 107669 1 262 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.194 -0.284 17919 107670 1 262 . 1 1 70 70 VAL H H 70 9.200 9.200 8.981 0.219 17919 107671 1 262 . 1 1 71 71 LEU N N 71 123.130 123.130 123.020 0.110 17919 107672 1 262 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.057 0.003 17919 107673 1 262 . 1 1 71 71 LEU C C 71 177.830 177.830 177.277 0.553 17919 107674 1 262 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.580 0.360 17919 107675 1 262 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.988 -1.138 17919 107676 1 262 . 1 1 71 71 LEU H H 71 8.120 8.120 8.381 -0.261 17919 107677 1 262 . 1 1 72 72 ARG N N 72 123.490 123.490 120.159 3.331 17919 107678 1 262 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.702 -0.401 17919 107679 1 262 . 1 1 72 72 ARG C C 72 175.350 175.350 177.959 -2.609 17919 107680 1 262 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.819 -0.209 17919 107681 1 262 . 1 1 72 72 ARG CB C 72 31.350 31.350 29.725 1.625 17919 107682 1 262 . 1 1 72 72 ARG H H 72 8.580 8.580 8.414 0.166 17919 107683 1 263 . 1 1 2 2 GLN N N 2 123.220 123.220 120.234 2.986 17919 107684 1 263 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.102 0.147 17919 107685 1 263 . 1 1 2 2 GLN C C 2 175.920 175.920 175.087 0.833 17919 107686 1 263 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.927 0.153 17919 107687 1 263 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.826 -0.066 17919 107688 1 263 . 1 1 2 2 GLN H H 2 8.900 8.900 8.369 0.531 17919 107689 1 263 . 1 1 3 3 ILE N N 3 115.340 115.340 119.538 -4.198 17919 107690 1 263 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.887 -0.674 17919 107691 1 263 . 1 1 3 3 ILE C C 3 172.450 172.450 173.909 -1.459 17919 107692 1 263 . 1 1 3 3 ILE CA C 3 59.570 59.570 58.230 1.339 17919 107693 1 263 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.229 0.981 17919 107694 1 263 . 1 1 3 3 ILE H H 3 8.320 8.320 8.811 -0.491 17919 107695 1 263 . 1 1 4 4 PHE N N 4 118.110 118.110 119.503 -1.393 17919 107696 1 263 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.402 0.228 17919 107697 1 263 . 1 1 4 4 PHE C C 4 175.320 175.320 175.135 0.185 17919 107698 1 263 . 1 1 4 4 PHE CA C 4 55.210 55.210 56.390 -1.180 17919 107699 1 263 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.540 -1.060 17919 107700 1 263 . 1 1 4 4 PHE H H 4 8.610 8.610 8.647 -0.037 17919 107701 1 263 . 1 1 5 5 VAL N N 5 121.000 121.000 123.509 -2.509 17919 107702 1 263 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.649 0.076 17919 107703 1 263 . 1 1 5 5 VAL C C 5 174.870 174.870 174.677 0.193 17919 107704 1 263 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.124 -0.504 17919 107705 1 263 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.429 -0.199 17919 107706 1 263 . 1 1 5 5 VAL H H 5 9.300 9.300 9.359 -0.059 17919 107707 1 263 . 1 1 6 6 LYS N N 6 127.520 127.520 130.228 -2.708 17919 107708 1 263 . 1 1 6 6 LYS HA H 6 5.367 5.367 4.929 0.438 17919 107709 1 263 . 1 1 6 6 LYS C C 6 177.140 177.140 176.106 1.034 17919 107710 1 263 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.910 -0.390 17919 107711 1 263 . 1 1 6 6 LYS CB C 6 35.050 35.050 33.592 1.458 17919 107712 1 263 . 1 1 6 6 LYS H H 6 8.820 8.820 8.987 -0.167 17919 107713 1 263 . 1 1 7 7 THR N N 7 115.400 115.400 117.818 -2.418 17919 107714 1 263 . 1 1 7 7 THR HA H 7 4.970 4.970 4.873 0.097 17919 107715 1 263 . 1 1 7 7 THR C C 7 176.910 176.910 175.968 0.942 17919 107716 1 263 . 1 1 7 7 THR CA C 7 60.470 60.470 59.695 0.775 17919 107717 1 263 . 1 1 7 7 THR CB C 7 70.630 70.630 71.947 -1.317 17919 107718 1 263 . 1 1 7 7 THR H H 7 8.730 8.730 8.725 0.005 17919 107719 1 263 . 1 1 8 8 LEU N N 8 121.330 121.330 122.709 -1.379 17919 107720 1 263 . 1 1 8 8 LEU HA H 8 4.310 4.310 3.935 0.375 17919 107721 1 263 . 1 1 8 8 LEU C C 8 178.800 178.800 178.689 0.111 17919 107722 1 263 . 1 1 8 8 LEU CA C 8 57.580 57.580 58.083 -0.503 17919 107723 1 263 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.414 0.556 17919 107724 1 263 . 1 1 8 8 LEU H H 8 9.100 9.100 9.013 0.087 17919 107725 1 263 . 1 1 9 9 THR N N 9 105.590 105.590 105.315 0.275 17919 107726 1 263 . 1 1 9 9 THR HA H 9 4.428 4.428 4.172 0.256 17919 107727 1 263 . 1 1 9 9 THR C C 9 175.520 175.520 176.342 -0.822 17919 107728 1 263 . 1 1 9 9 THR CA C 9 61.400 61.400 62.808 -1.408 17919 107729 1 263 . 1 1 9 9 THR CB C 9 69.140 69.140 68.683 0.457 17919 107730 1 263 . 1 1 9 9 THR H H 9 7.630 7.630 7.981 -0.351 17919 107731 1 263 . 1 1 10 10 GLY N N 10 108.890 108.890 110.562 -1.672 17919 107732 1 263 . 1 1 10 10 GLY C C 10 174.070 174.070 173.143 0.927 17919 107733 1 263 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.096 0.364 17919 107734 1 263 . 1 1 10 10 GLY H H 10 7.810 7.810 8.761 -0.951 17919 107735 1 263 . 1 1 11 11 LYS N N 11 121.600 121.600 122.697 -1.097 17919 107736 1 263 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.329 0.032 17919 107737 1 263 . 1 1 11 11 LYS C C 11 175.940 175.940 175.660 0.280 17919 107738 1 263 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.980 -0.700 17919 107739 1 263 . 1 1 11 11 LYS CB C 11 33.200 33.200 32.791 0.409 17919 107740 1 263 . 1 1 11 11 LYS H H 11 7.280 7.280 7.583 -0.303 17919 107741 1 263 . 1 1 12 12 THR N N 12 120.440 120.440 117.906 2.534 17919 107742 1 263 . 1 1 12 12 THR HA H 12 5.046 5.046 5.164 -0.118 17919 107743 1 263 . 1 1 12 12 THR C C 12 174.320 174.320 174.479 -0.159 17919 107744 1 263 . 1 1 12 12 THR CA C 12 62.390 62.390 62.038 0.352 17919 107745 1 263 . 1 1 12 12 THR CB C 12 69.910 69.910 70.153 -0.243 17919 107746 1 263 . 1 1 12 12 THR H H 12 8.650 8.650 8.468 0.182 17919 107747 1 263 . 1 1 13 13 ILE N N 13 127.110 127.110 121.514 5.596 17919 107748 1 263 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.775 -0.231 17919 107749 1 263 . 1 1 13 13 ILE C C 13 175.220 175.220 173.846 1.374 17919 107750 1 263 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.311 0.669 17919 107751 1 263 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.227 -0.277 17919 107752 1 263 . 1 1 13 13 ILE H H 13 9.450 9.450 9.107 0.344 17919 107753 1 263 . 1 1 14 14 THR N N 14 121.520 121.520 116.446 5.074 17919 107754 1 263 . 1 1 14 14 THR HA H 14 4.964 4.964 5.183 -0.219 17919 107755 1 263 . 1 1 14 14 THR C C 14 173.790 173.790 173.604 0.186 17919 107756 1 263 . 1 1 14 14 THR CA C 14 61.940 61.940 59.334 2.606 17919 107757 1 263 . 1 1 14 14 THR CB C 14 69.650 69.650 70.079 -0.429 17919 107758 1 263 . 1 1 14 14 THR H H 14 8.710 8.710 8.004 0.706 17919 107759 1 263 . 1 1 15 15 LEU N N 15 124.800 124.800 123.964 0.836 17919 107760 1 263 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.688 0.092 17919 107761 1 263 . 1 1 15 15 LEU C C 15 174.670 174.670 175.025 -0.355 17919 107762 1 263 . 1 1 15 15 LEU CA C 15 52.830 52.830 54.250 -1.420 17919 107763 1 263 . 1 1 15 15 LEU CB C 15 47.070 47.070 46.919 0.151 17919 107764 1 263 . 1 1 15 15 LEU H H 15 8.710 8.710 8.466 0.244 17919 107765 1 263 . 1 1 16 16 GLU N N 16 122.160 122.160 122.499 -0.339 17919 107766 1 263 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.528 -0.611 17919 107767 1 263 . 1 1 16 16 GLU C C 16 175.860 175.860 175.893 -0.033 17919 107768 1 263 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.257 -0.437 17919 107769 1 263 . 1 1 16 16 GLU CB C 16 29.450 29.450 31.376 -1.926 17919 107770 1 263 . 1 1 16 16 GLU H H 16 8.140 8.140 8.373 -0.233 17919 107771 1 263 . 1 1 17 17 VAL N N 17 117.210 117.210 117.993 -0.783 17919 107772 1 263 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.858 -0.144 17919 107773 1 263 . 1 1 17 17 VAL C C 17 174.160 174.160 174.728 -0.568 17919 107774 1 263 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.721 -0.291 17919 107775 1 263 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.322 1.077 17919 107776 1 263 . 1 1 17 17 VAL H H 17 8.900 8.900 8.692 0.208 17919 107777 1 263 . 1 1 18 18 GLU N N 18 118.990 118.990 120.090 -1.100 17919 107778 1 263 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.821 0.258 17919 107779 1 263 . 1 1 18 18 GLU C C 18 176.160 176.160 175.593 0.567 17919 107780 1 263 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.602 0.118 17919 107781 1 263 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.442 -0.132 17919 107782 1 263 . 1 1 18 18 GLU H H 18 8.640 8.640 8.550 0.090 17919 107783 1 263 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.228 -0.087 17919 107784 1 263 . 1 1 19 19 PRO C C 19 175.310 175.310 177.494 -2.184 17919 107785 1 263 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.551 -0.081 17919 107786 1 263 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.072 -0.122 17919 107787 1 263 . 1 1 20 20 SER N N 20 103.400 103.400 110.676 -7.276 17919 107788 1 263 . 1 1 20 20 SER HA H 20 4.370 4.370 4.349 0.021 17919 107789 1 263 . 1 1 20 20 SER C C 20 174.660 174.660 174.422 0.238 17919 107790 1 263 . 1 1 20 20 SER CA C 20 57.400 57.400 59.511 -2.111 17919 107791 1 263 . 1 1 20 20 SER CB C 20 63.370 63.370 62.806 0.564 17919 107792 1 263 . 1 1 20 20 SER H H 20 7.040 7.040 8.106 -1.066 17919 107793 1 263 . 1 1 21 21 ASP N N 21 123.480 123.480 122.681 0.799 17919 107794 1 263 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.576 0.119 17919 107795 1 263 . 1 1 21 21 ASP C C 21 176.360 176.360 175.617 0.743 17919 107796 1 263 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.402 0.298 17919 107797 1 263 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.500 -0.700 17919 107798 1 263 . 1 1 21 21 ASP H H 21 8.030 8.030 7.577 0.453 17919 107799 1 263 . 1 1 22 22 THR N N 22 108.800 108.800 112.719 -3.919 17919 107800 1 263 . 1 1 22 22 THR HA H 22 4.920 4.920 4.988 -0.068 17919 107801 1 263 . 1 1 22 22 THR C C 22 176.750 176.750 176.327 0.423 17919 107802 1 263 . 1 1 22 22 THR CA C 22 59.690 59.690 60.186 -0.496 17919 107803 1 263 . 1 1 22 22 THR CB C 22 71.200 71.200 71.163 0.037 17919 107804 1 263 . 1 1 22 22 THR H H 22 7.900 7.900 8.437 -0.537 17919 107805 1 263 . 1 1 23 23 ILE N N 23 121.190 121.190 122.824 -1.634 17919 107806 1 263 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.700 -0.043 17919 107807 1 263 . 1 1 23 23 ILE C C 23 179.040 179.040 177.754 1.286 17919 107808 1 263 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.278 -1.018 17919 107809 1 263 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.195 -1.845 17919 107810 1 263 . 1 1 23 23 ILE H H 23 8.560 8.560 8.331 0.229 17919 107811 1 263 . 1 1 24 24 GLU N N 24 120.830 120.830 120.879 -0.049 17919 107812 1 263 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.868 0.049 17919 107813 1 263 . 1 1 24 24 GLU C C 24 178.640 178.640 178.596 0.044 17919 107814 1 263 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.943 0.277 17919 107815 1 263 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.126 -0.846 17919 107816 1 263 . 1 1 24 24 GLU H H 24 9.760 9.760 8.166 1.594 17919 107817 1 263 . 1 1 25 25 ASN N N 25 120.570 120.570 117.239 3.331 17919 107818 1 263 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.495 0.030 17919 107819 1 263 . 1 1 25 25 ASN C C 25 178.380 178.380 178.055 0.325 17919 107820 1 263 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.048 0.012 17919 107821 1 263 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.550 -0.100 17919 107822 1 263 . 1 1 25 25 ASN H H 25 7.920 7.920 7.759 0.161 17919 107823 1 263 . 1 1 26 26 VAL N N 26 121.710 121.710 121.046 0.664 17919 107824 1 263 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.666 -0.269 17919 107825 1 263 . 1 1 26 26 VAL C C 26 177.950 177.950 177.282 0.668 17919 107826 1 263 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.618 1.042 17919 107827 1 263 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.379 -0.539 17919 107828 1 263 . 1 1 26 26 VAL H H 26 8.070 8.070 7.946 0.124 17919 107829 1 263 . 1 1 27 27 LYS N N 27 118.860 118.860 120.043 -1.183 17919 107830 1 263 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.239 0.341 17919 107831 1 263 . 1 1 27 27 LYS C C 27 180.550 180.550 178.815 1.735 17919 107832 1 263 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.229 0.021 17919 107833 1 263 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.099 1.631 17919 107834 1 263 . 1 1 27 27 LYS H H 27 8.560 8.560 8.562 -0.002 17919 107835 1 263 . 1 1 28 28 ALA N N 28 123.440 123.440 122.384 1.056 17919 107836 1 263 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.067 0.093 17919 107837 1 263 . 1 1 28 28 ALA C C 28 180.300 180.300 178.991 1.309 17919 107838 1 263 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.982 0.388 17919 107839 1 263 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.498 -0.788 17919 107840 1 263 . 1 1 28 28 ALA H H 28 8.060 8.060 8.026 0.034 17919 107841 1 263 . 1 1 29 29 LYS N N 29 119.940 119.940 117.217 2.723 17919 107842 1 263 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.128 0.079 17919 107843 1 263 . 1 1 29 29 LYS C C 29 180.320 180.320 177.800 2.520 17919 107844 1 263 . 1 1 29 29 LYS CA C 29 59.650 59.650 58.606 1.044 17919 107845 1 263 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.470 0.820 17919 107846 1 263 . 1 1 29 29 LYS H H 29 7.850 7.850 7.538 0.312 17919 107847 1 263 . 1 1 30 30 ILE N N 30 121.080 121.080 118.630 2.450 17919 107848 1 263 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.758 -0.251 17919 107849 1 263 . 1 1 30 30 ILE C C 30 178.310 178.310 177.478 0.832 17919 107850 1 263 . 1 1 30 30 ILE CA C 30 66.150 66.150 64.279 1.871 17919 107851 1 263 . 1 1 30 30 ILE CB C 30 36.800 36.800 38.143 -1.343 17919 107852 1 263 . 1 1 30 30 ILE H H 30 8.280 8.280 7.689 0.591 17919 107853 1 263 . 1 1 31 31 GLN N N 31 123.490 123.490 120.297 3.193 17919 107854 1 263 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.996 -0.167 17919 107855 1 263 . 1 1 31 31 GLN C C 31 178.890 178.890 178.344 0.546 17919 107856 1 263 . 1 1 31 31 GLN CA C 31 60.000 60.000 58.987 1.013 17919 107857 1 263 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.263 -0.543 17919 107858 1 263 . 1 1 31 31 GLN H H 31 8.580 8.580 7.606 0.974 17919 107859 1 263 . 1 1 32 32 ASP N N 32 119.360 119.360 118.394 0.966 17919 107860 1 263 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.520 -0.166 17919 107861 1 263 . 1 1 32 32 ASP C C 32 177.250 177.250 177.037 0.213 17919 107862 1 263 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.252 0.938 17919 107863 1 263 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.708 -0.128 17919 107864 1 263 . 1 1 32 32 ASP H H 32 8.010 8.010 7.962 0.048 17919 107865 1 263 . 1 1 33 33 LYS N N 33 115.130 115.130 118.243 -3.113 17919 107866 1 263 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.390 -0.053 17919 107867 1 263 . 1 1 33 33 LYS C C 33 177.870 177.870 177.830 0.040 17919 107868 1 263 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.241 0.809 17919 107869 1 263 . 1 1 33 33 LYS CB C 33 34.170 34.170 35.096 -0.926 17919 107870 1 263 . 1 1 33 33 LYS H H 33 7.430 7.430 7.743 -0.313 17919 107871 1 263 . 1 1 34 34 GLU N N 34 113.870 113.870 116.812 -2.942 17919 107872 1 263 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.439 0.186 17919 107873 1 263 . 1 1 34 34 GLU C C 34 177.840 177.840 177.475 0.365 17919 107874 1 263 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.970 -1.800 17919 107875 1 263 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.232 1.428 17919 107876 1 263 . 1 1 34 34 GLU H H 34 8.740 8.740 8.353 0.387 17919 107877 1 263 . 1 1 35 35 GLY N N 35 108.650 108.650 107.841 0.809 17919 107878 1 263 . 1 1 35 35 GLY C C 35 173.960 173.960 174.284 -0.324 17919 107879 1 263 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.145 0.935 17919 107880 1 263 . 1 1 35 35 GLY H H 35 8.530 8.530 8.085 0.445 17919 107881 1 263 . 1 1 36 36 ILE N N 36 119.880 119.880 123.842 -3.962 17919 107882 1 263 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.248 0.197 17919 107883 1 263 . 1 1 36 36 ILE C C 36 173.590 173.590 174.832 -1.242 17919 107884 1 263 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.320 -0.570 17919 107885 1 263 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.123 2.457 17919 107886 1 263 . 1 1 36 36 ILE H H 36 6.150 6.150 7.843 -1.693 17919 107887 1 263 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.692 -0.058 17919 107888 1 263 . 1 1 37 37 PRO C C 37 176.940 176.940 176.186 0.754 17919 107889 1 263 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.580 0.080 17919 107890 1 263 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.426 0.424 17919 107891 1 263 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.207 -0.090 17919 107892 1 263 . 1 1 38 38 PRO C C 38 178.320 178.320 178.467 -0.147 17919 107893 1 263 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.532 0.728 17919 107894 1 263 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.798 1.092 17919 107895 1 263 . 1 1 39 39 ASP N N 39 113.380 113.380 115.978 -2.598 17919 107896 1 263 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.474 -0.044 17919 107897 1 263 . 1 1 39 39 ASP C C 39 177.090 177.090 177.108 -0.018 17919 107898 1 263 . 1 1 39 39 ASP CA C 39 55.640 55.640 55.952 -0.312 17919 107899 1 263 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.333 -0.793 17919 107900 1 263 . 1 1 39 39 ASP H H 39 8.550 8.550 8.643 -0.093 17919 107901 1 263 . 1 1 40 40 GLN N N 40 116.780 116.780 116.006 0.774 17919 107902 1 263 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.474 -0.010 17919 107903 1 263 . 1 1 40 40 GLN C C 40 175.380 175.380 174.800 0.580 17919 107904 1 263 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.093 -0.452 17919 107905 1 263 . 1 1 40 40 GLN CB C 40 30.140 30.140 30.159 -0.019 17919 107906 1 263 . 1 1 40 40 GLN H H 40 7.820 7.820 7.850 -0.030 17919 107907 1 263 . 1 1 41 41 GLN N N 41 117.720 117.720 120.092 -2.372 17919 107908 1 263 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.484 -0.240 17919 107909 1 263 . 1 1 41 41 GLN C C 41 176.300 176.300 175.296 1.004 17919 107910 1 263 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.362 1.108 17919 107911 1 263 . 1 1 41 41 GLN CB C 41 31.650 31.650 30.051 1.599 17919 107912 1 263 . 1 1 41 41 GLN H H 41 7.480 7.480 7.235 0.245 17919 107913 1 263 . 1 1 42 42 ARG N N 42 122.680 122.680 125.917 -3.237 17919 107914 1 263 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.661 -0.161 17919 107915 1 263 . 1 1 42 42 ARG C C 42 174.050 174.050 174.624 -0.574 17919 107916 1 263 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.531 0.519 17919 107917 1 263 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.805 -1.055 17919 107918 1 263 . 1 1 42 42 ARG H H 42 8.530 8.530 8.816 -0.286 17919 107919 1 263 . 1 1 43 43 LEU N N 43 124.040 124.040 125.190 -1.150 17919 107920 1 263 . 1 1 43 43 LEU C C 43 175.290 175.290 176.092 -0.802 17919 107921 1 263 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.447 -0.467 17919 107922 1 263 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.022 1.768 17919 107923 1 263 . 1 1 43 43 LEU H H 43 8.820 8.820 8.713 0.107 17919 107924 1 263 . 1 1 44 44 ILE N N 44 121.920 121.920 120.210 1.710 17919 107925 1 263 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.094 -0.102 17919 107926 1 263 . 1 1 44 44 ILE C C 44 176.060 176.060 174.738 1.322 17919 107927 1 263 . 1 1 44 44 ILE CA C 44 58.980 58.980 58.630 0.350 17919 107928 1 263 . 1 1 44 44 ILE CB C 44 41.420 41.420 39.650 1.770 17919 107929 1 263 . 1 1 44 44 ILE H H 44 9.030 9.030 8.670 0.360 17919 107930 1 263 . 1 1 45 45 PHE N N 45 125.390 125.390 126.255 -0.865 17919 107931 1 263 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.873 0.172 17919 107932 1 263 . 1 1 45 45 PHE C C 45 174.470 174.470 174.029 0.441 17919 107933 1 263 . 1 1 45 45 PHE CA C 45 57.020 57.020 57.473 -0.453 17919 107934 1 263 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.061 0.699 17919 107935 1 263 . 1 1 45 45 PHE H H 45 8.830 8.830 9.059 -0.229 17919 107936 1 263 . 1 1 46 46 ALA N N 46 132.200 132.200 128.554 3.646 17919 107937 1 263 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.631 0.059 17919 107938 1 263 . 1 1 46 46 ALA C C 46 177.290 177.290 178.219 -0.929 17919 107939 1 263 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.888 -0.348 17919 107940 1 263 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.922 -0.352 17919 107941 1 263 . 1 1 46 46 ALA H H 46 8.810 8.810 8.553 0.257 17919 107942 1 263 . 1 1 47 47 GLY N N 47 102.340 102.340 102.628 -0.288 17919 107943 1 263 . 1 1 47 47 GLY C C 47 173.810 173.810 174.624 -0.814 17919 107944 1 263 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.995 0.355 17919 107945 1 263 . 1 1 47 47 GLY H H 47 8.130 8.130 8.436 -0.306 17919 107946 1 263 . 1 1 48 48 LYS N N 48 121.570 121.570 121.681 -0.111 17919 107947 1 263 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.545 0.077 17919 107948 1 263 . 1 1 48 48 LYS C C 48 174.700 174.700 175.598 -0.898 17919 107949 1 263 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.270 -0.720 17919 107950 1 263 . 1 1 48 48 LYS CB C 48 34.530 34.530 33.811 0.719 17919 107951 1 263 . 1 1 48 48 LYS H H 48 7.980 7.980 7.945 0.035 17919 107952 1 263 . 1 1 49 49 GLN N N 49 122.410 122.410 123.164 -0.754 17919 107953 1 263 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.553 0.007 17919 107954 1 263 . 1 1 49 49 GLN C C 49 175.670 175.670 175.626 0.044 17919 107955 1 263 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.160 -0.420 17919 107956 1 263 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.598 -0.598 17919 107957 1 263 . 1 1 49 49 GLN H H 49 8.600 8.600 8.596 0.004 17919 107958 1 263 . 1 1 50 50 LEU N N 50 125.520 125.520 126.798 -1.278 17919 107959 1 263 . 1 1 50 50 LEU HA H 50 4.090 4.090 3.910 0.180 17919 107960 1 263 . 1 1 50 50 LEU C C 50 176.660 176.660 176.308 0.352 17919 107961 1 263 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.773 -0.533 17919 107962 1 263 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.601 -0.031 17919 107963 1 263 . 1 1 50 50 LEU H H 50 8.530 8.530 8.072 0.458 17919 107964 1 263 . 1 1 51 51 GLU N N 51 122.940 122.940 126.079 -3.139 17919 107965 1 263 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.470 0.018 17919 107966 1 263 . 1 1 51 51 GLU C C 51 175.870 175.870 177.103 -1.233 17919 107967 1 263 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.643 0.317 17919 107968 1 263 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.750 -0.180 17919 107969 1 263 . 1 1 51 51 GLU H H 51 8.400 8.400 8.835 -0.435 17919 107970 1 263 . 1 1 52 52 ASP N N 52 120.030 120.030 126.859 -6.829 17919 107971 1 263 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.339 0.020 17919 107972 1 263 . 1 1 52 52 ASP C C 52 177.330 177.330 177.070 0.260 17919 107973 1 263 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.875 -0.915 17919 107974 1 263 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.659 0.191 17919 107975 1 263 . 1 1 52 52 ASP H H 52 8.160 8.160 8.794 -0.634 17919 107976 1 263 . 1 1 53 53 GLY N N 53 106.660 106.660 104.453 2.207 17919 107977 1 263 . 1 1 53 53 GLY C C 53 174.870 174.870 174.101 0.769 17919 107978 1 263 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.727 0.443 17919 107979 1 263 . 1 1 53 53 GLY H H 53 9.390 9.390 8.367 1.023 17919 107980 1 263 . 1 1 54 54 ARG N N 54 119.050 119.050 120.360 -1.310 17919 107981 1 263 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.738 -0.043 17919 107982 1 263 . 1 1 54 54 ARG C C 54 175.350 175.350 175.513 -0.163 17919 107983 1 263 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.003 0.387 17919 107984 1 263 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.188 -0.538 17919 107985 1 263 . 1 1 54 54 ARG H H 54 7.460 7.460 7.671 -0.211 17919 107986 1 263 . 1 1 55 55 THR N N 55 108.400 108.400 112.638 -4.238 17919 107987 1 263 . 1 1 55 55 THR HA H 55 5.240 5.240 4.886 0.354 17919 107988 1 263 . 1 1 55 55 THR C C 55 176.560 176.560 176.726 -0.166 17919 107989 1 263 . 1 1 55 55 THR CA C 55 59.690 59.690 60.903 -1.213 17919 107990 1 263 . 1 1 55 55 THR CB C 55 72.260 72.260 70.364 1.896 17919 107991 1 263 . 1 1 55 55 THR H H 55 8.730 8.730 8.933 -0.203 17919 107992 1 263 . 1 1 56 56 LEU N N 56 117.920 117.920 121.239 -3.319 17919 107993 1 263 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.916 0.144 17919 107994 1 263 . 1 1 56 56 LEU C C 56 180.810 180.810 178.783 2.027 17919 107995 1 263 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.152 0.558 17919 107996 1 263 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.046 -0.676 17919 107997 1 263 . 1 1 56 56 LEU H H 56 8.140 8.140 8.744 -0.604 17919 107998 1 263 . 1 1 57 57 SER N N 57 113.330 113.330 114.037 -0.707 17919 107999 1 263 . 1 1 57 57 SER HA H 57 4.370 4.370 4.316 0.054 17919 108000 1 263 . 1 1 57 57 SER C C 57 178.310 178.310 177.022 1.288 17919 108001 1 263 . 1 1 57 57 SER CA C 57 61.080 61.080 61.345 -0.265 17919 108002 1 263 . 1 1 57 57 SER CB C 57 62.530 62.530 62.411 0.119 17919 108003 1 263 . 1 1 57 57 SER H H 57 8.470 8.470 8.467 0.003 17919 108004 1 263 . 1 1 58 58 ASP N N 58 124.190 124.190 123.840 0.350 17919 108005 1 263 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.350 -0.054 17919 108006 1 263 . 1 1 58 58 ASP C C 58 177.400 177.400 176.816 0.584 17919 108007 1 263 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.728 0.452 17919 108008 1 263 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.382 -0.282 17919 108009 1 263 . 1 1 58 58 ASP H H 58 7.930 7.930 7.917 0.013 17919 108010 1 263 . 1 1 59 59 TYR N N 59 115.510 115.510 115.041 0.469 17919 108011 1 263 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.648 0.022 17919 108012 1 263 . 1 1 59 59 TYR C C 59 174.700 174.700 175.124 -0.424 17919 108013 1 263 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.274 0.976 17919 108014 1 263 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.477 1.593 17919 108015 1 263 . 1 1 59 59 TYR H H 59 7.250 7.250 7.490 -0.240 17919 108016 1 263 . 1 1 60 60 ASN N N 60 115.900 115.900 118.226 -2.326 17919 108017 1 263 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.476 -0.121 17919 108018 1 263 . 1 1 60 60 ASN C C 60 174.340 174.340 174.554 -0.214 17919 108019 1 263 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.080 0.040 17919 108020 1 263 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.200 0.210 17919 108021 1 263 . 1 1 60 60 ASN H H 60 8.150 8.150 7.764 0.386 17919 108022 1 263 . 1 1 61 61 ILE N N 61 118.600 118.600 120.960 -2.360 17919 108023 1 263 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.711 -0.318 17919 108024 1 263 . 1 1 61 61 ILE C C 61 174.610 174.610 174.617 -0.007 17919 108025 1 263 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.462 0.959 17919 108026 1 263 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.430 -0.690 17919 108027 1 263 . 1 1 61 61 ILE H H 61 7.250 7.250 8.389 -1.139 17919 108028 1 263 . 1 1 62 62 GLN N N 62 124.740 124.740 125.524 -0.784 17919 108029 1 263 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.771 -0.265 17919 108030 1 263 . 1 1 62 62 GLN C C 62 175.970 175.970 176.024 -0.054 17919 108031 1 263 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.607 0.053 17919 108032 1 263 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.993 -0.343 17919 108033 1 263 . 1 1 62 62 GLN H H 62 7.610 7.610 8.246 -0.636 17919 108034 1 263 . 1 1 63 63 LYS N N 63 120.300 120.300 121.046 -0.746 17919 108035 1 263 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.017 -0.016 17919 108036 1 263 . 1 1 63 63 LYS C C 63 175.810 175.810 177.474 -1.664 17919 108037 1 263 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.696 0.094 17919 108038 1 263 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.688 0.962 17919 108039 1 263 . 1 1 63 63 LYS H H 63 8.490 8.490 8.630 -0.140 17919 108040 1 263 . 1 1 64 64 GLU N N 64 113.950 113.950 118.838 -4.888 17919 108041 1 263 . 1 1 64 64 GLU HA H 64 3.465 3.465 4.170 -0.705 17919 108042 1 263 . 1 1 64 64 GLU C C 64 175.250 175.250 175.852 -0.602 17919 108043 1 263 . 1 1 64 64 GLU CA C 64 57.890 57.890 58.232 -0.342 17919 108044 1 263 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.179 -2.279 17919 108045 1 263 . 1 1 64 64 GLU H H 64 9.280 9.280 9.009 0.271 17919 108046 1 263 . 1 1 65 65 SER N N 65 114.730 114.730 115.518 -0.788 17919 108047 1 263 . 1 1 65 65 SER HA H 65 4.640 4.640 4.427 0.213 17919 108048 1 263 . 1 1 65 65 SER C C 65 172.160 172.160 174.107 -1.947 17919 108049 1 263 . 1 1 65 65 SER CA C 65 60.890 60.890 60.715 0.175 17919 108050 1 263 . 1 1 65 65 SER CB C 65 64.910 64.910 64.241 0.669 17919 108051 1 263 . 1 1 65 65 SER H H 65 7.670 7.670 7.877 -0.207 17919 108052 1 263 . 1 1 66 66 THR N N 66 117.110 117.110 119.391 -2.281 17919 108053 1 263 . 1 1 66 66 THR HA H 66 5.270 5.270 4.995 0.275 17919 108054 1 263 . 1 1 66 66 THR C C 66 173.950 173.950 174.330 -0.380 17919 108055 1 263 . 1 1 66 66 THR CA C 66 62.340 62.340 61.787 0.553 17919 108056 1 263 . 1 1 66 66 THR CB C 66 70.080 70.080 70.004 0.076 17919 108057 1 263 . 1 1 66 66 THR H H 66 8.730 8.730 8.516 0.214 17919 108058 1 263 . 1 1 67 67 LEU N N 67 127.110 127.110 126.722 0.388 17919 108059 1 263 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.976 0.084 17919 108060 1 263 . 1 1 67 67 LEU C C 67 175.770 175.770 175.944 -0.174 17919 108061 1 263 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.745 0.155 17919 108062 1 263 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.715 0.544 17919 108063 1 263 . 1 1 67 67 LEU H H 67 9.410 9.410 8.888 0.522 17919 108064 1 263 . 1 1 68 68 HIS N N 68 118.380 118.380 120.593 -2.213 17919 108065 1 263 . 1 1 68 68 HIS HA H 68 5.240 5.240 4.876 0.364 17919 108066 1 263 . 1 1 68 68 HIS C C 68 173.150 173.150 173.191 -0.041 17919 108067 1 263 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.509 0.491 17919 108068 1 263 . 1 1 68 68 HIS CB C 68 30.530 30.530 31.713 -1.183 17919 108069 1 263 . 1 1 68 68 HIS H H 68 9.230 9.230 8.411 0.819 17919 108070 1 263 . 1 1 69 69 LEU N N 69 124.460 124.460 130.608 -6.148 17919 108071 1 263 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.429 -0.239 17919 108072 1 263 . 1 1 69 69 LEU C C 69 175.270 175.270 174.401 0.869 17919 108073 1 263 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.183 0.707 17919 108074 1 263 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.555 -0.175 17919 108075 1 263 . 1 1 69 69 LEU H H 69 8.340 8.340 8.381 -0.041 17919 108076 1 263 . 1 1 70 70 VAL N N 70 126.940 126.940 121.721 5.219 17919 108077 1 263 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.466 -0.116 17919 108078 1 263 . 1 1 70 70 VAL C C 70 174.000 174.000 173.729 0.271 17919 108079 1 263 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.119 0.681 17919 108080 1 263 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.632 -0.722 17919 108081 1 263 . 1 1 70 70 VAL H H 70 9.200 9.200 8.667 0.533 17919 108082 1 263 . 1 1 71 71 LEU N N 71 123.130 123.130 122.213 0.917 17919 108083 1 263 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.157 -0.097 17919 108084 1 263 . 1 1 71 71 LEU C C 71 177.830 177.830 176.555 1.275 17919 108085 1 263 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.381 0.559 17919 108086 1 263 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.555 -0.705 17919 108087 1 263 . 1 1 71 71 LEU H H 71 8.120 8.120 8.330 -0.210 17919 108088 1 263 . 1 1 72 72 ARG N N 72 123.490 123.490 121.756 1.734 17919 108089 1 263 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.620 -0.319 17919 108090 1 263 . 1 1 72 72 ARG C C 72 175.350 175.350 174.676 0.674 17919 108091 1 263 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.524 0.086 17919 108092 1 263 . 1 1 72 72 ARG CB C 72 31.350 31.350 31.511 -0.161 17919 108093 1 263 . 1 1 72 72 ARG H H 72 8.580 8.580 8.206 0.374 17919 108094 1 264 . 1 1 2 2 GLN N N 2 123.220 123.220 121.542 1.678 17919 108095 1 264 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.388 -0.139 17919 108096 1 264 . 1 1 2 2 GLN C C 2 175.920 175.920 174.832 1.088 17919 108097 1 264 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.897 0.183 17919 108098 1 264 . 1 1 2 2 GLN CB C 2 30.760 30.760 31.185 -0.425 17919 108099 1 264 . 1 1 2 2 GLN H H 2 8.900 8.900 8.424 0.476 17919 108100 1 264 . 1 1 3 3 ILE N N 3 115.340 115.340 117.119 -1.779 17919 108101 1 264 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.713 -0.499 17919 108102 1 264 . 1 1 3 3 ILE C C 3 172.450 172.450 173.150 -0.700 17919 108103 1 264 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.475 0.095 17919 108104 1 264 . 1 1 3 3 ILE CB C 3 42.210 42.210 42.052 0.158 17919 108105 1 264 . 1 1 3 3 ILE H H 3 8.320 8.320 8.618 -0.298 17919 108106 1 264 . 1 1 4 4 PHE N N 4 118.110 118.110 120.789 -2.679 17919 108107 1 264 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.308 0.322 17919 108108 1 264 . 1 1 4 4 PHE C C 4 175.320 175.320 175.063 0.257 17919 108109 1 264 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.870 -0.660 17919 108110 1 264 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.054 -0.574 17919 108111 1 264 . 1 1 4 4 PHE H H 4 8.610 8.610 8.258 0.352 17919 108112 1 264 . 1 1 5 5 VAL N N 5 121.000 121.000 121.551 -0.551 17919 108113 1 264 . 1 1 5 5 VAL HA H 5 4.725 4.725 5.081 -0.356 17919 108114 1 264 . 1 1 5 5 VAL C C 5 174.870 174.870 174.584 0.286 17919 108115 1 264 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.033 -0.413 17919 108116 1 264 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.708 -0.478 17919 108117 1 264 . 1 1 5 5 VAL H H 5 9.300 9.300 9.159 0.141 17919 108118 1 264 . 1 1 6 6 LYS N N 6 127.520 127.520 128.472 -0.952 17919 108119 1 264 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.401 -0.034 17919 108120 1 264 . 1 1 6 6 LYS C C 6 177.140 177.140 176.477 0.663 17919 108121 1 264 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.216 0.304 17919 108122 1 264 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.827 -0.777 17919 108123 1 264 . 1 1 6 6 LYS H H 6 8.820 8.820 9.221 -0.401 17919 108124 1 264 . 1 1 7 7 THR N N 7 115.400 115.400 118.787 -3.387 17919 108125 1 264 . 1 1 7 7 THR HA H 7 4.970 4.970 4.294 0.676 17919 108126 1 264 . 1 1 7 7 THR C C 7 176.910 176.910 176.640 0.270 17919 108127 1 264 . 1 1 7 7 THR CA C 7 60.470 60.470 61.724 -1.254 17919 108128 1 264 . 1 1 7 7 THR CB C 7 70.630 70.630 70.294 0.336 17919 108129 1 264 . 1 1 7 7 THR H H 7 8.730 8.730 8.967 -0.237 17919 108130 1 264 . 1 1 8 8 LEU N N 8 121.330 121.330 119.610 1.720 17919 108131 1 264 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.367 -0.057 17919 108132 1 264 . 1 1 8 8 LEU C C 8 178.800 178.800 177.605 1.195 17919 108133 1 264 . 1 1 8 8 LEU CA C 8 57.580 57.580 58.003 -0.423 17919 108134 1 264 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.130 0.840 17919 108135 1 264 . 1 1 8 8 LEU H H 8 9.100 9.100 8.198 0.902 17919 108136 1 264 . 1 1 9 9 THR N N 9 105.590 105.590 106.648 -1.058 17919 108137 1 264 . 1 1 9 9 THR HA H 9 4.428 4.428 4.312 0.116 17919 108138 1 264 . 1 1 9 9 THR C C 9 175.520 175.520 175.856 -0.336 17919 108139 1 264 . 1 1 9 9 THR CA C 9 61.400 61.400 61.621 -0.221 17919 108140 1 264 . 1 1 9 9 THR CB C 9 69.140 69.140 68.578 0.562 17919 108141 1 264 . 1 1 9 9 THR H H 9 7.630 7.630 7.471 0.159 17919 108142 1 264 . 1 1 10 10 GLY N N 10 108.890 108.890 111.649 -2.759 17919 108143 1 264 . 1 1 10 10 GLY C C 10 174.070 174.070 174.039 0.031 17919 108144 1 264 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.484 -0.024 17919 108145 1 264 . 1 1 10 10 GLY H H 10 7.810 7.810 8.635 -0.825 17919 108146 1 264 . 1 1 11 11 LYS N N 11 121.600 121.600 120.482 1.118 17919 108147 1 264 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.536 -0.175 17919 108148 1 264 . 1 1 11 11 LYS C C 11 175.940 175.940 175.264 0.676 17919 108149 1 264 . 1 1 11 11 LYS CA C 11 56.280 56.280 55.694 0.586 17919 108150 1 264 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.593 -0.393 17919 108151 1 264 . 1 1 11 11 LYS H H 11 7.280 7.280 7.693 -0.413 17919 108152 1 264 . 1 1 12 12 THR N N 12 120.440 120.440 117.499 2.941 17919 108153 1 264 . 1 1 12 12 THR HA H 12 5.046 5.046 5.269 -0.223 17919 108154 1 264 . 1 1 12 12 THR C C 12 174.320 174.320 174.160 0.160 17919 108155 1 264 . 1 1 12 12 THR CA C 12 62.390 62.390 61.779 0.611 17919 108156 1 264 . 1 1 12 12 THR CB C 12 69.910 69.910 70.133 -0.223 17919 108157 1 264 . 1 1 12 12 THR H H 12 8.650 8.650 8.288 0.362 17919 108158 1 264 . 1 1 13 13 ILE N N 13 127.110 127.110 127.643 -0.533 17919 108159 1 264 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.472 0.072 17919 108160 1 264 . 1 1 13 13 ILE C C 13 175.220 175.220 174.837 0.383 17919 108161 1 264 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.347 -0.367 17919 108162 1 264 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.956 -0.006 17919 108163 1 264 . 1 1 13 13 ILE H H 13 9.450 9.450 9.279 0.171 17919 108164 1 264 . 1 1 14 14 THR N N 14 121.520 121.520 122.170 -0.650 17919 108165 1 264 . 1 1 14 14 THR HA H 14 4.964 4.964 4.745 0.219 17919 108166 1 264 . 1 1 14 14 THR C C 14 173.790 173.790 173.741 0.049 17919 108167 1 264 . 1 1 14 14 THR CA C 14 61.940 61.940 62.138 -0.198 17919 108168 1 264 . 1 1 14 14 THR CB C 14 69.650 69.650 69.700 -0.050 17919 108169 1 264 . 1 1 14 14 THR H H 14 8.710 8.710 8.530 0.180 17919 108170 1 264 . 1 1 15 15 LEU N N 15 124.800 124.800 127.384 -2.584 17919 108171 1 264 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.666 0.114 17919 108172 1 264 . 1 1 15 15 LEU C C 15 174.670 174.670 175.060 -0.390 17919 108173 1 264 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.596 -0.766 17919 108174 1 264 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.365 1.705 17919 108175 1 264 . 1 1 15 15 LEU H H 15 8.710 8.710 9.004 -0.294 17919 108176 1 264 . 1 1 16 16 GLU N N 16 122.160 122.160 123.459 -1.299 17919 108177 1 264 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.982 -0.065 17919 108178 1 264 . 1 1 16 16 GLU C C 16 175.860 175.860 175.842 0.018 17919 108179 1 264 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.207 -0.387 17919 108180 1 264 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.369 -0.919 17919 108181 1 264 . 1 1 16 16 GLU H H 16 8.140 8.140 8.721 -0.581 17919 108182 1 264 . 1 1 17 17 VAL N N 17 117.210 117.210 122.468 -5.258 17919 108183 1 264 . 1 1 17 17 VAL HA H 17 4.714 4.714 5.060 -0.346 17919 108184 1 264 . 1 1 17 17 VAL C C 17 174.160 174.160 174.691 -0.531 17919 108185 1 264 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.212 -0.782 17919 108186 1 264 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.530 0.870 17919 108187 1 264 . 1 1 17 17 VAL H H 17 8.900 8.900 8.925 -0.025 17919 108188 1 264 . 1 1 18 18 GLU N N 18 118.990 118.990 119.945 -0.955 17919 108189 1 264 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.790 0.289 17919 108190 1 264 . 1 1 18 18 GLU C C 18 176.160 176.160 175.645 0.515 17919 108191 1 264 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.104 -0.384 17919 108192 1 264 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.762 -0.452 17919 108193 1 264 . 1 1 18 18 GLU H H 18 8.640 8.640 9.039 -0.399 17919 108194 1 264 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.171 -0.030 17919 108195 1 264 . 1 1 19 19 PRO C C 19 175.310 175.310 177.399 -2.089 17919 108196 1 264 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.926 -0.456 17919 108197 1 264 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.874 0.076 17919 108198 1 264 . 1 1 20 20 SER N N 20 103.400 103.400 109.576 -6.176 17919 108199 1 264 . 1 1 20 20 SER HA H 20 4.370 4.370 4.261 0.109 17919 108200 1 264 . 1 1 20 20 SER C C 20 174.660 174.660 174.598 0.062 17919 108201 1 264 . 1 1 20 20 SER CA C 20 57.400 57.400 58.585 -1.185 17919 108202 1 264 . 1 1 20 20 SER CB C 20 63.370 63.370 62.459 0.911 17919 108203 1 264 . 1 1 20 20 SER H H 20 7.040 7.040 8.297 -1.257 17919 108204 1 264 . 1 1 21 21 ASP N N 21 123.480 123.480 124.134 -0.654 17919 108205 1 264 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.755 -0.060 17919 108206 1 264 . 1 1 21 21 ASP C C 21 176.360 176.360 175.937 0.423 17919 108207 1 264 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.019 0.681 17919 108208 1 264 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.687 -0.887 17919 108209 1 264 . 1 1 21 21 ASP H H 21 8.030 8.030 8.126 -0.096 17919 108210 1 264 . 1 1 22 22 THR N N 22 108.800 108.800 112.153 -3.353 17919 108211 1 264 . 1 1 22 22 THR HA H 22 4.920 4.920 4.724 0.196 17919 108212 1 264 . 1 1 22 22 THR C C 22 176.750 176.750 175.959 0.791 17919 108213 1 264 . 1 1 22 22 THR CA C 22 59.690 59.690 60.907 -1.217 17919 108214 1 264 . 1 1 22 22 THR CB C 22 71.200 71.200 70.582 0.619 17919 108215 1 264 . 1 1 22 22 THR H H 22 7.900 7.900 8.296 -0.396 17919 108216 1 264 . 1 1 23 23 ILE N N 23 121.190 121.190 122.382 -1.192 17919 108217 1 264 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.873 -0.216 17919 108218 1 264 . 1 1 23 23 ILE C C 23 179.040 179.040 177.730 1.310 17919 108219 1 264 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.581 -0.321 17919 108220 1 264 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.615 -2.265 17919 108221 1 264 . 1 1 23 23 ILE H H 23 8.560 8.560 8.809 -0.249 17919 108222 1 264 . 1 1 24 24 GLU N N 24 120.830 120.830 120.780 0.050 17919 108223 1 264 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.848 0.069 17919 108224 1 264 . 1 1 24 24 GLU C C 24 178.640 178.640 178.679 -0.039 17919 108225 1 264 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.269 -0.049 17919 108226 1 264 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.307 -1.027 17919 108227 1 264 . 1 1 24 24 GLU H H 24 9.760 9.760 8.304 1.456 17919 108228 1 264 . 1 1 25 25 ASN N N 25 120.570 120.570 117.492 3.078 17919 108229 1 264 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.541 -0.016 17919 108230 1 264 . 1 1 25 25 ASN C C 25 178.380 178.380 177.856 0.524 17919 108231 1 264 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.002 0.058 17919 108232 1 264 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.759 -0.309 17919 108233 1 264 . 1 1 25 25 ASN H H 25 7.920 7.920 7.575 0.345 17919 108234 1 264 . 1 1 26 26 VAL N N 26 121.710 121.710 120.025 1.685 17919 108235 1 264 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.730 -0.333 17919 108236 1 264 . 1 1 26 26 VAL C C 26 177.950 177.950 177.932 0.018 17919 108237 1 264 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.096 1.565 17919 108238 1 264 . 1 1 26 26 VAL CB C 26 30.840 30.840 30.953 -0.113 17919 108239 1 264 . 1 1 26 26 VAL H H 26 8.070 8.070 8.447 -0.377 17919 108240 1 264 . 1 1 27 27 LYS N N 27 118.860 118.860 120.432 -1.572 17919 108241 1 264 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.233 0.347 17919 108242 1 264 . 1 1 27 27 LYS C C 27 180.550 180.550 179.123 1.427 17919 108243 1 264 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.579 -0.329 17919 108244 1 264 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.257 1.474 17919 108245 1 264 . 1 1 27 27 LYS H H 27 8.560 8.560 8.361 0.199 17919 108246 1 264 . 1 1 28 28 ALA N N 28 123.440 123.440 122.816 0.624 17919 108247 1 264 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.120 0.040 17919 108248 1 264 . 1 1 28 28 ALA C C 28 180.300 180.300 179.303 0.997 17919 108249 1 264 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.068 0.302 17919 108250 1 264 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.449 -0.739 17919 108251 1 264 . 1 1 28 28 ALA H H 28 8.060 8.060 8.177 -0.117 17919 108252 1 264 . 1 1 29 29 LYS N N 29 119.940 119.940 117.375 2.565 17919 108253 1 264 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.125 0.082 17919 108254 1 264 . 1 1 29 29 LYS C C 29 180.320 180.320 178.657 1.663 17919 108255 1 264 . 1 1 29 29 LYS CA C 29 59.650 59.650 58.960 0.690 17919 108256 1 264 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.394 0.896 17919 108257 1 264 . 1 1 29 29 LYS H H 29 7.850 7.850 7.641 0.209 17919 108258 1 264 . 1 1 30 30 ILE N N 30 121.080 121.080 119.154 1.926 17919 108259 1 264 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.845 -0.338 17919 108260 1 264 . 1 1 30 30 ILE C C 30 178.310 178.310 177.435 0.875 17919 108261 1 264 . 1 1 30 30 ILE CA C 30 66.150 66.150 63.747 2.403 17919 108262 1 264 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.590 -0.790 17919 108263 1 264 . 1 1 30 30 ILE H H 30 8.280 8.280 7.581 0.699 17919 108264 1 264 . 1 1 31 31 GLN N N 31 123.490 123.490 121.299 2.191 17919 108265 1 264 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.882 -0.053 17919 108266 1 264 . 1 1 31 31 GLN C C 31 178.890 178.890 178.305 0.585 17919 108267 1 264 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.417 0.583 17919 108268 1 264 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.534 -0.814 17919 108269 1 264 . 1 1 31 31 GLN H H 31 8.580 8.580 8.458 0.122 17919 108270 1 264 . 1 1 32 32 ASP N N 32 119.360 119.360 119.421 -0.061 17919 108271 1 264 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.397 -0.043 17919 108272 1 264 . 1 1 32 32 ASP C C 32 177.250 177.250 177.886 -0.636 17919 108273 1 264 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.911 0.279 17919 108274 1 264 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.429 0.151 17919 108275 1 264 . 1 1 32 32 ASP H H 32 8.010 8.010 7.876 0.134 17919 108276 1 264 . 1 1 33 33 LYS N N 33 115.130 115.130 117.580 -2.450 17919 108277 1 264 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.339 -0.002 17919 108278 1 264 . 1 1 33 33 LYS C C 33 177.870 177.870 177.130 0.740 17919 108279 1 264 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.228 0.822 17919 108280 1 264 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.383 0.787 17919 108281 1 264 . 1 1 33 33 LYS H H 33 7.430 7.430 7.437 -0.007 17919 108282 1 264 . 1 1 34 34 GLU N N 34 113.870 113.870 115.190 -1.320 17919 108283 1 264 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.516 0.109 17919 108284 1 264 . 1 1 34 34 GLU C C 34 177.840 177.840 177.391 0.449 17919 108285 1 264 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.302 -1.132 17919 108286 1 264 . 1 1 34 34 GLU CB C 34 32.660 32.660 32.275 0.385 17919 108287 1 264 . 1 1 34 34 GLU H H 34 8.740 8.740 8.025 0.715 17919 108288 1 264 . 1 1 35 35 GLY N N 35 108.650 108.650 109.157 -0.507 17919 108289 1 264 . 1 1 35 35 GLY C C 35 173.960 173.960 174.025 -0.065 17919 108290 1 264 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.519 0.561 17919 108291 1 264 . 1 1 35 35 GLY H H 35 8.530 8.530 8.377 0.153 17919 108292 1 264 . 1 1 36 36 ILE N N 36 119.880 119.880 117.415 2.465 17919 108293 1 264 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.640 -0.195 17919 108294 1 264 . 1 1 36 36 ILE C C 36 173.590 173.590 173.487 0.103 17919 108295 1 264 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.349 0.401 17919 108296 1 264 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.958 1.622 17919 108297 1 264 . 1 1 36 36 ILE H H 36 6.150 6.150 7.365 -1.215 17919 108298 1 264 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.712 -0.078 17919 108299 1 264 . 1 1 37 37 PRO C C 37 176.940 176.940 176.165 0.775 17919 108300 1 264 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.136 0.524 17919 108301 1 264 . 1 1 37 37 PRO CB C 37 31.850 31.850 30.846 1.004 17919 108302 1 264 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.158 -0.041 17919 108303 1 264 . 1 1 38 38 PRO C C 38 178.320 178.320 177.665 0.655 17919 108304 1 264 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.527 0.733 17919 108305 1 264 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.717 1.173 17919 108306 1 264 . 1 1 39 39 ASP N N 39 113.380 113.380 114.560 -1.180 17919 108307 1 264 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.413 0.017 17919 108308 1 264 . 1 1 39 39 ASP C C 39 177.090 177.090 178.107 -1.017 17919 108309 1 264 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.449 -0.809 17919 108310 1 264 . 1 1 39 39 ASP CB C 39 39.540 39.540 39.786 -0.246 17919 108311 1 264 . 1 1 39 39 ASP H H 39 8.550 8.550 8.809 -0.259 17919 108312 1 264 . 1 1 40 40 GLN N N 40 116.780 116.780 118.068 -1.288 17919 108313 1 264 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.696 -0.232 17919 108314 1 264 . 1 1 40 40 GLN C C 40 175.380 175.380 175.897 -0.517 17919 108315 1 264 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.229 -0.589 17919 108316 1 264 . 1 1 40 40 GLN CB C 40 30.140 30.140 30.159 -0.019 17919 108317 1 264 . 1 1 40 40 GLN H H 40 7.820 7.820 8.034 -0.214 17919 108318 1 264 . 1 1 41 41 GLN N N 41 117.720 117.720 119.224 -1.504 17919 108319 1 264 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.376 -0.132 17919 108320 1 264 . 1 1 41 41 GLN C C 41 176.300 176.300 174.904 1.396 17919 108321 1 264 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.175 0.295 17919 108322 1 264 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.817 1.833 17919 108323 1 264 . 1 1 41 41 GLN H H 41 7.480 7.480 7.194 0.286 17919 108324 1 264 . 1 1 42 42 ARG N N 42 122.680 122.680 125.597 -2.917 17919 108325 1 264 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.749 -0.249 17919 108326 1 264 . 1 1 42 42 ARG C C 42 174.050 174.050 173.875 0.175 17919 108327 1 264 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.921 0.129 17919 108328 1 264 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.072 -1.322 17919 108329 1 264 . 1 1 42 42 ARG H H 42 8.530 8.530 8.991 -0.461 17919 108330 1 264 . 1 1 43 43 LEU N N 43 124.040 124.040 127.188 -3.148 17919 108331 1 264 . 1 1 43 43 LEU C C 43 175.290 175.290 175.657 -0.367 17919 108332 1 264 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.802 -0.822 17919 108333 1 264 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.105 1.685 17919 108334 1 264 . 1 1 43 43 LEU H H 43 8.820 8.820 8.771 0.049 17919 108335 1 264 . 1 1 44 44 ILE N N 44 121.920 121.920 121.774 0.146 17919 108336 1 264 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.079 -0.087 17919 108337 1 264 . 1 1 44 44 ILE C C 44 176.060 176.060 175.524 0.536 17919 108338 1 264 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.574 -1.594 17919 108339 1 264 . 1 1 44 44 ILE CB C 44 41.420 41.420 40.858 0.562 17919 108340 1 264 . 1 1 44 44 ILE H H 44 9.030 9.030 8.974 0.056 17919 108341 1 264 . 1 1 45 45 PHE N N 45 125.390 125.390 130.164 -4.774 17919 108342 1 264 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.642 0.403 17919 108343 1 264 . 1 1 45 45 PHE C C 45 174.470 174.470 175.376 -0.906 17919 108344 1 264 . 1 1 45 45 PHE CA C 45 57.020 57.020 58.403 -1.383 17919 108345 1 264 . 1 1 45 45 PHE CB C 45 43.760 43.760 40.004 3.756 17919 108346 1 264 . 1 1 45 45 PHE H H 45 8.830 8.830 7.973 0.857 17919 108347 1 264 . 1 1 46 46 ALA N N 46 132.200 132.200 122.599 9.601 17919 108348 1 264 . 1 1 46 46 ALA HA H 46 3.690 3.690 4.275 -0.585 17919 108349 1 264 . 1 1 46 46 ALA C C 46 177.290 177.290 177.330 -0.040 17919 108350 1 264 . 1 1 46 46 ALA CA C 46 52.540 52.540 51.450 1.090 17919 108351 1 264 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.896 -0.326 17919 108352 1 264 . 1 1 46 46 ALA H H 46 8.810 8.810 8.052 0.758 17919 108353 1 264 . 1 1 47 47 GLY N N 47 102.340 102.340 108.992 -6.652 17919 108354 1 264 . 1 1 47 47 GLY C C 47 173.810 173.810 174.029 -0.219 17919 108355 1 264 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.355 -0.005 17919 108356 1 264 . 1 1 47 47 GLY H H 47 8.130 8.130 8.494 -0.364 17919 108357 1 264 . 1 1 48 48 LYS N N 48 121.570 121.570 120.616 0.954 17919 108358 1 264 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.597 0.025 17919 108359 1 264 . 1 1 48 48 LYS C C 48 174.700 174.700 175.261 -0.561 17919 108360 1 264 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.035 -0.485 17919 108361 1 264 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.555 -0.025 17919 108362 1 264 . 1 1 48 48 LYS H H 48 7.980 7.980 7.723 0.257 17919 108363 1 264 . 1 1 49 49 GLN N N 49 122.410 122.410 121.183 1.227 17919 108364 1 264 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.571 -0.011 17919 108365 1 264 . 1 1 49 49 GLN C C 49 175.670 175.670 175.848 -0.178 17919 108366 1 264 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.822 -0.082 17919 108367 1 264 . 1 1 49 49 GLN CB C 49 29.000 29.000 28.799 0.201 17919 108368 1 264 . 1 1 49 49 GLN H H 49 8.600 8.600 8.481 0.119 17919 108369 1 264 . 1 1 50 50 LEU N N 50 125.520 125.520 127.338 -1.818 17919 108370 1 264 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.264 -0.174 17919 108371 1 264 . 1 1 50 50 LEU C C 50 176.660 176.660 176.941 -0.281 17919 108372 1 264 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.997 -0.757 17919 108373 1 264 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.226 -0.656 17919 108374 1 264 . 1 1 50 50 LEU H H 50 8.530 8.530 8.793 -0.263 17919 108375 1 264 . 1 1 51 51 GLU N N 51 122.940 122.940 122.529 0.411 17919 108376 1 264 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.576 -0.088 17919 108377 1 264 . 1 1 51 51 GLU C C 51 175.870 175.870 176.789 -0.919 17919 108378 1 264 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.522 0.438 17919 108379 1 264 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.484 0.086 17919 108380 1 264 . 1 1 51 51 GLU H H 51 8.400 8.400 8.598 -0.198 17919 108381 1 264 . 1 1 52 52 ASP N N 52 120.030 120.030 124.649 -4.619 17919 108382 1 264 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.481 -0.122 17919 108383 1 264 . 1 1 52 52 ASP C C 52 177.330 177.330 177.766 -0.436 17919 108384 1 264 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.346 -0.386 17919 108385 1 264 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.891 -0.041 17919 108386 1 264 . 1 1 52 52 ASP H H 52 8.160 8.160 8.885 -0.725 17919 108387 1 264 . 1 1 53 53 GLY N N 53 106.660 106.660 106.107 0.553 17919 108388 1 264 . 1 1 53 53 GLY C C 53 174.870 174.870 173.948 0.922 17919 108389 1 264 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.826 0.344 17919 108390 1 264 . 1 1 53 53 GLY H H 53 9.390 9.390 8.405 0.985 17919 108391 1 264 . 1 1 54 54 ARG N N 54 119.050 119.050 121.971 -2.921 17919 108392 1 264 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.528 0.167 17919 108393 1 264 . 1 1 54 54 ARG C C 54 175.350 175.350 175.360 -0.010 17919 108394 1 264 . 1 1 54 54 ARG CA C 54 54.390 54.390 53.714 0.676 17919 108395 1 264 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.507 0.143 17919 108396 1 264 . 1 1 54 54 ARG H H 54 7.460 7.460 7.380 0.080 17919 108397 1 264 . 1 1 55 55 THR N N 55 108.400 108.400 113.941 -5.541 17919 108398 1 264 . 1 1 55 55 THR HA H 55 5.240 5.240 5.011 0.229 17919 108399 1 264 . 1 1 55 55 THR C C 55 176.560 176.560 175.634 0.926 17919 108400 1 264 . 1 1 55 55 THR CA C 55 59.690 59.690 60.394 -0.704 17919 108401 1 264 . 1 1 55 55 THR CB C 55 72.260 72.260 70.996 1.264 17919 108402 1 264 . 1 1 55 55 THR H H 55 8.730 8.730 8.801 -0.071 17919 108403 1 264 . 1 1 56 56 LEU N N 56 117.920 117.920 121.417 -3.497 17919 108404 1 264 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.096 -0.036 17919 108405 1 264 . 1 1 56 56 LEU C C 56 180.810 180.810 178.805 2.005 17919 108406 1 264 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.014 0.696 17919 108407 1 264 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.581 -1.211 17919 108408 1 264 . 1 1 56 56 LEU H H 56 8.140 8.140 8.410 -0.270 17919 108409 1 264 . 1 1 57 57 SER N N 57 113.330 113.330 115.743 -2.413 17919 108410 1 264 . 1 1 57 57 SER HA H 57 4.370 4.370 4.059 0.311 17919 108411 1 264 . 1 1 57 57 SER C C 57 178.310 178.310 176.843 1.467 17919 108412 1 264 . 1 1 57 57 SER CA C 57 61.080 61.080 62.101 -1.021 17919 108413 1 264 . 1 1 57 57 SER CB C 57 62.530 62.530 63.055 -0.525 17919 108414 1 264 . 1 1 57 57 SER H H 57 8.470 8.470 8.339 0.131 17919 108415 1 264 . 1 1 58 58 ASP N N 58 124.190 124.190 121.411 2.779 17919 108416 1 264 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.361 -0.065 17919 108417 1 264 . 1 1 58 58 ASP C C 58 177.400 177.400 177.223 0.177 17919 108418 1 264 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.739 0.441 17919 108419 1 264 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.470 -0.370 17919 108420 1 264 . 1 1 58 58 ASP H H 58 7.930 7.930 7.807 0.123 17919 108421 1 264 . 1 1 59 59 TYR N N 59 115.510 115.510 115.802 -0.292 17919 108422 1 264 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.537 0.133 17919 108423 1 264 . 1 1 59 59 TYR C C 59 174.700 174.700 174.882 -0.182 17919 108424 1 264 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.904 0.346 17919 108425 1 264 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.353 1.716 17919 108426 1 264 . 1 1 59 59 TYR H H 59 7.250 7.250 7.149 0.101 17919 108427 1 264 . 1 1 60 60 ASN N N 60 115.900 115.900 115.610 0.290 17919 108428 1 264 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.383 -0.028 17919 108429 1 264 . 1 1 60 60 ASN C C 60 174.340 174.340 174.323 0.017 17919 108430 1 264 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.437 -0.317 17919 108431 1 264 . 1 1 60 60 ASN CB C 60 37.410 37.410 36.540 0.870 17919 108432 1 264 . 1 1 60 60 ASN H H 60 8.150 8.150 8.022 0.128 17919 108433 1 264 . 1 1 61 61 ILE N N 61 118.600 118.600 119.478 -0.878 17919 108434 1 264 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.879 -0.486 17919 108435 1 264 . 1 1 61 61 ILE C C 61 174.610 174.610 175.427 -0.817 17919 108436 1 264 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.579 0.841 17919 108437 1 264 . 1 1 61 61 ILE CB C 61 36.740 36.740 38.325 -1.585 17919 108438 1 264 . 1 1 61 61 ILE H H 61 7.250 7.250 7.779 -0.529 17919 108439 1 264 . 1 1 62 62 GLN N N 62 124.740 124.740 125.954 -1.214 17919 108440 1 264 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.778 -0.272 17919 108441 1 264 . 1 1 62 62 GLN C C 62 175.970 175.970 175.734 0.236 17919 108442 1 264 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.585 0.075 17919 108443 1 264 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.422 0.228 17919 108444 1 264 . 1 1 62 62 GLN H H 62 7.610 7.610 8.090 -0.480 17919 108445 1 264 . 1 1 63 63 LYS N N 63 120.300 120.300 121.607 -1.307 17919 108446 1 264 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.149 -0.148 17919 108447 1 264 . 1 1 63 63 LYS C C 63 175.810 175.810 176.930 -1.120 17919 108448 1 264 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.560 0.230 17919 108449 1 264 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.914 0.736 17919 108450 1 264 . 1 1 63 63 LYS H H 63 8.490 8.490 8.516 -0.026 17919 108451 1 264 . 1 1 64 64 GLU N N 64 113.950 113.950 119.648 -5.698 17919 108452 1 264 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.699 -0.234 17919 108453 1 264 . 1 1 64 64 GLU C C 64 175.250 175.250 176.013 -0.763 17919 108454 1 264 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.842 0.048 17919 108455 1 264 . 1 1 64 64 GLU CB C 64 25.900 25.900 29.039 -3.139 17919 108456 1 264 . 1 1 64 64 GLU H H 64 9.280 9.280 8.844 0.436 17919 108457 1 264 . 1 1 65 65 SER N N 65 114.730 114.730 116.091 -1.361 17919 108458 1 264 . 1 1 65 65 SER HA H 65 4.640 4.640 4.424 0.216 17919 108459 1 264 . 1 1 65 65 SER C C 65 172.160 172.160 173.846 -1.686 17919 108460 1 264 . 1 1 65 65 SER CA C 65 60.890 60.890 60.608 0.282 17919 108461 1 264 . 1 1 65 65 SER CB C 65 64.910 64.910 64.060 0.850 17919 108462 1 264 . 1 1 65 65 SER H H 65 7.670 7.670 7.506 0.164 17919 108463 1 264 . 1 1 66 66 THR N N 66 117.110 117.110 119.937 -2.827 17919 108464 1 264 . 1 1 66 66 THR HA H 66 5.270 5.270 5.123 0.147 17919 108465 1 264 . 1 1 66 66 THR C C 66 173.950 173.950 174.105 -0.155 17919 108466 1 264 . 1 1 66 66 THR CA C 66 62.340 62.340 61.606 0.734 17919 108467 1 264 . 1 1 66 66 THR CB C 66 70.080 70.080 71.147 -1.067 17919 108468 1 264 . 1 1 66 66 THR H H 66 8.730 8.730 8.475 0.255 17919 108469 1 264 . 1 1 67 67 LEU N N 67 127.110 127.110 126.436 0.674 17919 108470 1 264 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.919 0.141 17919 108471 1 264 . 1 1 67 67 LEU C C 67 175.770 175.770 175.136 0.634 17919 108472 1 264 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.903 -0.003 17919 108473 1 264 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.358 -0.098 17919 108474 1 264 . 1 1 67 67 LEU H H 67 9.410 9.410 9.111 0.299 17919 108475 1 264 . 1 1 68 68 HIS N N 68 118.380 118.380 120.675 -2.295 17919 108476 1 264 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.394 -0.154 17919 108477 1 264 . 1 1 68 68 HIS C C 68 173.150 173.150 173.788 -0.638 17919 108478 1 264 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.456 0.544 17919 108479 1 264 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.789 -2.260 17919 108480 1 264 . 1 1 68 68 HIS H H 68 9.230 9.230 9.180 0.050 17919 108481 1 264 . 1 1 69 69 LEU N N 69 124.460 124.460 128.681 -4.221 17919 108482 1 264 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.229 -0.039 17919 108483 1 264 . 1 1 69 69 LEU C C 69 175.270 175.270 174.270 1.000 17919 108484 1 264 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.291 0.599 17919 108485 1 264 . 1 1 69 69 LEU CB C 69 44.380 44.380 45.108 -0.728 17919 108486 1 264 . 1 1 69 69 LEU H H 69 8.340 8.340 8.197 0.143 17919 108487 1 264 . 1 1 70 70 VAL N N 70 126.940 126.940 122.006 4.934 17919 108488 1 264 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.508 -0.158 17919 108489 1 264 . 1 1 70 70 VAL C C 70 174.000 174.000 173.437 0.563 17919 108490 1 264 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.359 0.441 17919 108491 1 264 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.823 -0.913 17919 108492 1 264 . 1 1 70 70 VAL H H 70 9.200 9.200 9.036 0.164 17919 108493 1 264 . 1 1 71 71 LEU N N 71 123.130 123.130 124.175 -1.045 17919 108494 1 264 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.108 -0.048 17919 108495 1 264 . 1 1 71 71 LEU C C 71 177.830 177.830 176.840 0.990 17919 108496 1 264 . 1 1 71 71 LEU CA C 71 53.940 53.940 54.331 -0.391 17919 108497 1 264 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.495 0.355 17919 108498 1 264 . 1 1 71 71 LEU H H 71 8.120 8.120 8.397 -0.277 17919 108499 1 264 . 1 1 72 72 ARG N N 72 123.490 123.490 123.220 0.270 17919 108500 1 264 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.629 -0.328 17919 108501 1 264 . 1 1 72 72 ARG C C 72 175.350 175.350 174.236 1.114 17919 108502 1 264 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.221 0.389 17919 108503 1 264 . 1 1 72 72 ARG CB C 72 31.350 31.350 33.292 -1.942 17919 108504 1 264 . 1 1 72 72 ARG H H 72 8.580 8.580 8.499 0.081 17919 108505 1 265 . 1 1 2 2 GLN N N 2 123.220 123.220 122.619 0.601 17919 108506 1 265 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.411 -0.162 17919 108507 1 265 . 1 1 2 2 GLN C C 2 175.920 175.920 174.780 1.140 17919 108508 1 265 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.478 0.602 17919 108509 1 265 . 1 1 2 2 GLN CB C 2 30.760 30.760 31.233 -0.473 17919 108510 1 265 . 1 1 2 2 GLN H H 2 8.900 8.900 8.451 0.449 17919 108511 1 265 . 1 1 3 3 ILE N N 3 115.340 115.340 118.090 -2.750 17919 108512 1 265 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.788 -0.575 17919 108513 1 265 . 1 1 3 3 ILE C C 3 172.450 172.450 173.297 -0.847 17919 108514 1 265 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.161 0.409 17919 108515 1 265 . 1 1 3 3 ILE CB C 3 42.210 42.210 42.018 0.192 17919 108516 1 265 . 1 1 3 3 ILE H H 3 8.320 8.320 7.884 0.436 17919 108517 1 265 . 1 1 4 4 PHE N N 4 118.110 118.110 120.084 -1.974 17919 108518 1 265 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.589 0.041 17919 108519 1 265 . 1 1 4 4 PHE C C 4 175.320 175.320 175.597 -0.277 17919 108520 1 265 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.767 -0.557 17919 108521 1 265 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.205 -0.725 17919 108522 1 265 . 1 1 4 4 PHE H H 4 8.610 8.610 8.582 0.028 17919 108523 1 265 . 1 1 5 5 VAL N N 5 121.000 121.000 122.447 -1.447 17919 108524 1 265 . 1 1 5 5 VAL HA H 5 4.725 4.725 5.021 -0.296 17919 108525 1 265 . 1 1 5 5 VAL C C 5 174.870 174.870 175.345 -0.475 17919 108526 1 265 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.136 -0.517 17919 108527 1 265 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.666 0.564 17919 108528 1 265 . 1 1 5 5 VAL H H 5 9.300 9.300 9.367 -0.067 17919 108529 1 265 . 1 1 6 6 LYS N N 6 127.520 127.520 128.333 -0.813 17919 108530 1 265 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.309 0.058 17919 108531 1 265 . 1 1 6 6 LYS C C 6 177.140 177.140 177.150 -0.010 17919 108532 1 265 . 1 1 6 6 LYS CA C 6 54.520 54.520 55.030 -0.510 17919 108533 1 265 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.209 -0.159 17919 108534 1 265 . 1 1 6 6 LYS H H 6 8.820 8.820 9.184 -0.364 17919 108535 1 265 . 1 1 7 7 THR N N 7 115.400 115.400 116.728 -1.328 17919 108536 1 265 . 1 1 7 7 THR HA H 7 4.970 4.970 4.576 0.394 17919 108537 1 265 . 1 1 7 7 THR C C 7 176.910 176.910 176.776 0.134 17919 108538 1 265 . 1 1 7 7 THR CA C 7 60.470 60.470 61.087 -0.616 17919 108539 1 265 . 1 1 7 7 THR CB C 7 70.630 70.630 70.398 0.231 17919 108540 1 265 . 1 1 7 7 THR H H 7 8.730 8.730 8.524 0.206 17919 108541 1 265 . 1 1 8 8 LEU N N 8 121.330 121.330 119.985 1.345 17919 108542 1 265 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.288 0.022 17919 108543 1 265 . 1 1 8 8 LEU C C 8 178.800 178.800 178.427 0.373 17919 108544 1 265 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.793 -0.213 17919 108545 1 265 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.772 0.198 17919 108546 1 265 . 1 1 8 8 LEU H H 8 9.100 9.100 8.838 0.262 17919 108547 1 265 . 1 1 9 9 THR N N 9 105.590 105.590 109.169 -3.579 17919 108548 1 265 . 1 1 9 9 THR HA H 9 4.428 4.428 4.280 0.148 17919 108549 1 265 . 1 1 9 9 THR C C 9 175.520 175.520 175.793 -0.273 17919 108550 1 265 . 1 1 9 9 THR CA C 9 61.400 61.400 62.388 -0.988 17919 108551 1 265 . 1 1 9 9 THR CB C 9 69.140 69.140 69.113 0.027 17919 108552 1 265 . 1 1 9 9 THR H H 9 7.630 7.630 7.870 -0.240 17919 108553 1 265 . 1 1 10 10 GLY N N 10 108.890 108.890 110.786 -1.896 17919 108554 1 265 . 1 1 10 10 GLY C C 10 174.070 174.070 173.574 0.496 17919 108555 1 265 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.025 0.435 17919 108556 1 265 . 1 1 10 10 GLY H H 10 7.810 7.810 7.717 0.093 17919 108557 1 265 . 1 1 11 11 LYS N N 11 121.600 121.600 121.785 -0.185 17919 108558 1 265 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.566 -0.205 17919 108559 1 265 . 1 1 11 11 LYS C C 11 175.940 175.940 175.187 0.753 17919 108560 1 265 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.157 0.123 17919 108561 1 265 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.618 -0.418 17919 108562 1 265 . 1 1 11 11 LYS H H 11 7.280 7.280 7.657 -0.377 17919 108563 1 265 . 1 1 12 12 THR N N 12 120.440 120.440 120.461 -0.021 17919 108564 1 265 . 1 1 12 12 THR HA H 12 5.046 5.046 5.198 -0.152 17919 108565 1 265 . 1 1 12 12 THR C C 12 174.320 174.320 174.679 -0.359 17919 108566 1 265 . 1 1 12 12 THR CA C 12 62.390 62.390 61.171 1.219 17919 108567 1 265 . 1 1 12 12 THR CB C 12 69.910 69.910 70.082 -0.172 17919 108568 1 265 . 1 1 12 12 THR H H 12 8.650 8.650 8.263 0.387 17919 108569 1 265 . 1 1 13 13 ILE N N 13 127.110 127.110 122.779 4.331 17919 108570 1 265 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.809 -0.265 17919 108571 1 265 . 1 1 13 13 ILE C C 13 175.220 175.220 174.577 0.643 17919 108572 1 265 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.240 0.740 17919 108573 1 265 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.923 0.027 17919 108574 1 265 . 1 1 13 13 ILE H H 13 9.450 9.450 9.013 0.437 17919 108575 1 265 . 1 1 14 14 THR N N 14 121.520 121.520 121.904 -0.384 17919 108576 1 265 . 1 1 14 14 THR HA H 14 4.964 4.964 5.030 -0.066 17919 108577 1 265 . 1 1 14 14 THR C C 14 173.790 173.790 173.739 0.051 17919 108578 1 265 . 1 1 14 14 THR CA C 14 61.940 61.940 61.795 0.145 17919 108579 1 265 . 1 1 14 14 THR CB C 14 69.650 69.650 69.850 -0.201 17919 108580 1 265 . 1 1 14 14 THR H H 14 8.710 8.710 8.381 0.329 17919 108581 1 265 . 1 1 15 15 LEU N N 15 124.800 124.800 123.636 1.164 17919 108582 1 265 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.690 0.090 17919 108583 1 265 . 1 1 15 15 LEU C C 15 174.670 174.670 174.732 -0.062 17919 108584 1 265 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.739 -0.909 17919 108585 1 265 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.539 1.530 17919 108586 1 265 . 1 1 15 15 LEU H H 15 8.710 8.710 8.744 -0.034 17919 108587 1 265 . 1 1 16 16 GLU N N 16 122.160 122.160 123.119 -0.959 17919 108588 1 265 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.838 0.079 17919 108589 1 265 . 1 1 16 16 GLU C C 16 175.860 175.860 175.275 0.585 17919 108590 1 265 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.252 -0.432 17919 108591 1 265 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.705 -1.255 17919 108592 1 265 . 1 1 16 16 GLU H H 16 8.140 8.140 8.466 -0.326 17919 108593 1 265 . 1 1 17 17 VAL N N 17 117.210 117.210 120.334 -3.124 17919 108594 1 265 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.835 -0.121 17919 108595 1 265 . 1 1 17 17 VAL C C 17 174.160 174.160 174.761 -0.601 17919 108596 1 265 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.216 -0.786 17919 108597 1 265 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.348 1.052 17919 108598 1 265 . 1 1 17 17 VAL H H 17 8.900 8.900 8.821 0.079 17919 108599 1 265 . 1 1 18 18 GLU N N 18 118.990 118.990 122.608 -3.618 17919 108600 1 265 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.939 0.140 17919 108601 1 265 . 1 1 18 18 GLU C C 18 176.160 176.160 175.871 0.289 17919 108602 1 265 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.567 0.153 17919 108603 1 265 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.586 -0.276 17919 108604 1 265 . 1 1 18 18 GLU H H 18 8.640 8.640 9.323 -0.683 17919 108605 1 265 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.329 -0.188 17919 108606 1 265 . 1 1 19 19 PRO C C 19 175.310 175.310 177.479 -2.169 17919 108607 1 265 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.080 0.390 17919 108608 1 265 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.906 0.044 17919 108609 1 265 . 1 1 20 20 SER N N 20 103.400 103.400 111.190 -7.790 17919 108610 1 265 . 1 1 20 20 SER HA H 20 4.370 4.370 4.342 0.028 17919 108611 1 265 . 1 1 20 20 SER C C 20 174.660 174.660 174.147 0.513 17919 108612 1 265 . 1 1 20 20 SER CA C 20 57.400 57.400 58.254 -0.854 17919 108613 1 265 . 1 1 20 20 SER CB C 20 63.370 63.370 62.829 0.541 17919 108614 1 265 . 1 1 20 20 SER H H 20 7.040 7.040 8.061 -1.021 17919 108615 1 265 . 1 1 21 21 ASP N N 21 123.480 123.480 123.974 -0.494 17919 108616 1 265 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.638 0.058 17919 108617 1 265 . 1 1 21 21 ASP C C 21 176.360 176.360 175.933 0.427 17919 108618 1 265 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.359 0.341 17919 108619 1 265 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.454 -0.654 17919 108620 1 265 . 1 1 21 21 ASP H H 21 8.030 8.030 7.740 0.290 17919 108621 1 265 . 1 1 22 22 THR N N 22 108.800 108.800 113.010 -4.210 17919 108622 1 265 . 1 1 22 22 THR HA H 22 4.920 4.920 4.901 0.019 17919 108623 1 265 . 1 1 22 22 THR C C 22 176.750 176.750 176.298 0.452 17919 108624 1 265 . 1 1 22 22 THR CA C 22 59.690 59.690 61.163 -1.472 17919 108625 1 265 . 1 1 22 22 THR CB C 22 71.200 71.200 70.535 0.665 17919 108626 1 265 . 1 1 22 22 THR H H 22 7.900 7.900 8.433 -0.533 17919 108627 1 265 . 1 1 23 23 ILE N N 23 121.190 121.190 123.249 -2.059 17919 108628 1 265 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.774 -0.117 17919 108629 1 265 . 1 1 23 23 ILE C C 23 179.040 179.040 177.852 1.188 17919 108630 1 265 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.632 -0.372 17919 108631 1 265 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.188 -1.838 17919 108632 1 265 . 1 1 23 23 ILE H H 23 8.560 8.560 8.717 -0.157 17919 108633 1 265 . 1 1 24 24 GLU N N 24 120.830 120.830 121.386 -0.556 17919 108634 1 265 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.992 -0.075 17919 108635 1 265 . 1 1 24 24 GLU C C 24 178.640 178.640 178.905 -0.265 17919 108636 1 265 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.942 0.278 17919 108637 1 265 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.406 -1.126 17919 108638 1 265 . 1 1 24 24 GLU H H 24 9.760 9.760 8.079 1.681 17919 108639 1 265 . 1 1 25 25 ASN N N 25 120.570 120.570 117.428 3.142 17919 108640 1 265 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.490 0.035 17919 108641 1 265 . 1 1 25 25 ASN C C 25 178.380 178.380 178.009 0.371 17919 108642 1 265 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.048 0.012 17919 108643 1 265 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.764 -0.314 17919 108644 1 265 . 1 1 25 25 ASN H H 25 7.920 7.920 7.732 0.188 17919 108645 1 265 . 1 1 26 26 VAL N N 26 121.710 121.710 120.098 1.612 17919 108646 1 265 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.723 -0.326 17919 108647 1 265 . 1 1 26 26 VAL C C 26 177.950 177.950 177.589 0.361 17919 108648 1 265 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.143 1.517 17919 108649 1 265 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.308 -0.468 17919 108650 1 265 . 1 1 26 26 VAL H H 26 8.070 8.070 8.646 -0.576 17919 108651 1 265 . 1 1 27 27 LYS N N 27 118.860 118.860 120.862 -2.002 17919 108652 1 265 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.250 0.330 17919 108653 1 265 . 1 1 27 27 LYS C C 27 180.550 180.550 179.064 1.486 17919 108654 1 265 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.536 -0.286 17919 108655 1 265 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.212 1.518 17919 108656 1 265 . 1 1 27 27 LYS H H 27 8.560 8.560 8.190 0.370 17919 108657 1 265 . 1 1 28 28 ALA N N 28 123.440 123.440 122.832 0.608 17919 108658 1 265 . 1 1 28 28 ALA HA H 28 4.160 4.160 3.934 0.226 17919 108659 1 265 . 1 1 28 28 ALA C C 28 180.300 180.300 179.063 1.237 17919 108660 1 265 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.495 -0.125 17919 108661 1 265 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.302 -0.592 17919 108662 1 265 . 1 1 28 28 ALA H H 28 8.060 8.060 8.040 0.020 17919 108663 1 265 . 1 1 29 29 LYS N N 29 119.940 119.940 117.584 2.356 17919 108664 1 265 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.053 0.154 17919 108665 1 265 . 1 1 29 29 LYS C C 29 180.320 180.320 178.997 1.323 17919 108666 1 265 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.078 0.572 17919 108667 1 265 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.428 0.862 17919 108668 1 265 . 1 1 29 29 LYS H H 29 7.850 7.850 7.558 0.292 17919 108669 1 265 . 1 1 30 30 ILE N N 30 121.080 121.080 120.468 0.612 17919 108670 1 265 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.667 -0.161 17919 108671 1 265 . 1 1 30 30 ILE C C 30 178.310 178.310 177.472 0.838 17919 108672 1 265 . 1 1 30 30 ILE CA C 30 66.150 66.150 64.912 1.238 17919 108673 1 265 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.942 -1.142 17919 108674 1 265 . 1 1 30 30 ILE H H 30 8.280 8.280 8.119 0.161 17919 108675 1 265 . 1 1 31 31 GLN N N 31 123.490 123.490 120.731 2.759 17919 108676 1 265 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.076 -0.247 17919 108677 1 265 . 1 1 31 31 GLN C C 31 178.890 178.890 178.512 0.378 17919 108678 1 265 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.071 0.929 17919 108679 1 265 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.102 -0.382 17919 108680 1 265 . 1 1 31 31 GLN H H 31 8.580 8.580 7.935 0.645 17919 108681 1 265 . 1 1 32 32 ASP N N 32 119.360 119.360 117.941 1.419 17919 108682 1 265 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.488 -0.134 17919 108683 1 265 . 1 1 32 32 ASP C C 32 177.250 177.250 177.551 -0.301 17919 108684 1 265 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.055 1.135 17919 108685 1 265 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.704 -0.124 17919 108686 1 265 . 1 1 32 32 ASP H H 32 8.010 8.010 7.758 0.252 17919 108687 1 265 . 1 1 33 33 LYS N N 33 115.130 115.130 117.429 -2.299 17919 108688 1 265 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.459 -0.122 17919 108689 1 265 . 1 1 33 33 LYS C C 33 177.870 177.870 177.574 0.296 17919 108690 1 265 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.389 0.661 17919 108691 1 265 . 1 1 33 33 LYS CB C 33 34.170 34.170 34.364 -0.194 17919 108692 1 265 . 1 1 33 33 LYS H H 33 7.430 7.430 7.741 -0.311 17919 108693 1 265 . 1 1 34 34 GLU N N 34 113.870 113.870 115.320 -1.450 17919 108694 1 265 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.449 0.176 17919 108695 1 265 . 1 1 34 34 GLU C C 34 177.840 177.840 177.307 0.533 17919 108696 1 265 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.895 -0.726 17919 108697 1 265 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.665 0.996 17919 108698 1 265 . 1 1 34 34 GLU H H 34 8.740 8.740 7.867 0.873 17919 108699 1 265 . 1 1 35 35 GLY N N 35 108.650 108.650 109.496 -0.846 17919 108700 1 265 . 1 1 35 35 GLY C C 35 173.960 173.960 174.238 -0.278 17919 108701 1 265 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.829 0.251 17919 108702 1 265 . 1 1 35 35 GLY H H 35 8.530 8.530 8.279 0.251 17919 108703 1 265 . 1 1 36 36 ILE N N 36 119.880 119.880 117.249 2.631 17919 108704 1 265 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.574 -0.129 17919 108705 1 265 . 1 1 36 36 ILE C C 36 173.590 173.590 173.615 -0.025 17919 108706 1 265 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.652 0.098 17919 108707 1 265 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.649 1.931 17919 108708 1 265 . 1 1 36 36 ILE H H 36 6.150 6.150 7.485 -1.335 17919 108709 1 265 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.567 0.067 17919 108710 1 265 . 1 1 37 37 PRO C C 37 176.940 176.940 176.007 0.933 17919 108711 1 265 . 1 1 37 37 PRO CA C 37 61.660 61.660 62.029 -0.368 17919 108712 1 265 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.028 0.822 17919 108713 1 265 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.120 -0.003 17919 108714 1 265 . 1 1 38 38 PRO C C 38 178.320 178.320 177.755 0.565 17919 108715 1 265 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.411 0.849 17919 108716 1 265 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.745 1.145 17919 108717 1 265 . 1 1 39 39 ASP N N 39 113.380 113.380 114.074 -0.694 17919 108718 1 265 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.373 0.057 17919 108719 1 265 . 1 1 39 39 ASP C C 39 177.090 177.090 177.877 -0.787 17919 108720 1 265 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.314 -0.674 17919 108721 1 265 . 1 1 39 39 ASP CB C 39 39.540 39.540 39.596 -0.056 17919 108722 1 265 . 1 1 39 39 ASP H H 39 8.550 8.550 8.719 -0.169 17919 108723 1 265 . 1 1 40 40 GLN N N 40 116.780 116.780 117.416 -0.636 17919 108724 1 265 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.313 0.151 17919 108725 1 265 . 1 1 40 40 GLN C C 40 175.380 175.380 175.796 -0.416 17919 108726 1 265 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.640 -1.000 17919 108727 1 265 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.594 0.546 17919 108728 1 265 . 1 1 40 40 GLN H H 40 7.820 7.820 7.955 -0.135 17919 108729 1 265 . 1 1 41 41 GLN N N 41 117.720 117.720 118.909 -1.189 17919 108730 1 265 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.563 -0.319 17919 108731 1 265 . 1 1 41 41 GLN C C 41 176.300 176.300 175.397 0.903 17919 108732 1 265 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.339 1.131 17919 108733 1 265 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.761 1.889 17919 108734 1 265 . 1 1 41 41 GLN H H 41 7.480 7.480 7.240 0.240 17919 108735 1 265 . 1 1 42 42 ARG N N 42 122.680 122.680 126.047 -3.367 17919 108736 1 265 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.562 -0.062 17919 108737 1 265 . 1 1 42 42 ARG C C 42 174.050 174.050 174.531 -0.481 17919 108738 1 265 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.807 0.243 17919 108739 1 265 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.775 -1.024 17919 108740 1 265 . 1 1 42 42 ARG H H 42 8.530 8.530 9.021 -0.491 17919 108741 1 265 . 1 1 43 43 LEU N N 43 124.040 124.040 126.294 -2.254 17919 108742 1 265 . 1 1 43 43 LEU C C 43 175.290 175.290 175.895 -0.605 17919 108743 1 265 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.097 -1.117 17919 108744 1 265 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.620 2.171 17919 108745 1 265 . 1 1 43 43 LEU H H 43 8.820 8.820 8.774 0.046 17919 108746 1 265 . 1 1 44 44 ILE N N 44 121.920 121.920 120.639 1.281 17919 108747 1 265 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.221 -0.229 17919 108748 1 265 . 1 1 44 44 ILE C C 44 176.060 176.060 174.414 1.646 17919 108749 1 265 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.075 -1.095 17919 108750 1 265 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.402 0.018 17919 108751 1 265 . 1 1 44 44 ILE H H 44 9.030 9.030 9.032 -0.002 17919 108752 1 265 . 1 1 45 45 PHE N N 45 125.390 125.390 126.098 -0.708 17919 108753 1 265 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.955 0.090 17919 108754 1 265 . 1 1 45 45 PHE C C 45 174.470 174.470 174.054 0.416 17919 108755 1 265 . 1 1 45 45 PHE CA C 45 57.020 57.020 57.243 -0.223 17919 108756 1 265 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.426 0.334 17919 108757 1 265 . 1 1 45 45 PHE H H 45 8.830 8.830 9.099 -0.269 17919 108758 1 265 . 1 1 46 46 ALA N N 46 132.200 132.200 126.457 5.743 17919 108759 1 265 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.600 0.090 17919 108760 1 265 . 1 1 46 46 ALA C C 46 177.290 177.290 177.835 -0.545 17919 108761 1 265 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.745 -0.205 17919 108762 1 265 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.686 -0.116 17919 108763 1 265 . 1 1 46 46 ALA H H 46 8.810 8.810 8.700 0.110 17919 108764 1 265 . 1 1 47 47 GLY N N 47 102.340 102.340 103.782 -1.442 17919 108765 1 265 . 1 1 47 47 GLY C C 47 173.810 173.810 174.651 -0.841 17919 108766 1 265 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.998 0.352 17919 108767 1 265 . 1 1 47 47 GLY H H 47 8.130 8.130 8.405 -0.275 17919 108768 1 265 . 1 1 48 48 LYS N N 48 121.570 121.570 122.495 -0.925 17919 108769 1 265 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.425 0.197 17919 108770 1 265 . 1 1 48 48 LYS C C 48 174.700 174.700 175.996 -1.296 17919 108771 1 265 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.631 -1.081 17919 108772 1 265 . 1 1 48 48 LYS CB C 48 34.530 34.530 33.251 1.279 17919 108773 1 265 . 1 1 48 48 LYS H H 48 7.980 7.980 7.926 0.054 17919 108774 1 265 . 1 1 49 49 GLN N N 49 122.410 122.410 122.224 0.186 17919 108775 1 265 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.544 0.016 17919 108776 1 265 . 1 1 49 49 GLN C C 49 175.670 175.670 175.766 -0.096 17919 108777 1 265 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.872 -0.132 17919 108778 1 265 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.413 -0.413 17919 108779 1 265 . 1 1 49 49 GLN H H 49 8.600 8.600 8.533 0.067 17919 108780 1 265 . 1 1 50 50 LEU N N 50 125.520 125.520 126.710 -1.190 17919 108781 1 265 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.338 -0.248 17919 108782 1 265 . 1 1 50 50 LEU C C 50 176.660 176.660 176.121 0.539 17919 108783 1 265 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.592 0.648 17919 108784 1 265 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.879 -1.308 17919 108785 1 265 . 1 1 50 50 LEU H H 50 8.530 8.530 8.573 -0.043 17919 108786 1 265 . 1 1 51 51 GLU N N 51 122.940 122.940 121.359 1.581 17919 108787 1 265 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.563 -0.075 17919 108788 1 265 . 1 1 51 51 GLU C C 51 175.870 175.870 176.803 -0.933 17919 108789 1 265 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.302 0.658 17919 108790 1 265 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.325 -0.755 17919 108791 1 265 . 1 1 51 51 GLU H H 51 8.400 8.400 8.025 0.375 17919 108792 1 265 . 1 1 52 52 ASP N N 52 120.030 120.030 123.903 -3.873 17919 108793 1 265 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.407 -0.048 17919 108794 1 265 . 1 1 52 52 ASP C C 52 177.330 177.330 178.030 -0.700 17919 108795 1 265 . 1 1 52 52 ASP CA C 52 56.960 56.960 58.302 -1.342 17919 108796 1 265 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.774 0.076 17919 108797 1 265 . 1 1 52 52 ASP H H 52 8.160 8.160 8.900 -0.740 17919 108798 1 265 . 1 1 53 53 GLY N N 53 106.660 106.660 105.165 1.495 17919 108799 1 265 . 1 1 53 53 GLY C C 53 174.870 174.870 174.217 0.653 17919 108800 1 265 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.861 0.309 17919 108801 1 265 . 1 1 53 53 GLY H H 53 9.390 9.390 8.427 0.963 17919 108802 1 265 . 1 1 54 54 ARG N N 54 119.050 119.050 119.988 -0.938 17919 108803 1 265 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.751 -0.056 17919 108804 1 265 . 1 1 54 54 ARG C C 54 175.350 175.350 175.191 0.159 17919 108805 1 265 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.204 0.186 17919 108806 1 265 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.355 -0.705 17919 108807 1 265 . 1 1 54 54 ARG H H 54 7.460 7.460 7.553 -0.093 17919 108808 1 265 . 1 1 55 55 THR N N 55 108.400 108.400 110.565 -2.165 17919 108809 1 265 . 1 1 55 55 THR HA H 55 5.240 5.240 5.262 -0.022 17919 108810 1 265 . 1 1 55 55 THR C C 55 176.560 176.560 176.465 0.095 17919 108811 1 265 . 1 1 55 55 THR CA C 55 59.690 59.690 59.646 0.044 17919 108812 1 265 . 1 1 55 55 THR CB C 55 72.260 72.260 71.339 0.921 17919 108813 1 265 . 1 1 55 55 THR H H 55 8.730 8.730 8.730 -0.000 17919 108814 1 265 . 1 1 56 56 LEU N N 56 117.920 117.920 121.343 -3.423 17919 108815 1 265 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.940 0.120 17919 108816 1 265 . 1 1 56 56 LEU C C 56 180.810 180.810 178.830 1.980 17919 108817 1 265 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.579 0.131 17919 108818 1 265 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.345 -0.975 17919 108819 1 265 . 1 1 56 56 LEU H H 56 8.140 8.140 8.497 -0.357 17919 108820 1 265 . 1 1 57 57 SER N N 57 113.330 113.330 114.006 -0.676 17919 108821 1 265 . 1 1 57 57 SER HA H 57 4.370 4.370 4.191 0.179 17919 108822 1 265 . 1 1 57 57 SER C C 57 178.310 178.310 176.938 1.372 17919 108823 1 265 . 1 1 57 57 SER CA C 57 61.080 61.080 61.531 -0.451 17919 108824 1 265 . 1 1 57 57 SER CB C 57 62.530 62.530 62.969 -0.439 17919 108825 1 265 . 1 1 57 57 SER H H 57 8.470 8.470 8.253 0.217 17919 108826 1 265 . 1 1 58 58 ASP N N 58 124.190 124.190 122.389 1.801 17919 108827 1 265 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.336 -0.040 17919 108828 1 265 . 1 1 58 58 ASP C C 58 177.400 177.400 177.772 -0.372 17919 108829 1 265 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.887 0.293 17919 108830 1 265 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.512 -0.412 17919 108831 1 265 . 1 1 58 58 ASP H H 58 7.930 7.930 7.691 0.239 17919 108832 1 265 . 1 1 59 59 TYR N N 59 115.510 115.510 116.285 -0.775 17919 108833 1 265 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.572 0.098 17919 108834 1 265 . 1 1 59 59 TYR C C 59 174.700 174.700 174.887 -0.187 17919 108835 1 265 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.985 0.265 17919 108836 1 265 . 1 1 59 59 TYR CB C 59 40.070 40.070 37.604 2.466 17919 108837 1 265 . 1 1 59 59 TYR H H 59 7.250 7.250 7.509 -0.259 17919 108838 1 265 . 1 1 60 60 ASN N N 60 115.900 115.900 114.228 1.672 17919 108839 1 265 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.392 -0.037 17919 108840 1 265 . 1 1 60 60 ASN C C 60 174.340 174.340 174.778 -0.438 17919 108841 1 265 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.290 -0.170 17919 108842 1 265 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.003 0.407 17919 108843 1 265 . 1 1 60 60 ASN H H 60 8.150 8.150 8.154 -0.004 17919 108844 1 265 . 1 1 61 61 ILE N N 61 118.600 118.600 120.765 -2.165 17919 108845 1 265 . 1 1 61 61 ILE HA H 61 3.393 3.393 4.014 -0.621 17919 108846 1 265 . 1 1 61 61 ILE C C 61 174.610 174.610 175.346 -0.736 17919 108847 1 265 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.391 0.029 17919 108848 1 265 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.955 -1.215 17919 108849 1 265 . 1 1 61 61 ILE H H 61 7.250 7.250 7.822 -0.573 17919 108850 1 265 . 1 1 62 62 GLN N N 62 124.740 124.740 125.345 -0.605 17919 108851 1 265 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.790 -0.284 17919 108852 1 265 . 1 1 62 62 GLN C C 62 175.970 175.970 175.971 -0.001 17919 108853 1 265 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.214 0.446 17919 108854 1 265 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.104 0.546 17919 108855 1 265 . 1 1 62 62 GLN H H 62 7.610 7.610 8.128 -0.518 17919 108856 1 265 . 1 1 63 63 LYS N N 63 120.300 120.300 120.766 -0.466 17919 108857 1 265 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.127 -0.126 17919 108858 1 265 . 1 1 63 63 LYS C C 63 175.810 175.810 176.556 -0.746 17919 108859 1 265 . 1 1 63 63 LYS CA C 63 57.790 57.790 56.954 0.836 17919 108860 1 265 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.472 0.178 17919 108861 1 265 . 1 1 63 63 LYS H H 63 8.490 8.490 8.501 -0.011 17919 108862 1 265 . 1 1 64 64 GLU N N 64 113.950 113.950 116.158 -2.208 17919 108863 1 265 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.966 -0.501 17919 108864 1 265 . 1 1 64 64 GLU C C 64 175.250 175.250 175.785 -0.535 17919 108865 1 265 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.852 0.038 17919 108866 1 265 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.067 -2.167 17919 108867 1 265 . 1 1 64 64 GLU H H 64 9.280 9.280 8.844 0.436 17919 108868 1 265 . 1 1 65 65 SER N N 65 114.730 114.730 115.577 -0.847 17919 108869 1 265 . 1 1 65 65 SER HA H 65 4.640 4.640 4.532 0.108 17919 108870 1 265 . 1 1 65 65 SER C C 65 172.160 172.160 173.741 -1.581 17919 108871 1 265 . 1 1 65 65 SER CA C 65 60.890 60.890 60.252 0.638 17919 108872 1 265 . 1 1 65 65 SER CB C 65 64.910 64.910 63.973 0.937 17919 108873 1 265 . 1 1 65 65 SER H H 65 7.670 7.670 7.695 -0.025 17919 108874 1 265 . 1 1 66 66 THR N N 66 117.110 117.110 119.985 -2.875 17919 108875 1 265 . 1 1 66 66 THR HA H 66 5.270 5.270 5.090 0.180 17919 108876 1 265 . 1 1 66 66 THR C C 66 173.950 173.950 173.940 0.010 17919 108877 1 265 . 1 1 66 66 THR CA C 66 62.340 62.340 62.064 0.276 17919 108878 1 265 . 1 1 66 66 THR CB C 66 70.080 70.080 70.037 0.043 17919 108879 1 265 . 1 1 66 66 THR H H 66 8.730 8.730 8.345 0.385 17919 108880 1 265 . 1 1 67 67 LEU N N 67 127.110 127.110 126.241 0.869 17919 108881 1 265 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.855 0.205 17919 108882 1 265 . 1 1 67 67 LEU C C 67 175.770 175.770 175.051 0.719 17919 108883 1 265 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.663 0.237 17919 108884 1 265 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.555 -0.295 17919 108885 1 265 . 1 1 67 67 LEU H H 67 9.410 9.410 9.037 0.373 17919 108886 1 265 . 1 1 68 68 HIS N N 68 118.380 118.380 122.234 -3.854 17919 108887 1 265 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.334 -0.094 17919 108888 1 265 . 1 1 68 68 HIS C C 68 173.150 173.150 173.530 -0.380 17919 108889 1 265 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.406 0.594 17919 108890 1 265 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.922 -2.392 17919 108891 1 265 . 1 1 68 68 HIS H H 68 9.230 9.230 9.131 0.099 17919 108892 1 265 . 1 1 69 69 LEU N N 69 124.460 124.460 129.803 -5.343 17919 108893 1 265 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.188 0.002 17919 108894 1 265 . 1 1 69 69 LEU C C 69 175.270 175.270 174.775 0.495 17919 108895 1 265 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.160 0.730 17919 108896 1 265 . 1 1 69 69 LEU CB C 69 44.380 44.380 43.731 0.649 17919 108897 1 265 . 1 1 69 69 LEU H H 69 8.340 8.340 7.980 0.360 17919 108898 1 265 . 1 1 70 70 VAL N N 70 126.940 126.940 123.199 3.741 17919 108899 1 265 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.610 -0.260 17919 108900 1 265 . 1 1 70 70 VAL C C 70 174.000 174.000 173.577 0.423 17919 108901 1 265 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.503 1.297 17919 108902 1 265 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.903 -0.993 17919 108903 1 265 . 1 1 70 70 VAL H H 70 9.200 9.200 9.021 0.179 17919 108904 1 265 . 1 1 71 71 LEU N N 71 123.130 123.130 122.380 0.750 17919 108905 1 265 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.209 -0.149 17919 108906 1 265 . 1 1 71 71 LEU C C 71 177.830 177.830 177.328 0.502 17919 108907 1 265 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.123 0.817 17919 108908 1 265 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.625 -0.775 17919 108909 1 265 . 1 1 71 71 LEU H H 71 8.120 8.120 8.287 -0.167 17919 108910 1 265 . 1 1 72 72 ARG N N 72 123.490 123.490 123.061 0.429 17919 108911 1 265 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.156 0.145 17919 108912 1 265 . 1 1 72 72 ARG C C 72 175.350 175.350 175.055 0.295 17919 108913 1 265 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.994 -1.384 17919 108914 1 265 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.482 0.869 17919 108915 1 265 . 1 1 72 72 ARG H H 72 8.580 8.580 8.141 0.439 17919 108916 1 266 . 1 1 2 2 GLN N N 2 123.220 123.220 120.061 3.159 17919 108917 1 266 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.348 -0.099 17919 108918 1 266 . 1 1 2 2 GLN C C 2 175.920 175.920 175.407 0.513 17919 108919 1 266 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.397 0.683 17919 108920 1 266 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.910 -0.150 17919 108921 1 266 . 1 1 2 2 GLN H H 2 8.900 8.900 8.327 0.573 17919 108922 1 266 . 1 1 3 3 ILE N N 3 115.340 115.340 115.628 -0.288 17919 108923 1 266 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.820 -0.607 17919 108924 1 266 . 1 1 3 3 ILE C C 3 172.450 172.450 173.395 -0.945 17919 108925 1 266 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.314 0.256 17919 108926 1 266 . 1 1 3 3 ILE CB C 3 42.210 42.210 42.116 0.094 17919 108927 1 266 . 1 1 3 3 ILE H H 3 8.320 8.320 8.377 -0.057 17919 108928 1 266 . 1 1 4 4 PHE N N 4 118.110 118.110 119.289 -1.179 17919 108929 1 266 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.631 -0.001 17919 108930 1 266 . 1 1 4 4 PHE C C 4 175.320 175.320 174.999 0.321 17919 108931 1 266 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.721 -0.511 17919 108932 1 266 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.570 -1.090 17919 108933 1 266 . 1 1 4 4 PHE H H 4 8.610 8.610 8.956 -0.346 17919 108934 1 266 . 1 1 5 5 VAL N N 5 121.000 121.000 121.681 -0.681 17919 108935 1 266 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.999 -0.274 17919 108936 1 266 . 1 1 5 5 VAL C C 5 174.870 174.870 174.747 0.123 17919 108937 1 266 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.000 -0.380 17919 108938 1 266 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.800 -0.570 17919 108939 1 266 . 1 1 5 5 VAL H H 5 9.300 9.300 9.147 0.153 17919 108940 1 266 . 1 1 6 6 LYS N N 6 127.520 127.520 126.607 0.913 17919 108941 1 266 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.571 -0.204 17919 108942 1 266 . 1 1 6 6 LYS C C 6 177.140 177.140 176.414 0.726 17919 108943 1 266 . 1 1 6 6 LYS CA C 6 54.520 54.520 53.898 0.622 17919 108944 1 266 . 1 1 6 6 LYS CB C 6 35.050 35.050 36.059 -1.009 17919 108945 1 266 . 1 1 6 6 LYS H H 6 8.820 8.820 9.377 -0.557 17919 108946 1 266 . 1 1 7 7 THR N N 7 115.400 115.400 114.986 0.414 17919 108947 1 266 . 1 1 7 7 THR HA H 7 4.970 4.970 4.552 0.418 17919 108948 1 266 . 1 1 7 7 THR C C 7 176.910 176.910 176.323 0.587 17919 108949 1 266 . 1 1 7 7 THR CA C 7 60.470 60.470 60.377 0.093 17919 108950 1 266 . 1 1 7 7 THR CB C 7 70.630 70.630 70.612 0.018 17919 108951 1 266 . 1 1 7 7 THR H H 7 8.730 8.730 8.745 -0.015 17919 108952 1 266 . 1 1 8 8 LEU N N 8 121.330 121.330 121.385 -0.055 17919 108953 1 266 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.267 0.043 17919 108954 1 266 . 1 1 8 8 LEU C C 8 178.800 178.800 177.239 1.561 17919 108955 1 266 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.361 0.219 17919 108956 1 266 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.901 0.069 17919 108957 1 266 . 1 1 8 8 LEU H H 8 9.100 9.100 8.201 0.899 17919 108958 1 266 . 1 1 9 9 THR N N 9 105.590 105.590 108.695 -3.105 17919 108959 1 266 . 1 1 9 9 THR HA H 9 4.428 4.428 4.322 0.106 17919 108960 1 266 . 1 1 9 9 THR C C 9 175.520 175.520 175.663 -0.143 17919 108961 1 266 . 1 1 9 9 THR CA C 9 61.400 61.400 62.181 -0.781 17919 108962 1 266 . 1 1 9 9 THR CB C 9 69.140 69.140 69.225 -0.085 17919 108963 1 266 . 1 1 9 9 THR H H 9 7.630 7.630 7.588 0.042 17919 108964 1 266 . 1 1 10 10 GLY N N 10 108.890 108.890 111.001 -2.111 17919 108965 1 266 . 1 1 10 10 GLY C C 10 174.070 174.070 173.782 0.288 17919 108966 1 266 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.151 0.309 17919 108967 1 266 . 1 1 10 10 GLY H H 10 7.810 7.810 8.245 -0.435 17919 108968 1 266 . 1 1 11 11 LYS N N 11 121.600 121.600 121.951 -0.351 17919 108969 1 266 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.475 -0.114 17919 108970 1 266 . 1 1 11 11 LYS C C 11 175.940 175.940 175.865 0.075 17919 108971 1 266 . 1 1 11 11 LYS CA C 11 56.280 56.280 55.581 0.699 17919 108972 1 266 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.727 -0.527 17919 108973 1 266 . 1 1 11 11 LYS H H 11 7.280 7.280 7.604 -0.324 17919 108974 1 266 . 1 1 12 12 THR N N 12 120.440 120.440 121.534 -1.094 17919 108975 1 266 . 1 1 12 12 THR HA H 12 5.046 5.046 4.839 0.207 17919 108976 1 266 . 1 1 12 12 THR C C 12 174.320 174.320 174.182 0.138 17919 108977 1 266 . 1 1 12 12 THR CA C 12 62.390 62.390 61.946 0.445 17919 108978 1 266 . 1 1 12 12 THR CB C 12 69.910 69.910 69.833 0.077 17919 108979 1 266 . 1 1 12 12 THR H H 12 8.650 8.650 8.476 0.174 17919 108980 1 266 . 1 1 13 13 ILE N N 13 127.110 127.110 127.129 -0.019 17919 108981 1 266 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.520 0.024 17919 108982 1 266 . 1 1 13 13 ILE C C 13 175.220 175.220 175.435 -0.215 17919 108983 1 266 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.082 -0.102 17919 108984 1 266 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.460 -0.510 17919 108985 1 266 . 1 1 13 13 ILE H H 13 9.450 9.450 8.979 0.471 17919 108986 1 266 . 1 1 14 14 THR N N 14 121.520 121.520 121.492 0.028 17919 108987 1 266 . 1 1 14 14 THR HA H 14 4.964 4.964 5.060 -0.096 17919 108988 1 266 . 1 1 14 14 THR C C 14 173.790 173.790 173.907 -0.117 17919 108989 1 266 . 1 1 14 14 THR CA C 14 61.940 61.940 61.898 0.042 17919 108990 1 266 . 1 1 14 14 THR CB C 14 69.650 69.650 69.839 -0.189 17919 108991 1 266 . 1 1 14 14 THR H H 14 8.710 8.710 8.471 0.239 17919 108992 1 266 . 1 1 15 15 LEU N N 15 124.800 124.800 125.705 -0.905 17919 108993 1 266 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.723 0.057 17919 108994 1 266 . 1 1 15 15 LEU C C 15 174.670 174.670 174.721 -0.051 17919 108995 1 266 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.955 -1.125 17919 108996 1 266 . 1 1 15 15 LEU CB C 15 47.070 47.070 46.333 0.737 17919 108997 1 266 . 1 1 15 15 LEU H H 15 8.710 8.710 8.775 -0.065 17919 108998 1 266 . 1 1 16 16 GLU N N 16 122.160 122.160 123.073 -0.913 17919 108999 1 266 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.318 -0.401 17919 109000 1 266 . 1 1 16 16 GLU C C 16 175.860 175.860 175.593 0.267 17919 109001 1 266 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.083 -0.263 17919 109002 1 266 . 1 1 16 16 GLU CB C 16 29.450 29.450 31.463 -2.013 17919 109003 1 266 . 1 1 16 16 GLU H H 16 8.140 8.140 8.586 -0.446 17919 109004 1 266 . 1 1 17 17 VAL N N 17 117.210 117.210 119.290 -2.080 17919 109005 1 266 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.938 -0.224 17919 109006 1 266 . 1 1 17 17 VAL C C 17 174.160 174.160 174.613 -0.453 17919 109007 1 266 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.208 -0.777 17919 109008 1 266 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.528 0.873 17919 109009 1 266 . 1 1 17 17 VAL H H 17 8.900 8.900 8.881 0.019 17919 109010 1 266 . 1 1 18 18 GLU N N 18 118.990 118.990 121.169 -2.179 17919 109011 1 266 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.917 0.162 17919 109012 1 266 . 1 1 18 18 GLU C C 18 176.160 176.160 175.522 0.638 17919 109013 1 266 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.670 0.050 17919 109014 1 266 . 1 1 18 18 GLU CB C 18 30.310 30.310 31.142 -0.832 17919 109015 1 266 . 1 1 18 18 GLU H H 18 8.640 8.640 9.178 -0.538 17919 109016 1 266 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.326 -0.185 17919 109017 1 266 . 1 1 19 19 PRO C C 19 175.310 175.310 177.555 -2.245 17919 109018 1 266 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.259 0.211 17919 109019 1 266 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.060 -0.110 17919 109020 1 266 . 1 1 20 20 SER N N 20 103.400 103.400 110.407 -7.007 17919 109021 1 266 . 1 1 20 20 SER HA H 20 4.370 4.370 4.336 0.034 17919 109022 1 266 . 1 1 20 20 SER C C 20 174.660 174.660 173.982 0.678 17919 109023 1 266 . 1 1 20 20 SER CA C 20 57.400 57.400 59.251 -1.851 17919 109024 1 266 . 1 1 20 20 SER CB C 20 63.370 63.370 62.626 0.744 17919 109025 1 266 . 1 1 20 20 SER H H 20 7.040 7.040 8.019 -0.979 17919 109026 1 266 . 1 1 21 21 ASP N N 21 123.480 123.480 122.384 1.096 17919 109027 1 266 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.752 -0.057 17919 109028 1 266 . 1 1 21 21 ASP C C 21 176.360 176.360 175.961 0.399 17919 109029 1 266 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.004 0.696 17919 109030 1 266 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.697 -0.897 17919 109031 1 266 . 1 1 21 21 ASP H H 21 8.030 8.030 7.752 0.278 17919 109032 1 266 . 1 1 22 22 THR N N 22 108.800 108.800 111.550 -2.750 17919 109033 1 266 . 1 1 22 22 THR HA H 22 4.920 4.920 5.328 -0.408 17919 109034 1 266 . 1 1 22 22 THR C C 22 176.750 176.750 175.964 0.786 17919 109035 1 266 . 1 1 22 22 THR CA C 22 59.690 59.690 59.799 -0.109 17919 109036 1 266 . 1 1 22 22 THR CB C 22 71.200 71.200 71.838 -0.638 17919 109037 1 266 . 1 1 22 22 THR H H 22 7.900 7.900 7.989 -0.089 17919 109038 1 266 . 1 1 23 23 ILE N N 23 121.190 121.190 122.771 -1.581 17919 109039 1 266 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.832 -0.175 17919 109040 1 266 . 1 1 23 23 ILE C C 23 179.040 179.040 177.837 1.203 17919 109041 1 266 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.836 -0.576 17919 109042 1 266 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.587 -2.237 17919 109043 1 266 . 1 1 23 23 ILE H H 23 8.560 8.560 8.478 0.082 17919 109044 1 266 . 1 1 24 24 GLU N N 24 120.830 120.830 120.521 0.309 17919 109045 1 266 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.935 -0.018 17919 109046 1 266 . 1 1 24 24 GLU C C 24 178.640 178.640 178.427 0.213 17919 109047 1 266 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.831 0.389 17919 109048 1 266 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.240 -0.960 17919 109049 1 266 . 1 1 24 24 GLU H H 24 9.760 9.760 8.273 1.487 17919 109050 1 266 . 1 1 25 25 ASN N N 25 120.570 120.570 117.218 3.352 17919 109051 1 266 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.535 -0.010 17919 109052 1 266 . 1 1 25 25 ASN C C 25 178.380 178.380 177.810 0.570 17919 109053 1 266 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.046 0.014 17919 109054 1 266 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.701 -0.251 17919 109055 1 266 . 1 1 25 25 ASN H H 25 7.920 7.920 7.604 0.316 17919 109056 1 266 . 1 1 26 26 VAL N N 26 121.710 121.710 121.057 0.653 17919 109057 1 266 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.583 -0.186 17919 109058 1 266 . 1 1 26 26 VAL C C 26 177.950 177.950 177.566 0.384 17919 109059 1 266 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.725 0.935 17919 109060 1 266 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.541 -0.701 17919 109061 1 266 . 1 1 26 26 VAL H H 26 8.070 8.070 8.139 -0.069 17919 109062 1 266 . 1 1 27 27 LYS N N 27 118.860 118.860 120.058 -1.198 17919 109063 1 266 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.223 0.357 17919 109064 1 266 . 1 1 27 27 LYS C C 27 180.550 180.550 179.078 1.472 17919 109065 1 266 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.499 -0.249 17919 109066 1 266 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.139 1.591 17919 109067 1 266 . 1 1 27 27 LYS H H 27 8.560 8.560 8.058 0.502 17919 109068 1 266 . 1 1 28 28 ALA N N 28 123.440 123.440 121.741 1.699 17919 109069 1 266 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.015 0.145 17919 109070 1 266 . 1 1 28 28 ALA C C 28 180.300 180.300 179.189 1.111 17919 109071 1 266 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.248 0.122 17919 109072 1 266 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.299 -0.589 17919 109073 1 266 . 1 1 28 28 ALA H H 28 8.060 8.060 8.030 0.030 17919 109074 1 266 . 1 1 29 29 LYS N N 29 119.940 119.940 118.021 1.919 17919 109075 1 266 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.123 0.084 17919 109076 1 266 . 1 1 29 29 LYS C C 29 180.320 180.320 178.944 1.376 17919 109077 1 266 . 1 1 29 29 LYS CA C 29 59.650 59.650 58.481 1.169 17919 109078 1 266 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.383 0.907 17919 109079 1 266 . 1 1 29 29 LYS H H 29 7.850 7.850 7.584 0.266 17919 109080 1 266 . 1 1 30 30 ILE N N 30 121.080 121.080 120.464 0.616 17919 109081 1 266 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.693 -0.186 17919 109082 1 266 . 1 1 30 30 ILE C C 30 178.310 178.310 177.705 0.605 17919 109083 1 266 . 1 1 30 30 ILE CA C 30 66.150 66.150 64.933 1.217 17919 109084 1 266 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.604 -0.804 17919 109085 1 266 . 1 1 30 30 ILE H H 30 8.280 8.280 8.114 0.166 17919 109086 1 266 . 1 1 31 31 GLN N N 31 123.490 123.490 120.978 2.512 17919 109087 1 266 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.094 -0.265 17919 109088 1 266 . 1 1 31 31 GLN C C 31 178.890 178.890 178.443 0.447 17919 109089 1 266 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.257 0.743 17919 109090 1 266 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.142 -0.422 17919 109091 1 266 . 1 1 31 31 GLN H H 31 8.580 8.580 7.792 0.788 17919 109092 1 266 . 1 1 32 32 ASP N N 32 119.360 119.360 119.067 0.293 17919 109093 1 266 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.415 -0.061 17919 109094 1 266 . 1 1 32 32 ASP C C 32 177.250 177.250 177.583 -0.333 17919 109095 1 266 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.814 0.376 17919 109096 1 266 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.776 -0.196 17919 109097 1 266 . 1 1 32 32 ASP H H 32 8.010 8.010 7.794 0.216 17919 109098 1 266 . 1 1 33 33 LYS N N 33 115.130 115.130 118.914 -3.784 17919 109099 1 266 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.223 0.114 17919 109100 1 266 . 1 1 33 33 LYS C C 33 177.870 177.870 178.009 -0.139 17919 109101 1 266 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.951 0.099 17919 109102 1 266 . 1 1 33 33 LYS CB C 33 34.170 34.170 32.733 1.438 17919 109103 1 266 . 1 1 33 33 LYS H H 33 7.430 7.430 7.362 0.068 17919 109104 1 266 . 1 1 34 34 GLU N N 34 113.870 113.870 115.284 -1.414 17919 109105 1 266 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.465 0.160 17919 109106 1 266 . 1 1 34 34 GLU C C 34 177.840 177.840 177.358 0.482 17919 109107 1 266 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.056 -0.886 17919 109108 1 266 . 1 1 34 34 GLU CB C 34 32.660 32.660 30.636 2.024 17919 109109 1 266 . 1 1 34 34 GLU H H 34 8.740 8.740 8.124 0.616 17919 109110 1 266 . 1 1 35 35 GLY N N 35 108.650 108.650 109.865 -1.215 17919 109111 1 266 . 1 1 35 35 GLY C C 35 173.960 173.960 174.059 -0.099 17919 109112 1 266 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.829 0.251 17919 109113 1 266 . 1 1 35 35 GLY H H 35 8.530 8.530 8.405 0.125 17919 109114 1 266 . 1 1 36 36 ILE N N 36 119.880 119.880 116.267 3.613 17919 109115 1 266 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.584 -0.139 17919 109116 1 266 . 1 1 36 36 ILE C C 36 173.590 173.590 173.844 -0.254 17919 109117 1 266 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.236 0.514 17919 109118 1 266 . 1 1 36 36 ILE CB C 36 40.580 40.580 39.118 1.462 17919 109119 1 266 . 1 1 36 36 ILE H H 36 6.150 6.150 7.404 -1.254 17919 109120 1 266 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.465 0.169 17919 109121 1 266 . 1 1 37 37 PRO C C 37 176.940 176.940 176.220 0.720 17919 109122 1 266 . 1 1 37 37 PRO CA C 37 61.660 61.660 62.447 -0.787 17919 109123 1 266 . 1 1 37 37 PRO CB C 37 31.850 31.850 30.843 1.007 17919 109124 1 266 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.074 0.043 17919 109125 1 266 . 1 1 38 38 PRO C C 38 178.320 178.320 178.003 0.317 17919 109126 1 266 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.895 0.365 17919 109127 1 266 . 1 1 38 38 PRO CB C 38 32.890 32.890 32.000 0.890 17919 109128 1 266 . 1 1 39 39 ASP N N 39 113.380 113.380 114.444 -1.064 17919 109129 1 266 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.453 -0.023 17919 109130 1 266 . 1 1 39 39 ASP C C 39 177.090 177.090 177.790 -0.700 17919 109131 1 266 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.331 -0.691 17919 109132 1 266 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.725 -1.185 17919 109133 1 266 . 1 1 39 39 ASP H H 39 8.550 8.550 8.454 0.096 17919 109134 1 266 . 1 1 40 40 GLN N N 40 116.780 116.780 116.276 0.504 17919 109135 1 266 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.342 0.122 17919 109136 1 266 . 1 1 40 40 GLN C C 40 175.380 175.380 174.830 0.550 17919 109137 1 266 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.939 -0.299 17919 109138 1 266 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.208 0.932 17919 109139 1 266 . 1 1 40 40 GLN H H 40 7.820 7.820 7.928 -0.108 17919 109140 1 266 . 1 1 41 41 GLN N N 41 117.720 117.720 116.909 0.811 17919 109141 1 266 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.716 -0.472 17919 109142 1 266 . 1 1 41 41 GLN C C 41 176.300 176.300 175.075 1.225 17919 109143 1 266 . 1 1 41 41 GLN CA C 41 56.470 56.470 54.427 2.043 17919 109144 1 266 . 1 1 41 41 GLN CB C 41 31.650 31.650 31.514 0.136 17919 109145 1 266 . 1 1 41 41 GLN H H 41 7.480 7.480 7.141 0.339 17919 109146 1 266 . 1 1 42 42 ARG N N 42 122.680 122.680 123.297 -0.617 17919 109147 1 266 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.726 -0.226 17919 109148 1 266 . 1 1 42 42 ARG C C 42 174.050 174.050 174.579 -0.529 17919 109149 1 266 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.411 0.639 17919 109150 1 266 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.840 -2.091 17919 109151 1 266 . 1 1 42 42 ARG H H 42 8.530 8.530 8.778 -0.248 17919 109152 1 266 . 1 1 43 43 LEU N N 43 124.040 124.040 123.326 0.714 17919 109153 1 266 . 1 1 43 43 LEU C C 43 175.290 175.290 175.689 -0.399 17919 109154 1 266 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.572 -0.592 17919 109155 1 266 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.398 1.393 17919 109156 1 266 . 1 1 43 43 LEU H H 43 8.820 8.820 8.671 0.149 17919 109157 1 266 . 1 1 44 44 ILE N N 44 121.920 121.920 121.598 0.322 17919 109158 1 266 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.050 -0.058 17919 109159 1 266 . 1 1 44 44 ILE C C 44 176.060 176.060 174.116 1.944 17919 109160 1 266 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.179 -1.199 17919 109161 1 266 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.901 -0.481 17919 109162 1 266 . 1 1 44 44 ILE H H 44 9.030 9.030 9.169 -0.139 17919 109163 1 266 . 1 1 45 45 PHE N N 45 125.390 125.390 126.655 -1.265 17919 109164 1 266 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.974 0.070 17919 109165 1 266 . 1 1 45 45 PHE C C 45 174.470 174.470 174.436 0.034 17919 109166 1 266 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.998 0.022 17919 109167 1 266 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.384 0.376 17919 109168 1 266 . 1 1 45 45 PHE H H 45 8.830 8.830 8.604 0.226 17919 109169 1 266 . 1 1 46 46 ALA N N 46 132.200 132.200 129.177 3.023 17919 109170 1 266 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.590 0.100 17919 109171 1 266 . 1 1 46 46 ALA C C 46 177.290 177.290 177.887 -0.597 17919 109172 1 266 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.337 0.203 17919 109173 1 266 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.574 -0.004 17919 109174 1 266 . 1 1 46 46 ALA H H 46 8.810 8.810 8.271 0.539 17919 109175 1 266 . 1 1 47 47 GLY N N 47 102.340 102.340 104.139 -1.799 17919 109176 1 266 . 1 1 47 47 GLY C C 47 173.810 173.810 174.497 -0.687 17919 109177 1 266 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.949 0.401 17919 109178 1 266 . 1 1 47 47 GLY H H 47 8.130 8.130 8.468 -0.338 17919 109179 1 266 . 1 1 48 48 LYS N N 48 121.570 121.570 121.281 0.289 17919 109180 1 266 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.502 0.120 17919 109181 1 266 . 1 1 48 48 LYS C C 48 174.700 174.700 175.558 -0.858 17919 109182 1 266 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.342 -0.792 17919 109183 1 266 . 1 1 48 48 LYS CB C 48 34.530 34.530 33.740 0.789 17919 109184 1 266 . 1 1 48 48 LYS H H 48 7.980 7.980 7.790 0.190 17919 109185 1 266 . 1 1 49 49 GLN N N 49 122.410 122.410 122.324 0.086 17919 109186 1 266 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.248 0.312 17919 109187 1 266 . 1 1 49 49 GLN C C 49 175.670 175.670 175.788 -0.118 17919 109188 1 266 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.661 0.079 17919 109189 1 266 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.354 -0.353 17919 109190 1 266 . 1 1 49 49 GLN H H 49 8.600 8.600 8.535 0.065 17919 109191 1 266 . 1 1 50 50 LEU N N 50 125.520 125.520 128.489 -2.969 17919 109192 1 266 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.424 -0.334 17919 109193 1 266 . 1 1 50 50 LEU C C 50 176.660 176.660 176.306 0.354 17919 109194 1 266 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.449 -0.209 17919 109195 1 266 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.806 -0.236 17919 109196 1 266 . 1 1 50 50 LEU H H 50 8.530 8.530 8.236 0.294 17919 109197 1 266 . 1 1 51 51 GLU N N 51 122.940 122.940 121.688 1.252 17919 109198 1 266 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.500 -0.012 17919 109199 1 266 . 1 1 51 51 GLU C C 51 175.870 175.870 177.125 -1.255 17919 109200 1 266 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.707 0.253 17919 109201 1 266 . 1 1 51 51 GLU CB C 51 31.570 31.570 30.744 0.826 17919 109202 1 266 . 1 1 51 51 GLU H H 51 8.400 8.400 8.503 -0.103 17919 109203 1 266 . 1 1 52 52 ASP N N 52 120.030 120.030 125.069 -5.039 17919 109204 1 266 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.504 -0.145 17919 109205 1 266 . 1 1 52 52 ASP C C 52 177.330 177.330 177.165 0.165 17919 109206 1 266 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.375 -0.415 17919 109207 1 266 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.869 -0.019 17919 109208 1 266 . 1 1 52 52 ASP H H 52 8.160 8.160 8.828 -0.668 17919 109209 1 266 . 1 1 53 53 GLY N N 53 106.660 106.660 105.172 1.488 17919 109210 1 266 . 1 1 53 53 GLY C C 53 174.870 174.870 174.490 0.380 17919 109211 1 266 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.656 0.514 17919 109212 1 266 . 1 1 53 53 GLY H H 53 9.390 9.390 8.335 1.055 17919 109213 1 266 . 1 1 54 54 ARG N N 54 119.050 119.050 120.519 -1.469 17919 109214 1 266 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.662 0.033 17919 109215 1 266 . 1 1 54 54 ARG C C 54 175.350 175.350 176.086 -0.736 17919 109216 1 266 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.398 -0.008 17919 109217 1 266 . 1 1 54 54 ARG CB C 54 32.650 32.650 31.830 0.820 17919 109218 1 266 . 1 1 54 54 ARG H H 54 7.460 7.460 7.408 0.052 17919 109219 1 266 . 1 1 55 55 THR N N 55 108.400 108.400 112.031 -3.631 17919 109220 1 266 . 1 1 55 55 THR HA H 55 5.240 5.240 5.510 -0.270 17919 109221 1 266 . 1 1 55 55 THR C C 55 176.560 176.560 176.192 0.368 17919 109222 1 266 . 1 1 55 55 THR CA C 55 59.690 59.690 59.478 0.212 17919 109223 1 266 . 1 1 55 55 THR CB C 55 72.260 72.260 71.340 0.920 17919 109224 1 266 . 1 1 55 55 THR H H 55 8.730 8.730 9.059 -0.329 17919 109225 1 266 . 1 1 56 56 LEU N N 56 117.920 117.920 122.361 -4.441 17919 109226 1 266 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.035 0.025 17919 109227 1 266 . 1 1 56 56 LEU C C 56 180.810 180.810 178.858 1.952 17919 109228 1 266 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.610 0.100 17919 109229 1 266 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.089 -0.719 17919 109230 1 266 . 1 1 56 56 LEU H H 56 8.140 8.140 8.388 -0.248 17919 109231 1 266 . 1 1 57 57 SER N N 57 113.330 113.330 114.453 -1.123 17919 109232 1 266 . 1 1 57 57 SER HA H 57 4.370 4.370 4.093 0.277 17919 109233 1 266 . 1 1 57 57 SER C C 57 178.310 178.310 177.013 1.297 17919 109234 1 266 . 1 1 57 57 SER CA C 57 61.080 61.080 61.619 -0.539 17919 109235 1 266 . 1 1 57 57 SER CB C 57 62.530 62.530 62.235 0.295 17919 109236 1 266 . 1 1 57 57 SER H H 57 8.470 8.470 8.256 0.214 17919 109237 1 266 . 1 1 58 58 ASP N N 58 124.190 124.190 123.291 0.899 17919 109238 1 266 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.300 -0.004 17919 109239 1 266 . 1 1 58 58 ASP C C 58 177.400 177.400 177.419 -0.019 17919 109240 1 266 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.771 0.409 17919 109241 1 266 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.292 -0.193 17919 109242 1 266 . 1 1 58 58 ASP H H 58 7.930 7.930 7.602 0.328 17919 109243 1 266 . 1 1 59 59 TYR N N 59 115.510 115.510 115.702 -0.192 17919 109244 1 266 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.580 0.090 17919 109245 1 266 . 1 1 59 59 TYR C C 59 174.700 174.700 174.944 -0.244 17919 109246 1 266 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.501 0.749 17919 109247 1 266 . 1 1 59 59 TYR CB C 59 40.070 40.070 37.922 2.148 17919 109248 1 266 . 1 1 59 59 TYR H H 59 7.250 7.250 7.367 -0.117 17919 109249 1 266 . 1 1 60 60 ASN N N 60 115.900 115.900 117.777 -1.877 17919 109250 1 266 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.412 -0.057 17919 109251 1 266 . 1 1 60 60 ASN C C 60 174.340 174.340 174.821 -0.481 17919 109252 1 266 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.329 -0.209 17919 109253 1 266 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.175 0.235 17919 109254 1 266 . 1 1 60 60 ASN H H 60 8.150 8.150 7.841 0.309 17919 109255 1 266 . 1 1 61 61 ILE N N 61 118.600 118.600 115.298 3.302 17919 109256 1 266 . 1 1 61 61 ILE HA H 61 3.393 3.393 4.354 -0.961 17919 109257 1 266 . 1 1 61 61 ILE C C 61 174.610 174.610 174.777 -0.167 17919 109258 1 266 . 1 1 61 61 ILE CA C 61 62.420 62.420 60.545 1.875 17919 109259 1 266 . 1 1 61 61 ILE CB C 61 36.740 36.740 38.493 -1.753 17919 109260 1 266 . 1 1 61 61 ILE H H 61 7.250 7.250 7.497 -0.247 17919 109261 1 266 . 1 1 62 62 GLN N N 62 124.740 124.740 124.931 -0.191 17919 109262 1 266 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.691 -0.185 17919 109263 1 266 . 1 1 62 62 GLN C C 62 175.970 175.970 175.166 0.804 17919 109264 1 266 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.597 0.063 17919 109265 1 266 . 1 1 62 62 GLN CB C 62 31.650 31.650 30.329 1.321 17919 109266 1 266 . 1 1 62 62 GLN H H 62 7.610 7.610 8.317 -0.707 17919 109267 1 266 . 1 1 63 63 LYS N N 63 120.300 120.300 119.883 0.417 17919 109268 1 266 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.124 -0.123 17919 109269 1 266 . 1 1 63 63 LYS C C 63 175.810 175.810 176.548 -0.738 17919 109270 1 266 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.547 0.243 17919 109271 1 266 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.654 -0.004 17919 109272 1 266 . 1 1 63 63 LYS H H 63 8.490 8.490 8.409 0.081 17919 109273 1 266 . 1 1 64 64 GLU N N 64 113.950 113.950 117.171 -3.221 17919 109274 1 266 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.661 -0.196 17919 109275 1 266 . 1 1 64 64 GLU C C 64 175.250 175.250 175.550 -0.300 17919 109276 1 266 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.987 -0.097 17919 109277 1 266 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.861 -2.961 17919 109278 1 266 . 1 1 64 64 GLU H H 64 9.280 9.280 8.952 0.328 17919 109279 1 266 . 1 1 65 65 SER N N 65 114.730 114.730 115.292 -0.562 17919 109280 1 266 . 1 1 65 65 SER HA H 65 4.640 4.640 4.637 0.003 17919 109281 1 266 . 1 1 65 65 SER C C 65 172.160 172.160 173.797 -1.637 17919 109282 1 266 . 1 1 65 65 SER CA C 65 60.890 60.890 60.135 0.755 17919 109283 1 266 . 1 1 65 65 SER CB C 65 64.910 64.910 64.126 0.784 17919 109284 1 266 . 1 1 65 65 SER H H 65 7.670 7.670 7.616 0.054 17919 109285 1 266 . 1 1 66 66 THR N N 66 117.110 117.110 119.755 -2.645 17919 109286 1 266 . 1 1 66 66 THR HA H 66 5.270 5.270 5.053 0.217 17919 109287 1 266 . 1 1 66 66 THR C C 66 173.950 173.950 174.096 -0.146 17919 109288 1 266 . 1 1 66 66 THR CA C 66 62.340 62.340 61.795 0.545 17919 109289 1 266 . 1 1 66 66 THR CB C 66 70.080 70.080 69.859 0.221 17919 109290 1 266 . 1 1 66 66 THR H H 66 8.730 8.730 8.371 0.359 17919 109291 1 266 . 1 1 67 67 LEU N N 67 127.110 127.110 126.734 0.376 17919 109292 1 266 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.954 0.106 17919 109293 1 266 . 1 1 67 67 LEU C C 67 175.770 175.770 175.752 0.018 17919 109294 1 266 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.330 -0.430 17919 109295 1 266 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.489 0.771 17919 109296 1 266 . 1 1 67 67 LEU H H 67 9.410 9.410 9.149 0.261 17919 109297 1 266 . 1 1 68 68 HIS N N 68 118.380 118.380 120.878 -2.498 17919 109298 1 266 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.278 -0.038 17919 109299 1 266 . 1 1 68 68 HIS C C 68 173.150 173.150 173.827 -0.677 17919 109300 1 266 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.468 0.532 17919 109301 1 266 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.133 -1.603 17919 109302 1 266 . 1 1 68 68 HIS H H 68 9.230 9.230 9.070 0.160 17919 109303 1 266 . 1 1 69 69 LEU N N 69 124.460 124.460 128.909 -4.449 17919 109304 1 266 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.184 0.006 17919 109305 1 266 . 1 1 69 69 LEU C C 69 175.270 175.270 174.026 1.244 17919 109306 1 266 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.101 0.789 17919 109307 1 266 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.880 -0.500 17919 109308 1 266 . 1 1 69 69 LEU H H 69 8.340 8.340 8.662 -0.322 17919 109309 1 266 . 1 1 70 70 VAL N N 70 126.940 126.940 121.817 5.123 17919 109310 1 266 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.525 -0.175 17919 109311 1 266 . 1 1 70 70 VAL C C 70 174.000 174.000 173.876 0.124 17919 109312 1 266 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.686 1.114 17919 109313 1 266 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.752 -0.842 17919 109314 1 266 . 1 1 70 70 VAL H H 70 9.200 9.200 8.987 0.213 17919 109315 1 266 . 1 1 71 71 LEU N N 71 123.130 123.130 124.438 -1.308 17919 109316 1 266 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.761 0.299 17919 109317 1 266 . 1 1 71 71 LEU C C 71 177.830 177.830 178.376 -0.546 17919 109318 1 266 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.456 0.484 17919 109319 1 266 . 1 1 71 71 LEU CB C 71 42.850 42.850 41.761 1.089 17919 109320 1 266 . 1 1 71 71 LEU H H 71 8.120 8.120 8.486 -0.366 17919 109321 1 266 . 1 1 72 72 ARG N N 72 123.490 123.490 125.232 -1.742 17919 109322 1 266 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.092 0.209 17919 109323 1 266 . 1 1 72 72 ARG C C 72 175.350 175.350 175.841 -0.491 17919 109324 1 266 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.313 -0.703 17919 109325 1 266 . 1 1 72 72 ARG CB C 72 31.350 31.350 28.521 2.829 17919 109326 1 266 . 1 1 72 72 ARG H H 72 8.580 8.580 8.290 0.290 17919 109327 1 267 . 1 1 2 2 GLN N N 2 123.220 123.220 119.810 3.410 17919 109328 1 267 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.200 0.049 17919 109329 1 267 . 1 1 2 2 GLN C C 2 175.920 175.920 175.413 0.507 17919 109330 1 267 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.665 0.415 17919 109331 1 267 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.314 0.447 17919 109332 1 267 . 1 1 2 2 GLN H H 2 8.900 8.900 8.347 0.553 17919 109333 1 267 . 1 1 3 3 ILE N N 3 115.340 115.340 114.306 1.034 17919 109334 1 267 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.639 -0.426 17919 109335 1 267 . 1 1 3 3 ILE C C 3 172.450 172.450 173.312 -0.862 17919 109336 1 267 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.300 0.270 17919 109337 1 267 . 1 1 3 3 ILE CB C 3 42.210 42.210 42.299 -0.089 17919 109338 1 267 . 1 1 3 3 ILE H H 3 8.320 8.320 8.472 -0.152 17919 109339 1 267 . 1 1 4 4 PHE N N 4 118.110 118.110 119.660 -1.550 17919 109340 1 267 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.466 0.164 17919 109341 1 267 . 1 1 4 4 PHE C C 4 175.320 175.320 175.041 0.279 17919 109342 1 267 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.628 -0.418 17919 109343 1 267 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.980 -0.500 17919 109344 1 267 . 1 1 4 4 PHE H H 4 8.610 8.610 8.047 0.563 17919 109345 1 267 . 1 1 5 5 VAL N N 5 121.000 121.000 122.800 -1.800 17919 109346 1 267 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.816 -0.091 17919 109347 1 267 . 1 1 5 5 VAL C C 5 174.870 174.870 175.039 -0.169 17919 109348 1 267 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.106 -0.486 17919 109349 1 267 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.413 -0.183 17919 109350 1 267 . 1 1 5 5 VAL H H 5 9.300 9.300 9.273 0.027 17919 109351 1 267 . 1 1 6 6 LYS N N 6 127.520 127.520 129.227 -1.707 17919 109352 1 267 . 1 1 6 6 LYS HA H 6 5.367 5.367 4.660 0.707 17919 109353 1 267 . 1 1 6 6 LYS C C 6 177.140 177.140 176.582 0.558 17919 109354 1 267 . 1 1 6 6 LYS CA C 6 54.520 54.520 55.511 -0.991 17919 109355 1 267 . 1 1 6 6 LYS CB C 6 35.050 35.050 33.605 1.445 17919 109356 1 267 . 1 1 6 6 LYS H H 6 8.820 8.820 9.212 -0.392 17919 109357 1 267 . 1 1 7 7 THR N N 7 115.400 115.400 116.661 -1.261 17919 109358 1 267 . 1 1 7 7 THR HA H 7 4.970 4.970 4.568 0.402 17919 109359 1 267 . 1 1 7 7 THR C C 7 176.910 176.910 175.671 1.239 17919 109360 1 267 . 1 1 7 7 THR CA C 7 60.470 60.470 61.708 -1.238 17919 109361 1 267 . 1 1 7 7 THR CB C 7 70.630 70.630 70.233 0.397 17919 109362 1 267 . 1 1 7 7 THR H H 7 8.730 8.730 8.184 0.546 17919 109363 1 267 . 1 1 8 8 LEU N N 8 121.330 121.330 120.654 0.676 17919 109364 1 267 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.594 -0.284 17919 109365 1 267 . 1 1 8 8 LEU C C 8 178.800 178.800 176.698 2.102 17919 109366 1 267 . 1 1 8 8 LEU CA C 8 57.580 57.580 56.221 1.359 17919 109367 1 267 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.472 -0.502 17919 109368 1 267 . 1 1 8 8 LEU H H 8 9.100 9.100 8.431 0.669 17919 109369 1 267 . 1 1 9 9 THR N N 9 105.590 105.590 108.071 -2.481 17919 109370 1 267 . 1 1 9 9 THR HA H 9 4.428 4.428 4.487 -0.059 17919 109371 1 267 . 1 1 9 9 THR C C 9 175.520 175.520 175.252 0.268 17919 109372 1 267 . 1 1 9 9 THR CA C 9 61.400 61.400 61.181 0.219 17919 109373 1 267 . 1 1 9 9 THR CB C 9 69.140 69.140 68.523 0.617 17919 109374 1 267 . 1 1 9 9 THR H H 9 7.630 7.630 7.647 -0.017 17919 109375 1 267 . 1 1 10 10 GLY N N 10 108.890 108.890 111.182 -2.292 17919 109376 1 267 . 1 1 10 10 GLY C C 10 174.070 174.070 173.491 0.579 17919 109377 1 267 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.414 0.046 17919 109378 1 267 . 1 1 10 10 GLY H H 10 7.810 7.810 8.031 -0.221 17919 109379 1 267 . 1 1 11 11 LYS N N 11 121.600 121.600 118.929 2.671 17919 109380 1 267 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.736 -0.375 17919 109381 1 267 . 1 1 11 11 LYS C C 11 175.940 175.940 175.505 0.435 17919 109382 1 267 . 1 1 11 11 LYS CA C 11 56.280 56.280 54.553 1.728 17919 109383 1 267 . 1 1 11 11 LYS CB C 11 33.200 33.200 34.477 -1.277 17919 109384 1 267 . 1 1 11 11 LYS H H 11 7.280 7.280 7.858 -0.578 17919 109385 1 267 . 1 1 12 12 THR N N 12 120.440 120.440 121.391 -0.951 17919 109386 1 267 . 1 1 12 12 THR HA H 12 5.046 5.046 4.915 0.131 17919 109387 1 267 . 1 1 12 12 THR C C 12 174.320 174.320 174.907 -0.587 17919 109388 1 267 . 1 1 12 12 THR CA C 12 62.390 62.390 63.285 -0.895 17919 109389 1 267 . 1 1 12 12 THR CB C 12 69.910 69.910 69.477 0.433 17919 109390 1 267 . 1 1 12 12 THR H H 12 8.650 8.650 8.579 0.071 17919 109391 1 267 . 1 1 13 13 ILE N N 13 127.110 127.110 128.820 -1.710 17919 109392 1 267 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.300 0.244 17919 109393 1 267 . 1 1 13 13 ILE C C 13 175.220 175.220 175.648 -0.428 17919 109394 1 267 . 1 1 13 13 ILE CA C 13 59.980 59.980 61.071 -1.091 17919 109395 1 267 . 1 1 13 13 ILE CB C 13 40.950 40.950 38.854 2.096 17919 109396 1 267 . 1 1 13 13 ILE H H 13 9.450 9.450 9.080 0.370 17919 109397 1 267 . 1 1 14 14 THR N N 14 121.520 121.520 124.036 -2.516 17919 109398 1 267 . 1 1 14 14 THR HA H 14 4.964 4.964 5.036 -0.072 17919 109399 1 267 . 1 1 14 14 THR C C 14 173.790 173.790 173.843 -0.053 17919 109400 1 267 . 1 1 14 14 THR CA C 14 61.940 61.940 62.523 -0.583 17919 109401 1 267 . 1 1 14 14 THR CB C 14 69.650 69.650 69.395 0.255 17919 109402 1 267 . 1 1 14 14 THR H H 14 8.710 8.710 8.678 0.032 17919 109403 1 267 . 1 1 15 15 LEU N N 15 124.800 124.800 126.678 -1.878 17919 109404 1 267 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.806 -0.026 17919 109405 1 267 . 1 1 15 15 LEU C C 15 174.670 174.670 174.826 -0.156 17919 109406 1 267 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.765 -0.935 17919 109407 1 267 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.949 1.121 17919 109408 1 267 . 1 1 15 15 LEU H H 15 8.710 8.710 8.711 -0.001 17919 109409 1 267 . 1 1 16 16 GLU N N 16 122.160 122.160 123.513 -1.353 17919 109410 1 267 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.305 -0.388 17919 109411 1 267 . 1 1 16 16 GLU C C 16 175.860 175.860 175.747 0.113 17919 109412 1 267 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.041 -0.221 17919 109413 1 267 . 1 1 16 16 GLU CB C 16 29.450 29.450 31.416 -1.966 17919 109414 1 267 . 1 1 16 16 GLU H H 16 8.140 8.140 8.617 -0.477 17919 109415 1 267 . 1 1 17 17 VAL N N 17 117.210 117.210 122.522 -5.312 17919 109416 1 267 . 1 1 17 17 VAL HA H 17 4.714 4.714 5.022 -0.308 17919 109417 1 267 . 1 1 17 17 VAL C C 17 174.160 174.160 174.315 -0.155 17919 109418 1 267 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.126 -0.696 17919 109419 1 267 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.590 0.810 17919 109420 1 267 . 1 1 17 17 VAL H H 17 8.900 8.900 8.945 -0.045 17919 109421 1 267 . 1 1 18 18 GLU N N 18 118.990 118.990 120.798 -1.808 17919 109422 1 267 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.838 0.241 17919 109423 1 267 . 1 1 18 18 GLU C C 18 176.160 176.160 176.120 0.040 17919 109424 1 267 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.726 -0.006 17919 109425 1 267 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.151 0.159 17919 109426 1 267 . 1 1 18 18 GLU H H 18 8.640 8.640 9.059 -0.419 17919 109427 1 267 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.314 -0.173 17919 109428 1 267 . 1 1 19 19 PRO C C 19 175.310 175.310 177.495 -2.185 17919 109429 1 267 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.415 0.056 17919 109430 1 267 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.056 -0.106 17919 109431 1 267 . 1 1 20 20 SER N N 20 103.400 103.400 110.429 -7.029 17919 109432 1 267 . 1 1 20 20 SER HA H 20 4.370 4.370 4.290 0.080 17919 109433 1 267 . 1 1 20 20 SER C C 20 174.660 174.660 174.119 0.541 17919 109434 1 267 . 1 1 20 20 SER CA C 20 57.400 57.400 59.257 -1.857 17919 109435 1 267 . 1 1 20 20 SER CB C 20 63.370 63.370 63.160 0.210 17919 109436 1 267 . 1 1 20 20 SER H H 20 7.040 7.040 8.194 -1.154 17919 109437 1 267 . 1 1 21 21 ASP N N 21 123.480 123.480 123.595 -0.115 17919 109438 1 267 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.701 -0.006 17919 109439 1 267 . 1 1 21 21 ASP C C 21 176.360 176.360 175.979 0.381 17919 109440 1 267 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.093 0.607 17919 109441 1 267 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.170 -0.370 17919 109442 1 267 . 1 1 21 21 ASP H H 21 8.030 8.030 7.674 0.356 17919 109443 1 267 . 1 1 22 22 THR N N 22 108.800 108.800 113.954 -5.154 17919 109444 1 267 . 1 1 22 22 THR HA H 22 4.920 4.920 4.785 0.135 17919 109445 1 267 . 1 1 22 22 THR C C 22 176.750 176.750 176.284 0.466 17919 109446 1 267 . 1 1 22 22 THR CA C 22 59.690 59.690 61.275 -1.585 17919 109447 1 267 . 1 1 22 22 THR CB C 22 71.200 71.200 70.642 0.558 17919 109448 1 267 . 1 1 22 22 THR H H 22 7.900 7.900 8.158 -0.258 17919 109449 1 267 . 1 1 23 23 ILE N N 23 121.190 121.190 122.611 -1.421 17919 109450 1 267 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.731 -0.074 17919 109451 1 267 . 1 1 23 23 ILE C C 23 179.040 179.040 177.841 1.199 17919 109452 1 267 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.760 -0.500 17919 109453 1 267 . 1 1 23 23 ILE CB C 23 34.350 34.350 35.855 -1.505 17919 109454 1 267 . 1 1 23 23 ILE H H 23 8.560 8.560 9.013 -0.453 17919 109455 1 267 . 1 1 24 24 GLU N N 24 120.830 120.830 121.325 -0.495 17919 109456 1 267 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.831 0.086 17919 109457 1 267 . 1 1 24 24 GLU C C 24 178.640 178.640 178.337 0.303 17919 109458 1 267 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.205 0.015 17919 109459 1 267 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.433 -1.153 17919 109460 1 267 . 1 1 24 24 GLU H H 24 9.760 9.760 8.136 1.624 17919 109461 1 267 . 1 1 25 25 ASN N N 25 120.570 120.570 117.731 2.839 17919 109462 1 267 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.507 0.018 17919 109463 1 267 . 1 1 25 25 ASN C C 25 178.380 178.380 177.961 0.419 17919 109464 1 267 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.160 -0.100 17919 109465 1 267 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.876 -0.426 17919 109466 1 267 . 1 1 25 25 ASN H H 25 7.920 7.920 7.766 0.154 17919 109467 1 267 . 1 1 26 26 VAL N N 26 121.710 121.710 120.040 1.670 17919 109468 1 267 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.695 -0.298 17919 109469 1 267 . 1 1 26 26 VAL C C 26 177.950 177.950 177.975 -0.025 17919 109470 1 267 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.187 1.473 17919 109471 1 267 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.009 -0.169 17919 109472 1 267 . 1 1 26 26 VAL H H 26 8.070 8.070 8.390 -0.320 17919 109473 1 267 . 1 1 27 27 LYS N N 27 118.860 118.860 120.045 -1.185 17919 109474 1 267 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.296 0.284 17919 109475 1 267 . 1 1 27 27 LYS C C 27 180.550 180.550 179.058 1.492 17919 109476 1 267 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.483 -0.233 17919 109477 1 267 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.183 1.547 17919 109478 1 267 . 1 1 27 27 LYS H H 27 8.560 8.560 8.333 0.227 17919 109479 1 267 . 1 1 28 28 ALA N N 28 123.440 123.440 123.261 0.179 17919 109480 1 267 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.144 0.016 17919 109481 1 267 . 1 1 28 28 ALA C C 28 180.300 180.300 179.193 1.107 17919 109482 1 267 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.915 0.455 17919 109483 1 267 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.369 -0.659 17919 109484 1 267 . 1 1 28 28 ALA H H 28 8.060 8.060 7.835 0.225 17919 109485 1 267 . 1 1 29 29 LYS N N 29 119.940 119.940 119.388 0.552 17919 109486 1 267 . 1 1 29 29 LYS HA H 29 4.207 4.207 3.968 0.239 17919 109487 1 267 . 1 1 29 29 LYS C C 29 180.320 180.320 178.944 1.376 17919 109488 1 267 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.533 0.117 17919 109489 1 267 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.276 1.014 17919 109490 1 267 . 1 1 29 29 LYS H H 29 7.850 7.850 8.138 -0.288 17919 109491 1 267 . 1 1 30 30 ILE N N 30 121.080 121.080 120.161 0.919 17919 109492 1 267 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.593 -0.086 17919 109493 1 267 . 1 1 30 30 ILE C C 30 178.310 178.310 177.507 0.803 17919 109494 1 267 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.417 0.733 17919 109495 1 267 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.742 -0.942 17919 109496 1 267 . 1 1 30 30 ILE H H 30 8.280 8.280 8.218 0.062 17919 109497 1 267 . 1 1 31 31 GLN N N 31 123.490 123.490 119.915 3.575 17919 109498 1 267 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.123 -0.294 17919 109499 1 267 . 1 1 31 31 GLN C C 31 178.890 178.890 178.051 0.839 17919 109500 1 267 . 1 1 31 31 GLN CA C 31 60.000 60.000 58.961 1.039 17919 109501 1 267 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.581 -0.861 17919 109502 1 267 . 1 1 31 31 GLN H H 31 8.580 8.580 7.664 0.916 17919 109503 1 267 . 1 1 32 32 ASP N N 32 119.360 119.360 120.052 -0.692 17919 109504 1 267 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.384 -0.030 17919 109505 1 267 . 1 1 32 32 ASP C C 32 177.250 177.250 178.407 -1.157 17919 109506 1 267 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.887 0.303 17919 109507 1 267 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.907 -0.327 17919 109508 1 267 . 1 1 32 32 ASP H H 32 8.010 8.010 8.243 -0.233 17919 109509 1 267 . 1 1 33 33 LYS N N 33 115.130 115.130 117.615 -2.485 17919 109510 1 267 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.202 0.135 17919 109511 1 267 . 1 1 33 33 LYS C C 33 177.870 177.870 177.868 0.002 17919 109512 1 267 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.146 -0.096 17919 109513 1 267 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.417 0.753 17919 109514 1 267 . 1 1 33 33 LYS H H 33 7.430 7.430 7.642 -0.212 17919 109515 1 267 . 1 1 34 34 GLU N N 34 113.870 113.870 116.322 -2.452 17919 109516 1 267 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.447 0.178 17919 109517 1 267 . 1 1 34 34 GLU C C 34 177.840 177.840 176.522 1.318 17919 109518 1 267 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.000 0.170 17919 109519 1 267 . 1 1 34 34 GLU CB C 34 32.660 32.660 30.579 2.081 17919 109520 1 267 . 1 1 34 34 GLU H H 34 8.740 8.740 7.806 0.934 17919 109521 1 267 . 1 1 35 35 GLY N N 35 108.650 108.650 108.504 0.146 17919 109522 1 267 . 1 1 35 35 GLY C C 35 173.960 173.960 174.870 -0.910 17919 109523 1 267 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.990 0.090 17919 109524 1 267 . 1 1 35 35 GLY H H 35 8.530 8.530 7.831 0.699 17919 109525 1 267 . 1 1 36 36 ILE N N 36 119.880 119.880 122.097 -2.217 17919 109526 1 267 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.304 0.141 17919 109527 1 267 . 1 1 36 36 ILE C C 36 173.590 173.590 174.140 -0.550 17919 109528 1 267 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.272 -0.522 17919 109529 1 267 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.530 2.050 17919 109530 1 267 . 1 1 36 36 ILE H H 36 6.150 6.150 7.611 -1.461 17919 109531 1 267 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.539 0.095 17919 109532 1 267 . 1 1 37 37 PRO C C 37 176.940 176.940 176.074 0.866 17919 109533 1 267 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.684 -0.024 17919 109534 1 267 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.404 0.447 17919 109535 1 267 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.120 -0.003 17919 109536 1 267 . 1 1 38 38 PRO C C 38 178.320 178.320 178.387 -0.067 17919 109537 1 267 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.722 0.537 17919 109538 1 267 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.644 1.246 17919 109539 1 267 . 1 1 39 39 ASP N N 39 113.380 113.380 116.260 -2.880 17919 109540 1 267 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.363 0.067 17919 109541 1 267 . 1 1 39 39 ASP C C 39 177.090 177.090 177.413 -0.323 17919 109542 1 267 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.288 -0.648 17919 109543 1 267 . 1 1 39 39 ASP CB C 39 39.540 39.540 39.474 0.067 17919 109544 1 267 . 1 1 39 39 ASP H H 39 8.550 8.550 8.883 -0.333 17919 109545 1 267 . 1 1 40 40 GLN N N 40 116.780 116.780 118.185 -1.405 17919 109546 1 267 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.238 0.226 17919 109547 1 267 . 1 1 40 40 GLN C C 40 175.380 175.380 175.797 -0.417 17919 109548 1 267 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.760 -1.120 17919 109549 1 267 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.580 0.560 17919 109550 1 267 . 1 1 40 40 GLN H H 40 7.820 7.820 7.653 0.167 17919 109551 1 267 . 1 1 41 41 GLN N N 41 117.720 117.720 118.261 -0.541 17919 109552 1 267 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.289 -0.045 17919 109553 1 267 . 1 1 41 41 GLN C C 41 176.300 176.300 175.556 0.744 17919 109554 1 267 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.819 0.651 17919 109555 1 267 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.639 2.011 17919 109556 1 267 . 1 1 41 41 GLN H H 41 7.480 7.480 7.393 0.087 17919 109557 1 267 . 1 1 42 42 ARG N N 42 122.680 122.680 125.203 -2.523 17919 109558 1 267 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.610 -0.110 17919 109559 1 267 . 1 1 42 42 ARG C C 42 174.050 174.050 173.875 0.175 17919 109560 1 267 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.031 0.019 17919 109561 1 267 . 1 1 42 42 ARG CB C 42 31.750 31.750 31.840 -0.090 17919 109562 1 267 . 1 1 42 42 ARG H H 42 8.530 8.530 8.367 0.163 17919 109563 1 267 . 1 1 43 43 LEU N N 43 124.040 124.040 128.326 -4.286 17919 109564 1 267 . 1 1 43 43 LEU C C 43 175.290 175.290 175.009 0.281 17919 109565 1 267 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.723 -0.743 17919 109566 1 267 . 1 1 43 43 LEU CB C 43 45.790 45.790 45.253 0.537 17919 109567 1 267 . 1 1 43 43 LEU H H 43 8.820 8.820 8.722 0.098 17919 109568 1 267 . 1 1 44 44 ILE N N 44 121.920 121.920 119.310 2.610 17919 109569 1 267 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.041 -0.049 17919 109570 1 267 . 1 1 44 44 ILE C C 44 176.060 176.060 173.450 2.610 17919 109571 1 267 . 1 1 44 44 ILE CA C 44 58.980 58.980 58.736 0.244 17919 109572 1 267 . 1 1 44 44 ILE CB C 44 41.420 41.420 42.074 -0.654 17919 109573 1 267 . 1 1 44 44 ILE H H 44 9.030 9.030 9.079 -0.049 17919 109574 1 267 . 1 1 45 45 PHE N N 45 125.390 125.390 124.163 1.227 17919 109575 1 267 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.005 0.040 17919 109576 1 267 . 1 1 45 45 PHE C C 45 174.470 174.470 175.355 -0.885 17919 109577 1 267 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.237 0.783 17919 109578 1 267 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.544 1.216 17919 109579 1 267 . 1 1 45 45 PHE H H 45 8.830 8.830 7.971 0.859 17919 109580 1 267 . 1 1 46 46 ALA N N 46 132.200 132.200 130.037 2.163 17919 109581 1 267 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.596 0.094 17919 109582 1 267 . 1 1 46 46 ALA C C 46 177.290 177.290 177.086 0.204 17919 109583 1 267 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.756 -0.216 17919 109584 1 267 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.425 0.145 17919 109585 1 267 . 1 1 46 46 ALA H H 46 8.810 8.810 9.147 -0.337 17919 109586 1 267 . 1 1 47 47 GLY N N 47 102.340 102.340 103.240 -0.900 17919 109587 1 267 . 1 1 47 47 GLY C C 47 173.810 173.810 173.778 0.032 17919 109588 1 267 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.957 0.393 17919 109589 1 267 . 1 1 47 47 GLY H H 47 8.130 8.130 8.411 -0.281 17919 109590 1 267 . 1 1 48 48 LYS N N 48 121.570 121.570 120.567 1.003 17919 109591 1 267 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.643 -0.021 17919 109592 1 267 . 1 1 48 48 LYS C C 48 174.700 174.700 175.156 -0.456 17919 109593 1 267 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.065 -0.515 17919 109594 1 267 . 1 1 48 48 LYS CB C 48 34.530 34.530 35.115 -0.585 17919 109595 1 267 . 1 1 48 48 LYS H H 48 7.980 7.980 7.829 0.151 17919 109596 1 267 . 1 1 49 49 GLN N N 49 122.410 122.410 124.395 -1.985 17919 109597 1 267 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.290 0.270 17919 109598 1 267 . 1 1 49 49 GLN C C 49 175.670 175.670 175.596 0.074 17919 109599 1 267 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.641 0.100 17919 109600 1 267 . 1 1 49 49 GLN CB C 49 29.000 29.000 28.877 0.123 17919 109601 1 267 . 1 1 49 49 GLN H H 49 8.600 8.600 8.600 0.000 17919 109602 1 267 . 1 1 50 50 LEU N N 50 125.520 125.520 126.827 -1.307 17919 109603 1 267 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.130 -0.040 17919 109604 1 267 . 1 1 50 50 LEU C C 50 176.660 176.660 177.082 -0.422 17919 109605 1 267 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.038 0.203 17919 109606 1 267 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.452 0.118 17919 109607 1 267 . 1 1 50 50 LEU H H 50 8.530 8.530 8.451 0.079 17919 109608 1 267 . 1 1 51 51 GLU N N 51 122.940 122.940 125.517 -2.577 17919 109609 1 267 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.408 0.080 17919 109610 1 267 . 1 1 51 51 GLU C C 51 175.870 175.870 176.869 -0.999 17919 109611 1 267 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.885 0.076 17919 109612 1 267 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.384 0.186 17919 109613 1 267 . 1 1 51 51 GLU H H 51 8.400 8.400 8.596 -0.196 17919 109614 1 267 . 1 1 52 52 ASP N N 52 120.030 120.030 127.466 -7.436 17919 109615 1 267 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.435 -0.076 17919 109616 1 267 . 1 1 52 52 ASP C C 52 177.330 177.330 177.933 -0.603 17919 109617 1 267 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.230 -0.270 17919 109618 1 267 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.566 0.284 17919 109619 1 267 . 1 1 52 52 ASP H H 52 8.160 8.160 8.861 -0.701 17919 109620 1 267 . 1 1 53 53 GLY N N 53 106.660 106.660 105.350 1.310 17919 109621 1 267 . 1 1 53 53 GLY C C 53 174.870 174.870 174.107 0.763 17919 109622 1 267 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.833 0.337 17919 109623 1 267 . 1 1 53 53 GLY H H 53 9.390 9.390 8.388 1.002 17919 109624 1 267 . 1 1 54 54 ARG N N 54 119.050 119.050 120.363 -1.313 17919 109625 1 267 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.722 -0.027 17919 109626 1 267 . 1 1 54 54 ARG C C 54 175.350 175.350 174.893 0.457 17919 109627 1 267 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.555 -0.165 17919 109628 1 267 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.636 0.014 17919 109629 1 267 . 1 1 54 54 ARG H H 54 7.460 7.460 7.674 -0.214 17919 109630 1 267 . 1 1 55 55 THR N N 55 108.400 108.400 113.167 -4.767 17919 109631 1 267 . 1 1 55 55 THR HA H 55 5.240 5.240 4.963 0.277 17919 109632 1 267 . 1 1 55 55 THR C C 55 176.560 176.560 175.925 0.635 17919 109633 1 267 . 1 1 55 55 THR CA C 55 59.690 59.690 60.703 -1.013 17919 109634 1 267 . 1 1 55 55 THR CB C 55 72.260 72.260 70.751 1.509 17919 109635 1 267 . 1 1 55 55 THR H H 55 8.730 8.730 8.233 0.497 17919 109636 1 267 . 1 1 56 56 LEU N N 56 117.920 117.920 120.965 -3.045 17919 109637 1 267 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.044 0.016 17919 109638 1 267 . 1 1 56 56 LEU C C 56 180.810 180.810 178.865 1.945 17919 109639 1 267 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.136 0.574 17919 109640 1 267 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.253 -0.883 17919 109641 1 267 . 1 1 56 56 LEU H H 56 8.140 8.140 8.563 -0.423 17919 109642 1 267 . 1 1 57 57 SER N N 57 113.330 113.330 115.117 -1.787 17919 109643 1 267 . 1 1 57 57 SER HA H 57 4.370 4.370 4.105 0.265 17919 109644 1 267 . 1 1 57 57 SER C C 57 178.310 178.310 176.818 1.492 17919 109645 1 267 . 1 1 57 57 SER CA C 57 61.080 61.080 61.322 -0.242 17919 109646 1 267 . 1 1 57 57 SER CB C 57 62.530 62.530 62.615 -0.085 17919 109647 1 267 . 1 1 57 57 SER H H 57 8.470 8.470 8.723 -0.253 17919 109648 1 267 . 1 1 58 58 ASP N N 58 124.190 124.190 121.802 2.388 17919 109649 1 267 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.423 -0.127 17919 109650 1 267 . 1 1 58 58 ASP C C 58 177.400 177.400 177.265 0.135 17919 109651 1 267 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.459 0.721 17919 109652 1 267 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.820 -0.720 17919 109653 1 267 . 1 1 58 58 ASP H H 58 7.930 7.930 7.829 0.101 17919 109654 1 267 . 1 1 59 59 TYR N N 59 115.510 115.510 115.603 -0.093 17919 109655 1 267 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.542 0.128 17919 109656 1 267 . 1 1 59 59 TYR C C 59 174.700 174.700 174.727 -0.027 17919 109657 1 267 . 1 1 59 59 TYR CA C 59 58.250 58.250 58.823 -0.573 17919 109658 1 267 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.823 1.247 17919 109659 1 267 . 1 1 59 59 TYR H H 59 7.250 7.250 7.494 -0.244 17919 109660 1 267 . 1 1 60 60 ASN N N 60 115.900 115.900 115.673 0.227 17919 109661 1 267 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.424 -0.069 17919 109662 1 267 . 1 1 60 60 ASN C C 60 174.340 174.340 174.159 0.181 17919 109663 1 267 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.079 0.041 17919 109664 1 267 . 1 1 60 60 ASN CB C 60 37.410 37.410 36.358 1.052 17919 109665 1 267 . 1 1 60 60 ASN H H 60 8.150 8.150 7.969 0.181 17919 109666 1 267 . 1 1 61 61 ILE N N 61 118.600 118.600 120.458 -1.858 17919 109667 1 267 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.918 -0.525 17919 109668 1 267 . 1 1 61 61 ILE C C 61 174.610 174.610 174.600 0.010 17919 109669 1 267 . 1 1 61 61 ILE CA C 61 62.420 62.420 60.865 1.555 17919 109670 1 267 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.093 -0.353 17919 109671 1 267 . 1 1 61 61 ILE H H 61 7.250 7.250 8.013 -0.763 17919 109672 1 267 . 1 1 62 62 GLN N N 62 124.740 124.740 126.175 -1.435 17919 109673 1 267 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.647 -0.141 17919 109674 1 267 . 1 1 62 62 GLN C C 62 175.970 175.970 174.860 1.110 17919 109675 1 267 . 1 1 62 62 GLN CA C 62 53.660 53.660 52.953 0.707 17919 109676 1 267 . 1 1 62 62 GLN CB C 62 31.650 31.650 30.953 0.696 17919 109677 1 267 . 1 1 62 62 GLN H H 62 7.610 7.610 7.966 -0.356 17919 109678 1 267 . 1 1 63 63 LYS N N 63 120.300 120.300 120.825 -0.525 17919 109679 1 267 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.967 0.034 17919 109680 1 267 . 1 1 63 63 LYS C C 63 175.810 175.810 176.592 -0.782 17919 109681 1 267 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.163 -0.373 17919 109682 1 267 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.735 0.915 17919 109683 1 267 . 1 1 63 63 LYS H H 63 8.490 8.490 8.608 -0.118 17919 109684 1 267 . 1 1 64 64 GLU N N 64 113.950 113.950 118.206 -4.256 17919 109685 1 267 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.651 -0.186 17919 109686 1 267 . 1 1 64 64 GLU C C 64 175.250 175.250 175.746 -0.496 17919 109687 1 267 . 1 1 64 64 GLU CA C 64 57.890 57.890 58.042 -0.152 17919 109688 1 267 . 1 1 64 64 GLU CB C 64 25.900 25.900 29.291 -3.391 17919 109689 1 267 . 1 1 64 64 GLU H H 64 9.280 9.280 8.925 0.355 17919 109690 1 267 . 1 1 65 65 SER N N 65 114.730 114.730 115.885 -1.155 17919 109691 1 267 . 1 1 65 65 SER HA H 65 4.640 4.640 4.419 0.221 17919 109692 1 267 . 1 1 65 65 SER C C 65 172.160 172.160 173.952 -1.792 17919 109693 1 267 . 1 1 65 65 SER CA C 65 60.890 60.890 61.037 -0.147 17919 109694 1 267 . 1 1 65 65 SER CB C 65 64.910 64.910 63.638 1.272 17919 109695 1 267 . 1 1 65 65 SER H H 65 7.670 7.670 7.993 -0.323 17919 109696 1 267 . 1 1 66 66 THR N N 66 117.110 117.110 119.161 -2.051 17919 109697 1 267 . 1 1 66 66 THR HA H 66 5.270 5.270 5.051 0.220 17919 109698 1 267 . 1 1 66 66 THR C C 66 173.950 173.950 173.762 0.188 17919 109699 1 267 . 1 1 66 66 THR CA C 66 62.340 62.340 61.889 0.451 17919 109700 1 267 . 1 1 66 66 THR CB C 66 70.080 70.080 69.951 0.129 17919 109701 1 267 . 1 1 66 66 THR H H 66 8.730 8.730 8.256 0.474 17919 109702 1 267 . 1 1 67 67 LEU N N 67 127.110 127.110 126.978 0.132 17919 109703 1 267 . 1 1 67 67 LEU HA H 67 5.060 5.060 5.080 -0.020 17919 109704 1 267 . 1 1 67 67 LEU C C 67 175.770 175.770 175.428 0.342 17919 109705 1 267 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.781 0.119 17919 109706 1 267 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.843 0.417 17919 109707 1 267 . 1 1 67 67 LEU H H 67 9.410 9.410 9.201 0.209 17919 109708 1 267 . 1 1 68 68 HIS N N 68 118.380 118.380 120.896 -2.516 17919 109709 1 267 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.368 -0.128 17919 109710 1 267 . 1 1 68 68 HIS C C 68 173.150 173.150 173.793 -0.643 17919 109711 1 267 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.307 0.693 17919 109712 1 267 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.750 -2.220 17919 109713 1 267 . 1 1 68 68 HIS H H 68 9.230 9.230 9.298 -0.068 17919 109714 1 267 . 1 1 69 69 LEU N N 69 124.460 124.460 129.229 -4.769 17919 109715 1 267 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.819 0.370 17919 109716 1 267 . 1 1 69 69 LEU C C 69 175.270 175.270 174.121 1.149 17919 109717 1 267 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.386 0.504 17919 109718 1 267 . 1 1 69 69 LEU CB C 69 44.380 44.380 43.746 0.634 17919 109719 1 267 . 1 1 69 69 LEU H H 69 8.340 8.340 8.354 -0.014 17919 109720 1 267 . 1 1 70 70 VAL N N 70 126.940 126.940 126.890 0.050 17919 109721 1 267 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.171 0.179 17919 109722 1 267 . 1 1 70 70 VAL C C 70 174.000 174.000 174.743 -0.743 17919 109723 1 267 . 1 1 70 70 VAL CA C 70 60.800 60.800 62.507 -1.707 17919 109724 1 267 . 1 1 70 70 VAL CB C 70 34.910 34.910 32.609 2.301 17919 109725 1 267 . 1 1 70 70 VAL H H 70 9.200 9.200 8.986 0.214 17919 109726 1 267 . 1 1 71 71 LEU N N 71 123.130 123.130 123.834 -0.704 17919 109727 1 267 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.707 0.353 17919 109728 1 267 . 1 1 71 71 LEU C C 71 177.830 177.830 176.446 1.384 17919 109729 1 267 . 1 1 71 71 LEU CA C 71 53.940 53.940 52.473 1.467 17919 109730 1 267 . 1 1 71 71 LEU CB C 71 42.850 42.850 45.171 -2.321 17919 109731 1 267 . 1 1 71 71 LEU H H 71 8.120 8.120 8.270 -0.150 17919 109732 1 267 . 1 1 72 72 ARG N N 72 123.490 123.490 121.356 2.134 17919 109733 1 267 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.365 -0.064 17919 109734 1 267 . 1 1 72 72 ARG C C 72 175.350 175.350 175.364 -0.014 17919 109735 1 267 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.192 -0.582 17919 109736 1 267 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.477 0.872 17919 109737 1 267 . 1 1 72 72 ARG H H 72 8.580 8.580 8.513 0.067 17919 109738 1 268 . 1 1 2 2 GLN N N 2 123.220 123.220 122.309 0.911 17919 109739 1 268 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.392 -0.143 17919 109740 1 268 . 1 1 2 2 GLN C C 2 175.920 175.920 174.914 1.006 17919 109741 1 268 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.974 0.106 17919 109742 1 268 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.778 -0.018 17919 109743 1 268 . 1 1 2 2 GLN H H 2 8.900 8.900 8.430 0.470 17919 109744 1 268 . 1 1 3 3 ILE N N 3 115.340 115.340 116.981 -1.641 17919 109745 1 268 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.320 -0.107 17919 109746 1 268 . 1 1 3 3 ILE C C 3 172.450 172.450 173.113 -0.663 17919 109747 1 268 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.657 -0.087 17919 109748 1 268 . 1 1 3 3 ILE CB C 3 42.210 42.210 42.026 0.184 17919 109749 1 268 . 1 1 3 3 ILE H H 3 8.320 8.320 8.635 -0.315 17919 109750 1 268 . 1 1 4 4 PHE N N 4 118.110 118.110 119.561 -1.451 17919 109751 1 268 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.461 0.169 17919 109752 1 268 . 1 1 4 4 PHE C C 4 175.320 175.320 175.214 0.106 17919 109753 1 268 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.831 -0.621 17919 109754 1 268 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.350 -0.870 17919 109755 1 268 . 1 1 4 4 PHE H H 4 8.610 8.610 8.683 -0.073 17919 109756 1 268 . 1 1 5 5 VAL N N 5 121.000 121.000 120.657 0.343 17919 109757 1 268 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.955 -0.230 17919 109758 1 268 . 1 1 5 5 VAL C C 5 174.870 174.870 174.608 0.262 17919 109759 1 268 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.025 -0.405 17919 109760 1 268 . 1 1 5 5 VAL CB C 5 34.230 34.230 35.148 -0.918 17919 109761 1 268 . 1 1 5 5 VAL H H 5 9.300 9.300 9.333 -0.033 17919 109762 1 268 . 1 1 6 6 LYS N N 6 127.520 127.520 128.486 -0.966 17919 109763 1 268 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.209 0.158 17919 109764 1 268 . 1 1 6 6 LYS C C 6 177.140 177.140 175.913 1.227 17919 109765 1 268 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.446 0.074 17919 109766 1 268 . 1 1 6 6 LYS CB C 6 35.050 35.050 36.077 -1.027 17919 109767 1 268 . 1 1 6 6 LYS H H 6 8.820 8.820 9.284 -0.464 17919 109768 1 268 . 1 1 7 7 THR N N 7 115.400 115.400 115.958 -0.558 17919 109769 1 268 . 1 1 7 7 THR HA H 7 4.970 4.970 5.030 -0.060 17919 109770 1 268 . 1 1 7 7 THR C C 7 176.910 176.910 176.232 0.678 17919 109771 1 268 . 1 1 7 7 THR CA C 7 60.470 60.470 60.432 0.038 17919 109772 1 268 . 1 1 7 7 THR CB C 7 70.630 70.630 71.017 -0.387 17919 109773 1 268 . 1 1 7 7 THR H H 7 8.730 8.730 8.884 -0.154 17919 109774 1 268 . 1 1 8 8 LEU N N 8 121.330 121.330 122.559 -1.229 17919 109775 1 268 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.388 -0.078 17919 109776 1 268 . 1 1 8 8 LEU C C 8 178.800 178.800 177.335 1.465 17919 109777 1 268 . 1 1 8 8 LEU CA C 8 57.580 57.580 56.697 0.883 17919 109778 1 268 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.369 -0.399 17919 109779 1 268 . 1 1 8 8 LEU H H 8 9.100 9.100 8.633 0.467 17919 109780 1 268 . 1 1 9 9 THR N N 9 105.590 105.590 110.280 -4.690 17919 109781 1 268 . 1 1 9 9 THR HA H 9 4.428 4.428 4.394 0.034 17919 109782 1 268 . 1 1 9 9 THR C C 9 175.520 175.520 175.357 0.163 17919 109783 1 268 . 1 1 9 9 THR CA C 9 61.400 61.400 61.532 -0.132 17919 109784 1 268 . 1 1 9 9 THR CB C 9 69.140 69.140 69.415 -0.275 17919 109785 1 268 . 1 1 9 9 THR H H 9 7.630 7.630 7.612 0.018 17919 109786 1 268 . 1 1 10 10 GLY N N 10 108.890 108.890 110.769 -1.879 17919 109787 1 268 . 1 1 10 10 GLY C C 10 174.070 174.070 174.053 0.017 17919 109788 1 268 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.992 0.468 17919 109789 1 268 . 1 1 10 10 GLY H H 10 7.810 7.810 7.690 0.120 17919 109790 1 268 . 1 1 11 11 LYS N N 11 121.600 121.600 121.858 -0.258 17919 109791 1 268 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.568 -0.207 17919 109792 1 268 . 1 1 11 11 LYS C C 11 175.940 175.940 175.577 0.363 17919 109793 1 268 . 1 1 11 11 LYS CA C 11 56.280 56.280 55.414 0.866 17919 109794 1 268 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.978 -0.778 17919 109795 1 268 . 1 1 11 11 LYS H H 11 7.280 7.280 8.069 -0.789 17919 109796 1 268 . 1 1 12 12 THR N N 12 120.440 120.440 117.851 2.589 17919 109797 1 268 . 1 1 12 12 THR HA H 12 5.046 5.046 4.985 0.061 17919 109798 1 268 . 1 1 12 12 THR C C 12 174.320 174.320 173.858 0.462 17919 109799 1 268 . 1 1 12 12 THR CA C 12 62.390 62.390 61.447 0.943 17919 109800 1 268 . 1 1 12 12 THR CB C 12 69.910 69.910 70.441 -0.531 17919 109801 1 268 . 1 1 12 12 THR H H 12 8.650 8.650 8.439 0.211 17919 109802 1 268 . 1 1 13 13 ILE N N 13 127.110 127.110 128.100 -0.990 17919 109803 1 268 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.477 0.067 17919 109804 1 268 . 1 1 13 13 ILE C C 13 175.220 175.220 174.901 0.319 17919 109805 1 268 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.496 -0.516 17919 109806 1 268 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.930 0.020 17919 109807 1 268 . 1 1 13 13 ILE H H 13 9.450 9.450 9.324 0.126 17919 109808 1 268 . 1 1 14 14 THR N N 14 121.520 121.520 123.533 -2.013 17919 109809 1 268 . 1 1 14 14 THR HA H 14 4.964 4.964 4.842 0.122 17919 109810 1 268 . 1 1 14 14 THR C C 14 173.790 173.790 173.759 0.031 17919 109811 1 268 . 1 1 14 14 THR CA C 14 61.940 61.940 62.228 -0.288 17919 109812 1 268 . 1 1 14 14 THR CB C 14 69.650 69.650 69.802 -0.152 17919 109813 1 268 . 1 1 14 14 THR H H 14 8.710 8.710 8.544 0.166 17919 109814 1 268 . 1 1 15 15 LEU N N 15 124.800 124.800 127.232 -2.432 17919 109815 1 268 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.724 0.056 17919 109816 1 268 . 1 1 15 15 LEU C C 15 174.670 174.670 175.441 -0.771 17919 109817 1 268 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.778 -0.948 17919 109818 1 268 . 1 1 15 15 LEU CB C 15 47.070 47.070 44.123 2.947 17919 109819 1 268 . 1 1 15 15 LEU H H 15 8.710 8.710 9.151 -0.441 17919 109820 1 268 . 1 1 16 16 GLU N N 16 122.160 122.160 123.564 -1.404 17919 109821 1 268 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.981 -0.064 17919 109822 1 268 . 1 1 16 16 GLU C C 16 175.860 175.860 175.614 0.246 17919 109823 1 268 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.688 -0.868 17919 109824 1 268 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.922 -1.472 17919 109825 1 268 . 1 1 16 16 GLU H H 16 8.140 8.140 8.722 -0.582 17919 109826 1 268 . 1 1 17 17 VAL N N 17 117.210 117.210 119.195 -1.985 17919 109827 1 268 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.937 -0.223 17919 109828 1 268 . 1 1 17 17 VAL C C 17 174.160 174.160 175.045 -0.885 17919 109829 1 268 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.816 -0.386 17919 109830 1 268 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.164 1.236 17919 109831 1 268 . 1 1 17 17 VAL H H 17 8.900 8.900 8.568 0.332 17919 109832 1 268 . 1 1 18 18 GLU N N 18 118.990 118.990 121.534 -2.544 17919 109833 1 268 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.806 0.273 17919 109834 1 268 . 1 1 18 18 GLU C C 18 176.160 176.160 175.610 0.550 17919 109835 1 268 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.563 0.157 17919 109836 1 268 . 1 1 18 18 GLU CB C 18 30.310 30.310 29.866 0.444 17919 109837 1 268 . 1 1 18 18 GLU H H 18 8.640 8.640 9.049 -0.409 17919 109838 1 268 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.404 -0.263 17919 109839 1 268 . 1 1 19 19 PRO C C 19 175.310 175.310 177.750 -2.440 17919 109840 1 268 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.052 0.418 17919 109841 1 268 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.936 0.014 17919 109842 1 268 . 1 1 20 20 SER N N 20 103.400 103.400 112.587 -9.187 17919 109843 1 268 . 1 1 20 20 SER HA H 20 4.370 4.370 4.264 0.106 17919 109844 1 268 . 1 1 20 20 SER C C 20 174.660 174.660 174.780 -0.120 17919 109845 1 268 . 1 1 20 20 SER CA C 20 57.400 57.400 59.267 -1.867 17919 109846 1 268 . 1 1 20 20 SER CB C 20 63.370 63.370 62.884 0.486 17919 109847 1 268 . 1 1 20 20 SER H H 20 7.040 7.040 8.094 -1.054 17919 109848 1 268 . 1 1 21 21 ASP N N 21 123.480 123.480 124.682 -1.202 17919 109849 1 268 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.831 -0.136 17919 109850 1 268 . 1 1 21 21 ASP C C 21 176.360 176.360 175.772 0.588 17919 109851 1 268 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.767 0.934 17919 109852 1 268 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.867 -1.067 17919 109853 1 268 . 1 1 21 21 ASP H H 21 8.030 8.030 7.749 0.281 17919 109854 1 268 . 1 1 22 22 THR N N 22 108.800 108.800 112.857 -4.057 17919 109855 1 268 . 1 1 22 22 THR HA H 22 4.920 4.920 4.709 0.211 17919 109856 1 268 . 1 1 22 22 THR C C 22 176.750 176.750 176.238 0.512 17919 109857 1 268 . 1 1 22 22 THR CA C 22 59.690 59.690 61.271 -1.581 17919 109858 1 268 . 1 1 22 22 THR CB C 22 71.200 71.200 70.386 0.814 17919 109859 1 268 . 1 1 22 22 THR H H 22 7.900 7.900 8.259 -0.359 17919 109860 1 268 . 1 1 23 23 ILE N N 23 121.190 121.190 122.320 -1.130 17919 109861 1 268 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.744 -0.087 17919 109862 1 268 . 1 1 23 23 ILE C C 23 179.040 179.040 177.713 1.327 17919 109863 1 268 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.065 -0.805 17919 109864 1 268 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.434 -2.084 17919 109865 1 268 . 1 1 23 23 ILE H H 23 8.560 8.560 8.707 -0.147 17919 109866 1 268 . 1 1 24 24 GLU N N 24 120.830 120.830 120.597 0.233 17919 109867 1 268 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.868 0.049 17919 109868 1 268 . 1 1 24 24 GLU C C 24 178.640 178.640 178.526 0.114 17919 109869 1 268 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.021 0.199 17919 109870 1 268 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.384 -1.104 17919 109871 1 268 . 1 1 24 24 GLU H H 24 9.760 9.760 8.311 1.449 17919 109872 1 268 . 1 1 25 25 ASN N N 25 120.570 120.570 116.736 3.834 17919 109873 1 268 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.573 -0.048 17919 109874 1 268 . 1 1 25 25 ASN C C 25 178.380 178.380 177.990 0.390 17919 109875 1 268 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.649 0.411 17919 109876 1 268 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.504 -0.054 17919 109877 1 268 . 1 1 25 25 ASN H H 25 7.920 7.920 7.642 0.278 17919 109878 1 268 . 1 1 26 26 VAL N N 26 121.710 121.710 120.923 0.787 17919 109879 1 268 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.650 -0.253 17919 109880 1 268 . 1 1 26 26 VAL C C 26 177.950 177.950 177.459 0.491 17919 109881 1 268 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.135 1.525 17919 109882 1 268 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.673 -0.833 17919 109883 1 268 . 1 1 26 26 VAL H H 26 8.070 8.070 7.811 0.259 17919 109884 1 268 . 1 1 27 27 LYS N N 27 118.860 118.860 120.799 -1.939 17919 109885 1 268 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.165 0.415 17919 109886 1 268 . 1 1 27 27 LYS C C 27 180.550 180.550 179.031 1.519 17919 109887 1 268 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.730 -0.480 17919 109888 1 268 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.157 1.573 17919 109889 1 268 . 1 1 27 27 LYS H H 27 8.560 8.560 8.208 0.352 17919 109890 1 268 . 1 1 28 28 ALA N N 28 123.440 123.440 121.659 1.781 17919 109891 1 268 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.127 0.033 17919 109892 1 268 . 1 1 28 28 ALA C C 28 180.300 180.300 179.303 0.997 17919 109893 1 268 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.035 0.335 17919 109894 1 268 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.352 -0.642 17919 109895 1 268 . 1 1 28 28 ALA H H 28 8.060 8.060 8.168 -0.108 17919 109896 1 268 . 1 1 29 29 LYS N N 29 119.940 119.940 119.235 0.705 17919 109897 1 268 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.073 0.134 17919 109898 1 268 . 1 1 29 29 LYS C C 29 180.320 180.320 179.048 1.272 17919 109899 1 268 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.177 0.473 17919 109900 1 268 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.427 0.863 17919 109901 1 268 . 1 1 29 29 LYS H H 29 7.850 7.850 7.357 0.493 17919 109902 1 268 . 1 1 30 30 ILE N N 30 121.080 121.080 120.000 1.080 17919 109903 1 268 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.716 -0.209 17919 109904 1 268 . 1 1 30 30 ILE C C 30 178.310 178.310 177.319 0.991 17919 109905 1 268 . 1 1 30 30 ILE CA C 30 66.150 66.150 64.643 1.507 17919 109906 1 268 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.929 -1.129 17919 109907 1 268 . 1 1 30 30 ILE H H 30 8.280 8.280 8.147 0.133 17919 109908 1 268 . 1 1 31 31 GLN N N 31 123.490 123.490 120.864 2.626 17919 109909 1 268 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.073 -0.244 17919 109910 1 268 . 1 1 31 31 GLN C C 31 178.890 178.890 178.512 0.378 17919 109911 1 268 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.111 0.889 17919 109912 1 268 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.564 -0.844 17919 109913 1 268 . 1 1 31 31 GLN H H 31 8.580 8.580 8.472 0.108 17919 109914 1 268 . 1 1 32 32 ASP N N 32 119.360 119.360 118.894 0.466 17919 109915 1 268 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.451 -0.097 17919 109916 1 268 . 1 1 32 32 ASP C C 32 177.250 177.250 177.790 -0.540 17919 109917 1 268 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.622 0.568 17919 109918 1 268 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.850 -0.270 17919 109919 1 268 . 1 1 32 32 ASP H H 32 8.010 8.010 8.038 -0.028 17919 109920 1 268 . 1 1 33 33 LYS N N 33 115.130 115.130 117.981 -2.851 17919 109921 1 268 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.360 -0.023 17919 109922 1 268 . 1 1 33 33 LYS C C 33 177.870 177.870 177.960 -0.090 17919 109923 1 268 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.010 0.040 17919 109924 1 268 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.474 0.696 17919 109925 1 268 . 1 1 33 33 LYS H H 33 7.430 7.430 7.459 -0.029 17919 109926 1 268 . 1 1 34 34 GLU N N 34 113.870 113.870 114.560 -0.690 17919 109927 1 268 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.511 0.114 17919 109928 1 268 . 1 1 34 34 GLU C C 34 177.840 177.840 177.511 0.329 17919 109929 1 268 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.956 -0.786 17919 109930 1 268 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.630 1.030 17919 109931 1 268 . 1 1 34 34 GLU H H 34 8.740 8.740 8.335 0.405 17919 109932 1 268 . 1 1 35 35 GLY N N 35 108.650 108.650 108.140 0.510 17919 109933 1 268 . 1 1 35 35 GLY C C 35 173.960 173.960 174.333 -0.373 17919 109934 1 268 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.352 0.728 17919 109935 1 268 . 1 1 35 35 GLY H H 35 8.530 8.530 8.015 0.515 17919 109936 1 268 . 1 1 36 36 ILE N N 36 119.880 119.880 117.516 2.364 17919 109937 1 268 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.610 -0.165 17919 109938 1 268 . 1 1 36 36 ILE C C 36 173.590 173.590 173.595 -0.005 17919 109939 1 268 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.779 -0.028 17919 109940 1 268 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.684 1.896 17919 109941 1 268 . 1 1 36 36 ILE H H 36 6.150 6.150 7.632 -1.482 17919 109942 1 268 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.547 0.087 17919 109943 1 268 . 1 1 37 37 PRO C C 37 176.940 176.940 176.039 0.901 17919 109944 1 268 . 1 1 37 37 PRO CA C 37 61.660 61.660 62.195 -0.535 17919 109945 1 268 . 1 1 37 37 PRO CB C 37 31.850 31.850 30.875 0.975 17919 109946 1 268 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.098 0.019 17919 109947 1 268 . 1 1 38 38 PRO C C 38 178.320 178.320 178.742 -0.422 17919 109948 1 268 . 1 1 38 38 PRO CA C 38 66.260 66.260 66.083 0.177 17919 109949 1 268 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.853 1.037 17919 109950 1 268 . 1 1 39 39 ASP N N 39 113.380 113.380 114.394 -1.014 17919 109951 1 268 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.365 0.065 17919 109952 1 268 . 1 1 39 39 ASP C C 39 177.090 177.090 177.070 0.020 17919 109953 1 268 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.339 -0.699 17919 109954 1 268 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.506 -0.966 17919 109955 1 268 . 1 1 39 39 ASP H H 39 8.550 8.550 8.478 0.072 17919 109956 1 268 . 1 1 40 40 GLN N N 40 116.780 116.780 115.311 1.469 17919 109957 1 268 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.345 0.119 17919 109958 1 268 . 1 1 40 40 GLN C C 40 175.380 175.380 175.640 -0.260 17919 109959 1 268 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.639 0.001 17919 109960 1 268 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.538 0.602 17919 109961 1 268 . 1 1 40 40 GLN H H 40 7.820 7.820 7.713 0.107 17919 109962 1 268 . 1 1 41 41 GLN N N 41 117.720 117.720 119.259 -1.539 17919 109963 1 268 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.359 -0.115 17919 109964 1 268 . 1 1 41 41 GLN C C 41 176.300 176.300 175.483 0.817 17919 109965 1 268 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.909 0.561 17919 109966 1 268 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.232 2.418 17919 109967 1 268 . 1 1 41 41 GLN H H 41 7.480 7.480 7.340 0.141 17919 109968 1 268 . 1 1 42 42 ARG N N 42 122.680 122.680 124.889 -2.209 17919 109969 1 268 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.558 -0.058 17919 109970 1 268 . 1 1 42 42 ARG C C 42 174.050 174.050 174.190 -0.140 17919 109971 1 268 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.846 0.204 17919 109972 1 268 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.101 -0.351 17919 109973 1 268 . 1 1 42 42 ARG H H 42 8.530 8.530 8.204 0.326 17919 109974 1 268 . 1 1 43 43 LEU N N 43 124.040 124.040 127.188 -3.148 17919 109975 1 268 . 1 1 43 43 LEU C C 43 175.290 175.290 174.854 0.436 17919 109976 1 268 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.086 -1.106 17919 109977 1 268 . 1 1 43 43 LEU CB C 43 45.790 45.790 45.114 0.676 17919 109978 1 268 . 1 1 43 43 LEU H H 43 8.820 8.820 8.803 0.017 17919 109979 1 268 . 1 1 44 44 ILE N N 44 121.920 121.920 127.152 -5.232 17919 109980 1 268 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.044 -0.052 17919 109981 1 268 . 1 1 44 44 ILE C C 44 176.060 176.060 173.983 2.077 17919 109982 1 268 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.334 -1.354 17919 109983 1 268 . 1 1 44 44 ILE CB C 44 41.420 41.420 40.470 0.950 17919 109984 1 268 . 1 1 44 44 ILE H H 44 9.030 9.030 8.909 0.121 17919 109985 1 268 . 1 1 45 45 PHE N N 45 125.390 125.390 128.000 -2.610 17919 109986 1 268 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.023 0.022 17919 109987 1 268 . 1 1 45 45 PHE C C 45 174.470 174.470 174.457 0.013 17919 109988 1 268 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.145 0.875 17919 109989 1 268 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.276 0.484 17919 109990 1 268 . 1 1 45 45 PHE H H 45 8.830 8.830 8.900 -0.070 17919 109991 1 268 . 1 1 46 46 ALA N N 46 132.200 132.200 129.750 2.450 17919 109992 1 268 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.627 0.063 17919 109993 1 268 . 1 1 46 46 ALA C C 46 177.290 177.290 177.761 -0.471 17919 109994 1 268 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.315 0.226 17919 109995 1 268 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.373 0.197 17919 109996 1 268 . 1 1 46 46 ALA H H 46 8.810 8.810 8.623 0.187 17919 109997 1 268 . 1 1 47 47 GLY N N 47 102.340 102.340 106.387 -4.047 17919 109998 1 268 . 1 1 47 47 GLY C C 47 173.810 173.810 174.027 -0.217 17919 109999 1 268 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.912 0.438 17919 110000 1 268 . 1 1 47 47 GLY H H 47 8.130 8.130 8.641 -0.511 17919 110001 1 268 . 1 1 48 48 LYS N N 48 121.570 121.570 121.292 0.278 17919 110002 1 268 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.644 -0.022 17919 110003 1 268 . 1 1 48 48 LYS C C 48 174.700 174.700 175.163 -0.463 17919 110004 1 268 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.718 -0.168 17919 110005 1 268 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.508 0.022 17919 110006 1 268 . 1 1 48 48 LYS H H 48 7.980 7.980 7.778 0.202 17919 110007 1 268 . 1 1 49 49 GLN N N 49 122.410 122.410 124.201 -1.791 17919 110008 1 268 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.514 0.046 17919 110009 1 268 . 1 1 49 49 GLN C C 49 175.670 175.670 175.915 -0.245 17919 110010 1 268 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.497 -0.757 17919 110011 1 268 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.393 -0.393 17919 110012 1 268 . 1 1 49 49 GLN H H 49 8.600 8.600 8.485 0.115 17919 110013 1 268 . 1 1 50 50 LEU N N 50 125.520 125.520 126.524 -1.004 17919 110014 1 268 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.118 -0.028 17919 110015 1 268 . 1 1 50 50 LEU C C 50 176.660 176.660 175.787 0.873 17919 110016 1 268 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.757 0.483 17919 110017 1 268 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.590 -1.020 17919 110018 1 268 . 1 1 50 50 LEU H H 50 8.530 8.530 8.742 -0.212 17919 110019 1 268 . 1 1 51 51 GLU N N 51 122.940 122.940 120.730 2.210 17919 110020 1 268 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.506 -0.018 17919 110021 1 268 . 1 1 51 51 GLU C C 51 175.870 175.870 177.087 -1.217 17919 110022 1 268 . 1 1 51 51 GLU CA C 51 55.960 55.960 54.723 1.237 17919 110023 1 268 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.690 -1.120 17919 110024 1 268 . 1 1 51 51 GLU H H 51 8.400 8.400 7.768 0.632 17919 110025 1 268 . 1 1 52 52 ASP N N 52 120.030 120.030 127.532 -7.502 17919 110026 1 268 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.332 0.027 17919 110027 1 268 . 1 1 52 52 ASP C C 52 177.330 177.330 177.555 -0.225 17919 110028 1 268 . 1 1 52 52 ASP CA C 52 56.960 56.960 58.210 -1.250 17919 110029 1 268 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.741 0.109 17919 110030 1 268 . 1 1 52 52 ASP H H 52 8.160 8.160 8.791 -0.631 17919 110031 1 268 . 1 1 53 53 GLY N N 53 106.660 106.660 106.027 0.633 17919 110032 1 268 . 1 1 53 53 GLY C C 53 174.870 174.870 173.965 0.905 17919 110033 1 268 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.796 0.374 17919 110034 1 268 . 1 1 53 53 GLY H H 53 9.390 9.390 8.687 0.703 17919 110035 1 268 . 1 1 54 54 ARG N N 54 119.050 119.050 120.742 -1.692 17919 110036 1 268 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.649 0.046 17919 110037 1 268 . 1 1 54 54 ARG C C 54 175.350 175.350 175.700 -0.350 17919 110038 1 268 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.246 0.144 17919 110039 1 268 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.166 -0.516 17919 110040 1 268 . 1 1 54 54 ARG H H 54 7.460 7.460 7.515 -0.055 17919 110041 1 268 . 1 1 55 55 THR N N 55 108.400 108.400 112.397 -3.997 17919 110042 1 268 . 1 1 55 55 THR HA H 55 5.240 5.240 4.879 0.361 17919 110043 1 268 . 1 1 55 55 THR C C 55 176.560 176.560 176.261 0.299 17919 110044 1 268 . 1 1 55 55 THR CA C 55 59.690 59.690 60.647 -0.957 17919 110045 1 268 . 1 1 55 55 THR CB C 55 72.260 72.260 70.730 1.530 17919 110046 1 268 . 1 1 55 55 THR H H 55 8.730 8.730 9.054 -0.324 17919 110047 1 268 . 1 1 56 56 LEU N N 56 117.920 117.920 121.911 -3.991 17919 110048 1 268 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.001 0.059 17919 110049 1 268 . 1 1 56 56 LEU C C 56 180.810 180.810 179.047 1.763 17919 110050 1 268 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.467 0.243 17919 110051 1 268 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.435 -1.065 17919 110052 1 268 . 1 1 56 56 LEU H H 56 8.140 8.140 8.932 -0.792 17919 110053 1 268 . 1 1 57 57 SER N N 57 113.330 113.330 113.863 -0.533 17919 110054 1 268 . 1 1 57 57 SER HA H 57 4.370 4.370 4.162 0.208 17919 110055 1 268 . 1 1 57 57 SER C C 57 178.310 178.310 176.066 2.244 17919 110056 1 268 . 1 1 57 57 SER CA C 57 61.080 61.080 61.754 -0.674 17919 110057 1 268 . 1 1 57 57 SER CB C 57 62.530 62.530 62.734 -0.204 17919 110058 1 268 . 1 1 57 57 SER H H 57 8.470 8.470 8.063 0.407 17919 110059 1 268 . 1 1 58 58 ASP N N 58 124.190 124.190 121.143 3.047 17919 110060 1 268 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.347 -0.051 17919 110061 1 268 . 1 1 58 58 ASP C C 58 177.400 177.400 177.090 0.310 17919 110062 1 268 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.533 0.647 17919 110063 1 268 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.518 -0.418 17919 110064 1 268 . 1 1 58 58 ASP H H 58 7.930 7.930 7.620 0.310 17919 110065 1 268 . 1 1 59 59 TYR N N 59 115.510 115.510 116.293 -0.783 17919 110066 1 268 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.650 0.020 17919 110067 1 268 . 1 1 59 59 TYR C C 59 174.700 174.700 174.992 -0.292 17919 110068 1 268 . 1 1 59 59 TYR CA C 59 58.250 58.250 56.294 1.956 17919 110069 1 268 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.217 1.853 17919 110070 1 268 . 1 1 59 59 TYR H H 59 7.250 7.250 7.387 -0.137 17919 110071 1 268 . 1 1 60 60 ASN N N 60 115.900 115.900 117.635 -1.735 17919 110072 1 268 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.436 -0.081 17919 110073 1 268 . 1 1 60 60 ASN C C 60 174.340 174.340 174.607 -0.267 17919 110074 1 268 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.300 -0.180 17919 110075 1 268 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.736 -0.326 17919 110076 1 268 . 1 1 60 60 ASN H H 60 8.150 8.150 7.438 0.712 17919 110077 1 268 . 1 1 61 61 ILE N N 61 118.600 118.600 119.755 -1.155 17919 110078 1 268 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.744 -0.351 17919 110079 1 268 . 1 1 61 61 ILE C C 61 174.610 174.610 175.425 -0.815 17919 110080 1 268 . 1 1 61 61 ILE CA C 61 62.420 62.420 60.958 1.462 17919 110081 1 268 . 1 1 61 61 ILE CB C 61 36.740 36.740 36.285 0.455 17919 110082 1 268 . 1 1 61 61 ILE H H 61 7.250 7.250 7.732 -0.482 17919 110083 1 268 . 1 1 62 62 GLN N N 62 124.740 124.740 123.456 1.284 17919 110084 1 268 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.646 -0.140 17919 110085 1 268 . 1 1 62 62 GLN C C 62 175.970 175.970 175.982 -0.012 17919 110086 1 268 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.221 0.439 17919 110087 1 268 . 1 1 62 62 GLN CB C 62 31.650 31.650 32.018 -0.368 17919 110088 1 268 . 1 1 62 62 GLN H H 62 7.610 7.610 8.233 -0.623 17919 110089 1 268 . 1 1 63 63 LYS N N 63 120.300 120.300 121.102 -0.802 17919 110090 1 268 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.103 -0.102 17919 110091 1 268 . 1 1 63 63 LYS C C 63 175.810 175.810 177.076 -1.266 17919 110092 1 268 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.256 0.534 17919 110093 1 268 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.950 0.700 17919 110094 1 268 . 1 1 63 63 LYS H H 63 8.490 8.490 8.601 -0.111 17919 110095 1 268 . 1 1 64 64 GLU N N 64 113.950 113.950 119.288 -5.338 17919 110096 1 268 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.725 -0.260 17919 110097 1 268 . 1 1 64 64 GLU C C 64 175.250 175.250 175.901 -0.651 17919 110098 1 268 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.948 -0.058 17919 110099 1 268 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.692 -2.792 17919 110100 1 268 . 1 1 64 64 GLU H H 64 9.280 9.280 8.967 0.313 17919 110101 1 268 . 1 1 65 65 SER N N 65 114.730 114.730 115.090 -0.360 17919 110102 1 268 . 1 1 65 65 SER HA H 65 4.640 4.640 4.437 0.203 17919 110103 1 268 . 1 1 65 65 SER C C 65 172.160 172.160 173.451 -1.291 17919 110104 1 268 . 1 1 65 65 SER CA C 65 60.890 60.890 59.353 1.536 17919 110105 1 268 . 1 1 65 65 SER CB C 65 64.910 64.910 64.207 0.703 17919 110106 1 268 . 1 1 65 65 SER H H 65 7.670 7.670 7.307 0.363 17919 110107 1 268 . 1 1 66 66 THR N N 66 117.110 117.110 119.895 -2.785 17919 110108 1 268 . 1 1 66 66 THR HA H 66 5.270 5.270 5.199 0.071 17919 110109 1 268 . 1 1 66 66 THR C C 66 173.950 173.950 174.462 -0.512 17919 110110 1 268 . 1 1 66 66 THR CA C 66 62.340 62.340 61.704 0.636 17919 110111 1 268 . 1 1 66 66 THR CB C 66 70.080 70.080 70.436 -0.356 17919 110112 1 268 . 1 1 66 66 THR H H 66 8.730 8.730 8.516 0.214 17919 110113 1 268 . 1 1 67 67 LEU N N 67 127.110 127.110 127.234 -0.124 17919 110114 1 268 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.821 0.239 17919 110115 1 268 . 1 1 67 67 LEU C C 67 175.770 175.770 175.570 0.200 17919 110116 1 268 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.170 -0.270 17919 110117 1 268 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.048 0.212 17919 110118 1 268 . 1 1 67 67 LEU H H 67 9.410 9.410 8.930 0.480 17919 110119 1 268 . 1 1 68 68 HIS N N 68 118.380 118.380 120.421 -2.041 17919 110120 1 268 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.282 -0.042 17919 110121 1 268 . 1 1 68 68 HIS C C 68 173.150 173.150 173.561 -0.411 17919 110122 1 268 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.318 0.682 17919 110123 1 268 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.172 -1.643 17919 110124 1 268 . 1 1 68 68 HIS H H 68 9.230 9.230 8.795 0.435 17919 110125 1 268 . 1 1 69 69 LEU N N 69 124.460 124.460 129.953 -5.493 17919 110126 1 268 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.197 -0.007 17919 110127 1 268 . 1 1 69 69 LEU C C 69 175.270 175.270 174.056 1.214 17919 110128 1 268 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.152 0.738 17919 110129 1 268 . 1 1 69 69 LEU CB C 69 44.380 44.380 45.245 -0.865 17919 110130 1 268 . 1 1 69 69 LEU H H 69 8.340 8.340 8.870 -0.530 17919 110131 1 268 . 1 1 70 70 VAL N N 70 126.940 126.940 121.926 5.014 17919 110132 1 268 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.529 -0.179 17919 110133 1 268 . 1 1 70 70 VAL C C 70 174.000 174.000 173.853 0.147 17919 110134 1 268 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.753 1.047 17919 110135 1 268 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.121 -0.211 17919 110136 1 268 . 1 1 70 70 VAL H H 70 9.200 9.200 8.677 0.523 17919 110137 1 268 . 1 1 71 71 LEU N N 71 123.130 123.130 122.156 0.974 17919 110138 1 268 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.309 -0.249 17919 110139 1 268 . 1 1 71 71 LEU C C 71 177.830 177.830 177.151 0.679 17919 110140 1 268 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.033 0.907 17919 110141 1 268 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.965 -1.115 17919 110142 1 268 . 1 1 71 71 LEU H H 71 8.120 8.120 8.248 -0.128 17919 110143 1 268 . 1 1 72 72 ARG N N 72 123.490 123.490 120.962 2.528 17919 110144 1 268 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.739 -0.438 17919 110145 1 268 . 1 1 72 72 ARG C C 72 175.350 175.350 175.119 0.231 17919 110146 1 268 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.357 0.253 17919 110147 1 268 . 1 1 72 72 ARG CB C 72 31.350 31.350 32.262 -0.912 17919 110148 1 268 . 1 1 72 72 ARG H H 72 8.580 8.580 8.138 0.442 17919 110149 1 269 . 1 1 2 2 GLN N N 2 123.220 123.220 119.697 3.523 17919 110150 1 269 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.466 -0.217 17919 110151 1 269 . 1 1 2 2 GLN C C 2 175.920 175.920 176.195 -0.275 17919 110152 1 269 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.828 0.252 17919 110153 1 269 . 1 1 2 2 GLN CB C 2 30.760 30.760 29.594 1.166 17919 110154 1 269 . 1 1 2 2 GLN H H 2 8.900 8.900 8.374 0.526 17919 110155 1 269 . 1 1 3 3 ILE N N 3 115.340 115.340 118.620 -3.280 17919 110156 1 269 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.788 -0.575 17919 110157 1 269 . 1 1 3 3 ILE C C 3 172.450 172.450 173.990 -1.540 17919 110158 1 269 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.503 0.067 17919 110159 1 269 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.173 1.037 17919 110160 1 269 . 1 1 3 3 ILE H H 3 8.320 8.320 8.323 -0.003 17919 110161 1 269 . 1 1 4 4 PHE N N 4 118.110 118.110 120.083 -1.973 17919 110162 1 269 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.547 0.083 17919 110163 1 269 . 1 1 4 4 PHE C C 4 175.320 175.320 175.107 0.213 17919 110164 1 269 . 1 1 4 4 PHE CA C 4 55.210 55.210 56.341 -1.131 17919 110165 1 269 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.789 -1.309 17919 110166 1 269 . 1 1 4 4 PHE H H 4 8.610 8.610 8.425 0.185 17919 110167 1 269 . 1 1 5 5 VAL N N 5 121.000 121.000 122.239 -1.239 17919 110168 1 269 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.744 -0.019 17919 110169 1 269 . 1 1 5 5 VAL C C 5 174.870 174.870 174.433 0.437 17919 110170 1 269 . 1 1 5 5 VAL CA C 5 60.620 60.620 60.993 -0.373 17919 110171 1 269 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.986 -0.756 17919 110172 1 269 . 1 1 5 5 VAL H H 5 9.300 9.300 9.224 0.076 17919 110173 1 269 . 1 1 6 6 LYS N N 6 127.520 127.520 128.150 -0.630 17919 110174 1 269 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.017 0.350 17919 110175 1 269 . 1 1 6 6 LYS C C 6 177.140 177.140 175.823 1.317 17919 110176 1 269 . 1 1 6 6 LYS CA C 6 54.520 54.520 55.102 -0.582 17919 110177 1 269 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.013 0.037 17919 110178 1 269 . 1 1 6 6 LYS H H 6 8.820 8.820 9.195 -0.375 17919 110179 1 269 . 1 1 7 7 THR N N 7 115.400 115.400 120.766 -5.366 17919 110180 1 269 . 1 1 7 7 THR HA H 7 4.970 4.970 4.577 0.393 17919 110181 1 269 . 1 1 7 7 THR C C 7 176.910 176.910 175.236 1.674 17919 110182 1 269 . 1 1 7 7 THR CA C 7 60.470 60.470 61.669 -1.200 17919 110183 1 269 . 1 1 7 7 THR CB C 7 70.630 70.630 70.267 0.363 17919 110184 1 269 . 1 1 7 7 THR H H 7 8.730 8.730 8.777 -0.047 17919 110185 1 269 . 1 1 8 8 LEU N N 8 121.330 121.330 124.775 -3.445 17919 110186 1 269 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.204 0.106 17919 110187 1 269 . 1 1 8 8 LEU C C 8 178.800 178.800 177.047 1.753 17919 110188 1 269 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.327 0.253 17919 110189 1 269 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.166 -0.196 17919 110190 1 269 . 1 1 8 8 LEU H H 8 9.100 9.100 9.116 -0.016 17919 110191 1 269 . 1 1 9 9 THR N N 9 105.590 105.590 108.176 -2.586 17919 110192 1 269 . 1 1 9 9 THR HA H 9 4.428 4.428 4.276 0.152 17919 110193 1 269 . 1 1 9 9 THR C C 9 175.520 175.520 175.606 -0.086 17919 110194 1 269 . 1 1 9 9 THR CA C 9 61.400 61.400 61.888 -0.488 17919 110195 1 269 . 1 1 9 9 THR CB C 9 69.140 69.140 68.810 0.330 17919 110196 1 269 . 1 1 9 9 THR H H 9 7.630 7.630 7.570 0.060 17919 110197 1 269 . 1 1 10 10 GLY N N 10 108.890 108.890 111.114 -2.224 17919 110198 1 269 . 1 1 10 10 GLY C C 10 174.070 174.070 173.865 0.205 17919 110199 1 269 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.837 0.623 17919 110200 1 269 . 1 1 10 10 GLY H H 10 7.810 7.810 8.179 -0.369 17919 110201 1 269 . 1 1 11 11 LYS N N 11 121.600 121.600 122.714 -1.114 17919 110202 1 269 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.370 -0.009 17919 110203 1 269 . 1 1 11 11 LYS C C 11 175.940 175.940 175.279 0.661 17919 110204 1 269 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.815 -0.535 17919 110205 1 269 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.419 -0.219 17919 110206 1 269 . 1 1 11 11 LYS H H 11 7.280 7.280 7.847 -0.567 17919 110207 1 269 . 1 1 12 12 THR N N 12 120.440 120.440 114.517 5.923 17919 110208 1 269 . 1 1 12 12 THR HA H 12 5.046 5.046 5.466 -0.420 17919 110209 1 269 . 1 1 12 12 THR C C 12 174.320 174.320 174.107 0.213 17919 110210 1 269 . 1 1 12 12 THR CA C 12 62.390 62.390 59.944 2.446 17919 110211 1 269 . 1 1 12 12 THR CB C 12 69.910 69.910 71.268 -1.358 17919 110212 1 269 . 1 1 12 12 THR H H 12 8.650 8.650 8.196 0.454 17919 110213 1 269 . 1 1 13 13 ILE N N 13 127.110 127.110 123.907 3.203 17919 110214 1 269 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.380 0.164 17919 110215 1 269 . 1 1 13 13 ILE C C 13 175.220 175.220 174.569 0.651 17919 110216 1 269 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.522 0.458 17919 110217 1 269 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.379 0.571 17919 110218 1 269 . 1 1 13 13 ILE H H 13 9.450 9.450 9.128 0.322 17919 110219 1 269 . 1 1 14 14 THR N N 14 121.520 121.520 121.238 0.282 17919 110220 1 269 . 1 1 14 14 THR HA H 14 4.964 4.964 4.933 0.031 17919 110221 1 269 . 1 1 14 14 THR C C 14 173.790 173.790 173.652 0.138 17919 110222 1 269 . 1 1 14 14 THR CA C 14 61.940 61.940 61.063 0.877 17919 110223 1 269 . 1 1 14 14 THR CB C 14 69.650 69.650 70.113 -0.463 17919 110224 1 269 . 1 1 14 14 THR H H 14 8.710 8.710 8.235 0.475 17919 110225 1 269 . 1 1 15 15 LEU N N 15 124.800 124.800 125.079 -0.279 17919 110226 1 269 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.777 0.003 17919 110227 1 269 . 1 1 15 15 LEU C C 15 174.670 174.670 174.881 -0.211 17919 110228 1 269 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.227 -0.397 17919 110229 1 269 . 1 1 15 15 LEU CB C 15 47.070 47.070 46.422 0.648 17919 110230 1 269 . 1 1 15 15 LEU H H 15 8.710 8.710 8.387 0.323 17919 110231 1 269 . 1 1 16 16 GLU N N 16 122.160 122.160 121.277 0.883 17919 110232 1 269 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.382 -0.465 17919 110233 1 269 . 1 1 16 16 GLU C C 16 175.860 175.860 175.357 0.503 17919 110234 1 269 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.051 -0.231 17919 110235 1 269 . 1 1 16 16 GLU CB C 16 29.450 29.450 31.474 -2.024 17919 110236 1 269 . 1 1 16 16 GLU H H 16 8.140 8.140 8.456 -0.316 17919 110237 1 269 . 1 1 17 17 VAL N N 17 117.210 117.210 119.752 -2.542 17919 110238 1 269 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.957 -0.243 17919 110239 1 269 . 1 1 17 17 VAL C C 17 174.160 174.160 174.672 -0.512 17919 110240 1 269 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.117 -0.687 17919 110241 1 269 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.583 0.817 17919 110242 1 269 . 1 1 17 17 VAL H H 17 8.900 8.900 8.856 0.044 17919 110243 1 269 . 1 1 18 18 GLU N N 18 118.990 118.990 121.383 -2.393 17919 110244 1 269 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.837 0.242 17919 110245 1 269 . 1 1 18 18 GLU C C 18 176.160 176.160 175.921 0.239 17919 110246 1 269 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.818 -0.098 17919 110247 1 269 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.152 0.158 17919 110248 1 269 . 1 1 18 18 GLU H H 18 8.640 8.640 8.997 -0.357 17919 110249 1 269 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.166 -0.025 17919 110250 1 269 . 1 1 19 19 PRO C C 19 175.310 175.310 177.637 -2.327 17919 110251 1 269 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.734 -0.264 17919 110252 1 269 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.876 0.074 17919 110253 1 269 . 1 1 20 20 SER N N 20 103.400 103.400 109.530 -6.130 17919 110254 1 269 . 1 1 20 20 SER HA H 20 4.370 4.370 4.307 0.063 17919 110255 1 269 . 1 1 20 20 SER C C 20 174.660 174.660 174.722 -0.062 17919 110256 1 269 . 1 1 20 20 SER CA C 20 57.400 57.400 58.358 -0.958 17919 110257 1 269 . 1 1 20 20 SER CB C 20 63.370 63.370 62.840 0.530 17919 110258 1 269 . 1 1 20 20 SER H H 20 7.040 7.040 8.389 -1.349 17919 110259 1 269 . 1 1 21 21 ASP N N 21 123.480 123.480 124.127 -0.647 17919 110260 1 269 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.645 0.050 17919 110261 1 269 . 1 1 21 21 ASP C C 21 176.360 176.360 176.392 -0.032 17919 110262 1 269 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.077 0.623 17919 110263 1 269 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.577 -0.777 17919 110264 1 269 . 1 1 21 21 ASP H H 21 8.030 8.030 7.546 0.484 17919 110265 1 269 . 1 1 22 22 THR N N 22 108.800 108.800 112.618 -3.818 17919 110266 1 269 . 1 1 22 22 THR HA H 22 4.920 4.920 4.712 0.208 17919 110267 1 269 . 1 1 22 22 THR C C 22 176.750 176.750 175.773 0.977 17919 110268 1 269 . 1 1 22 22 THR CA C 22 59.690 59.690 61.599 -1.909 17919 110269 1 269 . 1 1 22 22 THR CB C 22 71.200 71.200 70.604 0.596 17919 110270 1 269 . 1 1 22 22 THR H H 22 7.900 7.900 8.076 -0.176 17919 110271 1 269 . 1 1 23 23 ILE N N 23 121.190 121.190 122.050 -0.860 17919 110272 1 269 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.912 -0.255 17919 110273 1 269 . 1 1 23 23 ILE C C 23 179.040 179.040 177.772 1.268 17919 110274 1 269 . 1 1 23 23 ILE CA C 23 62.260 62.260 61.434 0.826 17919 110275 1 269 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.751 -2.401 17919 110276 1 269 . 1 1 23 23 ILE H H 23 8.560 8.560 8.518 0.042 17919 110277 1 269 . 1 1 24 24 GLU N N 24 120.830 120.830 120.539 0.291 17919 110278 1 269 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.850 0.067 17919 110279 1 269 . 1 1 24 24 GLU C C 24 178.640 178.640 178.942 -0.302 17919 110280 1 269 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.225 -0.005 17919 110281 1 269 . 1 1 24 24 GLU CB C 24 28.280 28.280 28.840 -0.560 17919 110282 1 269 . 1 1 24 24 GLU H H 24 9.760 9.760 8.358 1.402 17919 110283 1 269 . 1 1 25 25 ASN N N 25 120.570 120.570 117.604 2.966 17919 110284 1 269 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.494 0.031 17919 110285 1 269 . 1 1 25 25 ASN C C 25 178.380 178.380 177.604 0.776 17919 110286 1 269 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.002 0.058 17919 110287 1 269 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.486 -0.036 17919 110288 1 269 . 1 1 25 25 ASN H H 25 7.920 7.920 7.767 0.153 17919 110289 1 269 . 1 1 26 26 VAL N N 26 121.710 121.710 120.059 1.651 17919 110290 1 269 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.648 -0.251 17919 110291 1 269 . 1 1 26 26 VAL C C 26 177.950 177.950 177.306 0.644 17919 110292 1 269 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.329 1.331 17919 110293 1 269 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.722 -0.882 17919 110294 1 269 . 1 1 26 26 VAL H H 26 8.070 8.070 7.176 0.894 17919 110295 1 269 . 1 1 27 27 LYS N N 27 118.860 118.860 120.062 -1.202 17919 110296 1 269 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.282 0.298 17919 110297 1 269 . 1 1 27 27 LYS C C 27 180.550 180.550 179.016 1.534 17919 110298 1 269 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.246 0.004 17919 110299 1 269 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.183 1.547 17919 110300 1 269 . 1 1 27 27 LYS H H 27 8.560 8.560 8.222 0.338 17919 110301 1 269 . 1 1 28 28 ALA N N 28 123.440 123.440 122.700 0.740 17919 110302 1 269 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.186 -0.026 17919 110303 1 269 . 1 1 28 28 ALA C C 28 180.300 180.300 178.790 1.510 17919 110304 1 269 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.634 0.736 17919 110305 1 269 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.493 -0.783 17919 110306 1 269 . 1 1 28 28 ALA H H 28 8.060 8.060 8.241 -0.181 17919 110307 1 269 . 1 1 29 29 LYS N N 29 119.940 119.940 119.648 0.292 17919 110308 1 269 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.090 0.117 17919 110309 1 269 . 1 1 29 29 LYS C C 29 180.320 180.320 179.146 1.174 17919 110310 1 269 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.008 0.643 17919 110311 1 269 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.505 0.785 17919 110312 1 269 . 1 1 29 29 LYS H H 29 7.850 7.850 7.446 0.404 17919 110313 1 269 . 1 1 30 30 ILE N N 30 121.080 121.080 119.831 1.249 17919 110314 1 269 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.627 -0.120 17919 110315 1 269 . 1 1 30 30 ILE C C 30 178.310 178.310 177.447 0.863 17919 110316 1 269 . 1 1 30 30 ILE CA C 30 66.150 66.150 64.573 1.577 17919 110317 1 269 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.840 -1.040 17919 110318 1 269 . 1 1 30 30 ILE H H 30 8.280 8.280 8.091 0.189 17919 110319 1 269 . 1 1 31 31 GLN N N 31 123.490 123.490 119.713 3.777 17919 110320 1 269 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.914 -0.085 17919 110321 1 269 . 1 1 31 31 GLN C C 31 178.890 178.890 178.614 0.276 17919 110322 1 269 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.161 0.839 17919 110323 1 269 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.442 -0.722 17919 110324 1 269 . 1 1 31 31 GLN H H 31 8.580 8.580 7.839 0.741 17919 110325 1 269 . 1 1 32 32 ASP N N 32 119.360 119.360 119.485 -0.125 17919 110326 1 269 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.432 -0.078 17919 110327 1 269 . 1 1 32 32 ASP C C 32 177.250 177.250 177.793 -0.543 17919 110328 1 269 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.599 0.591 17919 110329 1 269 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.747 -0.167 17919 110330 1 269 . 1 1 32 32 ASP H H 32 8.010 8.010 7.857 0.153 17919 110331 1 269 . 1 1 33 33 LYS N N 33 115.130 115.130 116.810 -1.680 17919 110332 1 269 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.366 -0.029 17919 110333 1 269 . 1 1 33 33 LYS C C 33 177.870 177.870 177.674 0.196 17919 110334 1 269 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.995 0.055 17919 110335 1 269 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.630 0.540 17919 110336 1 269 . 1 1 33 33 LYS H H 33 7.430 7.430 7.684 -0.254 17919 110337 1 269 . 1 1 34 34 GLU N N 34 113.870 113.870 115.003 -1.133 17919 110338 1 269 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.481 0.144 17919 110339 1 269 . 1 1 34 34 GLU C C 34 177.840 177.840 177.135 0.705 17919 110340 1 269 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.097 -0.927 17919 110341 1 269 . 1 1 34 34 GLU CB C 34 32.660 32.660 32.110 0.550 17919 110342 1 269 . 1 1 34 34 GLU H H 34 8.740 8.740 7.987 0.753 17919 110343 1 269 . 1 1 35 35 GLY N N 35 108.650 108.650 108.962 -0.312 17919 110344 1 269 . 1 1 35 35 GLY C C 35 173.960 173.960 174.412 -0.452 17919 110345 1 269 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.300 0.780 17919 110346 1 269 . 1 1 35 35 GLY H H 35 8.530 8.530 7.947 0.583 17919 110347 1 269 . 1 1 36 36 ILE N N 36 119.880 119.880 122.224 -2.344 17919 110348 1 269 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.207 0.238 17919 110349 1 269 . 1 1 36 36 ILE C C 36 173.590 173.590 174.418 -0.828 17919 110350 1 269 . 1 1 36 36 ILE CA C 36 57.750 57.750 59.156 -1.406 17919 110351 1 269 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.071 2.509 17919 110352 1 269 . 1 1 36 36 ILE H H 36 6.150 6.150 7.812 -1.662 17919 110353 1 269 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.546 0.088 17919 110354 1 269 . 1 1 37 37 PRO C C 37 176.940 176.940 176.086 0.854 17919 110355 1 269 . 1 1 37 37 PRO CA C 37 61.660 61.660 62.191 -0.531 17919 110356 1 269 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.333 0.517 17919 110357 1 269 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.108 0.009 17919 110358 1 269 . 1 1 38 38 PRO C C 38 178.320 178.320 178.337 -0.017 17919 110359 1 269 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.822 0.438 17919 110360 1 269 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.998 0.892 17919 110361 1 269 . 1 1 39 39 ASP N N 39 113.380 113.380 115.320 -1.940 17919 110362 1 269 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.412 0.018 17919 110363 1 269 . 1 1 39 39 ASP C C 39 177.090 177.090 177.918 -0.828 17919 110364 1 269 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.645 -1.005 17919 110365 1 269 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.583 -1.043 17919 110366 1 269 . 1 1 39 39 ASP H H 39 8.550 8.550 8.473 0.077 17919 110367 1 269 . 1 1 40 40 GLN N N 40 116.780 116.780 117.888 -1.108 17919 110368 1 269 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.199 0.265 17919 110369 1 269 . 1 1 40 40 GLN C C 40 175.380 175.380 176.134 -0.754 17919 110370 1 269 . 1 1 40 40 GLN CA C 40 55.640 55.640 57.166 -1.526 17919 110371 1 269 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.519 0.621 17919 110372 1 269 . 1 1 40 40 GLN H H 40 7.820 7.820 7.610 0.210 17919 110373 1 269 . 1 1 41 41 GLN N N 41 117.720 117.720 119.140 -1.420 17919 110374 1 269 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.254 -0.010 17919 110375 1 269 . 1 1 41 41 GLN C C 41 176.300 176.300 174.625 1.675 17919 110376 1 269 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.549 -0.079 17919 110377 1 269 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.454 2.196 17919 110378 1 269 . 1 1 41 41 GLN H H 41 7.480 7.480 7.380 0.100 17919 110379 1 269 . 1 1 42 42 ARG N N 42 122.680 122.680 124.302 -1.622 17919 110380 1 269 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.637 -0.137 17919 110381 1 269 . 1 1 42 42 ARG C C 42 174.050 174.050 174.479 -0.429 17919 110382 1 269 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.080 0.970 17919 110383 1 269 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.797 -1.047 17919 110384 1 269 . 1 1 42 42 ARG H H 42 8.530 8.530 8.241 0.289 17919 110385 1 269 . 1 1 43 43 LEU N N 43 124.040 124.040 126.364 -2.324 17919 110386 1 269 . 1 1 43 43 LEU C C 43 175.290 175.290 175.749 -0.459 17919 110387 1 269 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.303 -1.323 17919 110388 1 269 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.396 2.394 17919 110389 1 269 . 1 1 43 43 LEU H H 43 8.820 8.820 8.851 -0.031 17919 110390 1 269 . 1 1 44 44 ILE N N 44 121.920 121.920 122.465 -0.545 17919 110391 1 269 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.063 -0.071 17919 110392 1 269 . 1 1 44 44 ILE C C 44 176.060 176.060 174.477 1.583 17919 110393 1 269 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.114 -1.135 17919 110394 1 269 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.280 0.140 17919 110395 1 269 . 1 1 44 44 ILE H H 44 9.030 9.030 8.751 0.279 17919 110396 1 269 . 1 1 45 45 PHE N N 45 125.390 125.390 128.019 -2.629 17919 110397 1 269 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.022 0.023 17919 110398 1 269 . 1 1 45 45 PHE C C 45 174.470 174.470 174.844 -0.374 17919 110399 1 269 . 1 1 45 45 PHE CA C 45 57.020 57.020 55.917 1.103 17919 110400 1 269 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.853 0.907 17919 110401 1 269 . 1 1 45 45 PHE H H 45 8.830 8.830 8.418 0.412 17919 110402 1 269 . 1 1 46 46 ALA N N 46 132.200 132.200 130.403 1.797 17919 110403 1 269 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.745 -0.055 17919 110404 1 269 . 1 1 46 46 ALA C C 46 177.290 177.290 177.576 -0.286 17919 110405 1 269 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.716 -0.176 17919 110406 1 269 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.542 0.028 17919 110407 1 269 . 1 1 46 46 ALA H H 46 8.810 8.810 8.896 -0.086 17919 110408 1 269 . 1 1 47 47 GLY N N 47 102.340 102.340 103.934 -1.594 17919 110409 1 269 . 1 1 47 47 GLY C C 47 173.810 173.810 174.488 -0.678 17919 110410 1 269 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.261 0.089 17919 110411 1 269 . 1 1 47 47 GLY H H 47 8.130 8.130 8.375 -0.245 17919 110412 1 269 . 1 1 48 48 LYS N N 48 121.570 121.570 121.126 0.444 17919 110413 1 269 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.571 0.051 17919 110414 1 269 . 1 1 48 48 LYS C C 48 174.700 174.700 175.499 -0.799 17919 110415 1 269 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.944 -0.394 17919 110416 1 269 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.407 0.123 17919 110417 1 269 . 1 1 48 48 LYS H H 48 7.980 7.980 8.039 -0.059 17919 110418 1 269 . 1 1 49 49 GLN N N 49 122.410 122.410 121.064 1.346 17919 110419 1 269 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.394 0.166 17919 110420 1 269 . 1 1 49 49 GLN C C 49 175.670 175.670 175.895 -0.225 17919 110421 1 269 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.894 -0.154 17919 110422 1 269 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.334 -0.334 17919 110423 1 269 . 1 1 49 49 GLN H H 49 8.600 8.600 8.438 0.162 17919 110424 1 269 . 1 1 50 50 LEU N N 50 125.520 125.520 127.364 -1.844 17919 110425 1 269 . 1 1 50 50 LEU HA H 50 4.090 4.090 3.995 0.095 17919 110426 1 269 . 1 1 50 50 LEU C C 50 176.660 176.660 175.953 0.707 17919 110427 1 269 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.179 0.061 17919 110428 1 269 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.445 -0.875 17919 110429 1 269 . 1 1 50 50 LEU H H 50 8.530 8.530 8.888 -0.358 17919 110430 1 269 . 1 1 51 51 GLU N N 51 122.940 122.940 122.132 0.808 17919 110431 1 269 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.613 -0.125 17919 110432 1 269 . 1 1 51 51 GLU C C 51 175.870 175.870 176.083 -0.213 17919 110433 1 269 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.498 0.462 17919 110434 1 269 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.940 -1.370 17919 110435 1 269 . 1 1 51 51 GLU H H 51 8.400 8.400 8.018 0.382 17919 110436 1 269 . 1 1 52 52 ASP N N 52 120.030 120.030 124.781 -4.751 17919 110437 1 269 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.547 -0.188 17919 110438 1 269 . 1 1 52 52 ASP C C 52 177.330 177.330 176.824 0.506 17919 110439 1 269 . 1 1 52 52 ASP CA C 52 56.960 56.960 56.278 0.682 17919 110440 1 269 . 1 1 52 52 ASP CB C 52 40.850 40.850 41.243 -0.393 17919 110441 1 269 . 1 1 52 52 ASP H H 52 8.160 8.160 8.861 -0.701 17919 110442 1 269 . 1 1 53 53 GLY N N 53 106.660 106.660 106.297 0.363 17919 110443 1 269 . 1 1 53 53 GLY C C 53 174.870 174.870 173.748 1.122 17919 110444 1 269 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.866 0.304 17919 110445 1 269 . 1 1 53 53 GLY H H 53 9.390 9.390 8.541 0.849 17919 110446 1 269 . 1 1 54 54 ARG N N 54 119.050 119.050 120.400 -1.350 17919 110447 1 269 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.558 0.137 17919 110448 1 269 . 1 1 54 54 ARG C C 54 175.350 175.350 175.427 -0.077 17919 110449 1 269 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.222 0.168 17919 110450 1 269 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.090 -0.440 17919 110451 1 269 . 1 1 54 54 ARG H H 54 7.460 7.460 7.286 0.174 17919 110452 1 269 . 1 1 55 55 THR N N 55 108.400 108.400 111.936 -3.536 17919 110453 1 269 . 1 1 55 55 THR HA H 55 5.240 5.240 4.977 0.263 17919 110454 1 269 . 1 1 55 55 THR C C 55 176.560 176.560 175.857 0.703 17919 110455 1 269 . 1 1 55 55 THR CA C 55 59.690 59.690 60.572 -0.882 17919 110456 1 269 . 1 1 55 55 THR CB C 55 72.260 72.260 70.967 1.293 17919 110457 1 269 . 1 1 55 55 THR H H 55 8.730 8.730 8.899 -0.169 17919 110458 1 269 . 1 1 56 56 LEU N N 56 117.920 117.920 122.612 -4.692 17919 110459 1 269 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.915 0.145 17919 110460 1 269 . 1 1 56 56 LEU C C 56 180.810 180.810 178.827 1.983 17919 110461 1 269 . 1 1 56 56 LEU CA C 56 58.710 58.710 59.319 -0.609 17919 110462 1 269 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.587 -1.217 17919 110463 1 269 . 1 1 56 56 LEU H H 56 8.140 8.140 8.309 -0.169 17919 110464 1 269 . 1 1 57 57 SER N N 57 113.330 113.330 113.505 -0.175 17919 110465 1 269 . 1 1 57 57 SER HA H 57 4.370 4.370 4.025 0.345 17919 110466 1 269 . 1 1 57 57 SER C C 57 178.310 178.310 176.425 1.885 17919 110467 1 269 . 1 1 57 57 SER CA C 57 61.080 61.080 61.826 -0.746 17919 110468 1 269 . 1 1 57 57 SER CB C 57 62.530 62.530 62.642 -0.112 17919 110469 1 269 . 1 1 57 57 SER H H 57 8.470 8.470 8.006 0.464 17919 110470 1 269 . 1 1 58 58 ASP N N 58 124.190 124.190 120.198 3.992 17919 110471 1 269 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.332 -0.036 17919 110472 1 269 . 1 1 58 58 ASP C C 58 177.400 177.400 177.617 -0.217 17919 110473 1 269 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.580 0.600 17919 110474 1 269 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.648 -0.548 17919 110475 1 269 . 1 1 58 58 ASP H H 58 7.930 7.930 7.427 0.503 17919 110476 1 269 . 1 1 59 59 TYR N N 59 115.510 115.510 115.878 -0.368 17919 110477 1 269 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.639 0.031 17919 110478 1 269 . 1 1 59 59 TYR C C 59 174.700 174.700 174.878 -0.178 17919 110479 1 269 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.245 1.004 17919 110480 1 269 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.206 1.864 17919 110481 1 269 . 1 1 59 59 TYR H H 59 7.250 7.250 7.402 -0.152 17919 110482 1 269 . 1 1 60 60 ASN N N 60 115.900 115.900 116.110 -0.210 17919 110483 1 269 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.377 -0.022 17919 110484 1 269 . 1 1 60 60 ASN C C 60 174.340 174.340 174.467 -0.127 17919 110485 1 269 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.097 0.023 17919 110486 1 269 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.745 -0.334 17919 110487 1 269 . 1 1 60 60 ASN H H 60 8.150 8.150 7.423 0.727 17919 110488 1 269 . 1 1 61 61 ILE N N 61 118.600 118.600 119.719 -1.119 17919 110489 1 269 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.612 -0.219 17919 110490 1 269 . 1 1 61 61 ILE C C 61 174.610 174.610 175.610 -1.000 17919 110491 1 269 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.552 0.868 17919 110492 1 269 . 1 1 61 61 ILE CB C 61 36.740 36.740 35.996 0.744 17919 110493 1 269 . 1 1 61 61 ILE H H 61 7.250 7.250 7.960 -0.710 17919 110494 1 269 . 1 1 62 62 GLN N N 62 124.740 124.740 126.425 -1.685 17919 110495 1 269 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.657 -0.151 17919 110496 1 269 . 1 1 62 62 GLN C C 62 175.970 175.970 175.761 0.209 17919 110497 1 269 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.576 0.084 17919 110498 1 269 . 1 1 62 62 GLN CB C 62 31.650 31.650 32.782 -1.133 17919 110499 1 269 . 1 1 62 62 GLN H H 62 7.610 7.610 8.187 -0.577 17919 110500 1 269 . 1 1 63 63 LYS N N 63 120.300 120.300 124.307 -4.007 17919 110501 1 269 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.984 0.017 17919 110502 1 269 . 1 1 63 63 LYS C C 63 175.810 175.810 176.779 -0.969 17919 110503 1 269 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.279 -0.489 17919 110504 1 269 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.946 0.704 17919 110505 1 269 . 1 1 63 63 LYS H H 63 8.490 8.490 8.830 -0.340 17919 110506 1 269 . 1 1 64 64 GLU N N 64 113.950 113.950 119.412 -5.462 17919 110507 1 269 . 1 1 64 64 GLU HA H 64 3.465 3.465 4.129 -0.664 17919 110508 1 269 . 1 1 64 64 GLU C C 64 175.250 175.250 175.914 -0.664 17919 110509 1 269 . 1 1 64 64 GLU CA C 64 57.890 57.890 58.178 -0.288 17919 110510 1 269 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.473 -2.573 17919 110511 1 269 . 1 1 64 64 GLU H H 64 9.280 9.280 9.233 0.047 17919 110512 1 269 . 1 1 65 65 SER N N 65 114.730 114.730 115.473 -0.743 17919 110513 1 269 . 1 1 65 65 SER HA H 65 4.640 4.640 4.557 0.083 17919 110514 1 269 . 1 1 65 65 SER C C 65 172.160 172.160 174.107 -1.947 17919 110515 1 269 . 1 1 65 65 SER CA C 65 60.890 60.890 59.926 0.964 17919 110516 1 269 . 1 1 65 65 SER CB C 65 64.910 64.910 64.784 0.126 17919 110517 1 269 . 1 1 65 65 SER H H 65 7.670 7.670 8.266 -0.596 17919 110518 1 269 . 1 1 66 66 THR N N 66 117.110 117.110 119.088 -1.978 17919 110519 1 269 . 1 1 66 66 THR HA H 66 5.270 5.270 5.249 0.021 17919 110520 1 269 . 1 1 66 66 THR C C 66 173.950 173.950 173.841 0.109 17919 110521 1 269 . 1 1 66 66 THR CA C 66 62.340 62.340 62.052 0.288 17919 110522 1 269 . 1 1 66 66 THR CB C 66 70.080 70.080 70.167 -0.087 17919 110523 1 269 . 1 1 66 66 THR H H 66 8.730 8.730 8.481 0.249 17919 110524 1 269 . 1 1 67 67 LEU N N 67 127.110 127.110 126.981 0.129 17919 110525 1 269 . 1 1 67 67 LEU HA H 67 5.060 5.060 5.013 0.047 17919 110526 1 269 . 1 1 67 67 LEU C C 67 175.770 175.770 175.658 0.112 17919 110527 1 269 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.942 -0.042 17919 110528 1 269 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.388 -0.128 17919 110529 1 269 . 1 1 67 67 LEU H H 67 9.410 9.410 8.900 0.510 17919 110530 1 269 . 1 1 68 68 HIS N N 68 118.380 118.380 120.021 -1.641 17919 110531 1 269 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.192 0.048 17919 110532 1 269 . 1 1 68 68 HIS C C 68 173.150 173.150 173.996 -0.846 17919 110533 1 269 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.674 0.326 17919 110534 1 269 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.193 -1.663 17919 110535 1 269 . 1 1 68 68 HIS H H 68 9.230 9.230 9.288 -0.058 17919 110536 1 269 . 1 1 69 69 LEU N N 69 124.460 124.460 127.427 -2.967 17919 110537 1 269 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.262 -0.072 17919 110538 1 269 . 1 1 69 69 LEU C C 69 175.270 175.270 174.652 0.618 17919 110539 1 269 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.601 0.289 17919 110540 1 269 . 1 1 69 69 LEU CB C 69 44.380 44.380 43.675 0.705 17919 110541 1 269 . 1 1 69 69 LEU H H 69 8.340 8.340 8.564 -0.224 17919 110542 1 269 . 1 1 70 70 VAL N N 70 126.940 126.940 125.293 1.647 17919 110543 1 269 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.538 -0.188 17919 110544 1 269 . 1 1 70 70 VAL C C 70 174.000 174.000 173.865 0.135 17919 110545 1 269 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.749 1.051 17919 110546 1 269 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.198 -0.288 17919 110547 1 269 . 1 1 70 70 VAL H H 70 9.200 9.200 8.687 0.513 17919 110548 1 269 . 1 1 71 71 LEU N N 71 123.130 123.130 126.101 -2.971 17919 110549 1 269 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.090 -0.030 17919 110550 1 269 . 1 1 71 71 LEU C C 71 177.830 177.830 177.118 0.712 17919 110551 1 269 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.498 0.442 17919 110552 1 269 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.555 -0.705 17919 110553 1 269 . 1 1 71 71 LEU H H 71 8.120 8.120 8.529 -0.409 17919 110554 1 269 . 1 1 72 72 ARG N N 72 123.490 123.490 122.111 1.379 17919 110555 1 269 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.507 -0.206 17919 110556 1 269 . 1 1 72 72 ARG C C 72 175.350 175.350 175.870 -0.520 17919 110557 1 269 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.049 0.561 17919 110558 1 269 . 1 1 72 72 ARG CB C 72 31.350 31.350 29.205 2.145 17919 110559 1 269 . 1 1 72 72 ARG H H 72 8.580 8.580 8.352 0.228 17919 110560 1 270 . 1 1 2 2 GLN N N 2 123.220 123.220 120.885 2.335 17919 110561 1 270 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.264 -0.015 17919 110562 1 270 . 1 1 2 2 GLN C C 2 175.920 175.920 175.964 -0.044 17919 110563 1 270 . 1 1 2 2 GLN CA C 2 55.080 55.080 55.369 -0.289 17919 110564 1 270 . 1 1 2 2 GLN CB C 2 30.760 30.760 29.584 1.176 17919 110565 1 270 . 1 1 2 2 GLN H H 2 8.900 8.900 8.414 0.486 17919 110566 1 270 . 1 1 3 3 ILE N N 3 115.340 115.340 116.708 -1.368 17919 110567 1 270 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.467 -0.254 17919 110568 1 270 . 1 1 3 3 ILE C C 3 172.450 172.450 173.328 -0.878 17919 110569 1 270 . 1 1 3 3 ILE CA C 3 59.570 59.570 58.855 0.716 17919 110570 1 270 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.905 0.305 17919 110571 1 270 . 1 1 3 3 ILE H H 3 8.320 8.320 8.674 -0.354 17919 110572 1 270 . 1 1 4 4 PHE N N 4 118.110 118.110 119.479 -1.369 17919 110573 1 270 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.572 0.058 17919 110574 1 270 . 1 1 4 4 PHE C C 4 175.320 175.320 175.060 0.260 17919 110575 1 270 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.251 -0.041 17919 110576 1 270 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.697 -0.217 17919 110577 1 270 . 1 1 4 4 PHE H H 4 8.610 8.610 8.850 -0.240 17919 110578 1 270 . 1 1 5 5 VAL N N 5 121.000 121.000 121.096 -0.096 17919 110579 1 270 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.978 -0.253 17919 110580 1 270 . 1 1 5 5 VAL C C 5 174.870 174.870 174.729 0.141 17919 110581 1 270 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.039 -0.419 17919 110582 1 270 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.200 0.030 17919 110583 1 270 . 1 1 5 5 VAL H H 5 9.300 9.300 9.102 0.198 17919 110584 1 270 . 1 1 6 6 LYS N N 6 127.520 127.520 128.150 -0.630 17919 110585 1 270 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.118 0.249 17919 110586 1 270 . 1 1 6 6 LYS C C 6 177.140 177.140 175.598 1.542 17919 110587 1 270 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.325 0.195 17919 110588 1 270 . 1 1 6 6 LYS CB C 6 35.050 35.050 36.218 -1.168 17919 110589 1 270 . 1 1 6 6 LYS H H 6 8.820 8.820 9.159 -0.339 17919 110590 1 270 . 1 1 7 7 THR N N 7 115.400 115.400 121.169 -5.769 17919 110591 1 270 . 1 1 7 7 THR HA H 7 4.970 4.970 4.591 0.379 17919 110592 1 270 . 1 1 7 7 THR C C 7 176.910 176.910 175.931 0.979 17919 110593 1 270 . 1 1 7 7 THR CA C 7 60.470 60.470 62.729 -2.259 17919 110594 1 270 . 1 1 7 7 THR CB C 7 70.630 70.630 70.204 0.426 17919 110595 1 270 . 1 1 7 7 THR H H 7 8.730 8.730 9.025 -0.295 17919 110596 1 270 . 1 1 8 8 LEU N N 8 121.330 121.330 123.045 -1.715 17919 110597 1 270 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.116 0.194 17919 110598 1 270 . 1 1 8 8 LEU C C 8 178.800 178.800 177.810 0.990 17919 110599 1 270 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.049 0.531 17919 110600 1 270 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.804 0.166 17919 110601 1 270 . 1 1 8 8 LEU H H 8 9.100 9.100 8.627 0.473 17919 110602 1 270 . 1 1 9 9 THR N N 9 105.590 105.590 107.503 -1.913 17919 110603 1 270 . 1 1 9 9 THR HA H 9 4.428 4.428 4.429 -0.001 17919 110604 1 270 . 1 1 9 9 THR C C 9 175.520 175.520 174.596 0.924 17919 110605 1 270 . 1 1 9 9 THR CA C 9 61.400 61.400 61.531 -0.131 17919 110606 1 270 . 1 1 9 9 THR CB C 9 69.140 69.140 68.827 0.313 17919 110607 1 270 . 1 1 9 9 THR H H 9 7.630 7.630 7.710 -0.080 17919 110608 1 270 . 1 1 10 10 GLY N N 10 108.890 108.890 110.539 -1.649 17919 110609 1 270 . 1 1 10 10 GLY C C 10 174.070 174.070 173.003 1.067 17919 110610 1 270 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.164 0.296 17919 110611 1 270 . 1 1 10 10 GLY H H 10 7.810 7.810 8.163 -0.353 17919 110612 1 270 . 1 1 11 11 LYS N N 11 121.600 121.600 123.252 -1.652 17919 110613 1 270 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.579 -0.218 17919 110614 1 270 . 1 1 11 11 LYS C C 11 175.940 175.940 174.745 1.195 17919 110615 1 270 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.421 -0.141 17919 110616 1 270 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.334 -0.133 17919 110617 1 270 . 1 1 11 11 LYS H H 11 7.280 7.280 8.264 -0.984 17919 110618 1 270 . 1 1 12 12 THR N N 12 120.440 120.440 120.135 0.305 17919 110619 1 270 . 1 1 12 12 THR HA H 12 5.046 5.046 5.381 -0.335 17919 110620 1 270 . 1 1 12 12 THR C C 12 174.320 174.320 174.323 -0.003 17919 110621 1 270 . 1 1 12 12 THR CA C 12 62.390 62.390 61.281 1.109 17919 110622 1 270 . 1 1 12 12 THR CB C 12 69.910 69.910 70.520 -0.610 17919 110623 1 270 . 1 1 12 12 THR H H 12 8.650 8.650 8.374 0.276 17919 110624 1 270 . 1 1 13 13 ILE N N 13 127.110 127.110 120.673 6.437 17919 110625 1 270 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.801 -0.257 17919 110626 1 270 . 1 1 13 13 ILE C C 13 175.220 175.220 175.125 0.095 17919 110627 1 270 . 1 1 13 13 ILE CA C 13 59.980 59.980 58.942 1.038 17919 110628 1 270 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.399 -0.449 17919 110629 1 270 . 1 1 13 13 ILE H H 13 9.450 9.450 8.782 0.668 17919 110630 1 270 . 1 1 14 14 THR N N 14 121.520 121.520 120.334 1.186 17919 110631 1 270 . 1 1 14 14 THR HA H 14 4.964 4.964 5.004 -0.040 17919 110632 1 270 . 1 1 14 14 THR C C 14 173.790 173.790 173.844 -0.054 17919 110633 1 270 . 1 1 14 14 THR CA C 14 61.940 61.940 62.849 -0.909 17919 110634 1 270 . 1 1 14 14 THR CB C 14 69.650 69.650 69.538 0.112 17919 110635 1 270 . 1 1 14 14 THR H H 14 8.710 8.710 8.546 0.164 17919 110636 1 270 . 1 1 15 15 LEU N N 15 124.800 124.800 126.742 -1.942 17919 110637 1 270 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.788 -0.008 17919 110638 1 270 . 1 1 15 15 LEU C C 15 174.670 174.670 175.348 -0.678 17919 110639 1 270 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.832 -1.002 17919 110640 1 270 . 1 1 15 15 LEU CB C 15 47.070 47.070 44.364 2.706 17919 110641 1 270 . 1 1 15 15 LEU H H 15 8.710 8.710 8.702 0.008 17919 110642 1 270 . 1 1 16 16 GLU N N 16 122.160 122.160 123.650 -1.490 17919 110643 1 270 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.333 -0.416 17919 110644 1 270 . 1 1 16 16 GLU C C 16 175.860 175.860 176.001 -0.141 17919 110645 1 270 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.679 -0.859 17919 110646 1 270 . 1 1 16 16 GLU CB C 16 29.450 29.450 31.115 -1.665 17919 110647 1 270 . 1 1 16 16 GLU H H 16 8.140 8.140 8.657 -0.517 17919 110648 1 270 . 1 1 17 17 VAL N N 17 117.210 117.210 118.189 -0.979 17919 110649 1 270 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.757 -0.043 17919 110650 1 270 . 1 1 17 17 VAL C C 17 174.160 174.160 174.401 -0.241 17919 110651 1 270 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.660 -0.230 17919 110652 1 270 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.219 1.181 17919 110653 1 270 . 1 1 17 17 VAL H H 17 8.900 8.900 8.818 0.082 17919 110654 1 270 . 1 1 18 18 GLU N N 18 118.990 118.990 120.235 -1.245 17919 110655 1 270 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.852 0.227 17919 110656 1 270 . 1 1 18 18 GLU C C 18 176.160 176.160 175.768 0.392 17919 110657 1 270 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.250 0.470 17919 110658 1 270 . 1 1 18 18 GLU CB C 18 30.310 30.310 31.012 -0.702 17919 110659 1 270 . 1 1 18 18 GLU H H 18 8.640 8.640 8.748 -0.108 17919 110660 1 270 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.486 -0.345 17919 110661 1 270 . 1 1 19 19 PRO C C 19 175.310 175.310 176.930 -1.620 17919 110662 1 270 . 1 1 19 19 PRO CA C 19 65.470 65.470 64.422 1.048 17919 110663 1 270 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.027 -0.077 17919 110664 1 270 . 1 1 20 20 SER N N 20 103.400 103.400 112.765 -9.365 17919 110665 1 270 . 1 1 20 20 SER HA H 20 4.370 4.370 4.423 -0.053 17919 110666 1 270 . 1 1 20 20 SER C C 20 174.660 174.660 174.079 0.581 17919 110667 1 270 . 1 1 20 20 SER CA C 20 57.400 57.400 57.878 -0.478 17919 110668 1 270 . 1 1 20 20 SER CB C 20 63.370 63.370 62.643 0.727 17919 110669 1 270 . 1 1 20 20 SER H H 20 7.040 7.040 8.156 -1.116 17919 110670 1 270 . 1 1 21 21 ASP N N 21 123.480 123.480 125.067 -1.587 17919 110671 1 270 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.702 -0.007 17919 110672 1 270 . 1 1 21 21 ASP C C 21 176.360 176.360 175.667 0.693 17919 110673 1 270 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.863 0.837 17919 110674 1 270 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.557 -0.757 17919 110675 1 270 . 1 1 21 21 ASP H H 21 8.030 8.030 8.026 0.004 17919 110676 1 270 . 1 1 22 22 THR N N 22 108.800 108.800 113.453 -4.653 17919 110677 1 270 . 1 1 22 22 THR HA H 22 4.920 4.920 4.584 0.336 17919 110678 1 270 . 1 1 22 22 THR C C 22 176.750 176.750 176.484 0.266 17919 110679 1 270 . 1 1 22 22 THR CA C 22 59.690 59.690 61.965 -2.275 17919 110680 1 270 . 1 1 22 22 THR CB C 22 71.200 71.200 70.568 0.632 17919 110681 1 270 . 1 1 22 22 THR H H 22 7.900 7.900 8.204 -0.304 17919 110682 1 270 . 1 1 23 23 ILE N N 23 121.190 121.190 122.475 -1.285 17919 110683 1 270 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.776 -0.119 17919 110684 1 270 . 1 1 23 23 ILE C C 23 179.040 179.040 177.647 1.393 17919 110685 1 270 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.715 -0.455 17919 110686 1 270 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.195 -1.845 17919 110687 1 270 . 1 1 23 23 ILE H H 23 8.560 8.560 8.801 -0.241 17919 110688 1 270 . 1 1 24 24 GLU N N 24 120.830 120.830 120.697 0.133 17919 110689 1 270 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.946 -0.029 17919 110690 1 270 . 1 1 24 24 GLU C C 24 178.640 178.640 178.620 0.020 17919 110691 1 270 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.748 0.471 17919 110692 1 270 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.561 -1.281 17919 110693 1 270 . 1 1 24 24 GLU H H 24 9.760 9.760 8.206 1.554 17919 110694 1 270 . 1 1 25 25 ASN N N 25 120.570 120.570 118.452 2.118 17919 110695 1 270 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.508 0.017 17919 110696 1 270 . 1 1 25 25 ASN C C 25 178.380 178.380 177.878 0.502 17919 110697 1 270 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.124 -0.064 17919 110698 1 270 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.778 -0.328 17919 110699 1 270 . 1 1 25 25 ASN H H 25 7.920 7.920 7.532 0.388 17919 110700 1 270 . 1 1 26 26 VAL N N 26 121.710 121.710 120.651 1.059 17919 110701 1 270 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.679 -0.282 17919 110702 1 270 . 1 1 26 26 VAL C C 26 177.950 177.950 177.958 -0.008 17919 110703 1 270 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.387 1.273 17919 110704 1 270 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.175 -0.335 17919 110705 1 270 . 1 1 26 26 VAL H H 26 8.070 8.070 8.319 -0.249 17919 110706 1 270 . 1 1 27 27 LYS N N 27 118.860 118.860 119.499 -0.639 17919 110707 1 270 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.241 0.339 17919 110708 1 270 . 1 1 27 27 LYS C C 27 180.550 180.550 178.844 1.706 17919 110709 1 270 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.591 -0.341 17919 110710 1 270 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.270 1.460 17919 110711 1 270 . 1 1 27 27 LYS H H 27 8.560 8.560 8.624 -0.064 17919 110712 1 270 . 1 1 28 28 ALA N N 28 123.440 123.440 120.976 2.464 17919 110713 1 270 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.212 -0.052 17919 110714 1 270 . 1 1 28 28 ALA C C 28 180.300 180.300 179.113 1.187 17919 110715 1 270 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.086 0.284 17919 110716 1 270 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.338 -0.628 17919 110717 1 270 . 1 1 28 28 ALA H H 28 8.060 8.060 7.866 0.194 17919 110718 1 270 . 1 1 29 29 LYS N N 29 119.940 119.940 118.862 1.078 17919 110719 1 270 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.107 0.100 17919 110720 1 270 . 1 1 29 29 LYS C C 29 180.320 180.320 178.879 1.441 17919 110721 1 270 . 1 1 29 29 LYS CA C 29 59.650 59.650 58.512 1.138 17919 110722 1 270 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.044 1.246 17919 110723 1 270 . 1 1 29 29 LYS H H 29 7.850 7.850 7.500 0.350 17919 110724 1 270 . 1 1 30 30 ILE N N 30 121.080 121.080 120.160 0.920 17919 110725 1 270 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.726 -0.219 17919 110726 1 270 . 1 1 30 30 ILE C C 30 178.310 178.310 177.253 1.057 17919 110727 1 270 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.290 0.860 17919 110728 1 270 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.642 -0.842 17919 110729 1 270 . 1 1 30 30 ILE H H 30 8.280 8.280 7.927 0.353 17919 110730 1 270 . 1 1 31 31 GLN N N 31 123.490 123.490 121.192 2.298 17919 110731 1 270 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.088 -0.259 17919 110732 1 270 . 1 1 31 31 GLN C C 31 178.890 178.890 178.033 0.857 17919 110733 1 270 . 1 1 31 31 GLN CA C 31 60.000 60.000 58.772 1.228 17919 110734 1 270 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.007 -0.287 17919 110735 1 270 . 1 1 31 31 GLN H H 31 8.580 8.580 7.880 0.700 17919 110736 1 270 . 1 1 32 32 ASP N N 32 119.360 119.360 118.689 0.671 17919 110737 1 270 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.398 -0.044 17919 110738 1 270 . 1 1 32 32 ASP C C 32 177.250 177.250 178.151 -0.901 17919 110739 1 270 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.770 0.420 17919 110740 1 270 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.858 -0.278 17919 110741 1 270 . 1 1 32 32 ASP H H 32 8.010 8.010 7.755 0.255 17919 110742 1 270 . 1 1 33 33 LYS N N 33 115.130 115.130 118.596 -3.466 17919 110743 1 270 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.240 0.097 17919 110744 1 270 . 1 1 33 33 LYS C C 33 177.870 177.870 178.595 -0.725 17919 110745 1 270 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.358 -0.308 17919 110746 1 270 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.147 1.023 17919 110747 1 270 . 1 1 33 33 LYS H H 33 7.430 7.430 7.447 -0.017 17919 110748 1 270 . 1 1 34 34 GLU N N 34 113.870 113.870 114.672 -0.802 17919 110749 1 270 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.441 0.184 17919 110750 1 270 . 1 1 34 34 GLU C C 34 177.840 177.840 177.570 0.270 17919 110751 1 270 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.971 -0.801 17919 110752 1 270 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.369 1.290 17919 110753 1 270 . 1 1 34 34 GLU H H 34 8.740 8.740 8.032 0.708 17919 110754 1 270 . 1 1 35 35 GLY N N 35 108.650 108.650 108.294 0.356 17919 110755 1 270 . 1 1 35 35 GLY C C 35 173.960 173.960 174.095 -0.135 17919 110756 1 270 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.505 0.575 17919 110757 1 270 . 1 1 35 35 GLY H H 35 8.530 8.530 8.207 0.323 17919 110758 1 270 . 1 1 36 36 ILE N N 36 119.880 119.880 122.777 -2.897 17919 110759 1 270 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.425 0.020 17919 110760 1 270 . 1 1 36 36 ILE C C 36 173.590 173.590 174.198 -0.608 17919 110761 1 270 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.905 -0.155 17919 110762 1 270 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.583 1.997 17919 110763 1 270 . 1 1 36 36 ILE H H 36 6.150 6.150 7.741 -1.591 17919 110764 1 270 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.849 -0.215 17919 110765 1 270 . 1 1 37 37 PRO C C 37 176.940 176.940 176.102 0.838 17919 110766 1 270 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.534 0.126 17919 110767 1 270 . 1 1 37 37 PRO CB C 37 31.850 31.850 30.765 1.085 17919 110768 1 270 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.238 -0.121 17919 110769 1 270 . 1 1 38 38 PRO C C 38 178.320 178.320 178.793 -0.473 17919 110770 1 270 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.866 0.394 17919 110771 1 270 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.810 1.080 17919 110772 1 270 . 1 1 39 39 ASP N N 39 113.380 113.380 116.656 -3.276 17919 110773 1 270 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.455 -0.026 17919 110774 1 270 . 1 1 39 39 ASP C C 39 177.090 177.090 177.277 -0.187 17919 110775 1 270 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.210 -0.570 17919 110776 1 270 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.577 -1.037 17919 110777 1 270 . 1 1 39 39 ASP H H 39 8.550 8.550 8.749 -0.199 17919 110778 1 270 . 1 1 40 40 GLN N N 40 116.780 116.780 116.507 0.273 17919 110779 1 270 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.422 0.042 17919 110780 1 270 . 1 1 40 40 GLN C C 40 175.380 175.380 175.192 0.188 17919 110781 1 270 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.636 0.004 17919 110782 1 270 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.661 0.479 17919 110783 1 270 . 1 1 40 40 GLN H H 40 7.820 7.820 7.639 0.181 17919 110784 1 270 . 1 1 41 41 GLN N N 41 117.720 117.720 119.119 -1.399 17919 110785 1 270 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.356 -0.112 17919 110786 1 270 . 1 1 41 41 GLN C C 41 176.300 176.300 174.580 1.720 17919 110787 1 270 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.726 0.744 17919 110788 1 270 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.934 1.716 17919 110789 1 270 . 1 1 41 41 GLN H H 41 7.480 7.480 7.308 0.172 17919 110790 1 270 . 1 1 42 42 ARG N N 42 122.680 122.680 125.513 -2.833 17919 110791 1 270 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.645 -0.145 17919 110792 1 270 . 1 1 42 42 ARG C C 42 174.050 174.050 174.063 -0.013 17919 110793 1 270 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.821 0.229 17919 110794 1 270 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.582 -0.832 17919 110795 1 270 . 1 1 42 42 ARG H H 42 8.530 8.530 8.100 0.430 17919 110796 1 270 . 1 1 43 43 LEU N N 43 124.040 124.040 127.322 -3.282 17919 110797 1 270 . 1 1 43 43 LEU C C 43 175.290 175.290 175.854 -0.564 17919 110798 1 270 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.714 -0.734 17919 110799 1 270 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.872 1.918 17919 110800 1 270 . 1 1 43 43 LEU H H 43 8.820 8.820 8.927 -0.107 17919 110801 1 270 . 1 1 44 44 ILE N N 44 121.920 121.920 118.504 3.416 17919 110802 1 270 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.076 -0.084 17919 110803 1 270 . 1 1 44 44 ILE C C 44 176.060 176.060 173.587 2.473 17919 110804 1 270 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.492 -0.512 17919 110805 1 270 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.306 0.113 17919 110806 1 270 . 1 1 44 44 ILE H H 44 9.030 9.030 8.824 0.206 17919 110807 1 270 . 1 1 45 45 PHE N N 45 125.390 125.390 127.619 -2.229 17919 110808 1 270 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.129 -0.084 17919 110809 1 270 . 1 1 45 45 PHE C C 45 174.470 174.470 175.217 -0.747 17919 110810 1 270 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.203 0.817 17919 110811 1 270 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.501 0.259 17919 110812 1 270 . 1 1 45 45 PHE H H 45 8.830 8.830 9.160 -0.330 17919 110813 1 270 . 1 1 46 46 ALA N N 46 132.200 132.200 129.353 2.847 17919 110814 1 270 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.713 -0.023 17919 110815 1 270 . 1 1 46 46 ALA C C 46 177.290 177.290 177.675 -0.385 17919 110816 1 270 . 1 1 46 46 ALA CA C 46 52.540 52.540 53.036 -0.496 17919 110817 1 270 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.564 0.006 17919 110818 1 270 . 1 1 46 46 ALA H H 46 8.810 8.810 8.442 0.368 17919 110819 1 270 . 1 1 47 47 GLY N N 47 102.340 102.340 104.218 -1.878 17919 110820 1 270 . 1 1 47 47 GLY C C 47 173.810 173.810 174.458 -0.648 17919 110821 1 270 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.310 0.040 17919 110822 1 270 . 1 1 47 47 GLY H H 47 8.130 8.130 8.493 -0.363 17919 110823 1 270 . 1 1 48 48 LYS N N 48 121.570 121.570 121.493 0.077 17919 110824 1 270 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.648 -0.026 17919 110825 1 270 . 1 1 48 48 LYS C C 48 174.700 174.700 175.634 -0.934 17919 110826 1 270 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.914 -0.364 17919 110827 1 270 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.420 0.110 17919 110828 1 270 . 1 1 48 48 LYS H H 48 7.980 7.980 8.045 -0.065 17919 110829 1 270 . 1 1 49 49 GLN N N 49 122.410 122.410 123.071 -0.661 17919 110830 1 270 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.429 0.131 17919 110831 1 270 . 1 1 49 49 GLN C C 49 175.670 175.670 175.934 -0.264 17919 110832 1 270 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.472 -0.732 17919 110833 1 270 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.373 -0.374 17919 110834 1 270 . 1 1 49 49 GLN H H 49 8.600 8.600 8.600 -0.000 17919 110835 1 270 . 1 1 50 50 LEU N N 50 125.520 125.520 127.218 -1.698 17919 110836 1 270 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.180 -0.090 17919 110837 1 270 . 1 1 50 50 LEU C C 50 176.660 176.660 176.055 0.605 17919 110838 1 270 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.250 -0.010 17919 110839 1 270 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.241 -0.671 17919 110840 1 270 . 1 1 50 50 LEU H H 50 8.530 8.530 8.830 -0.300 17919 110841 1 270 . 1 1 51 51 GLU N N 51 122.940 122.940 123.227 -0.287 17919 110842 1 270 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.595 -0.107 17919 110843 1 270 . 1 1 51 51 GLU C C 51 175.870 175.870 176.774 -0.904 17919 110844 1 270 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.211 0.749 17919 110845 1 270 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.580 -1.010 17919 110846 1 270 . 1 1 51 51 GLU H H 51 8.400 8.400 8.249 0.151 17919 110847 1 270 . 1 1 52 52 ASP N N 52 120.030 120.030 124.095 -4.065 17919 110848 1 270 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.399 -0.040 17919 110849 1 270 . 1 1 52 52 ASP C C 52 177.330 177.330 178.083 -0.753 17919 110850 1 270 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.582 -0.622 17919 110851 1 270 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.922 -0.072 17919 110852 1 270 . 1 1 52 52 ASP H H 52 8.160 8.160 8.844 -0.684 17919 110853 1 270 . 1 1 53 53 GLY N N 53 106.660 106.660 107.494 -0.834 17919 110854 1 270 . 1 1 53 53 GLY C C 53 174.870 174.870 174.698 0.172 17919 110855 1 270 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.508 -0.338 17919 110856 1 270 . 1 1 53 53 GLY H H 53 9.390 9.390 8.585 0.805 17919 110857 1 270 . 1 1 54 54 ARG N N 54 119.050 119.050 121.478 -2.428 17919 110858 1 270 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.303 0.392 17919 110859 1 270 . 1 1 54 54 ARG C C 54 175.350 175.350 175.892 -0.542 17919 110860 1 270 . 1 1 54 54 ARG CA C 54 54.390 54.390 56.305 -1.915 17919 110861 1 270 . 1 1 54 54 ARG CB C 54 32.650 32.650 31.025 1.625 17919 110862 1 270 . 1 1 54 54 ARG H H 54 7.460 7.460 7.586 -0.126 17919 110863 1 270 . 1 1 55 55 THR N N 55 108.400 108.400 111.861 -3.461 17919 110864 1 270 . 1 1 55 55 THR HA H 55 5.240 5.240 5.079 0.161 17919 110865 1 270 . 1 1 55 55 THR C C 55 176.560 176.560 176.194 0.366 17919 110866 1 270 . 1 1 55 55 THR CA C 55 59.690 59.690 59.864 -0.174 17919 110867 1 270 . 1 1 55 55 THR CB C 55 72.260 72.260 70.981 1.279 17919 110868 1 270 . 1 1 55 55 THR H H 55 8.730 8.730 8.974 -0.244 17919 110869 1 270 . 1 1 56 56 LEU N N 56 117.920 117.920 120.977 -3.057 17919 110870 1 270 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.961 0.099 17919 110871 1 270 . 1 1 56 56 LEU C C 56 180.810 180.810 179.024 1.786 17919 110872 1 270 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.502 0.208 17919 110873 1 270 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.361 -0.991 17919 110874 1 270 . 1 1 56 56 LEU H H 56 8.140 8.140 8.170 -0.030 17919 110875 1 270 . 1 1 57 57 SER N N 57 113.330 113.330 114.911 -1.581 17919 110876 1 270 . 1 1 57 57 SER HA H 57 4.370 4.370 4.129 0.241 17919 110877 1 270 . 1 1 57 57 SER C C 57 178.310 178.310 176.233 2.077 17919 110878 1 270 . 1 1 57 57 SER CA C 57 61.080 61.080 62.333 -1.253 17919 110879 1 270 . 1 1 57 57 SER CB C 57 62.530 62.530 62.737 -0.207 17919 110880 1 270 . 1 1 57 57 SER H H 57 8.470 8.470 8.487 -0.017 17919 110881 1 270 . 1 1 58 58 ASP N N 58 124.190 124.190 121.669 2.521 17919 110882 1 270 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.394 -0.098 17919 110883 1 270 . 1 1 58 58 ASP C C 58 177.400 177.400 177.890 -0.490 17919 110884 1 270 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.401 0.779 17919 110885 1 270 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.412 -0.312 17919 110886 1 270 . 1 1 58 58 ASP H H 58 7.930 7.930 7.647 0.283 17919 110887 1 270 . 1 1 59 59 TYR N N 59 115.510 115.510 116.857 -1.347 17919 110888 1 270 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.406 0.264 17919 110889 1 270 . 1 1 59 59 TYR C C 59 174.700 174.700 174.871 -0.171 17919 110890 1 270 . 1 1 59 59 TYR CA C 59 58.250 58.250 58.086 0.165 17919 110891 1 270 . 1 1 59 59 TYR CB C 59 40.070 40.070 37.911 2.159 17919 110892 1 270 . 1 1 59 59 TYR H H 59 7.250 7.250 7.337 -0.087 17919 110893 1 270 . 1 1 60 60 ASN N N 60 115.900 115.900 114.350 1.550 17919 110894 1 270 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.410 -0.055 17919 110895 1 270 . 1 1 60 60 ASN C C 60 174.340 174.340 174.607 -0.267 17919 110896 1 270 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.085 0.035 17919 110897 1 270 . 1 1 60 60 ASN CB C 60 37.410 37.410 36.740 0.670 17919 110898 1 270 . 1 1 60 60 ASN H H 60 8.150 8.150 7.642 0.508 17919 110899 1 270 . 1 1 61 61 ILE N N 61 118.600 118.600 119.591 -0.991 17919 110900 1 270 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.850 -0.457 17919 110901 1 270 . 1 1 61 61 ILE C C 61 174.610 174.610 175.443 -0.833 17919 110902 1 270 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.844 0.576 17919 110903 1 270 . 1 1 61 61 ILE CB C 61 36.740 36.740 38.228 -1.488 17919 110904 1 270 . 1 1 61 61 ILE H H 61 7.250 7.250 8.005 -0.755 17919 110905 1 270 . 1 1 62 62 GLN N N 62 124.740 124.740 125.707 -0.967 17919 110906 1 270 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.775 -0.269 17919 110907 1 270 . 1 1 62 62 GLN C C 62 175.970 175.970 175.492 0.478 17919 110908 1 270 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.261 0.399 17919 110909 1 270 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.513 0.137 17919 110910 1 270 . 1 1 62 62 GLN H H 62 7.610 7.610 7.932 -0.322 17919 110911 1 270 . 1 1 63 63 LYS N N 63 120.300 120.300 121.004 -0.704 17919 110912 1 270 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.117 -0.116 17919 110913 1 270 . 1 1 63 63 LYS C C 63 175.810 175.810 176.676 -0.866 17919 110914 1 270 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.879 -0.089 17919 110915 1 270 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.828 0.822 17919 110916 1 270 . 1 1 63 63 LYS H H 63 8.490 8.490 8.461 0.029 17919 110917 1 270 . 1 1 64 64 GLU N N 64 113.950 113.950 119.599 -5.649 17919 110918 1 270 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.517 -0.052 17919 110919 1 270 . 1 1 64 64 GLU C C 64 175.250 175.250 176.218 -0.968 17919 110920 1 270 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.816 0.074 17919 110921 1 270 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.546 -2.646 17919 110922 1 270 . 1 1 64 64 GLU H H 64 9.280 9.280 8.824 0.456 17919 110923 1 270 . 1 1 65 65 SER N N 65 114.730 114.730 115.316 -0.586 17919 110924 1 270 . 1 1 65 65 SER HA H 65 4.640 4.640 4.475 0.165 17919 110925 1 270 . 1 1 65 65 SER C C 65 172.160 172.160 174.168 -2.008 17919 110926 1 270 . 1 1 65 65 SER CA C 65 60.890 60.890 60.305 0.585 17919 110927 1 270 . 1 1 65 65 SER CB C 65 64.910 64.910 64.343 0.567 17919 110928 1 270 . 1 1 65 65 SER H H 65 7.670 7.670 7.312 0.358 17919 110929 1 270 . 1 1 66 66 THR N N 66 117.110 117.110 120.589 -3.479 17919 110930 1 270 . 1 1 66 66 THR HA H 66 5.270 5.270 5.353 -0.083 17919 110931 1 270 . 1 1 66 66 THR C C 66 173.950 173.950 173.989 -0.039 17919 110932 1 270 . 1 1 66 66 THR CA C 66 62.340 62.340 61.408 0.932 17919 110933 1 270 . 1 1 66 66 THR CB C 66 70.080 70.080 70.585 -0.505 17919 110934 1 270 . 1 1 66 66 THR H H 66 8.730 8.730 8.592 0.138 17919 110935 1 270 . 1 1 67 67 LEU N N 67 127.110 127.110 127.636 -0.526 17919 110936 1 270 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.781 0.279 17919 110937 1 270 . 1 1 67 67 LEU C C 67 175.770 175.770 175.208 0.562 17919 110938 1 270 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.919 -0.019 17919 110939 1 270 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.523 -0.263 17919 110940 1 270 . 1 1 67 67 LEU H H 67 9.410 9.410 9.055 0.355 17919 110941 1 270 . 1 1 68 68 HIS N N 68 118.380 118.380 120.174 -1.794 17919 110942 1 270 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.298 -0.058 17919 110943 1 270 . 1 1 68 68 HIS C C 68 173.150 173.150 174.416 -1.266 17919 110944 1 270 . 1 1 68 68 HIS CA C 68 55.000 55.000 55.111 -0.111 17919 110945 1 270 . 1 1 68 68 HIS CB C 68 30.530 30.530 31.542 -1.012 17919 110946 1 270 . 1 1 68 68 HIS H H 68 9.230 9.230 8.727 0.503 17919 110947 1 270 . 1 1 69 69 LEU N N 69 124.460 124.460 126.395 -1.935 17919 110948 1 270 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.836 0.354 17919 110949 1 270 . 1 1 69 69 LEU C C 69 175.270 175.270 174.598 0.672 17919 110950 1 270 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.368 -0.478 17919 110951 1 270 . 1 1 69 69 LEU CB C 69 44.380 44.380 43.743 0.637 17919 110952 1 270 . 1 1 69 69 LEU H H 69 8.340 8.340 8.995 -0.655 17919 110953 1 270 . 1 1 70 70 VAL N N 70 126.940 126.940 126.286 0.654 17919 110954 1 270 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.428 -0.078 17919 110955 1 270 . 1 1 70 70 VAL C C 70 174.000 174.000 174.680 -0.680 17919 110956 1 270 . 1 1 70 70 VAL CA C 70 60.800 60.800 61.159 -0.359 17919 110957 1 270 . 1 1 70 70 VAL CB C 70 34.910 34.910 34.457 0.453 17919 110958 1 270 . 1 1 70 70 VAL H H 70 9.200 9.200 9.084 0.116 17919 110959 1 270 . 1 1 71 71 LEU N N 71 123.130 123.130 124.979 -1.849 17919 110960 1 270 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.698 0.362 17919 110961 1 270 . 1 1 71 71 LEU C C 71 177.830 177.830 176.774 1.056 17919 110962 1 270 . 1 1 71 71 LEU CA C 71 53.940 53.940 54.088 -0.148 17919 110963 1 270 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.625 -0.775 17919 110964 1 270 . 1 1 71 71 LEU H H 71 8.120 8.120 8.407 -0.287 17919 110965 1 270 . 1 1 72 72 ARG N N 72 123.490 123.490 119.556 3.934 17919 110966 1 270 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.661 -0.360 17919 110967 1 270 . 1 1 72 72 ARG C C 72 175.350 175.350 175.469 -0.119 17919 110968 1 270 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.158 0.452 17919 110969 1 270 . 1 1 72 72 ARG CB C 72 31.350 31.350 31.956 -0.606 17919 110970 1 270 . 1 1 72 72 ARG H H 72 8.580 8.580 8.513 0.067 17919 110971 1 271 . 1 1 2 2 GLN N N 2 123.220 123.220 120.433 2.787 17919 110972 1 271 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.384 -0.135 17919 110973 1 271 . 1 1 2 2 GLN C C 2 175.920 175.920 175.062 0.858 17919 110974 1 271 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.602 0.478 17919 110975 1 271 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.130 0.630 17919 110976 1 271 . 1 1 2 2 GLN H H 2 8.900 8.900 8.611 0.289 17919 110977 1 271 . 1 1 3 3 ILE N N 3 115.340 115.340 113.904 1.436 17919 110978 1 271 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.387 -0.174 17919 110979 1 271 . 1 1 3 3 ILE C C 3 172.450 172.450 173.675 -1.225 17919 110980 1 271 . 1 1 3 3 ILE CA C 3 59.570 59.570 58.679 0.890 17919 110981 1 271 . 1 1 3 3 ILE CB C 3 42.210 42.210 42.152 0.058 17919 110982 1 271 . 1 1 3 3 ILE H H 3 8.320 8.320 8.437 -0.117 17919 110983 1 271 . 1 1 4 4 PHE N N 4 118.110 118.110 118.888 -0.778 17919 110984 1 271 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.201 0.429 17919 110985 1 271 . 1 1 4 4 PHE C C 4 175.320 175.320 174.682 0.638 17919 110986 1 271 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.806 -0.596 17919 110987 1 271 . 1 1 4 4 PHE CB C 4 41.480 41.480 40.505 0.975 17919 110988 1 271 . 1 1 4 4 PHE H H 4 8.610 8.610 8.585 0.025 17919 110989 1 271 . 1 1 5 5 VAL N N 5 121.000 121.000 124.893 -3.893 17919 110990 1 271 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.451 0.274 17919 110991 1 271 . 1 1 5 5 VAL C C 5 174.870 174.870 174.302 0.568 17919 110992 1 271 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.921 -1.301 17919 110993 1 271 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.059 0.170 17919 110994 1 271 . 1 1 5 5 VAL H H 5 9.300 9.300 9.272 0.028 17919 110995 1 271 . 1 1 6 6 LYS N N 6 127.520 127.520 128.188 -0.668 17919 110996 1 271 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.395 -0.028 17919 110997 1 271 . 1 1 6 6 LYS C C 6 177.140 177.140 176.075 1.065 17919 110998 1 271 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.075 0.445 17919 110999 1 271 . 1 1 6 6 LYS CB C 6 35.050 35.050 36.285 -1.235 17919 111000 1 271 . 1 1 6 6 LYS H H 6 8.820 8.820 9.405 -0.585 17919 111001 1 271 . 1 1 7 7 THR N N 7 115.400 115.400 117.586 -2.186 17919 111002 1 271 . 1 1 7 7 THR HA H 7 4.970 4.970 4.728 0.242 17919 111003 1 271 . 1 1 7 7 THR C C 7 176.910 176.910 176.413 0.497 17919 111004 1 271 . 1 1 7 7 THR CA C 7 60.470 60.470 60.971 -0.501 17919 111005 1 271 . 1 1 7 7 THR CB C 7 70.630 70.630 70.672 -0.042 17919 111006 1 271 . 1 1 7 7 THR H H 7 8.730 8.730 8.739 -0.009 17919 111007 1 271 . 1 1 8 8 LEU N N 8 121.330 121.330 123.957 -2.627 17919 111008 1 271 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.249 0.061 17919 111009 1 271 . 1 1 8 8 LEU C C 8 178.800 178.800 178.009 0.791 17919 111010 1 271 . 1 1 8 8 LEU CA C 8 57.580 57.580 58.046 -0.466 17919 111011 1 271 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.013 -0.043 17919 111012 1 271 . 1 1 8 8 LEU H H 8 9.100 9.100 9.075 0.025 17919 111013 1 271 . 1 1 9 9 THR N N 9 105.590 105.590 108.269 -2.679 17919 111014 1 271 . 1 1 9 9 THR HA H 9 4.428 4.428 4.307 0.121 17919 111015 1 271 . 1 1 9 9 THR C C 9 175.520 175.520 175.605 -0.085 17919 111016 1 271 . 1 1 9 9 THR CA C 9 61.400 61.400 62.119 -0.719 17919 111017 1 271 . 1 1 9 9 THR CB C 9 69.140 69.140 69.391 -0.251 17919 111018 1 271 . 1 1 9 9 THR H H 9 7.630 7.630 7.648 -0.018 17919 111019 1 271 . 1 1 10 10 GLY N N 10 108.890 108.890 112.024 -3.134 17919 111020 1 271 . 1 1 10 10 GLY C C 10 174.070 174.070 173.605 0.465 17919 111021 1 271 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.924 0.536 17919 111022 1 271 . 1 1 10 10 GLY H H 10 7.810 7.810 8.072 -0.262 17919 111023 1 271 . 1 1 11 11 LYS N N 11 121.600 121.600 121.906 -0.306 17919 111024 1 271 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.465 -0.104 17919 111025 1 271 . 1 1 11 11 LYS C C 11 175.940 175.940 175.061 0.879 17919 111026 1 271 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.305 -0.025 17919 111027 1 271 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.835 -0.635 17919 111028 1 271 . 1 1 11 11 LYS H H 11 7.280 7.280 7.995 -0.715 17919 111029 1 271 . 1 1 12 12 THR N N 12 120.440 120.440 119.981 0.459 17919 111030 1 271 . 1 1 12 12 THR HA H 12 5.046 5.046 5.332 -0.286 17919 111031 1 271 . 1 1 12 12 THR C C 12 174.320 174.320 174.544 -0.224 17919 111032 1 271 . 1 1 12 12 THR CA C 12 62.390 62.390 61.325 1.065 17919 111033 1 271 . 1 1 12 12 THR CB C 12 69.910 69.910 70.284 -0.374 17919 111034 1 271 . 1 1 12 12 THR H H 12 8.650 8.650 8.171 0.479 17919 111035 1 271 . 1 1 13 13 ILE N N 13 127.110 127.110 123.178 3.932 17919 111036 1 271 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.752 -0.208 17919 111037 1 271 . 1 1 13 13 ILE C C 13 175.220 175.220 174.661 0.559 17919 111038 1 271 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.647 0.333 17919 111039 1 271 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.548 0.402 17919 111040 1 271 . 1 1 13 13 ILE H H 13 9.450 9.450 8.964 0.486 17919 111041 1 271 . 1 1 14 14 THR N N 14 121.520 121.520 122.991 -1.471 17919 111042 1 271 . 1 1 14 14 THR HA H 14 4.964 4.964 5.322 -0.358 17919 111043 1 271 . 1 1 14 14 THR C C 14 173.790 173.790 174.159 -0.369 17919 111044 1 271 . 1 1 14 14 THR CA C 14 61.940 61.940 62.170 -0.230 17919 111045 1 271 . 1 1 14 14 THR CB C 14 69.650 69.650 69.860 -0.210 17919 111046 1 271 . 1 1 14 14 THR H H 14 8.710 8.710 8.446 0.264 17919 111047 1 271 . 1 1 15 15 LEU N N 15 124.800 124.800 127.518 -2.718 17919 111048 1 271 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.678 0.102 17919 111049 1 271 . 1 1 15 15 LEU C C 15 174.670 174.670 175.220 -0.550 17919 111050 1 271 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.841 -1.011 17919 111051 1 271 . 1 1 15 15 LEU CB C 15 47.070 47.070 46.336 0.734 17919 111052 1 271 . 1 1 15 15 LEU H H 15 8.710 8.710 8.676 0.034 17919 111053 1 271 . 1 1 16 16 GLU N N 16 122.160 122.160 123.728 -1.568 17919 111054 1 271 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.753 0.164 17919 111055 1 271 . 1 1 16 16 GLU C C 16 175.860 175.860 175.344 0.516 17919 111056 1 271 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.861 -1.041 17919 111057 1 271 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.625 -1.175 17919 111058 1 271 . 1 1 16 16 GLU H H 16 8.140 8.140 8.759 -0.619 17919 111059 1 271 . 1 1 17 17 VAL N N 17 117.210 117.210 118.756 -1.546 17919 111060 1 271 . 1 1 17 17 VAL HA H 17 4.714 4.714 5.011 -0.297 17919 111061 1 271 . 1 1 17 17 VAL C C 17 174.160 174.160 174.879 -0.719 17919 111062 1 271 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.785 -0.355 17919 111063 1 271 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.199 1.201 17919 111064 1 271 . 1 1 17 17 VAL H H 17 8.900 8.900 8.797 0.103 17919 111065 1 271 . 1 1 18 18 GLU N N 18 118.990 118.990 123.344 -4.354 17919 111066 1 271 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.747 0.332 17919 111067 1 271 . 1 1 18 18 GLU C C 18 176.160 176.160 175.373 0.787 17919 111068 1 271 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.956 -0.236 17919 111069 1 271 . 1 1 18 18 GLU CB C 18 30.310 30.310 29.952 0.358 17919 111070 1 271 . 1 1 18 18 GLU H H 18 8.640 8.640 8.526 0.114 17919 111071 1 271 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.295 -0.154 17919 111072 1 271 . 1 1 19 19 PRO C C 19 175.310 175.310 177.474 -2.164 17919 111073 1 271 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.428 0.042 17919 111074 1 271 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.939 0.011 17919 111075 1 271 . 1 1 20 20 SER N N 20 103.400 103.400 108.775 -5.375 17919 111076 1 271 . 1 1 20 20 SER HA H 20 4.370 4.370 4.367 0.003 17919 111077 1 271 . 1 1 20 20 SER C C 20 174.660 174.660 174.559 0.101 17919 111078 1 271 . 1 1 20 20 SER CA C 20 57.400 57.400 58.468 -1.068 17919 111079 1 271 . 1 1 20 20 SER CB C 20 63.370 63.370 63.145 0.225 17919 111080 1 271 . 1 1 20 20 SER H H 20 7.040 7.040 7.928 -0.888 17919 111081 1 271 . 1 1 21 21 ASP N N 21 123.480 123.480 125.097 -1.617 17919 111082 1 271 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.651 0.044 17919 111083 1 271 . 1 1 21 21 ASP C C 21 176.360 176.360 176.384 -0.024 17919 111084 1 271 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.412 0.288 17919 111085 1 271 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.345 -0.545 17919 111086 1 271 . 1 1 21 21 ASP H H 21 8.030 8.030 7.758 0.272 17919 111087 1 271 . 1 1 22 22 THR N N 22 108.800 108.800 114.550 -5.750 17919 111088 1 271 . 1 1 22 22 THR HA H 22 4.920 4.920 4.854 0.066 17919 111089 1 271 . 1 1 22 22 THR C C 22 176.750 176.750 176.024 0.726 17919 111090 1 271 . 1 1 22 22 THR CA C 22 59.690 59.690 61.852 -2.162 17919 111091 1 271 . 1 1 22 22 THR CB C 22 71.200 71.200 70.793 0.407 17919 111092 1 271 . 1 1 22 22 THR H H 22 7.900 7.900 8.164 -0.264 17919 111093 1 271 . 1 1 23 23 ILE N N 23 121.190 121.190 122.355 -1.165 17919 111094 1 271 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.778 -0.121 17919 111095 1 271 . 1 1 23 23 ILE C C 23 179.040 179.040 177.825 1.215 17919 111096 1 271 . 1 1 23 23 ILE CA C 23 62.260 62.260 61.902 0.358 17919 111097 1 271 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.303 -1.954 17919 111098 1 271 . 1 1 23 23 ILE H H 23 8.560 8.560 8.664 -0.104 17919 111099 1 271 . 1 1 24 24 GLU N N 24 120.830 120.830 121.049 -0.219 17919 111100 1 271 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.820 0.097 17919 111101 1 271 . 1 1 24 24 GLU C C 24 178.640 178.640 178.694 -0.054 17919 111102 1 271 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.044 0.176 17919 111103 1 271 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.425 -1.145 17919 111104 1 271 . 1 1 24 24 GLU H H 24 9.760 9.760 8.432 1.328 17919 111105 1 271 . 1 1 25 25 ASN N N 25 120.570 120.570 117.543 3.027 17919 111106 1 271 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.555 -0.030 17919 111107 1 271 . 1 1 25 25 ASN C C 25 178.380 178.380 177.866 0.514 17919 111108 1 271 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.984 0.076 17919 111109 1 271 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.860 -0.410 17919 111110 1 271 . 1 1 25 25 ASN H H 25 7.920 7.920 7.528 0.392 17919 111111 1 271 . 1 1 26 26 VAL N N 26 121.710 121.710 120.415 1.295 17919 111112 1 271 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.603 -0.206 17919 111113 1 271 . 1 1 26 26 VAL C C 26 177.950 177.950 177.737 0.213 17919 111114 1 271 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.597 1.062 17919 111115 1 271 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.361 -0.521 17919 111116 1 271 . 1 1 26 26 VAL H H 26 8.070 8.070 8.076 -0.006 17919 111117 1 271 . 1 1 27 27 LYS N N 27 118.860 118.860 119.754 -0.894 17919 111118 1 271 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.297 0.283 17919 111119 1 271 . 1 1 27 27 LYS C C 27 180.550 180.550 178.850 1.700 17919 111120 1 271 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.157 0.093 17919 111121 1 271 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.227 1.504 17919 111122 1 271 . 1 1 27 27 LYS H H 27 8.560 8.560 8.031 0.529 17919 111123 1 271 . 1 1 28 28 ALA N N 28 123.440 123.440 123.267 0.173 17919 111124 1 271 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.116 0.044 17919 111125 1 271 . 1 1 28 28 ALA C C 28 180.300 180.300 179.242 1.058 17919 111126 1 271 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.051 0.319 17919 111127 1 271 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.476 -0.766 17919 111128 1 271 . 1 1 28 28 ALA H H 28 8.060 8.060 8.224 -0.164 17919 111129 1 271 . 1 1 29 29 LYS N N 29 119.940 119.940 118.889 1.051 17919 111130 1 271 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.041 0.166 17919 111131 1 271 . 1 1 29 29 LYS C C 29 180.320 180.320 179.296 1.024 17919 111132 1 271 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.175 0.476 17919 111133 1 271 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.440 0.851 17919 111134 1 271 . 1 1 29 29 LYS H H 29 7.850 7.850 7.919 -0.069 17919 111135 1 271 . 1 1 30 30 ILE N N 30 121.080 121.080 120.309 0.771 17919 111136 1 271 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.595 -0.088 17919 111137 1 271 . 1 1 30 30 ILE C C 30 178.310 178.310 177.268 1.042 17919 111138 1 271 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.296 0.854 17919 111139 1 271 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.822 -1.022 17919 111140 1 271 . 1 1 30 30 ILE H H 30 8.280 8.280 8.088 0.192 17919 111141 1 271 . 1 1 31 31 GLN N N 31 123.490 123.490 120.292 3.198 17919 111142 1 271 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.005 -0.176 17919 111143 1 271 . 1 1 31 31 GLN C C 31 178.890 178.890 178.255 0.635 17919 111144 1 271 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.118 0.882 17919 111145 1 271 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.479 -0.759 17919 111146 1 271 . 1 1 31 31 GLN H H 31 8.580 8.580 7.775 0.805 17919 111147 1 271 . 1 1 32 32 ASP N N 32 119.360 119.360 118.989 0.371 17919 111148 1 271 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.379 -0.025 17919 111149 1 271 . 1 1 32 32 ASP C C 32 177.250 177.250 177.782 -0.532 17919 111150 1 271 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.884 0.306 17919 111151 1 271 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.736 -0.156 17919 111152 1 271 . 1 1 32 32 ASP H H 32 8.010 8.010 7.901 0.109 17919 111153 1 271 . 1 1 33 33 LYS N N 33 115.130 115.130 117.874 -2.744 17919 111154 1 271 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.304 0.033 17919 111155 1 271 . 1 1 33 33 LYS C C 33 177.870 177.870 178.241 -0.371 17919 111156 1 271 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.923 0.126 17919 111157 1 271 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.042 1.128 17919 111158 1 271 . 1 1 33 33 LYS H H 33 7.430 7.430 7.632 -0.202 17919 111159 1 271 . 1 1 34 34 GLU N N 34 113.870 113.870 114.627 -0.757 17919 111160 1 271 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.473 0.152 17919 111161 1 271 . 1 1 34 34 GLU C C 34 177.840 177.840 177.720 0.120 17919 111162 1 271 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.771 -0.601 17919 111163 1 271 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.021 1.639 17919 111164 1 271 . 1 1 34 34 GLU H H 34 8.740 8.740 8.096 0.644 17919 111165 1 271 . 1 1 35 35 GLY N N 35 108.650 108.650 109.668 -1.018 17919 111166 1 271 . 1 1 35 35 GLY C C 35 173.960 173.960 174.224 -0.264 17919 111167 1 271 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.859 0.221 17919 111168 1 271 . 1 1 35 35 GLY H H 35 8.530 8.530 8.226 0.304 17919 111169 1 271 . 1 1 36 36 ILE N N 36 119.880 119.880 121.985 -2.105 17919 111170 1 271 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.353 0.092 17919 111171 1 271 . 1 1 36 36 ILE C C 36 173.590 173.590 174.469 -0.879 17919 111172 1 271 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.469 0.281 17919 111173 1 271 . 1 1 36 36 ILE CB C 36 40.580 40.580 39.327 1.253 17919 111174 1 271 . 1 1 36 36 ILE H H 36 6.150 6.150 7.568 -1.418 17919 111175 1 271 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.663 -0.029 17919 111176 1 271 . 1 1 37 37 PRO C C 37 176.940 176.940 176.058 0.882 17919 111177 1 271 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.212 0.449 17919 111178 1 271 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.004 0.846 17919 111179 1 271 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.096 0.021 17919 111180 1 271 . 1 1 38 38 PRO C C 38 178.320 178.320 178.643 -0.323 17919 111181 1 271 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.779 0.481 17919 111182 1 271 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.815 1.075 17919 111183 1 271 . 1 1 39 39 ASP N N 39 113.380 113.380 115.932 -2.552 17919 111184 1 271 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.378 0.052 17919 111185 1 271 . 1 1 39 39 ASP C C 39 177.090 177.090 177.355 -0.265 17919 111186 1 271 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.525 -0.885 17919 111187 1 271 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.387 -0.847 17919 111188 1 271 . 1 1 39 39 ASP H H 39 8.550 8.550 8.618 -0.068 17919 111189 1 271 . 1 1 40 40 GLN N N 40 116.780 116.780 116.409 0.371 17919 111190 1 271 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.397 0.067 17919 111191 1 271 . 1 1 40 40 GLN C C 40 175.380 175.380 175.687 -0.307 17919 111192 1 271 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.307 0.333 17919 111193 1 271 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.035 1.105 17919 111194 1 271 . 1 1 40 40 GLN H H 40 7.820 7.820 7.987 -0.167 17919 111195 1 271 . 1 1 41 41 GLN N N 41 117.720 117.720 119.565 -1.845 17919 111196 1 271 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.553 -0.309 17919 111197 1 271 . 1 1 41 41 GLN C C 41 176.300 176.300 174.854 1.446 17919 111198 1 271 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.779 0.691 17919 111199 1 271 . 1 1 41 41 GLN CB C 41 31.650 31.650 30.725 0.925 17919 111200 1 271 . 1 1 41 41 GLN H H 41 7.480 7.480 7.308 0.172 17919 111201 1 271 . 1 1 42 42 ARG N N 42 122.680 122.680 123.049 -0.369 17919 111202 1 271 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.647 -0.147 17919 111203 1 271 . 1 1 42 42 ARG C C 42 174.050 174.050 174.071 -0.021 17919 111204 1 271 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.173 -0.123 17919 111205 1 271 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.879 -2.129 17919 111206 1 271 . 1 1 42 42 ARG H H 42 8.530 8.530 8.598 -0.068 17919 111207 1 271 . 1 1 43 43 LEU N N 43 124.040 124.040 123.976 0.064 17919 111208 1 271 . 1 1 43 43 LEU C C 43 175.290 175.290 175.845 -0.555 17919 111209 1 271 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.468 -0.488 17919 111210 1 271 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.845 0.945 17919 111211 1 271 . 1 1 43 43 LEU H H 43 8.820 8.820 8.779 0.041 17919 111212 1 271 . 1 1 44 44 ILE N N 44 121.920 121.920 120.855 1.065 17919 111213 1 271 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.192 -0.200 17919 111214 1 271 . 1 1 44 44 ILE C C 44 176.060 176.060 174.429 1.631 17919 111215 1 271 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.183 -1.203 17919 111216 1 271 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.656 -0.236 17919 111217 1 271 . 1 1 44 44 ILE H H 44 9.030 9.030 8.652 0.378 17919 111218 1 271 . 1 1 45 45 PHE N N 45 125.390 125.390 125.890 -0.500 17919 111219 1 271 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.985 0.060 17919 111220 1 271 . 1 1 45 45 PHE C C 45 174.470 174.470 174.474 -0.004 17919 111221 1 271 . 1 1 45 45 PHE CA C 45 57.020 57.020 57.104 -0.084 17919 111222 1 271 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.346 0.414 17919 111223 1 271 . 1 1 45 45 PHE H H 45 8.830 8.830 8.854 -0.024 17919 111224 1 271 . 1 1 46 46 ALA N N 46 132.200 132.200 127.566 4.634 17919 111225 1 271 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.729 -0.039 17919 111226 1 271 . 1 1 46 46 ALA C C 46 177.290 177.290 177.726 -0.436 17919 111227 1 271 . 1 1 46 46 ALA CA C 46 52.540 52.540 53.019 -0.479 17919 111228 1 271 . 1 1 46 46 ALA CB C 46 16.570 16.570 17.056 -0.486 17919 111229 1 271 . 1 1 46 46 ALA H H 46 8.810 8.810 8.327 0.483 17919 111230 1 271 . 1 1 47 47 GLY N N 47 102.340 102.340 102.639 -0.299 17919 111231 1 271 . 1 1 47 47 GLY C C 47 173.810 173.810 174.130 -0.320 17919 111232 1 271 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.907 0.443 17919 111233 1 271 . 1 1 47 47 GLY H H 47 8.130 8.130 8.566 -0.436 17919 111234 1 271 . 1 1 48 48 LYS N N 48 121.570 121.570 119.801 1.769 17919 111235 1 271 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.714 -0.092 17919 111236 1 271 . 1 1 48 48 LYS C C 48 174.700 174.700 175.202 -0.502 17919 111237 1 271 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.531 0.019 17919 111238 1 271 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.620 -0.090 17919 111239 1 271 . 1 1 48 48 LYS H H 48 7.980 7.980 7.687 0.293 17919 111240 1 271 . 1 1 49 49 GLN N N 49 122.410 122.410 121.609 0.801 17919 111241 1 271 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.680 -0.120 17919 111242 1 271 . 1 1 49 49 GLN C C 49 175.670 175.670 176.012 -0.342 17919 111243 1 271 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.987 -0.247 17919 111244 1 271 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.427 -0.427 17919 111245 1 271 . 1 1 49 49 GLN H H 49 8.600 8.600 8.540 0.060 17919 111246 1 271 . 1 1 50 50 LEU N N 50 125.520 125.520 126.956 -1.436 17919 111247 1 271 . 1 1 50 50 LEU HA H 50 4.090 4.090 3.634 0.456 17919 111248 1 271 . 1 1 50 50 LEU C C 50 176.660 176.660 175.960 0.700 17919 111249 1 271 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.171 0.069 17919 111250 1 271 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.793 -0.223 17919 111251 1 271 . 1 1 50 50 LEU H H 50 8.530 8.530 8.403 0.127 17919 111252 1 271 . 1 1 51 51 GLU N N 51 122.940 122.940 123.592 -0.652 17919 111253 1 271 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.356 0.132 17919 111254 1 271 . 1 1 51 51 GLU C C 51 175.870 175.870 176.582 -0.712 17919 111255 1 271 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.172 0.788 17919 111256 1 271 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.728 -0.158 17919 111257 1 271 . 1 1 51 51 GLU H H 51 8.400 8.400 7.902 0.498 17919 111258 1 271 . 1 1 52 52 ASP N N 52 120.030 120.030 127.429 -7.399 17919 111259 1 271 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.299 0.060 17919 111260 1 271 . 1 1 52 52 ASP C C 52 177.330 177.330 177.463 -0.133 17919 111261 1 271 . 1 1 52 52 ASP CA C 52 56.960 56.960 58.148 -1.188 17919 111262 1 271 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.708 0.142 17919 111263 1 271 . 1 1 52 52 ASP H H 52 8.160 8.160 8.706 -0.546 17919 111264 1 271 . 1 1 53 53 GLY N N 53 106.660 106.660 105.366 1.294 17919 111265 1 271 . 1 1 53 53 GLY C C 53 174.870 174.870 174.251 0.619 17919 111266 1 271 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.846 0.323 17919 111267 1 271 . 1 1 53 53 GLY H H 53 9.390 9.390 8.471 0.919 17919 111268 1 271 . 1 1 54 54 ARG N N 54 119.050 119.050 120.695 -1.645 17919 111269 1 271 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.849 -0.154 17919 111270 1 271 . 1 1 54 54 ARG C C 54 175.350 175.350 175.535 -0.185 17919 111271 1 271 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.417 -0.027 17919 111272 1 271 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.571 -0.921 17919 111273 1 271 . 1 1 54 54 ARG H H 54 7.460 7.460 7.529 -0.069 17919 111274 1 271 . 1 1 55 55 THR N N 55 108.400 108.400 111.415 -3.015 17919 111275 1 271 . 1 1 55 55 THR HA H 55 5.240 5.240 4.999 0.241 17919 111276 1 271 . 1 1 55 55 THR C C 55 176.560 176.560 176.661 -0.101 17919 111277 1 271 . 1 1 55 55 THR CA C 55 59.690 59.690 60.112 -0.423 17919 111278 1 271 . 1 1 55 55 THR CB C 55 72.260 72.260 71.423 0.837 17919 111279 1 271 . 1 1 55 55 THR H H 55 8.730 8.730 9.390 -0.660 17919 111280 1 271 . 1 1 56 56 LEU N N 56 117.920 117.920 121.825 -3.905 17919 111281 1 271 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.837 0.223 17919 111282 1 271 . 1 1 56 56 LEU C C 56 180.810 180.810 179.053 1.757 17919 111283 1 271 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.542 0.168 17919 111284 1 271 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.256 -0.886 17919 111285 1 271 . 1 1 56 56 LEU H H 56 8.140 8.140 8.924 -0.784 17919 111286 1 271 . 1 1 57 57 SER N N 57 113.330 113.330 113.318 0.012 17919 111287 1 271 . 1 1 57 57 SER HA H 57 4.370 4.370 4.271 0.099 17919 111288 1 271 . 1 1 57 57 SER C C 57 178.310 178.310 176.857 1.453 17919 111289 1 271 . 1 1 57 57 SER CA C 57 61.080 61.080 61.394 -0.314 17919 111290 1 271 . 1 1 57 57 SER CB C 57 62.530 62.530 62.604 -0.074 17919 111291 1 271 . 1 1 57 57 SER H H 57 8.470 8.470 8.269 0.201 17919 111292 1 271 . 1 1 58 58 ASP N N 58 124.190 124.190 124.202 -0.012 17919 111293 1 271 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.365 -0.069 17919 111294 1 271 . 1 1 58 58 ASP C C 58 177.400 177.400 177.330 0.070 17919 111295 1 271 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.909 0.271 17919 111296 1 271 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.541 -0.441 17919 111297 1 271 . 1 1 58 58 ASP H H 58 7.930 7.930 7.817 0.113 17919 111298 1 271 . 1 1 59 59 TYR N N 59 115.510 115.510 117.460 -1.950 17919 111299 1 271 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.454 0.216 17919 111300 1 271 . 1 1 59 59 TYR C C 59 174.700 174.700 174.689 0.011 17919 111301 1 271 . 1 1 59 59 TYR CA C 59 58.250 58.250 59.104 -0.854 17919 111302 1 271 . 1 1 59 59 TYR CB C 59 40.070 40.070 39.219 0.851 17919 111303 1 271 . 1 1 59 59 TYR H H 59 7.250 7.250 7.882 -0.632 17919 111304 1 271 . 1 1 60 60 ASN N N 60 115.900 115.900 117.500 -1.600 17919 111305 1 271 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.507 -0.152 17919 111306 1 271 . 1 1 60 60 ASN C C 60 174.340 174.340 174.143 0.197 17919 111307 1 271 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.076 0.044 17919 111308 1 271 . 1 1 60 60 ASN CB C 60 37.410 37.410 36.940 0.470 17919 111309 1 271 . 1 1 60 60 ASN H H 60 8.150 8.150 8.079 0.071 17919 111310 1 271 . 1 1 61 61 ILE N N 61 118.600 118.600 121.675 -3.075 17919 111311 1 271 . 1 1 61 61 ILE HA H 61 3.393 3.393 4.402 -1.009 17919 111312 1 271 . 1 1 61 61 ILE C C 61 174.610 174.610 174.983 -0.373 17919 111313 1 271 . 1 1 61 61 ILE CA C 61 62.420 62.420 60.786 1.633 17919 111314 1 271 . 1 1 61 61 ILE CB C 61 36.740 36.740 40.201 -3.461 17919 111315 1 271 . 1 1 61 61 ILE H H 61 7.250 7.250 8.588 -1.338 17919 111316 1 271 . 1 1 62 62 GLN N N 62 124.740 124.740 124.025 0.715 17919 111317 1 271 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.800 -0.294 17919 111318 1 271 . 1 1 62 62 GLN C C 62 175.970 175.970 175.719 0.251 17919 111319 1 271 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.691 -0.031 17919 111320 1 271 . 1 1 62 62 GLN CB C 62 31.650 31.650 32.323 -0.673 17919 111321 1 271 . 1 1 62 62 GLN H H 62 7.610 7.610 8.357 -0.747 17919 111322 1 271 . 1 1 63 63 LYS N N 63 120.300 120.300 120.447 -0.147 17919 111323 1 271 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.063 -0.062 17919 111324 1 271 . 1 1 63 63 LYS C C 63 175.810 175.810 176.727 -0.917 17919 111325 1 271 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.595 0.195 17919 111326 1 271 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.002 0.648 17919 111327 1 271 . 1 1 63 63 LYS H H 63 8.490 8.490 8.548 -0.058 17919 111328 1 271 . 1 1 64 64 GLU N N 64 113.950 113.950 119.771 -5.821 17919 111329 1 271 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.685 -0.220 17919 111330 1 271 . 1 1 64 64 GLU C C 64 175.250 175.250 176.469 -1.219 17919 111331 1 271 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.866 0.024 17919 111332 1 271 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.504 -2.604 17919 111333 1 271 . 1 1 64 64 GLU H H 64 9.280 9.280 8.839 0.441 17919 111334 1 271 . 1 1 65 65 SER N N 65 114.730 114.730 116.324 -1.594 17919 111335 1 271 . 1 1 65 65 SER HA H 65 4.640 4.640 4.262 0.378 17919 111336 1 271 . 1 1 65 65 SER C C 65 172.160 172.160 173.703 -1.543 17919 111337 1 271 . 1 1 65 65 SER CA C 65 60.890 60.890 60.441 0.449 17919 111338 1 271 . 1 1 65 65 SER CB C 65 64.910 64.910 63.797 1.113 17919 111339 1 271 . 1 1 65 65 SER H H 65 7.670 7.670 7.420 0.250 17919 111340 1 271 . 1 1 66 66 THR N N 66 117.110 117.110 117.849 -0.739 17919 111341 1 271 . 1 1 66 66 THR HA H 66 5.270 5.270 5.233 0.037 17919 111342 1 271 . 1 1 66 66 THR C C 66 173.950 173.950 173.788 0.162 17919 111343 1 271 . 1 1 66 66 THR CA C 66 62.340 62.340 61.482 0.858 17919 111344 1 271 . 1 1 66 66 THR CB C 66 70.080 70.080 70.331 -0.251 17919 111345 1 271 . 1 1 66 66 THR H H 66 8.730 8.730 8.161 0.569 17919 111346 1 271 . 1 1 67 67 LEU N N 67 127.110 127.110 127.290 -0.180 17919 111347 1 271 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.632 0.428 17919 111348 1 271 . 1 1 67 67 LEU C C 67 175.770 175.770 175.468 0.302 17919 111349 1 271 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.597 0.303 17919 111350 1 271 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.005 0.255 17919 111351 1 271 . 1 1 67 67 LEU H H 67 9.410 9.410 8.842 0.568 17919 111352 1 271 . 1 1 68 68 HIS N N 68 118.380 118.380 122.592 -4.212 17919 111353 1 271 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.417 -0.177 17919 111354 1 271 . 1 1 68 68 HIS C C 68 173.150 173.150 173.624 -0.474 17919 111355 1 271 . 1 1 68 68 HIS CA C 68 55.000 55.000 53.822 1.178 17919 111356 1 271 . 1 1 68 68 HIS CB C 68 30.530 30.530 31.996 -1.466 17919 111357 1 271 . 1 1 68 68 HIS H H 68 9.230 9.230 8.929 0.301 17919 111358 1 271 . 1 1 69 69 LEU N N 69 124.460 124.460 130.438 -5.978 17919 111359 1 271 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.695 0.495 17919 111360 1 271 . 1 1 69 69 LEU C C 69 175.270 175.270 174.138 1.132 17919 111361 1 271 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.774 0.116 17919 111362 1 271 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.579 -0.199 17919 111363 1 271 . 1 1 69 69 LEU H H 69 8.340 8.340 8.600 -0.260 17919 111364 1 271 . 1 1 70 70 VAL N N 70 126.940 126.940 123.633 3.307 17919 111365 1 271 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.520 -0.170 17919 111366 1 271 . 1 1 70 70 VAL C C 70 174.000 174.000 173.372 0.628 17919 111367 1 271 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.799 1.001 17919 111368 1 271 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.324 -0.414 17919 111369 1 271 . 1 1 70 70 VAL H H 70 9.200 9.200 8.636 0.564 17919 111370 1 271 . 1 1 71 71 LEU N N 71 123.130 123.130 125.059 -1.929 17919 111371 1 271 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.164 -0.104 17919 111372 1 271 . 1 1 71 71 LEU C C 71 177.830 177.830 177.670 0.160 17919 111373 1 271 . 1 1 71 71 LEU CA C 71 53.940 53.940 52.855 1.085 17919 111374 1 271 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.851 -0.001 17919 111375 1 271 . 1 1 71 71 LEU H H 71 8.120 8.120 8.431 -0.311 17919 111376 1 271 . 1 1 72 72 ARG N N 72 123.490 123.490 124.156 -0.666 17919 111377 1 271 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.393 -0.092 17919 111378 1 271 . 1 1 72 72 ARG C C 72 175.350 175.350 176.123 -0.773 17919 111379 1 271 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.793 -0.183 17919 111380 1 271 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.885 0.465 17919 111381 1 271 . 1 1 72 72 ARG H H 72 8.580 8.580 8.583 -0.003 17919 111382 1 272 . 1 1 2 2 GLN N N 2 123.220 123.220 120.019 3.201 17919 111383 1 272 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.296 -0.047 17919 111384 1 272 . 1 1 2 2 GLN C C 2 175.920 175.920 175.632 0.288 17919 111385 1 272 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.484 0.596 17919 111386 1 272 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.029 0.731 17919 111387 1 272 . 1 1 2 2 GLN H H 2 8.900 8.900 8.391 0.509 17919 111388 1 272 . 1 1 3 3 ILE N N 3 115.340 115.340 115.983 -0.643 17919 111389 1 272 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.336 -0.123 17919 111390 1 272 . 1 1 3 3 ILE C C 3 172.450 172.450 173.169 -0.719 17919 111391 1 272 . 1 1 3 3 ILE CA C 3 59.570 59.570 58.865 0.705 17919 111392 1 272 . 1 1 3 3 ILE CB C 3 42.210 42.210 42.155 0.055 17919 111393 1 272 . 1 1 3 3 ILE H H 3 8.320 8.320 8.655 -0.335 17919 111394 1 272 . 1 1 4 4 PHE N N 4 118.110 118.110 118.702 -0.592 17919 111395 1 272 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.655 -0.025 17919 111396 1 272 . 1 1 4 4 PHE C C 4 175.320 175.320 175.162 0.158 17919 111397 1 272 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.670 -0.460 17919 111398 1 272 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.763 -0.283 17919 111399 1 272 . 1 1 4 4 PHE H H 4 8.610 8.610 7.926 0.684 17919 111400 1 272 . 1 1 5 5 VAL N N 5 121.000 121.000 123.106 -2.106 17919 111401 1 272 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.554 0.171 17919 111402 1 272 . 1 1 5 5 VAL C C 5 174.870 174.870 174.826 0.044 17919 111403 1 272 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.469 -0.849 17919 111404 1 272 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.458 0.772 17919 111405 1 272 . 1 1 5 5 VAL H H 5 9.300 9.300 9.344 -0.044 17919 111406 1 272 . 1 1 6 6 LYS N N 6 127.520 127.520 128.839 -1.319 17919 111407 1 272 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.139 0.228 17919 111408 1 272 . 1 1 6 6 LYS C C 6 177.140 177.140 176.506 0.634 17919 111409 1 272 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.660 -0.140 17919 111410 1 272 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.782 0.268 17919 111411 1 272 . 1 1 6 6 LYS H H 6 8.820 8.820 9.018 -0.198 17919 111412 1 272 . 1 1 7 7 THR N N 7 115.400 115.400 118.163 -2.763 17919 111413 1 272 . 1 1 7 7 THR HA H 7 4.970 4.970 4.443 0.527 17919 111414 1 272 . 1 1 7 7 THR C C 7 176.910 176.910 176.003 0.907 17919 111415 1 272 . 1 1 7 7 THR CA C 7 60.470 60.470 61.597 -1.127 17919 111416 1 272 . 1 1 7 7 THR CB C 7 70.630 70.630 70.209 0.421 17919 111417 1 272 . 1 1 7 7 THR H H 7 8.730 8.730 8.763 -0.033 17919 111418 1 272 . 1 1 8 8 LEU N N 8 121.330 121.330 122.455 -1.125 17919 111419 1 272 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.515 -0.205 17919 111420 1 272 . 1 1 8 8 LEU C C 8 178.800 178.800 177.820 0.980 17919 111421 1 272 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.240 0.340 17919 111422 1 272 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.146 -0.176 17919 111423 1 272 . 1 1 8 8 LEU H H 8 9.100 9.100 8.747 0.353 17919 111424 1 272 . 1 1 9 9 THR N N 9 105.590 105.590 110.363 -4.773 17919 111425 1 272 . 1 1 9 9 THR HA H 9 4.428 4.428 4.297 0.131 17919 111426 1 272 . 1 1 9 9 THR C C 9 175.520 175.520 175.731 -0.211 17919 111427 1 272 . 1 1 9 9 THR CA C 9 61.400 61.400 61.886 -0.486 17919 111428 1 272 . 1 1 9 9 THR CB C 9 69.140 69.140 69.105 0.035 17919 111429 1 272 . 1 1 9 9 THR H H 9 7.630 7.630 7.590 0.040 17919 111430 1 272 . 1 1 10 10 GLY N N 10 108.890 108.890 111.423 -2.533 17919 111431 1 272 . 1 1 10 10 GLY C C 10 174.070 174.070 173.963 0.107 17919 111432 1 272 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.322 0.138 17919 111433 1 272 . 1 1 10 10 GLY H H 10 7.810 7.810 8.172 -0.362 17919 111434 1 272 . 1 1 11 11 LYS N N 11 121.600 121.600 121.296 0.304 17919 111435 1 272 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.278 0.083 17919 111436 1 272 . 1 1 11 11 LYS C C 11 175.940 175.940 175.477 0.463 17919 111437 1 272 . 1 1 11 11 LYS CA C 11 56.280 56.280 57.236 -0.956 17919 111438 1 272 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.258 -0.058 17919 111439 1 272 . 1 1 11 11 LYS H H 11 7.280 7.280 7.610 -0.330 17919 111440 1 272 . 1 1 12 12 THR N N 12 120.440 120.440 119.356 1.084 17919 111441 1 272 . 1 1 12 12 THR HA H 12 5.046 5.046 5.165 -0.119 17919 111442 1 272 . 1 1 12 12 THR C C 12 174.320 174.320 174.292 0.028 17919 111443 1 272 . 1 1 12 12 THR CA C 12 62.390 62.390 61.861 0.529 17919 111444 1 272 . 1 1 12 12 THR CB C 12 69.910 69.910 69.866 0.044 17919 111445 1 272 . 1 1 12 12 THR H H 12 8.650 8.650 8.230 0.420 17919 111446 1 272 . 1 1 13 13 ILE N N 13 127.110 127.110 122.559 4.551 17919 111447 1 272 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.736 -0.192 17919 111448 1 272 . 1 1 13 13 ILE C C 13 175.220 175.220 174.479 0.741 17919 111449 1 272 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.329 0.651 17919 111450 1 272 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.467 -0.517 17919 111451 1 272 . 1 1 13 13 ILE H H 13 9.450 9.450 9.275 0.175 17919 111452 1 272 . 1 1 14 14 THR N N 14 121.520 121.520 122.798 -1.278 17919 111453 1 272 . 1 1 14 14 THR HA H 14 4.964 4.964 5.096 -0.132 17919 111454 1 272 . 1 1 14 14 THR C C 14 173.790 173.790 173.439 0.351 17919 111455 1 272 . 1 1 14 14 THR CA C 14 61.940 61.940 62.494 -0.554 17919 111456 1 272 . 1 1 14 14 THR CB C 14 69.650 69.650 69.706 -0.056 17919 111457 1 272 . 1 1 14 14 THR H H 14 8.710 8.710 8.670 0.040 17919 111458 1 272 . 1 1 15 15 LEU N N 15 124.800 124.800 126.245 -1.445 17919 111459 1 272 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.795 -0.015 17919 111460 1 272 . 1 1 15 15 LEU C C 15 174.670 174.670 174.741 -0.071 17919 111461 1 272 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.611 -0.781 17919 111462 1 272 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.662 1.408 17919 111463 1 272 . 1 1 15 15 LEU H H 15 8.710 8.710 9.182 -0.472 17919 111464 1 272 . 1 1 16 16 GLU N N 16 122.160 122.160 123.171 -1.011 17919 111465 1 272 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.339 -0.422 17919 111466 1 272 . 1 1 16 16 GLU C C 16 175.860 175.860 176.026 -0.166 17919 111467 1 272 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.287 -0.467 17919 111468 1 272 . 1 1 16 16 GLU CB C 16 29.450 29.450 29.898 -0.448 17919 111469 1 272 . 1 1 16 16 GLU H H 16 8.140 8.140 8.607 -0.467 17919 111470 1 272 . 1 1 17 17 VAL N N 17 117.210 117.210 118.856 -1.646 17919 111471 1 272 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.835 -0.121 17919 111472 1 272 . 1 1 17 17 VAL C C 17 174.160 174.160 174.510 -0.350 17919 111473 1 272 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.384 -0.954 17919 111474 1 272 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.530 0.870 17919 111475 1 272 . 1 1 17 17 VAL H H 17 8.900 8.900 8.616 0.284 17919 111476 1 272 . 1 1 18 18 GLU N N 18 118.990 118.990 120.640 -1.650 17919 111477 1 272 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.871 0.208 17919 111478 1 272 . 1 1 18 18 GLU C C 18 176.160 176.160 175.873 0.287 17919 111479 1 272 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.573 0.147 17919 111480 1 272 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.143 0.167 17919 111481 1 272 . 1 1 18 18 GLU H H 18 8.640 8.640 8.540 0.100 17919 111482 1 272 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.280 -0.139 17919 111483 1 272 . 1 1 19 19 PRO C C 19 175.310 175.310 177.874 -2.564 17919 111484 1 272 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.399 0.071 17919 111485 1 272 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.964 -0.014 17919 111486 1 272 . 1 1 20 20 SER N N 20 103.400 103.400 109.650 -6.250 17919 111487 1 272 . 1 1 20 20 SER HA H 20 4.370 4.370 4.281 0.089 17919 111488 1 272 . 1 1 20 20 SER C C 20 174.660 174.660 174.741 -0.081 17919 111489 1 272 . 1 1 20 20 SER CA C 20 57.400 57.400 58.538 -1.138 17919 111490 1 272 . 1 1 20 20 SER CB C 20 63.370 63.370 62.614 0.756 17919 111491 1 272 . 1 1 20 20 SER H H 20 7.040 7.040 7.940 -0.900 17919 111492 1 272 . 1 1 21 21 ASP N N 21 123.480 123.480 124.290 -0.810 17919 111493 1 272 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.769 -0.074 17919 111494 1 272 . 1 1 21 21 ASP C C 21 176.360 176.360 176.207 0.153 17919 111495 1 272 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.716 0.984 17919 111496 1 272 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.927 -1.127 17919 111497 1 272 . 1 1 21 21 ASP H H 21 8.030 8.030 8.051 -0.021 17919 111498 1 272 . 1 1 22 22 THR N N 22 108.800 108.800 113.375 -4.575 17919 111499 1 272 . 1 1 22 22 THR HA H 22 4.920 4.920 4.736 0.184 17919 111500 1 272 . 1 1 22 22 THR C C 22 176.750 176.750 176.474 0.276 17919 111501 1 272 . 1 1 22 22 THR CA C 22 59.690 59.690 61.257 -1.567 17919 111502 1 272 . 1 1 22 22 THR CB C 22 71.200 71.200 70.795 0.405 17919 111503 1 272 . 1 1 22 22 THR H H 22 7.900 7.900 8.153 -0.253 17919 111504 1 272 . 1 1 23 23 ILE N N 23 121.190 121.190 123.710 -2.520 17919 111505 1 272 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.659 -0.002 17919 111506 1 272 . 1 1 23 23 ILE C C 23 179.040 179.040 177.847 1.193 17919 111507 1 272 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.637 -1.377 17919 111508 1 272 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.408 -2.058 17919 111509 1 272 . 1 1 23 23 ILE H H 23 8.560 8.560 8.513 0.047 17919 111510 1 272 . 1 1 24 24 GLU N N 24 120.830 120.830 119.932 0.898 17919 111511 1 272 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.862 0.055 17919 111512 1 272 . 1 1 24 24 GLU C C 24 178.640 178.640 178.500 0.140 17919 111513 1 272 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.660 0.560 17919 111514 1 272 . 1 1 24 24 GLU CB C 24 28.280 28.280 28.787 -0.506 17919 111515 1 272 . 1 1 24 24 GLU H H 24 9.760 9.760 8.690 1.070 17919 111516 1 272 . 1 1 25 25 ASN N N 25 120.570 120.570 118.826 1.744 17919 111517 1 272 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.477 0.048 17919 111518 1 272 . 1 1 25 25 ASN C C 25 178.380 178.380 177.781 0.599 17919 111519 1 272 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.723 0.337 17919 111520 1 272 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.171 0.279 17919 111521 1 272 . 1 1 25 25 ASN H H 25 7.920 7.920 7.686 0.234 17919 111522 1 272 . 1 1 26 26 VAL N N 26 121.710 121.710 119.617 2.093 17919 111523 1 272 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.649 -0.252 17919 111524 1 272 . 1 1 26 26 VAL C C 26 177.950 177.950 177.867 0.083 17919 111525 1 272 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.246 1.414 17919 111526 1 272 . 1 1 26 26 VAL CB C 26 30.840 30.840 30.953 -0.113 17919 111527 1 272 . 1 1 26 26 VAL H H 26 8.070 8.070 8.066 0.004 17919 111528 1 272 . 1 1 27 27 LYS N N 27 118.860 118.860 120.548 -1.688 17919 111529 1 272 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.210 0.370 17919 111530 1 272 . 1 1 27 27 LYS C C 27 180.550 180.550 179.275 1.275 17919 111531 1 272 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.604 -0.354 17919 111532 1 272 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.197 1.533 17919 111533 1 272 . 1 1 27 27 LYS H H 27 8.560 8.560 8.274 0.286 17919 111534 1 272 . 1 1 28 28 ALA N N 28 123.440 123.440 122.938 0.502 17919 111535 1 272 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.061 0.099 17919 111536 1 272 . 1 1 28 28 ALA C C 28 180.300 180.300 179.188 1.112 17919 111537 1 272 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.213 0.157 17919 111538 1 272 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.363 -0.653 17919 111539 1 272 . 1 1 28 28 ALA H H 28 8.060 8.060 8.614 -0.554 17919 111540 1 272 . 1 1 29 29 LYS N N 29 119.940 119.940 118.083 1.857 17919 111541 1 272 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.078 0.129 17919 111542 1 272 . 1 1 29 29 LYS C C 29 180.320 180.320 178.743 1.577 17919 111543 1 272 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.004 0.646 17919 111544 1 272 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.465 0.825 17919 111545 1 272 . 1 1 29 29 LYS H H 29 7.850 7.850 7.709 0.141 17919 111546 1 272 . 1 1 30 30 ILE N N 30 121.080 121.080 119.294 1.786 17919 111547 1 272 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.676 -0.169 17919 111548 1 272 . 1 1 30 30 ILE C C 30 178.310 178.310 177.351 0.959 17919 111549 1 272 . 1 1 30 30 ILE CA C 30 66.150 66.150 64.652 1.498 17919 111550 1 272 . 1 1 30 30 ILE CB C 30 36.800 36.800 38.060 -1.260 17919 111551 1 272 . 1 1 30 30 ILE H H 30 8.280 8.280 8.166 0.114 17919 111552 1 272 . 1 1 31 31 GLN N N 31 123.490 123.490 120.779 2.711 17919 111553 1 272 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.966 -0.137 17919 111554 1 272 . 1 1 31 31 GLN C C 31 178.890 178.890 178.554 0.336 17919 111555 1 272 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.018 0.982 17919 111556 1 272 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.520 -0.800 17919 111557 1 272 . 1 1 31 31 GLN H H 31 8.580 8.580 8.170 0.410 17919 111558 1 272 . 1 1 32 32 ASP N N 32 119.360 119.360 119.151 0.209 17919 111559 1 272 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.520 -0.166 17919 111560 1 272 . 1 1 32 32 ASP C C 32 177.250 177.250 177.156 0.094 17919 111561 1 272 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.285 0.905 17919 111562 1 272 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.493 0.087 17919 111563 1 272 . 1 1 32 32 ASP H H 32 8.010 8.010 7.891 0.119 17919 111564 1 272 . 1 1 33 33 LYS N N 33 115.130 115.130 118.171 -3.041 17919 111565 1 272 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.427 -0.090 17919 111566 1 272 . 1 1 33 33 LYS C C 33 177.870 177.870 177.663 0.207 17919 111567 1 272 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.724 0.327 17919 111568 1 272 . 1 1 33 33 LYS CB C 33 34.170 34.170 34.645 -0.475 17919 111569 1 272 . 1 1 33 33 LYS H H 33 7.430 7.430 7.683 -0.253 17919 111570 1 272 . 1 1 34 34 GLU N N 34 113.870 113.870 114.981 -1.111 17919 111571 1 272 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.449 0.176 17919 111572 1 272 . 1 1 34 34 GLU C C 34 177.840 177.840 177.367 0.473 17919 111573 1 272 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.214 -1.044 17919 111574 1 272 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.716 0.944 17919 111575 1 272 . 1 1 34 34 GLU H H 34 8.740 8.740 8.264 0.476 17919 111576 1 272 . 1 1 35 35 GLY N N 35 108.650 108.650 108.602 0.048 17919 111577 1 272 . 1 1 35 35 GLY C C 35 173.960 173.960 174.097 -0.137 17919 111578 1 272 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.362 0.718 17919 111579 1 272 . 1 1 35 35 GLY H H 35 8.530 8.530 8.226 0.304 17919 111580 1 272 . 1 1 36 36 ILE N N 36 119.880 119.880 123.007 -3.127 17919 111581 1 272 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.311 0.134 17919 111582 1 272 . 1 1 36 36 ILE C C 36 173.590 173.590 174.326 -0.736 17919 111583 1 272 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.982 -0.232 17919 111584 1 272 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.301 2.279 17919 111585 1 272 . 1 1 36 36 ILE H H 36 6.150 6.150 7.661 -1.511 17919 111586 1 272 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.815 -0.181 17919 111587 1 272 . 1 1 37 37 PRO C C 37 176.940 176.940 176.376 0.564 17919 111588 1 272 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.471 0.189 17919 111589 1 272 . 1 1 37 37 PRO CB C 37 31.850 31.850 30.965 0.885 17919 111590 1 272 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.160 -0.043 17919 111591 1 272 . 1 1 38 38 PRO C C 38 178.320 178.320 178.599 -0.279 17919 111592 1 272 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.956 0.304 17919 111593 1 272 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.716 1.174 17919 111594 1 272 . 1 1 39 39 ASP N N 39 113.380 113.380 115.828 -2.448 17919 111595 1 272 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.393 0.037 17919 111596 1 272 . 1 1 39 39 ASP C C 39 177.090 177.090 177.703 -0.613 17919 111597 1 272 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.930 -1.290 17919 111598 1 272 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.425 -0.885 17919 111599 1 272 . 1 1 39 39 ASP H H 39 8.550 8.550 8.850 -0.300 17919 111600 1 272 . 1 1 40 40 GLN N N 40 116.780 116.780 117.447 -0.667 17919 111601 1 272 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.346 0.118 17919 111602 1 272 . 1 1 40 40 GLN C C 40 175.380 175.380 175.967 -0.587 17919 111603 1 272 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.028 -0.388 17919 111604 1 272 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.829 0.311 17919 111605 1 272 . 1 1 40 40 GLN H H 40 7.820 7.820 7.686 0.134 17919 111606 1 272 . 1 1 41 41 GLN N N 41 117.720 117.720 119.359 -1.639 17919 111607 1 272 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.539 -0.295 17919 111608 1 272 . 1 1 41 41 GLN C C 41 176.300 176.300 174.460 1.840 17919 111609 1 272 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.010 0.460 17919 111610 1 272 . 1 1 41 41 GLN CB C 41 31.650 31.650 30.157 1.493 17919 111611 1 272 . 1 1 41 41 GLN H H 41 7.480 7.480 7.424 0.056 17919 111612 1 272 . 1 1 42 42 ARG N N 42 122.680 122.680 124.839 -2.159 17919 111613 1 272 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.682 -0.182 17919 111614 1 272 . 1 1 42 42 ARG C C 42 174.050 174.050 173.971 0.079 17919 111615 1 272 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.644 0.406 17919 111616 1 272 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.160 -1.410 17919 111617 1 272 . 1 1 42 42 ARG H H 42 8.530 8.530 8.188 0.342 17919 111618 1 272 . 1 1 43 43 LEU N N 43 124.040 124.040 126.485 -2.445 17919 111619 1 272 . 1 1 43 43 LEU C C 43 175.290 175.290 175.592 -0.302 17919 111620 1 272 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.821 -0.841 17919 111621 1 272 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.714 2.076 17919 111622 1 272 . 1 1 43 43 LEU H H 43 8.820 8.820 8.761 0.059 17919 111623 1 272 . 1 1 44 44 ILE N N 44 121.920 121.920 122.325 -0.405 17919 111624 1 272 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.063 -0.071 17919 111625 1 272 . 1 1 44 44 ILE C C 44 176.060 176.060 174.151 1.909 17919 111626 1 272 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.248 -1.268 17919 111627 1 272 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.856 -0.436 17919 111628 1 272 . 1 1 44 44 ILE H H 44 9.030 9.030 9.018 0.012 17919 111629 1 272 . 1 1 45 45 PHE N N 45 125.390 125.390 127.412 -2.022 17919 111630 1 272 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.049 -0.004 17919 111631 1 272 . 1 1 45 45 PHE C C 45 174.470 174.470 174.555 -0.085 17919 111632 1 272 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.090 0.930 17919 111633 1 272 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.572 1.188 17919 111634 1 272 . 1 1 45 45 PHE H H 45 8.830 8.830 8.703 0.127 17919 111635 1 272 . 1 1 46 46 ALA N N 46 132.200 132.200 132.107 0.093 17919 111636 1 272 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.747 -0.057 17919 111637 1 272 . 1 1 46 46 ALA C C 46 177.290 177.290 177.333 -0.043 17919 111638 1 272 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.716 -0.176 17919 111639 1 272 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.895 -0.325 17919 111640 1 272 . 1 1 46 46 ALA H H 46 8.810 8.810 9.041 -0.231 17919 111641 1 272 . 1 1 47 47 GLY N N 47 102.340 102.340 104.099 -1.759 17919 111642 1 272 . 1 1 47 47 GLY C C 47 173.810 173.810 174.127 -0.317 17919 111643 1 272 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.175 0.175 17919 111644 1 272 . 1 1 47 47 GLY H H 47 8.130 8.130 8.434 -0.304 17919 111645 1 272 . 1 1 48 48 LYS N N 48 121.570 121.570 121.427 0.143 17919 111646 1 272 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.627 -0.005 17919 111647 1 272 . 1 1 48 48 LYS C C 48 174.700 174.700 175.404 -0.704 17919 111648 1 272 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.979 -0.429 17919 111649 1 272 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.389 0.141 17919 111650 1 272 . 1 1 48 48 LYS H H 48 7.980 7.980 7.898 0.082 17919 111651 1 272 . 1 1 49 49 GLN N N 49 122.410 122.410 124.632 -2.222 17919 111652 1 272 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.494 0.066 17919 111653 1 272 . 1 1 49 49 GLN C C 49 175.670 175.670 175.850 -0.180 17919 111654 1 272 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.963 -0.223 17919 111655 1 272 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.141 -0.141 17919 111656 1 272 . 1 1 49 49 GLN H H 49 8.600 8.600 8.578 0.022 17919 111657 1 272 . 1 1 50 50 LEU N N 50 125.520 125.520 127.273 -1.753 17919 111658 1 272 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.062 0.028 17919 111659 1 272 . 1 1 50 50 LEU C C 50 176.660 176.660 176.547 0.113 17919 111660 1 272 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.357 -0.117 17919 111661 1 272 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.125 -0.555 17919 111662 1 272 . 1 1 50 50 LEU H H 50 8.530 8.530 8.519 0.011 17919 111663 1 272 . 1 1 51 51 GLU N N 51 122.940 122.940 121.878 1.062 17919 111664 1 272 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.617 -0.129 17919 111665 1 272 . 1 1 51 51 GLU C C 51 175.870 175.870 176.753 -0.883 17919 111666 1 272 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.455 0.505 17919 111667 1 272 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.317 0.253 17919 111668 1 272 . 1 1 51 51 GLU H H 51 8.400 8.400 8.398 0.002 17919 111669 1 272 . 1 1 52 52 ASP N N 52 120.030 120.030 124.648 -4.618 17919 111670 1 272 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.366 -0.007 17919 111671 1 272 . 1 1 52 52 ASP C C 52 177.330 177.330 177.599 -0.269 17919 111672 1 272 . 1 1 52 52 ASP CA C 52 56.960 56.960 58.469 -1.509 17919 111673 1 272 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.792 0.058 17919 111674 1 272 . 1 1 52 52 ASP H H 52 8.160 8.160 8.882 -0.722 17919 111675 1 272 . 1 1 53 53 GLY N N 53 106.660 106.660 105.514 1.146 17919 111676 1 272 . 1 1 53 53 GLY C C 53 174.870 174.870 174.611 0.259 17919 111677 1 272 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.499 -0.330 17919 111678 1 272 . 1 1 53 53 GLY H H 53 9.390 9.390 8.679 0.711 17919 111679 1 272 . 1 1 54 54 ARG N N 54 119.050 119.050 120.026 -0.976 17919 111680 1 272 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.291 0.404 17919 111681 1 272 . 1 1 54 54 ARG C C 54 175.350 175.350 175.913 -0.563 17919 111682 1 272 . 1 1 54 54 ARG CA C 54 54.390 54.390 55.315 -0.925 17919 111683 1 272 . 1 1 54 54 ARG CB C 54 32.650 32.650 30.750 1.900 17919 111684 1 272 . 1 1 54 54 ARG H H 54 7.460 7.460 7.841 -0.381 17919 111685 1 272 . 1 1 55 55 THR N N 55 108.400 108.400 109.933 -1.533 17919 111686 1 272 . 1 1 55 55 THR HA H 55 5.240 5.240 4.992 0.248 17919 111687 1 272 . 1 1 55 55 THR C C 55 176.560 176.560 176.323 0.237 17919 111688 1 272 . 1 1 55 55 THR CA C 55 59.690 59.690 59.757 -0.067 17919 111689 1 272 . 1 1 55 55 THR CB C 55 72.260 72.260 71.580 0.680 17919 111690 1 272 . 1 1 55 55 THR H H 55 8.730 8.730 8.505 0.225 17919 111691 1 272 . 1 1 56 56 LEU N N 56 117.920 117.920 120.767 -2.847 17919 111692 1 272 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.002 0.058 17919 111693 1 272 . 1 1 56 56 LEU C C 56 180.810 180.810 179.033 1.777 17919 111694 1 272 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.474 0.236 17919 111695 1 272 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.060 -0.690 17919 111696 1 272 . 1 1 56 56 LEU H H 56 8.140 8.140 8.364 -0.224 17919 111697 1 272 . 1 1 57 57 SER N N 57 113.330 113.330 114.679 -1.349 17919 111698 1 272 . 1 1 57 57 SER HA H 57 4.370 4.370 4.221 0.149 17919 111699 1 272 . 1 1 57 57 SER C C 57 178.310 178.310 176.751 1.559 17919 111700 1 272 . 1 1 57 57 SER CA C 57 61.080 61.080 62.062 -0.981 17919 111701 1 272 . 1 1 57 57 SER CB C 57 62.530 62.530 62.642 -0.112 17919 111702 1 272 . 1 1 57 57 SER H H 57 8.470 8.470 8.181 0.289 17919 111703 1 272 . 1 1 58 58 ASP N N 58 124.190 124.190 121.533 2.657 17919 111704 1 272 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.329 -0.033 17919 111705 1 272 . 1 1 58 58 ASP C C 58 177.400 177.400 176.644 0.756 17919 111706 1 272 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.591 0.589 17919 111707 1 272 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.488 -0.388 17919 111708 1 272 . 1 1 58 58 ASP H H 58 7.930 7.930 7.772 0.158 17919 111709 1 272 . 1 1 59 59 TYR N N 59 115.510 115.510 114.948 0.562 17919 111710 1 272 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.629 0.041 17919 111711 1 272 . 1 1 59 59 TYR C C 59 174.700 174.700 175.411 -0.711 17919 111712 1 272 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.587 0.663 17919 111713 1 272 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.948 1.122 17919 111714 1 272 . 1 1 59 59 TYR H H 59 7.250 7.250 7.148 0.102 17919 111715 1 272 . 1 1 60 60 ASN N N 60 115.900 115.900 115.875 0.025 17919 111716 1 272 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.351 0.004 17919 111717 1 272 . 1 1 60 60 ASN C C 60 174.340 174.340 174.352 -0.012 17919 111718 1 272 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.525 -0.405 17919 111719 1 272 . 1 1 60 60 ASN CB C 60 37.410 37.410 36.942 0.468 17919 111720 1 272 . 1 1 60 60 ASN H H 60 8.150 8.150 7.860 0.290 17919 111721 1 272 . 1 1 61 61 ILE N N 61 118.600 118.600 119.876 -1.276 17919 111722 1 272 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.765 -0.372 17919 111723 1 272 . 1 1 61 61 ILE C C 61 174.610 174.610 174.967 -0.357 17919 111724 1 272 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.910 0.509 17919 111725 1 272 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.815 -1.075 17919 111726 1 272 . 1 1 61 61 ILE H H 61 7.250 7.250 8.001 -0.751 17919 111727 1 272 . 1 1 62 62 GLN N N 62 124.740 124.740 125.796 -1.056 17919 111728 1 272 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.747 -0.241 17919 111729 1 272 . 1 1 62 62 GLN C C 62 175.970 175.970 175.375 0.595 17919 111730 1 272 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.444 0.216 17919 111731 1 272 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.713 -0.063 17919 111732 1 272 . 1 1 62 62 GLN H H 62 7.610 7.610 7.941 -0.331 17919 111733 1 272 . 1 1 63 63 LYS N N 63 120.300 120.300 120.747 -0.447 17919 111734 1 272 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.006 -0.005 17919 111735 1 272 . 1 1 63 63 LYS C C 63 175.810 175.810 176.616 -0.806 17919 111736 1 272 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.380 0.410 17919 111737 1 272 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.007 0.643 17919 111738 1 272 . 1 1 63 63 LYS H H 63 8.490 8.490 8.440 0.050 17919 111739 1 272 . 1 1 64 64 GLU N N 64 113.950 113.950 117.398 -3.448 17919 111740 1 272 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.817 -0.352 17919 111741 1 272 . 1 1 64 64 GLU C C 64 175.250 175.250 175.871 -0.621 17919 111742 1 272 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.857 0.033 17919 111743 1 272 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.170 -2.270 17919 111744 1 272 . 1 1 64 64 GLU H H 64 9.280 9.280 9.061 0.219 17919 111745 1 272 . 1 1 65 65 SER N N 65 114.730 114.730 115.903 -1.173 17919 111746 1 272 . 1 1 65 65 SER HA H 65 4.640 4.640 4.463 0.177 17919 111747 1 272 . 1 1 65 65 SER C C 65 172.160 172.160 173.771 -1.611 17919 111748 1 272 . 1 1 65 65 SER CA C 65 60.890 60.890 61.114 -0.224 17919 111749 1 272 . 1 1 65 65 SER CB C 65 64.910 64.910 63.920 0.990 17919 111750 1 272 . 1 1 65 65 SER H H 65 7.670 7.670 7.685 -0.015 17919 111751 1 272 . 1 1 66 66 THR N N 66 117.110 117.110 118.147 -1.037 17919 111752 1 272 . 1 1 66 66 THR HA H 66 5.270 5.270 5.134 0.136 17919 111753 1 272 . 1 1 66 66 THR C C 66 173.950 173.950 173.660 0.290 17919 111754 1 272 . 1 1 66 66 THR CA C 66 62.340 62.340 61.895 0.445 17919 111755 1 272 . 1 1 66 66 THR CB C 66 70.080 70.080 70.237 -0.157 17919 111756 1 272 . 1 1 66 66 THR H H 66 8.730 8.730 8.223 0.507 17919 111757 1 272 . 1 1 67 67 LEU N N 67 127.110 127.110 126.009 1.101 17919 111758 1 272 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.945 0.115 17919 111759 1 272 . 1 1 67 67 LEU C C 67 175.770 175.770 174.761 1.009 17919 111760 1 272 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.906 -0.006 17919 111761 1 272 . 1 1 67 67 LEU CB C 67 44.260 44.260 45.584 -1.323 17919 111762 1 272 . 1 1 67 67 LEU H H 67 9.410 9.410 8.955 0.455 17919 111763 1 272 . 1 1 68 68 HIS N N 68 118.380 118.380 120.090 -1.710 17919 111764 1 272 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.441 -0.201 17919 111765 1 272 . 1 1 68 68 HIS C C 68 173.150 173.150 173.217 -0.067 17919 111766 1 272 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.847 0.153 17919 111767 1 272 . 1 1 68 68 HIS CB C 68 30.530 30.530 33.546 -3.016 17919 111768 1 272 . 1 1 68 68 HIS H H 68 9.230 9.230 9.022 0.208 17919 111769 1 272 . 1 1 69 69 LEU N N 69 124.460 124.460 128.702 -4.242 17919 111770 1 272 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.805 0.385 17919 111771 1 272 . 1 1 69 69 LEU C C 69 175.270 175.270 174.003 1.267 17919 111772 1 272 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.606 0.284 17919 111773 1 272 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.147 0.233 17919 111774 1 272 . 1 1 69 69 LEU H H 69 8.340 8.340 8.220 0.120 17919 111775 1 272 . 1 1 70 70 VAL N N 70 126.940 126.940 125.757 1.183 17919 111776 1 272 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.540 -0.190 17919 111777 1 272 . 1 1 70 70 VAL C C 70 174.000 174.000 174.291 -0.291 17919 111778 1 272 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.407 0.393 17919 111779 1 272 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.212 -0.302 17919 111780 1 272 . 1 1 70 70 VAL H H 70 9.200 9.200 9.025 0.175 17919 111781 1 272 . 1 1 71 71 LEU N N 71 123.130 123.130 126.922 -3.792 17919 111782 1 272 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.081 -0.021 17919 111783 1 272 . 1 1 71 71 LEU C C 71 177.830 177.830 175.804 2.026 17919 111784 1 272 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.555 0.385 17919 111785 1 272 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.095 -0.245 17919 111786 1 272 . 1 1 71 71 LEU H H 71 8.120 8.120 8.554 -0.434 17919 111787 1 272 . 1 1 72 72 ARG N N 72 123.490 123.490 127.974 -4.484 17919 111788 1 272 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.556 -0.255 17919 111789 1 272 . 1 1 72 72 ARG C C 72 175.350 175.350 174.860 0.490 17919 111790 1 272 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.726 -0.116 17919 111791 1 272 . 1 1 72 72 ARG CB C 72 31.350 31.350 31.106 0.244 17919 111792 1 272 . 1 1 72 72 ARG H H 72 8.580 8.580 8.662 -0.082 17919 111793 1 273 . 1 1 2 2 GLN N N 2 123.220 123.220 120.315 2.905 17919 111794 1 273 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.339 -0.090 17919 111795 1 273 . 1 1 2 2 GLN C C 2 175.920 175.920 175.027 0.893 17919 111796 1 273 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.616 0.464 17919 111797 1 273 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.921 -0.161 17919 111798 1 273 . 1 1 2 2 GLN H H 2 8.900 8.900 8.296 0.604 17919 111799 1 273 . 1 1 3 3 ILE N N 3 115.340 115.340 117.971 -2.631 17919 111800 1 273 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.555 -0.342 17919 111801 1 273 . 1 1 3 3 ILE C C 3 172.450 172.450 173.596 -1.146 17919 111802 1 273 . 1 1 3 3 ILE CA C 3 59.570 59.570 58.714 0.856 17919 111803 1 273 . 1 1 3 3 ILE CB C 3 42.210 42.210 42.019 0.191 17919 111804 1 273 . 1 1 3 3 ILE H H 3 8.320 8.320 8.821 -0.501 17919 111805 1 273 . 1 1 4 4 PHE N N 4 118.110 118.110 118.574 -0.464 17919 111806 1 273 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.234 0.396 17919 111807 1 273 . 1 1 4 4 PHE C C 4 175.320 175.320 174.758 0.562 17919 111808 1 273 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.798 -0.589 17919 111809 1 273 . 1 1 4 4 PHE CB C 4 41.480 41.480 40.923 0.557 17919 111810 1 273 . 1 1 4 4 PHE H H 4 8.610 8.610 8.399 0.211 17919 111811 1 273 . 1 1 5 5 VAL N N 5 121.000 121.000 124.155 -3.155 17919 111812 1 273 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.670 0.055 17919 111813 1 273 . 1 1 5 5 VAL C C 5 174.870 174.870 175.221 -0.351 17919 111814 1 273 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.317 -0.697 17919 111815 1 273 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.440 0.790 17919 111816 1 273 . 1 1 5 5 VAL H H 5 9.300 9.300 9.420 -0.120 17919 111817 1 273 . 1 1 6 6 LYS N N 6 127.520 127.520 128.669 -1.149 17919 111818 1 273 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.070 0.297 17919 111819 1 273 . 1 1 6 6 LYS C C 6 177.140 177.140 176.300 0.840 17919 111820 1 273 . 1 1 6 6 LYS CA C 6 54.520 54.520 55.106 -0.586 17919 111821 1 273 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.309 0.740 17919 111822 1 273 . 1 1 6 6 LYS H H 6 8.820 8.820 9.283 -0.463 17919 111823 1 273 . 1 1 7 7 THR N N 7 115.400 115.400 116.477 -1.077 17919 111824 1 273 . 1 1 7 7 THR HA H 7 4.970 4.970 4.809 0.161 17919 111825 1 273 . 1 1 7 7 THR C C 7 176.910 176.910 176.569 0.341 17919 111826 1 273 . 1 1 7 7 THR CA C 7 60.470 60.470 59.801 0.669 17919 111827 1 273 . 1 1 7 7 THR CB C 7 70.630 70.630 70.510 0.120 17919 111828 1 273 . 1 1 7 7 THR H H 7 8.730 8.730 8.391 0.339 17919 111829 1 273 . 1 1 8 8 LEU N N 8 121.330 121.330 122.911 -1.581 17919 111830 1 273 . 1 1 8 8 LEU HA H 8 4.310 4.310 3.970 0.340 17919 111831 1 273 . 1 1 8 8 LEU C C 8 178.800 178.800 178.358 0.442 17919 111832 1 273 . 1 1 8 8 LEU CA C 8 57.580 57.580 58.077 -0.497 17919 111833 1 273 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.111 0.859 17919 111834 1 273 . 1 1 8 8 LEU H H 8 9.100 9.100 9.032 0.068 17919 111835 1 273 . 1 1 9 9 THR N N 9 105.590 105.590 105.909 -0.319 17919 111836 1 273 . 1 1 9 9 THR HA H 9 4.428 4.428 4.265 0.163 17919 111837 1 273 . 1 1 9 9 THR C C 9 175.520 175.520 175.781 -0.261 17919 111838 1 273 . 1 1 9 9 THR CA C 9 61.400 61.400 62.090 -0.690 17919 111839 1 273 . 1 1 9 9 THR CB C 9 69.140 69.140 68.977 0.163 17919 111840 1 273 . 1 1 9 9 THR H H 9 7.630 7.630 7.696 -0.066 17919 111841 1 273 . 1 1 10 10 GLY N N 10 108.890 108.890 110.853 -1.963 17919 111842 1 273 . 1 1 10 10 GLY C C 10 174.070 174.070 173.380 0.690 17919 111843 1 273 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.874 0.586 17919 111844 1 273 . 1 1 10 10 GLY H H 10 7.810 7.810 8.243 -0.433 17919 111845 1 273 . 1 1 11 11 LYS N N 11 121.600 121.600 120.808 0.792 17919 111846 1 273 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.267 0.094 17919 111847 1 273 . 1 1 11 11 LYS C C 11 175.940 175.940 175.872 0.068 17919 111848 1 273 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.894 -0.614 17919 111849 1 273 . 1 1 11 11 LYS CB C 11 33.200 33.200 32.779 0.421 17919 111850 1 273 . 1 1 11 11 LYS H H 11 7.280 7.280 7.922 -0.642 17919 111851 1 273 . 1 1 12 12 THR N N 12 120.440 120.440 120.067 0.373 17919 111852 1 273 . 1 1 12 12 THR HA H 12 5.046 5.046 4.776 0.270 17919 111853 1 273 . 1 1 12 12 THR C C 12 174.320 174.320 174.766 -0.446 17919 111854 1 273 . 1 1 12 12 THR CA C 12 62.390 62.390 62.800 -0.410 17919 111855 1 273 . 1 1 12 12 THR CB C 12 69.910 69.910 69.378 0.532 17919 111856 1 273 . 1 1 12 12 THR H H 12 8.650 8.650 8.330 0.320 17919 111857 1 273 . 1 1 13 13 ILE N N 13 127.110 127.110 124.541 2.569 17919 111858 1 273 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.649 -0.105 17919 111859 1 273 . 1 1 13 13 ILE C C 13 175.220 175.220 174.916 0.304 17919 111860 1 273 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.635 0.345 17919 111861 1 273 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.152 0.798 17919 111862 1 273 . 1 1 13 13 ILE H H 13 9.450 9.450 9.059 0.391 17919 111863 1 273 . 1 1 14 14 THR N N 14 121.520 121.520 122.658 -1.138 17919 111864 1 273 . 1 1 14 14 THR HA H 14 4.964 4.964 5.178 -0.214 17919 111865 1 273 . 1 1 14 14 THR C C 14 173.790 173.790 173.923 -0.133 17919 111866 1 273 . 1 1 14 14 THR CA C 14 61.940 61.940 61.851 0.089 17919 111867 1 273 . 1 1 14 14 THR CB C 14 69.650 69.650 69.407 0.243 17919 111868 1 273 . 1 1 14 14 THR H H 14 8.710 8.710 8.486 0.224 17919 111869 1 273 . 1 1 15 15 LEU N N 15 124.800 124.800 125.696 -0.896 17919 111870 1 273 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.890 -0.110 17919 111871 1 273 . 1 1 15 15 LEU C C 15 174.670 174.670 175.256 -0.586 17919 111872 1 273 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.016 -0.186 17919 111873 1 273 . 1 1 15 15 LEU CB C 15 47.070 47.070 46.408 0.662 17919 111874 1 273 . 1 1 15 15 LEU H H 15 8.710 8.710 8.489 0.221 17919 111875 1 273 . 1 1 16 16 GLU N N 16 122.160 122.160 121.939 0.221 17919 111876 1 273 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.458 -0.541 17919 111877 1 273 . 1 1 16 16 GLU C C 16 175.860 175.860 175.747 0.113 17919 111878 1 273 . 1 1 16 16 GLU CA C 16 54.820 54.820 54.909 -0.089 17919 111879 1 273 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.621 -1.171 17919 111880 1 273 . 1 1 16 16 GLU H H 16 8.140 8.140 8.586 -0.446 17919 111881 1 273 . 1 1 17 17 VAL N N 17 117.210 117.210 118.603 -1.393 17919 111882 1 273 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.848 -0.134 17919 111883 1 273 . 1 1 17 17 VAL C C 17 174.160 174.160 174.392 -0.232 17919 111884 1 273 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.918 -1.488 17919 111885 1 273 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.667 0.733 17919 111886 1 273 . 1 1 17 17 VAL H H 17 8.900 8.900 8.379 0.521 17919 111887 1 273 . 1 1 18 18 GLU N N 18 118.990 118.990 122.777 -3.787 17919 111888 1 273 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.822 0.257 17919 111889 1 273 . 1 1 18 18 GLU C C 18 176.160 176.160 176.037 0.123 17919 111890 1 273 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.555 0.165 17919 111891 1 273 . 1 1 18 18 GLU CB C 18 30.310 30.310 32.355 -2.045 17919 111892 1 273 . 1 1 18 18 GLU H H 18 8.640 8.640 8.826 -0.186 17919 111893 1 273 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.184 -0.043 17919 111894 1 273 . 1 1 19 19 PRO C C 19 175.310 175.310 178.138 -2.828 17919 111895 1 273 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.765 -0.295 17919 111896 1 273 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.782 0.168 17919 111897 1 273 . 1 1 20 20 SER N N 20 103.400 103.400 109.976 -6.576 17919 111898 1 273 . 1 1 20 20 SER HA H 20 4.370 4.370 4.205 0.165 17919 111899 1 273 . 1 1 20 20 SER C C 20 174.660 174.660 174.958 -0.298 17919 111900 1 273 . 1 1 20 20 SER CA C 20 57.400 57.400 59.613 -2.213 17919 111901 1 273 . 1 1 20 20 SER CB C 20 63.370 63.370 62.611 0.759 17919 111902 1 273 . 1 1 20 20 SER H H 20 7.040 7.040 8.163 -1.123 17919 111903 1 273 . 1 1 21 21 ASP N N 21 123.480 123.480 123.835 -0.355 17919 111904 1 273 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.644 0.051 17919 111905 1 273 . 1 1 21 21 ASP C C 21 176.360 176.360 176.607 -0.247 17919 111906 1 273 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.958 0.742 17919 111907 1 273 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.328 -0.528 17919 111908 1 273 . 1 1 21 21 ASP H H 21 8.030 8.030 7.697 0.333 17919 111909 1 273 . 1 1 22 22 THR N N 22 108.800 108.800 113.940 -5.140 17919 111910 1 273 . 1 1 22 22 THR HA H 22 4.920 4.920 4.737 0.183 17919 111911 1 273 . 1 1 22 22 THR C C 22 176.750 176.750 176.209 0.541 17919 111912 1 273 . 1 1 22 22 THR CA C 22 59.690 59.690 61.366 -1.676 17919 111913 1 273 . 1 1 22 22 THR CB C 22 71.200 71.200 70.347 0.853 17919 111914 1 273 . 1 1 22 22 THR H H 22 7.900 7.900 8.103 -0.203 17919 111915 1 273 . 1 1 23 23 ILE N N 23 121.190 121.190 121.002 0.188 17919 111916 1 273 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.861 -0.204 17919 111917 1 273 . 1 1 23 23 ILE C C 23 179.040 179.040 177.689 1.351 17919 111918 1 273 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.498 -0.238 17919 111919 1 273 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.303 -1.953 17919 111920 1 273 . 1 1 23 23 ILE H H 23 8.560 8.560 8.901 -0.341 17919 111921 1 273 . 1 1 24 24 GLU N N 24 120.830 120.830 121.759 -0.929 17919 111922 1 273 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.967 -0.050 17919 111923 1 273 . 1 1 24 24 GLU C C 24 178.640 178.640 178.418 0.222 17919 111924 1 273 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.968 0.252 17919 111925 1 273 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.365 -1.085 17919 111926 1 273 . 1 1 24 24 GLU H H 24 9.760 9.760 8.114 1.646 17919 111927 1 273 . 1 1 25 25 ASN N N 25 120.570 120.570 118.293 2.277 17919 111928 1 273 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.413 0.112 17919 111929 1 273 . 1 1 25 25 ASN C C 25 178.380 178.380 177.973 0.407 17919 111930 1 273 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.875 0.185 17919 111931 1 273 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.417 0.033 17919 111932 1 273 . 1 1 25 25 ASN H H 25 7.920 7.920 7.710 0.210 17919 111933 1 273 . 1 1 26 26 VAL N N 26 121.710 121.710 120.832 0.878 17919 111934 1 273 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.639 -0.242 17919 111935 1 273 . 1 1 26 26 VAL C C 26 177.950 177.950 177.460 0.490 17919 111936 1 273 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.731 0.929 17919 111937 1 273 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.478 -0.638 17919 111938 1 273 . 1 1 26 26 VAL H H 26 8.070 8.070 7.709 0.361 17919 111939 1 273 . 1 1 27 27 LYS N N 27 118.860 118.860 120.325 -1.465 17919 111940 1 273 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.136 0.444 17919 111941 1 273 . 1 1 27 27 LYS C C 27 180.550 180.550 178.954 1.596 17919 111942 1 273 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.604 -0.354 17919 111943 1 273 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.161 1.569 17919 111944 1 273 . 1 1 27 27 LYS H H 27 8.560 8.560 8.201 0.359 17919 111945 1 273 . 1 1 28 28 ALA N N 28 123.440 123.440 122.053 1.387 17919 111946 1 273 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.125 0.035 17919 111947 1 273 . 1 1 28 28 ALA C C 28 180.300 180.300 178.982 1.318 17919 111948 1 273 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.239 0.131 17919 111949 1 273 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.431 -0.721 17919 111950 1 273 . 1 1 28 28 ALA H H 28 8.060 8.060 8.389 -0.329 17919 111951 1 273 . 1 1 29 29 LYS N N 29 119.940 119.940 118.557 1.383 17919 111952 1 273 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.078 0.129 17919 111953 1 273 . 1 1 29 29 LYS C C 29 180.320 180.320 179.085 1.235 17919 111954 1 273 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.126 0.525 17919 111955 1 273 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.367 0.923 17919 111956 1 273 . 1 1 29 29 LYS H H 29 7.850 7.850 7.362 0.488 17919 111957 1 273 . 1 1 30 30 ILE N N 30 121.080 121.080 120.762 0.318 17919 111958 1 273 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.689 -0.182 17919 111959 1 273 . 1 1 30 30 ILE C C 30 178.310 178.310 177.303 1.007 17919 111960 1 273 . 1 1 30 30 ILE CA C 30 66.150 66.150 64.998 1.152 17919 111961 1 273 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.921 -1.121 17919 111962 1 273 . 1 1 30 30 ILE H H 30 8.280 8.280 7.986 0.294 17919 111963 1 273 . 1 1 31 31 GLN N N 31 123.490 123.490 121.298 2.192 17919 111964 1 273 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.060 -0.231 17919 111965 1 273 . 1 1 31 31 GLN C C 31 178.890 178.890 178.604 0.286 17919 111966 1 273 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.158 0.842 17919 111967 1 273 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.508 -0.788 17919 111968 1 273 . 1 1 31 31 GLN H H 31 8.580 8.580 8.485 0.095 17919 111969 1 273 . 1 1 32 32 ASP N N 32 119.360 119.360 119.222 0.138 17919 111970 1 273 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.441 -0.087 17919 111971 1 273 . 1 1 32 32 ASP C C 32 177.250 177.250 177.757 -0.507 17919 111972 1 273 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.636 0.554 17919 111973 1 273 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.755 -0.175 17919 111974 1 273 . 1 1 32 32 ASP H H 32 8.010 8.010 7.886 0.124 17919 111975 1 273 . 1 1 33 33 LYS N N 33 115.130 115.130 118.422 -3.292 17919 111976 1 273 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.276 0.061 17919 111977 1 273 . 1 1 33 33 LYS C C 33 177.870 177.870 177.805 0.065 17919 111978 1 273 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.821 0.229 17919 111979 1 273 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.085 1.085 17919 111980 1 273 . 1 1 33 33 LYS H H 33 7.430 7.430 7.434 -0.004 17919 111981 1 273 . 1 1 34 34 GLU N N 34 113.870 113.870 114.742 -0.872 17919 111982 1 273 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.543 0.082 17919 111983 1 273 . 1 1 34 34 GLU C C 34 177.840 177.840 177.295 0.545 17919 111984 1 273 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.144 -0.974 17919 111985 1 273 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.112 1.548 17919 111986 1 273 . 1 1 34 34 GLU H H 34 8.740 8.740 8.285 0.455 17919 111987 1 273 . 1 1 35 35 GLY N N 35 108.650 108.650 108.517 0.133 17919 111988 1 273 . 1 1 35 35 GLY C C 35 173.960 173.960 174.435 -0.475 17919 111989 1 273 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.272 0.808 17919 111990 1 273 . 1 1 35 35 GLY H H 35 8.530 8.530 7.860 0.670 17919 111991 1 273 . 1 1 36 36 ILE N N 36 119.880 119.880 123.148 -3.268 17919 111992 1 273 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.292 0.153 17919 111993 1 273 . 1 1 36 36 ILE C C 36 173.590 173.590 174.251 -0.661 17919 111994 1 273 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.166 -0.416 17919 111995 1 273 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.407 2.173 17919 111996 1 273 . 1 1 36 36 ILE H H 36 6.150 6.150 7.749 -1.599 17919 111997 1 273 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.457 0.177 17919 111998 1 273 . 1 1 37 37 PRO C C 37 176.940 176.940 176.065 0.875 17919 111999 1 273 . 1 1 37 37 PRO CA C 37 61.660 61.660 62.413 -0.753 17919 112000 1 273 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.140 0.710 17919 112001 1 273 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.031 0.086 17919 112002 1 273 . 1 1 38 38 PRO C C 38 178.320 178.320 178.599 -0.279 17919 112003 1 273 . 1 1 38 38 PRO CA C 38 66.260 66.260 66.173 0.087 17919 112004 1 273 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.847 1.043 17919 112005 1 273 . 1 1 39 39 ASP N N 39 113.380 113.380 114.025 -0.645 17919 112006 1 273 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.434 -0.004 17919 112007 1 273 . 1 1 39 39 ASP C C 39 177.090 177.090 177.324 -0.234 17919 112008 1 273 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.068 -0.428 17919 112009 1 273 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.298 -0.758 17919 112010 1 273 . 1 1 39 39 ASP H H 39 8.550 8.550 8.600 -0.050 17919 112011 1 273 . 1 1 40 40 GLN N N 40 116.780 116.780 116.039 0.741 17919 112012 1 273 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.527 -0.063 17919 112013 1 273 . 1 1 40 40 GLN C C 40 175.380 175.380 175.408 -0.028 17919 112014 1 273 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.655 -0.015 17919 112015 1 273 . 1 1 40 40 GLN CB C 40 30.140 30.140 30.119 0.021 17919 112016 1 273 . 1 1 40 40 GLN H H 40 7.820 7.820 8.039 -0.219 17919 112017 1 273 . 1 1 41 41 GLN N N 41 117.720 117.720 120.107 -2.387 17919 112018 1 273 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.248 -0.004 17919 112019 1 273 . 1 1 41 41 GLN C C 41 176.300 176.300 175.478 0.822 17919 112020 1 273 . 1 1 41 41 GLN CA C 41 56.470 56.470 57.011 -0.541 17919 112021 1 273 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.298 2.352 17919 112022 1 273 . 1 1 41 41 GLN H H 41 7.480 7.480 7.471 0.009 17919 112023 1 273 . 1 1 42 42 ARG N N 42 122.680 122.680 122.637 0.043 17919 112024 1 273 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.618 -0.118 17919 112025 1 273 . 1 1 42 42 ARG C C 42 174.050 174.050 174.558 -0.508 17919 112026 1 273 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.742 0.308 17919 112027 1 273 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.515 -0.765 17919 112028 1 273 . 1 1 42 42 ARG H H 42 8.530 8.530 9.030 -0.500 17919 112029 1 273 . 1 1 43 43 LEU N N 43 124.040 124.040 127.219 -3.179 17919 112030 1 273 . 1 1 43 43 LEU C C 43 175.290 175.290 174.924 0.366 17919 112031 1 273 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.168 -1.188 17919 112032 1 273 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.376 2.414 17919 112033 1 273 . 1 1 43 43 LEU H H 43 8.820 8.820 8.931 -0.111 17919 112034 1 273 . 1 1 44 44 ILE N N 44 121.920 121.920 123.598 -1.678 17919 112035 1 273 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.960 0.032 17919 112036 1 273 . 1 1 44 44 ILE C C 44 176.060 176.060 174.377 1.683 17919 112037 1 273 . 1 1 44 44 ILE CA C 44 58.980 58.980 58.075 0.905 17919 112038 1 273 . 1 1 44 44 ILE CB C 44 41.420 41.420 38.838 2.582 17919 112039 1 273 . 1 1 44 44 ILE H H 44 9.030 9.030 8.664 0.366 17919 112040 1 273 . 1 1 45 45 PHE N N 45 125.390 125.390 127.493 -2.103 17919 112041 1 273 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.950 0.095 17919 112042 1 273 . 1 1 45 45 PHE C C 45 174.470 174.470 174.528 -0.058 17919 112043 1 273 . 1 1 45 45 PHE CA C 45 57.020 57.020 55.612 1.408 17919 112044 1 273 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.786 0.974 17919 112045 1 273 . 1 1 45 45 PHE H H 45 8.830 8.830 9.022 -0.192 17919 112046 1 273 . 1 1 46 46 ALA N N 46 132.200 132.200 130.620 1.580 17919 112047 1 273 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.754 -0.064 17919 112048 1 273 . 1 1 46 46 ALA C C 46 177.290 177.290 177.330 -0.040 17919 112049 1 273 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.999 -0.459 17919 112050 1 273 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.546 0.024 17919 112051 1 273 . 1 1 46 46 ALA H H 46 8.810 8.810 9.232 -0.422 17919 112052 1 273 . 1 1 47 47 GLY N N 47 102.340 102.340 103.664 -1.324 17919 112053 1 273 . 1 1 47 47 GLY C C 47 173.810 173.810 174.141 -0.331 17919 112054 1 273 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.162 0.188 17919 112055 1 273 . 1 1 47 47 GLY H H 47 8.130 8.130 8.454 -0.324 17919 112056 1 273 . 1 1 48 48 LYS N N 48 121.570 121.570 121.386 0.184 17919 112057 1 273 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.584 0.038 17919 112058 1 273 . 1 1 48 48 LYS C C 48 174.700 174.700 175.077 -0.377 17919 112059 1 273 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.933 -0.383 17919 112060 1 273 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.799 -0.269 17919 112061 1 273 . 1 1 48 48 LYS H H 48 7.980 7.980 7.845 0.135 17919 112062 1 273 . 1 1 49 49 GLN N N 49 122.410 122.410 126.696 -4.286 17919 112063 1 273 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.623 -0.063 17919 112064 1 273 . 1 1 49 49 GLN C C 49 175.670 175.670 175.340 0.330 17919 112065 1 273 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.062 -0.321 17919 112066 1 273 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.475 -0.475 17919 112067 1 273 . 1 1 49 49 GLN H H 49 8.600 8.600 8.737 -0.137 17919 112068 1 273 . 1 1 50 50 LEU N N 50 125.520 125.520 128.578 -3.058 17919 112069 1 273 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.024 0.066 17919 112070 1 273 . 1 1 50 50 LEU C C 50 176.660 176.660 175.409 1.251 17919 112071 1 273 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.568 0.672 17919 112072 1 273 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.015 -0.445 17919 112073 1 273 . 1 1 50 50 LEU H H 50 8.530 8.530 8.778 -0.248 17919 112074 1 273 . 1 1 51 51 GLU N N 51 122.940 122.940 123.689 -0.749 17919 112075 1 273 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.450 0.038 17919 112076 1 273 . 1 1 51 51 GLU C C 51 175.870 175.870 176.758 -0.888 17919 112077 1 273 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.224 0.736 17919 112078 1 273 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.130 -0.560 17919 112079 1 273 . 1 1 51 51 GLU H H 51 8.400 8.400 8.502 -0.102 17919 112080 1 273 . 1 1 52 52 ASP N N 52 120.030 120.030 126.546 -6.516 17919 112081 1 273 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.421 -0.062 17919 112082 1 273 . 1 1 52 52 ASP C C 52 177.330 177.330 178.066 -0.736 17919 112083 1 273 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.960 -1.000 17919 112084 1 273 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.574 0.276 17919 112085 1 273 . 1 1 52 52 ASP H H 52 8.160 8.160 8.797 -0.637 17919 112086 1 273 . 1 1 53 53 GLY N N 53 106.660 106.660 105.560 1.100 17919 112087 1 273 . 1 1 53 53 GLY C C 53 174.870 174.870 174.313 0.557 17919 112088 1 273 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.163 0.007 17919 112089 1 273 . 1 1 53 53 GLY H H 53 9.390 9.390 8.501 0.889 17919 112090 1 273 . 1 1 54 54 ARG N N 54 119.050 119.050 120.354 -1.304 17919 112091 1 273 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.655 0.040 17919 112092 1 273 . 1 1 54 54 ARG C C 54 175.350 175.350 175.677 -0.327 17919 112093 1 273 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.562 -0.172 17919 112094 1 273 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.300 0.350 17919 112095 1 273 . 1 1 54 54 ARG H H 54 7.460 7.460 7.426 0.034 17919 112096 1 273 . 1 1 55 55 THR N N 55 108.400 108.400 111.842 -3.442 17919 112097 1 273 . 1 1 55 55 THR HA H 55 5.240 5.240 5.193 0.047 17919 112098 1 273 . 1 1 55 55 THR C C 55 176.560 176.560 176.848 -0.288 17919 112099 1 273 . 1 1 55 55 THR CA C 55 59.690 59.690 60.423 -0.733 17919 112100 1 273 . 1 1 55 55 THR CB C 55 72.260 72.260 70.848 1.412 17919 112101 1 273 . 1 1 55 55 THR H H 55 8.730 8.730 9.063 -0.333 17919 112102 1 273 . 1 1 56 56 LEU N N 56 117.920 117.920 123.534 -5.614 17919 112103 1 273 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.987 0.073 17919 112104 1 273 . 1 1 56 56 LEU C C 56 180.810 180.810 178.697 2.113 17919 112105 1 273 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.680 0.030 17919 112106 1 273 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.261 -0.891 17919 112107 1 273 . 1 1 56 56 LEU H H 56 8.140 8.140 8.948 -0.808 17919 112108 1 273 . 1 1 57 57 SER N N 57 113.330 113.330 114.780 -1.450 17919 112109 1 273 . 1 1 57 57 SER HA H 57 4.370 4.370 4.124 0.246 17919 112110 1 273 . 1 1 57 57 SER C C 57 178.310 178.310 176.746 1.564 17919 112111 1 273 . 1 1 57 57 SER CA C 57 61.080 61.080 62.084 -1.004 17919 112112 1 273 . 1 1 57 57 SER CB C 57 62.530 62.530 62.652 -0.122 17919 112113 1 273 . 1 1 57 57 SER H H 57 8.470 8.470 8.183 0.287 17919 112114 1 273 . 1 1 58 58 ASP N N 58 124.190 124.190 121.088 3.102 17919 112115 1 273 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.362 -0.066 17919 112116 1 273 . 1 1 58 58 ASP C C 58 177.400 177.400 176.894 0.506 17919 112117 1 273 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.421 0.759 17919 112118 1 273 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.418 -0.318 17919 112119 1 273 . 1 1 58 58 ASP H H 58 7.930 7.930 7.965 -0.035 17919 112120 1 273 . 1 1 59 59 TYR N N 59 115.510 115.510 115.773 -0.263 17919 112121 1 273 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.667 0.003 17919 112122 1 273 . 1 1 59 59 TYR C C 59 174.700 174.700 175.004 -0.304 17919 112123 1 273 . 1 1 59 59 TYR CA C 59 58.250 58.250 56.982 1.268 17919 112124 1 273 . 1 1 59 59 TYR CB C 59 40.070 40.070 39.288 0.781 17919 112125 1 273 . 1 1 59 59 TYR H H 59 7.250 7.250 7.410 -0.160 17919 112126 1 273 . 1 1 60 60 ASN N N 60 115.900 115.900 118.027 -2.127 17919 112127 1 273 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.376 -0.021 17919 112128 1 273 . 1 1 60 60 ASN C C 60 174.340 174.340 174.965 -0.625 17919 112129 1 273 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.249 -0.129 17919 112130 1 273 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.854 -0.444 17919 112131 1 273 . 1 1 60 60 ASN H H 60 8.150 8.150 7.957 0.193 17919 112132 1 273 . 1 1 61 61 ILE N N 61 118.600 118.600 119.662 -1.062 17919 112133 1 273 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.897 -0.504 17919 112134 1 273 . 1 1 61 61 ILE C C 61 174.610 174.610 175.450 -0.840 17919 112135 1 273 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.409 0.011 17919 112136 1 273 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.681 -0.941 17919 112137 1 273 . 1 1 61 61 ILE H H 61 7.250 7.250 7.568 -0.318 17919 112138 1 273 . 1 1 62 62 GLN N N 62 124.740 124.740 124.225 0.515 17919 112139 1 273 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.784 -0.278 17919 112140 1 273 . 1 1 62 62 GLN C C 62 175.970 175.970 175.594 0.376 17919 112141 1 273 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.103 0.557 17919 112142 1 273 . 1 1 62 62 GLN CB C 62 31.650 31.650 32.996 -1.346 17919 112143 1 273 . 1 1 62 62 GLN H H 62 7.610 7.610 8.115 -0.505 17919 112144 1 273 . 1 1 63 63 LYS N N 63 120.300 120.300 121.505 -1.205 17919 112145 1 273 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.139 -0.138 17919 112146 1 273 . 1 1 63 63 LYS C C 63 175.810 175.810 176.747 -0.937 17919 112147 1 273 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.556 0.234 17919 112148 1 273 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.056 0.594 17919 112149 1 273 . 1 1 63 63 LYS H H 63 8.490 8.490 8.525 -0.035 17919 112150 1 273 . 1 1 64 64 GLU N N 64 113.950 113.950 117.503 -3.553 17919 112151 1 273 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.478 -0.013 17919 112152 1 273 . 1 1 64 64 GLU C C 64 175.250 175.250 175.785 -0.535 17919 112153 1 273 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.999 -0.110 17919 112154 1 273 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.882 -2.982 17919 112155 1 273 . 1 1 64 64 GLU H H 64 9.280 9.280 8.997 0.283 17919 112156 1 273 . 1 1 65 65 SER N N 65 114.730 114.730 115.927 -1.197 17919 112157 1 273 . 1 1 65 65 SER HA H 65 4.640 4.640 4.432 0.208 17919 112158 1 273 . 1 1 65 65 SER C C 65 172.160 172.160 173.712 -1.552 17919 112159 1 273 . 1 1 65 65 SER CA C 65 60.890 60.890 61.090 -0.200 17919 112160 1 273 . 1 1 65 65 SER CB C 65 64.910 64.910 63.832 1.078 17919 112161 1 273 . 1 1 65 65 SER H H 65 7.670 7.670 7.747 -0.077 17919 112162 1 273 . 1 1 66 66 THR N N 66 117.110 117.110 118.484 -1.374 17919 112163 1 273 . 1 1 66 66 THR HA H 66 5.270 5.270 5.215 0.055 17919 112164 1 273 . 1 1 66 66 THR C C 66 173.950 173.950 173.772 0.178 17919 112165 1 273 . 1 1 66 66 THR CA C 66 62.340 62.340 62.100 0.240 17919 112166 1 273 . 1 1 66 66 THR CB C 66 70.080 70.080 69.792 0.288 17919 112167 1 273 . 1 1 66 66 THR H H 66 8.730 8.730 8.386 0.344 17919 112168 1 273 . 1 1 67 67 LEU N N 67 127.110 127.110 127.358 -0.248 17919 112169 1 273 . 1 1 67 67 LEU HA H 67 5.060 5.060 5.217 -0.157 17919 112170 1 273 . 1 1 67 67 LEU C C 67 175.770 175.770 175.486 0.284 17919 112171 1 273 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.625 0.275 17919 112172 1 273 . 1 1 67 67 LEU CB C 67 44.260 44.260 45.108 -0.848 17919 112173 1 273 . 1 1 67 67 LEU H H 67 9.410 9.410 9.261 0.149 17919 112174 1 273 . 1 1 68 68 HIS N N 68 118.380 118.380 118.403 -0.023 17919 112175 1 273 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.444 -0.204 17919 112176 1 273 . 1 1 68 68 HIS C C 68 173.150 173.150 172.981 0.169 17919 112177 1 273 . 1 1 68 68 HIS CA C 68 55.000 55.000 53.776 1.224 17919 112178 1 273 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.870 -2.340 17919 112179 1 273 . 1 1 68 68 HIS H H 68 9.230 9.230 9.020 0.210 17919 112180 1 273 . 1 1 69 69 LEU N N 69 124.460 124.460 126.275 -1.815 17919 112181 1 273 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.233 -0.043 17919 112182 1 273 . 1 1 69 69 LEU C C 69 175.270 175.270 175.011 0.259 17919 112183 1 273 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.638 0.252 17919 112184 1 273 . 1 1 69 69 LEU CB C 69 44.380 44.380 43.966 0.414 17919 112185 1 273 . 1 1 69 69 LEU H H 69 8.340 8.340 8.393 -0.053 17919 112186 1 273 . 1 1 70 70 VAL N N 70 126.940 126.940 120.727 6.213 17919 112187 1 273 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.631 -0.281 17919 112188 1 273 . 1 1 70 70 VAL C C 70 174.000 174.000 174.048 -0.048 17919 112189 1 273 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.456 1.344 17919 112190 1 273 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.847 -0.937 17919 112191 1 273 . 1 1 70 70 VAL H H 70 9.200 9.200 9.061 0.139 17919 112192 1 273 . 1 1 71 71 LEU N N 71 123.130 123.130 121.229 1.901 17919 112193 1 273 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.125 -0.065 17919 112194 1 273 . 1 1 71 71 LEU C C 71 177.830 177.830 177.739 0.091 17919 112195 1 273 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.461 0.479 17919 112196 1 273 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.920 -0.070 17919 112197 1 273 . 1 1 71 71 LEU H H 71 8.120 8.120 8.425 -0.305 17919 112198 1 273 . 1 1 72 72 ARG N N 72 123.490 123.490 123.922 -0.432 17919 112199 1 273 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.341 -0.040 17919 112200 1 273 . 1 1 72 72 ARG C C 72 175.350 175.350 175.247 0.103 17919 112201 1 273 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.095 -0.485 17919 112202 1 273 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.968 0.382 17919 112203 1 273 . 1 1 72 72 ARG H H 72 8.580 8.580 8.109 0.471 17919 112204 1 274 . 1 1 2 2 GLN N N 2 123.220 123.220 120.435 2.785 17919 112205 1 274 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.215 0.034 17919 112206 1 274 . 1 1 2 2 GLN C C 2 175.920 175.920 175.791 0.129 17919 112207 1 274 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.845 0.235 17919 112208 1 274 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.322 0.438 17919 112209 1 274 . 1 1 2 2 GLN H H 2 8.900 8.900 8.418 0.482 17919 112210 1 274 . 1 1 3 3 ILE N N 3 115.340 115.340 115.677 -0.337 17919 112211 1 274 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.843 -0.630 17919 112212 1 274 . 1 1 3 3 ILE C C 3 172.450 172.450 173.734 -1.284 17919 112213 1 274 . 1 1 3 3 ILE CA C 3 59.570 59.570 58.775 0.795 17919 112214 1 274 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.955 0.255 17919 112215 1 274 . 1 1 3 3 ILE H H 3 8.320 8.320 8.743 -0.423 17919 112216 1 274 . 1 1 4 4 PHE N N 4 118.110 118.110 119.457 -1.347 17919 112217 1 274 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.531 0.099 17919 112218 1 274 . 1 1 4 4 PHE C C 4 175.320 175.320 175.563 -0.243 17919 112219 1 274 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.844 -0.634 17919 112220 1 274 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.688 -0.208 17919 112221 1 274 . 1 1 4 4 PHE H H 4 8.610 8.610 9.056 -0.446 17919 112222 1 274 . 1 1 5 5 VAL N N 5 121.000 121.000 121.449 -0.449 17919 112223 1 274 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.350 0.375 17919 112224 1 274 . 1 1 5 5 VAL C C 5 174.870 174.870 174.131 0.739 17919 112225 1 274 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.516 -0.896 17919 112226 1 274 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.665 0.565 17919 112227 1 274 . 1 1 5 5 VAL H H 5 9.300 9.300 9.285 0.015 17919 112228 1 274 . 1 1 6 6 LYS N N 6 127.520 127.520 129.346 -1.826 17919 112229 1 274 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.144 0.223 17919 112230 1 274 . 1 1 6 6 LYS C C 6 177.140 177.140 176.434 0.706 17919 112231 1 274 . 1 1 6 6 LYS CA C 6 54.520 54.520 53.686 0.834 17919 112232 1 274 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.347 0.703 17919 112233 1 274 . 1 1 6 6 LYS H H 6 8.820 8.820 8.209 0.611 17919 112234 1 274 . 1 1 7 7 THR N N 7 115.400 115.400 120.200 -4.800 17919 112235 1 274 . 1 1 7 7 THR HA H 7 4.970 4.970 4.377 0.593 17919 112236 1 274 . 1 1 7 7 THR C C 7 176.910 176.910 175.343 1.567 17919 112237 1 274 . 1 1 7 7 THR CA C 7 60.470 60.470 61.986 -1.516 17919 112238 1 274 . 1 1 7 7 THR CB C 7 70.630 70.630 69.987 0.643 17919 112239 1 274 . 1 1 7 7 THR H H 7 8.730 8.730 8.596 0.134 17919 112240 1 274 . 1 1 8 8 LEU N N 8 121.330 121.330 122.909 -1.579 17919 112241 1 274 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.269 0.041 17919 112242 1 274 . 1 1 8 8 LEU C C 8 178.800 178.800 177.379 1.421 17919 112243 1 274 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.317 0.263 17919 112244 1 274 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.203 -0.233 17919 112245 1 274 . 1 1 8 8 LEU H H 8 9.100 9.100 8.639 0.461 17919 112246 1 274 . 1 1 9 9 THR N N 9 105.590 105.590 108.877 -3.287 17919 112247 1 274 . 1 1 9 9 THR HA H 9 4.428 4.428 4.367 0.061 17919 112248 1 274 . 1 1 9 9 THR C C 9 175.520 175.520 175.342 0.178 17919 112249 1 274 . 1 1 9 9 THR CA C 9 61.400 61.400 61.606 -0.206 17919 112250 1 274 . 1 1 9 9 THR CB C 9 69.140 69.140 69.156 -0.016 17919 112251 1 274 . 1 1 9 9 THR H H 9 7.630 7.630 7.491 0.139 17919 112252 1 274 . 1 1 10 10 GLY N N 10 108.890 108.890 110.631 -1.741 17919 112253 1 274 . 1 1 10 10 GLY C C 10 174.070 174.070 173.571 0.499 17919 112254 1 274 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.919 0.541 17919 112255 1 274 . 1 1 10 10 GLY H H 10 7.810 7.810 7.959 -0.149 17919 112256 1 274 . 1 1 11 11 LYS N N 11 121.600 121.600 121.962 -0.362 17919 112257 1 274 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.475 -0.114 17919 112258 1 274 . 1 1 11 11 LYS C C 11 175.940 175.940 175.277 0.663 17919 112259 1 274 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.142 0.138 17919 112260 1 274 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.558 -0.358 17919 112261 1 274 . 1 1 11 11 LYS H H 11 7.280 7.280 7.744 -0.464 17919 112262 1 274 . 1 1 12 12 THR N N 12 120.440 120.440 120.940 -0.500 17919 112263 1 274 . 1 1 12 12 THR HA H 12 5.046 5.046 4.700 0.346 17919 112264 1 274 . 1 1 12 12 THR C C 12 174.320 174.320 174.601 -0.281 17919 112265 1 274 . 1 1 12 12 THR CA C 12 62.390 62.390 62.210 0.180 17919 112266 1 274 . 1 1 12 12 THR CB C 12 69.910 69.910 69.554 0.356 17919 112267 1 274 . 1 1 12 12 THR H H 12 8.650 8.650 8.275 0.375 17919 112268 1 274 . 1 1 13 13 ILE N N 13 127.110 127.110 126.853 0.257 17919 112269 1 274 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.578 -0.034 17919 112270 1 274 . 1 1 13 13 ILE C C 13 175.220 175.220 174.678 0.542 17919 112271 1 274 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.506 -0.526 17919 112272 1 274 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.448 -0.498 17919 112273 1 274 . 1 1 13 13 ILE H H 13 9.450 9.450 8.950 0.500 17919 112274 1 274 . 1 1 14 14 THR N N 14 121.520 121.520 122.513 -0.993 17919 112275 1 274 . 1 1 14 14 THR HA H 14 4.964 4.964 4.930 0.034 17919 112276 1 274 . 1 1 14 14 THR C C 14 173.790 173.790 173.708 0.082 17919 112277 1 274 . 1 1 14 14 THR CA C 14 61.940 61.940 61.553 0.387 17919 112278 1 274 . 1 1 14 14 THR CB C 14 69.650 69.650 69.799 -0.148 17919 112279 1 274 . 1 1 14 14 THR H H 14 8.710 8.710 8.271 0.439 17919 112280 1 274 . 1 1 15 15 LEU N N 15 124.800 124.800 125.957 -1.157 17919 112281 1 274 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.735 0.045 17919 112282 1 274 . 1 1 15 15 LEU C C 15 174.670 174.670 174.801 -0.131 17919 112283 1 274 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.384 -0.554 17919 112284 1 274 . 1 1 15 15 LEU CB C 15 47.070 47.070 46.262 0.808 17919 112285 1 274 . 1 1 15 15 LEU H H 15 8.710 8.710 8.946 -0.236 17919 112286 1 274 . 1 1 16 16 GLU N N 16 122.160 122.160 122.204 -0.044 17919 112287 1 274 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.250 -0.333 17919 112288 1 274 . 1 1 16 16 GLU C C 16 175.860 175.860 175.566 0.294 17919 112289 1 274 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.118 -0.298 17919 112290 1 274 . 1 1 16 16 GLU CB C 16 29.450 29.450 31.166 -1.716 17919 112291 1 274 . 1 1 16 16 GLU H H 16 8.140 8.140 8.591 -0.451 17919 112292 1 274 . 1 1 17 17 VAL N N 17 117.210 117.210 123.388 -6.178 17919 112293 1 274 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.918 -0.204 17919 112294 1 274 . 1 1 17 17 VAL C C 17 174.160 174.160 174.065 0.095 17919 112295 1 274 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.336 -0.905 17919 112296 1 274 . 1 1 17 17 VAL CB C 17 36.400 36.400 34.951 1.449 17919 112297 1 274 . 1 1 17 17 VAL H H 17 8.900 8.900 8.874 0.026 17919 112298 1 274 . 1 1 18 18 GLU N N 18 118.990 118.990 121.198 -2.208 17919 112299 1 274 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.781 0.298 17919 112300 1 274 . 1 1 18 18 GLU C C 18 176.160 176.160 176.289 -0.129 17919 112301 1 274 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.685 -0.966 17919 112302 1 274 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.542 -0.232 17919 112303 1 274 . 1 1 18 18 GLU H H 18 8.640 8.640 8.978 -0.338 17919 112304 1 274 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.272 -0.131 17919 112305 1 274 . 1 1 19 19 PRO C C 19 175.310 175.310 177.570 -2.260 17919 112306 1 274 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.628 -0.158 17919 112307 1 274 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.015 -0.065 17919 112308 1 274 . 1 1 20 20 SER N N 20 103.400 103.400 109.874 -6.474 17919 112309 1 274 . 1 1 20 20 SER HA H 20 4.370 4.370 4.370 -0.000 17919 112310 1 274 . 1 1 20 20 SER C C 20 174.660 174.660 174.651 0.009 17919 112311 1 274 . 1 1 20 20 SER CA C 20 57.400 57.400 58.796 -1.396 17919 112312 1 274 . 1 1 20 20 SER CB C 20 63.370 63.370 62.772 0.598 17919 112313 1 274 . 1 1 20 20 SER H H 20 7.040 7.040 7.990 -0.950 17919 112314 1 274 . 1 1 21 21 ASP N N 21 123.480 123.480 122.791 0.689 17919 112315 1 274 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.698 -0.003 17919 112316 1 274 . 1 1 21 21 ASP C C 21 176.360 176.360 175.888 0.472 17919 112317 1 274 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.246 0.454 17919 112318 1 274 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.424 -0.624 17919 112319 1 274 . 1 1 21 21 ASP H H 21 8.030 8.030 7.863 0.167 17919 112320 1 274 . 1 1 22 22 THR N N 22 108.800 108.800 111.405 -2.605 17919 112321 1 274 . 1 1 22 22 THR HA H 22 4.920 4.920 5.014 -0.094 17919 112322 1 274 . 1 1 22 22 THR C C 22 176.750 176.750 175.959 0.791 17919 112323 1 274 . 1 1 22 22 THR CA C 22 59.690 59.690 60.443 -0.753 17919 112324 1 274 . 1 1 22 22 THR CB C 22 71.200 71.200 71.494 -0.294 17919 112325 1 274 . 1 1 22 22 THR H H 22 7.900 7.900 8.029 -0.129 17919 112326 1 274 . 1 1 23 23 ILE N N 23 121.190 121.190 122.059 -0.869 17919 112327 1 274 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.776 -0.119 17919 112328 1 274 . 1 1 23 23 ILE C C 23 179.040 179.040 177.730 1.310 17919 112329 1 274 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.040 -0.780 17919 112330 1 274 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.522 -2.172 17919 112331 1 274 . 1 1 23 23 ILE H H 23 8.560 8.560 8.509 0.051 17919 112332 1 274 . 1 1 24 24 GLU N N 24 120.830 120.830 120.560 0.270 17919 112333 1 274 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.816 0.101 17919 112334 1 274 . 1 1 24 24 GLU C C 24 178.640 178.640 178.264 0.376 17919 112335 1 274 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.139 0.081 17919 112336 1 274 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.414 -1.134 17919 112337 1 274 . 1 1 24 24 GLU H H 24 9.760 9.760 8.531 1.229 17919 112338 1 274 . 1 1 25 25 ASN N N 25 120.570 120.570 117.412 3.158 17919 112339 1 274 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.491 0.034 17919 112340 1 274 . 1 1 25 25 ASN C C 25 178.380 178.380 178.055 0.325 17919 112341 1 274 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.079 -0.019 17919 112342 1 274 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.709 -0.259 17919 112343 1 274 . 1 1 25 25 ASN H H 25 7.920 7.920 7.713 0.207 17919 112344 1 274 . 1 1 26 26 VAL N N 26 121.710 121.710 120.448 1.262 17919 112345 1 274 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.682 -0.285 17919 112346 1 274 . 1 1 26 26 VAL C C 26 177.950 177.950 177.650 0.300 17919 112347 1 274 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.159 1.501 17919 112348 1 274 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.528 -0.688 17919 112349 1 274 . 1 1 26 26 VAL H H 26 8.070 8.070 8.255 -0.185 17919 112350 1 274 . 1 1 27 27 LYS N N 27 118.860 118.860 120.728 -1.868 17919 112351 1 274 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.035 0.545 17919 112352 1 274 . 1 1 27 27 LYS C C 27 180.550 180.550 178.871 1.679 17919 112353 1 274 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.807 -0.557 17919 112354 1 274 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.191 1.539 17919 112355 1 274 . 1 1 27 27 LYS H H 27 8.560 8.560 8.269 0.291 17919 112356 1 274 . 1 1 28 28 ALA N N 28 123.440 123.440 122.424 1.016 17919 112357 1 274 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.124 0.036 17919 112358 1 274 . 1 1 28 28 ALA C C 28 180.300 180.300 179.142 1.158 17919 112359 1 274 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.105 0.265 17919 112360 1 274 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.421 -0.711 17919 112361 1 274 . 1 1 28 28 ALA H H 28 8.060 8.060 7.608 0.452 17919 112362 1 274 . 1 1 29 29 LYS N N 29 119.940 119.940 119.182 0.758 17919 112363 1 274 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.042 0.165 17919 112364 1 274 . 1 1 29 29 LYS C C 29 180.320 180.320 179.056 1.264 17919 112365 1 274 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.388 0.262 17919 112366 1 274 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.393 0.897 17919 112367 1 274 . 1 1 29 29 LYS H H 29 7.850 7.850 7.552 0.298 17919 112368 1 274 . 1 1 30 30 ILE N N 30 121.080 121.080 120.064 1.016 17919 112369 1 274 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.658 -0.151 17919 112370 1 274 . 1 1 30 30 ILE C C 30 178.310 178.310 177.824 0.486 17919 112371 1 274 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.537 0.613 17919 112372 1 274 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.879 -1.079 17919 112373 1 274 . 1 1 30 30 ILE H H 30 8.280 8.280 8.322 -0.042 17919 112374 1 274 . 1 1 31 31 GLN N N 31 123.490 123.490 121.277 2.213 17919 112375 1 274 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.938 -0.109 17919 112376 1 274 . 1 1 31 31 GLN C C 31 178.890 178.890 178.050 0.840 17919 112377 1 274 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.026 0.974 17919 112378 1 274 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.539 -0.819 17919 112379 1 274 . 1 1 31 31 GLN H H 31 8.580 8.580 8.126 0.454 17919 112380 1 274 . 1 1 32 32 ASP N N 32 119.360 119.360 118.450 0.910 17919 112381 1 274 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.430 -0.076 17919 112382 1 274 . 1 1 32 32 ASP C C 32 177.250 177.250 177.436 -0.186 17919 112383 1 274 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.310 0.880 17919 112384 1 274 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.635 -0.055 17919 112385 1 274 . 1 1 32 32 ASP H H 32 8.010 8.010 7.976 0.034 17919 112386 1 274 . 1 1 33 33 LYS N N 33 115.130 115.130 117.455 -2.325 17919 112387 1 274 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.545 -0.208 17919 112388 1 274 . 1 1 33 33 LYS C C 33 177.870 177.870 177.783 0.087 17919 112389 1 274 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.171 0.879 17919 112390 1 274 . 1 1 33 33 LYS CB C 33 34.170 34.170 34.226 -0.056 17919 112391 1 274 . 1 1 33 33 LYS H H 33 7.430 7.430 7.732 -0.302 17919 112392 1 274 . 1 1 34 34 GLU N N 34 113.870 113.870 115.136 -1.266 17919 112393 1 274 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.556 0.069 17919 112394 1 274 . 1 1 34 34 GLU C C 34 177.840 177.840 177.098 0.742 17919 112395 1 274 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.528 -0.358 17919 112396 1 274 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.951 0.709 17919 112397 1 274 . 1 1 34 34 GLU H H 34 8.740 8.740 7.665 1.075 17919 112398 1 274 . 1 1 35 35 GLY N N 35 108.650 108.650 109.570 -0.920 17919 112399 1 274 . 1 1 35 35 GLY C C 35 173.960 173.960 174.610 -0.650 17919 112400 1 274 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.951 0.129 17919 112401 1 274 . 1 1 35 35 GLY H H 35 8.530 8.530 8.219 0.311 17919 112402 1 274 . 1 1 36 36 ILE N N 36 119.880 119.880 121.671 -1.791 17919 112403 1 274 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.194 0.251 17919 112404 1 274 . 1 1 36 36 ILE C C 36 173.590 173.590 174.519 -0.929 17919 112405 1 274 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.677 -0.927 17919 112406 1 274 . 1 1 36 36 ILE CB C 36 40.580 40.580 37.852 2.728 17919 112407 1 274 . 1 1 36 36 ILE H H 36 6.150 6.150 7.756 -1.606 17919 112408 1 274 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.694 -0.060 17919 112409 1 274 . 1 1 37 37 PRO C C 37 176.940 176.940 176.264 0.676 17919 112410 1 274 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.425 0.235 17919 112411 1 274 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.416 0.434 17919 112412 1 274 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.138 -0.021 17919 112413 1 274 . 1 1 38 38 PRO C C 38 178.320 178.320 178.481 -0.161 17919 112414 1 274 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.946 0.314 17919 112415 1 274 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.861 1.029 17919 112416 1 274 . 1 1 39 39 ASP N N 39 113.380 113.380 113.585 -0.205 17919 112417 1 274 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.498 -0.068 17919 112418 1 274 . 1 1 39 39 ASP C C 39 177.090 177.090 177.129 -0.039 17919 112419 1 274 . 1 1 39 39 ASP CA C 39 55.640 55.640 55.551 0.089 17919 112420 1 274 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.495 -0.954 17919 112421 1 274 . 1 1 39 39 ASP H H 39 8.550 8.550 8.675 -0.125 17919 112422 1 274 . 1 1 40 40 GLN N N 40 116.780 116.780 116.775 0.005 17919 112423 1 274 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.470 -0.006 17919 112424 1 274 . 1 1 40 40 GLN C C 40 175.380 175.380 175.526 -0.146 17919 112425 1 274 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.011 -0.371 17919 112426 1 274 . 1 1 40 40 GLN CB C 40 30.140 30.140 30.443 -0.303 17919 112427 1 274 . 1 1 40 40 GLN H H 40 7.820 7.820 7.836 -0.016 17919 112428 1 274 . 1 1 41 41 GLN N N 41 117.720 117.720 119.922 -2.202 17919 112429 1 274 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.324 -0.080 17919 112430 1 274 . 1 1 41 41 GLN C C 41 176.300 176.300 174.838 1.462 17919 112431 1 274 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.676 -0.206 17919 112432 1 274 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.889 1.761 17919 112433 1 274 . 1 1 41 41 GLN H H 41 7.480 7.480 7.379 0.101 17919 112434 1 274 . 1 1 42 42 ARG N N 42 122.680 122.680 123.891 -1.211 17919 112435 1 274 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.701 -0.201 17919 112436 1 274 . 1 1 42 42 ARG C C 42 174.050 174.050 173.890 0.160 17919 112437 1 274 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.787 0.263 17919 112438 1 274 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.224 -1.474 17919 112439 1 274 . 1 1 42 42 ARG H H 42 8.530 8.530 8.464 0.066 17919 112440 1 274 . 1 1 43 43 LEU N N 43 124.040 124.040 126.813 -2.773 17919 112441 1 274 . 1 1 43 43 LEU C C 43 175.290 175.290 175.699 -0.409 17919 112442 1 274 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.661 -1.681 17919 112443 1 274 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.876 1.914 17919 112444 1 274 . 1 1 43 43 LEU H H 43 8.820 8.820 8.754 0.066 17919 112445 1 274 . 1 1 44 44 ILE N N 44 121.920 121.920 122.797 -0.877 17919 112446 1 274 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.054 -0.062 17919 112447 1 274 . 1 1 44 44 ILE C C 44 176.060 176.060 174.576 1.484 17919 112448 1 274 . 1 1 44 44 ILE CA C 44 58.980 58.980 58.874 0.106 17919 112449 1 274 . 1 1 44 44 ILE CB C 44 41.420 41.420 38.882 2.538 17919 112450 1 274 . 1 1 44 44 ILE H H 44 9.030 9.030 8.380 0.650 17919 112451 1 274 . 1 1 45 45 PHE N N 45 125.390 125.390 128.372 -2.982 17919 112452 1 274 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.925 0.120 17919 112453 1 274 . 1 1 45 45 PHE C C 45 174.470 174.470 174.685 -0.215 17919 112454 1 274 . 1 1 45 45 PHE CA C 45 57.020 57.020 55.796 1.224 17919 112455 1 274 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.838 0.922 17919 112456 1 274 . 1 1 45 45 PHE H H 45 8.830 8.830 7.961 0.869 17919 112457 1 274 . 1 1 46 46 ALA N N 46 132.200 132.200 129.268 2.932 17919 112458 1 274 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.686 0.004 17919 112459 1 274 . 1 1 46 46 ALA C C 46 177.290 177.290 177.461 -0.171 17919 112460 1 274 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.735 -0.195 17919 112461 1 274 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.571 -0.001 17919 112462 1 274 . 1 1 46 46 ALA H H 46 8.810 8.810 8.615 0.195 17919 112463 1 274 . 1 1 47 47 GLY N N 47 102.340 102.340 103.163 -0.823 17919 112464 1 274 . 1 1 47 47 GLY C C 47 173.810 173.810 174.605 -0.795 17919 112465 1 274 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.852 0.497 17919 112466 1 274 . 1 1 47 47 GLY H H 47 8.130 8.130 8.400 -0.270 17919 112467 1 274 . 1 1 48 48 LYS N N 48 121.570 121.570 121.941 -0.371 17919 112468 1 274 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.588 0.034 17919 112469 1 274 . 1 1 48 48 LYS C C 48 174.700 174.700 176.057 -1.357 17919 112470 1 274 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.540 0.010 17919 112471 1 274 . 1 1 48 48 LYS CB C 48 34.530 34.530 33.356 1.174 17919 112472 1 274 . 1 1 48 48 LYS H H 48 7.980 7.980 7.820 0.160 17919 112473 1 274 . 1 1 49 49 GLN N N 49 122.410 122.410 120.797 1.613 17919 112474 1 274 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.267 0.293 17919 112475 1 274 . 1 1 49 49 GLN C C 49 175.670 175.670 176.002 -0.332 17919 112476 1 274 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.273 -0.533 17919 112477 1 274 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.045 -0.045 17919 112478 1 274 . 1 1 49 49 GLN H H 49 8.600 8.600 8.456 0.144 17919 112479 1 274 . 1 1 50 50 LEU N N 50 125.520 125.520 125.691 -0.171 17919 112480 1 274 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.157 -0.067 17919 112481 1 274 . 1 1 50 50 LEU C C 50 176.660 176.660 176.396 0.264 17919 112482 1 274 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.130 0.110 17919 112483 1 274 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.042 -0.472 17919 112484 1 274 . 1 1 50 50 LEU H H 50 8.530 8.530 8.755 -0.225 17919 112485 1 274 . 1 1 51 51 GLU N N 51 122.940 122.940 124.087 -1.147 17919 112486 1 274 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.464 0.024 17919 112487 1 274 . 1 1 51 51 GLU C C 51 175.870 175.870 177.011 -1.141 17919 112488 1 274 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.338 0.622 17919 112489 1 274 . 1 1 51 51 GLU CB C 51 31.570 31.570 30.956 0.614 17919 112490 1 274 . 1 1 51 51 GLU H H 51 8.400 8.400 8.546 -0.146 17919 112491 1 274 . 1 1 52 52 ASP N N 52 120.030 120.030 128.207 -8.177 17919 112492 1 274 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.374 -0.015 17919 112493 1 274 . 1 1 52 52 ASP C C 52 177.330 177.330 177.455 -0.125 17919 112494 1 274 . 1 1 52 52 ASP CA C 52 56.960 56.960 56.929 0.031 17919 112495 1 274 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.657 0.193 17919 112496 1 274 . 1 1 52 52 ASP H H 52 8.160 8.160 8.853 -0.693 17919 112497 1 274 . 1 1 53 53 GLY N N 53 106.660 106.660 104.902 1.758 17919 112498 1 274 . 1 1 53 53 GLY C C 53 174.870 174.870 174.156 0.714 17919 112499 1 274 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.559 0.611 17919 112500 1 274 . 1 1 53 53 GLY H H 53 9.390 9.390 8.400 0.990 17919 112501 1 274 . 1 1 54 54 ARG N N 54 119.050 119.050 120.270 -1.220 17919 112502 1 274 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.602 0.093 17919 112503 1 274 . 1 1 54 54 ARG C C 54 175.350 175.350 175.695 -0.345 17919 112504 1 274 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.892 -0.502 17919 112505 1 274 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.727 -0.077 17919 112506 1 274 . 1 1 54 54 ARG H H 54 7.460 7.460 7.490 -0.030 17919 112507 1 274 . 1 1 55 55 THR N N 55 108.400 108.400 112.289 -3.889 17919 112508 1 274 . 1 1 55 55 THR HA H 55 5.240 5.240 4.992 0.248 17919 112509 1 274 . 1 1 55 55 THR C C 55 176.560 176.560 176.406 0.154 17919 112510 1 274 . 1 1 55 55 THR CA C 55 59.690 59.690 60.341 -0.651 17919 112511 1 274 . 1 1 55 55 THR CB C 55 72.260 72.260 71.042 1.218 17919 112512 1 274 . 1 1 55 55 THR H H 55 8.730 8.730 9.148 -0.418 17919 112513 1 274 . 1 1 56 56 LEU N N 56 117.920 117.920 122.285 -4.365 17919 112514 1 274 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.927 0.133 17919 112515 1 274 . 1 1 56 56 LEU C C 56 180.810 180.810 178.941 1.869 17919 112516 1 274 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.446 0.265 17919 112517 1 274 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.187 -0.817 17919 112518 1 274 . 1 1 56 56 LEU H H 56 8.140 8.140 8.854 -0.714 17919 112519 1 274 . 1 1 57 57 SER N N 57 113.330 113.330 114.669 -1.339 17919 112520 1 274 . 1 1 57 57 SER HA H 57 4.370 4.370 4.196 0.174 17919 112521 1 274 . 1 1 57 57 SER C C 57 178.310 178.310 177.056 1.254 17919 112522 1 274 . 1 1 57 57 SER CA C 57 61.080 61.080 62.166 -1.086 17919 112523 1 274 . 1 1 57 57 SER CB C 57 62.530 62.530 62.728 -0.198 17919 112524 1 274 . 1 1 57 57 SER H H 57 8.470 8.470 8.318 0.152 17919 112525 1 274 . 1 1 58 58 ASP N N 58 124.190 124.190 121.934 2.256 17919 112526 1 274 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.376 -0.080 17919 112527 1 274 . 1 1 58 58 ASP C C 58 177.400 177.400 177.030 0.370 17919 112528 1 274 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.579 0.601 17919 112529 1 274 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.335 -0.235 17919 112530 1 274 . 1 1 58 58 ASP H H 58 7.930 7.930 7.729 0.201 17919 112531 1 274 . 1 1 59 59 TYR N N 59 115.510 115.510 115.273 0.237 17919 112532 1 274 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.709 -0.039 17919 112533 1 274 . 1 1 59 59 TYR C C 59 174.700 174.700 175.431 -0.731 17919 112534 1 274 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.137 1.113 17919 112535 1 274 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.543 1.527 17919 112536 1 274 . 1 1 59 59 TYR H H 59 7.250 7.250 7.215 0.035 17919 112537 1 274 . 1 1 60 60 ASN N N 60 115.900 115.900 117.701 -1.801 17919 112538 1 274 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.401 -0.046 17919 112539 1 274 . 1 1 60 60 ASN C C 60 174.340 174.340 174.586 -0.246 17919 112540 1 274 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.218 -0.098 17919 112541 1 274 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.369 0.041 17919 112542 1 274 . 1 1 60 60 ASN H H 60 8.150 8.150 7.803 0.347 17919 112543 1 274 . 1 1 61 61 ILE N N 61 118.600 118.600 120.387 -1.787 17919 112544 1 274 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.787 -0.394 17919 112545 1 274 . 1 1 61 61 ILE C C 61 174.610 174.610 174.746 -0.136 17919 112546 1 274 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.623 0.797 17919 112547 1 274 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.279 -0.539 17919 112548 1 274 . 1 1 61 61 ILE H H 61 7.250 7.250 8.027 -0.777 17919 112549 1 274 . 1 1 62 62 GLN N N 62 124.740 124.740 125.408 -0.668 17919 112550 1 274 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.730 -0.224 17919 112551 1 274 . 1 1 62 62 GLN C C 62 175.970 175.970 175.743 0.227 17919 112552 1 274 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.614 0.046 17919 112553 1 274 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.612 0.038 17919 112554 1 274 . 1 1 62 62 GLN H H 62 7.610 7.610 7.917 -0.307 17919 112555 1 274 . 1 1 63 63 LYS N N 63 120.300 120.300 123.307 -3.007 17919 112556 1 274 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.996 0.005 17919 112557 1 274 . 1 1 63 63 LYS C C 63 175.810 175.810 176.968 -1.158 17919 112558 1 274 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.327 -0.537 17919 112559 1 274 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.004 0.646 17919 112560 1 274 . 1 1 63 63 LYS H H 63 8.490 8.490 8.672 -0.182 17919 112561 1 274 . 1 1 64 64 GLU N N 64 113.950 113.950 120.339 -6.389 17919 112562 1 274 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.759 -0.294 17919 112563 1 274 . 1 1 64 64 GLU C C 64 175.250 175.250 175.461 -0.211 17919 112564 1 274 . 1 1 64 64 GLU CA C 64 57.890 57.890 58.454 -0.564 17919 112565 1 274 . 1 1 64 64 GLU CB C 64 25.900 25.900 29.301 -3.401 17919 112566 1 274 . 1 1 64 64 GLU H H 64 9.280 9.280 9.064 0.216 17919 112567 1 274 . 1 1 65 65 SER N N 65 114.730 114.730 116.061 -1.331 17919 112568 1 274 . 1 1 65 65 SER HA H 65 4.640 4.640 4.397 0.243 17919 112569 1 274 . 1 1 65 65 SER C C 65 172.160 172.160 173.927 -1.767 17919 112570 1 274 . 1 1 65 65 SER CA C 65 60.890 60.890 61.114 -0.224 17919 112571 1 274 . 1 1 65 65 SER CB C 65 64.910 64.910 63.789 1.121 17919 112572 1 274 . 1 1 65 65 SER H H 65 7.670 7.670 7.916 -0.246 17919 112573 1 274 . 1 1 66 66 THR N N 66 117.110 117.110 119.857 -2.747 17919 112574 1 274 . 1 1 66 66 THR HA H 66 5.270 5.270 5.212 0.058 17919 112575 1 274 . 1 1 66 66 THR C C 66 173.950 173.950 174.607 -0.657 17919 112576 1 274 . 1 1 66 66 THR CA C 66 62.340 62.340 62.105 0.235 17919 112577 1 274 . 1 1 66 66 THR CB C 66 70.080 70.080 69.983 0.097 17919 112578 1 274 . 1 1 66 66 THR H H 66 8.730 8.730 8.417 0.313 17919 112579 1 274 . 1 1 67 67 LEU N N 67 127.110 127.110 126.793 0.317 17919 112580 1 274 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.655 0.405 17919 112581 1 274 . 1 1 67 67 LEU C C 67 175.770 175.770 176.367 -0.597 17919 112582 1 274 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.843 0.057 17919 112583 1 274 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.446 0.814 17919 112584 1 274 . 1 1 67 67 LEU H H 67 9.410 9.410 9.120 0.290 17919 112585 1 274 . 1 1 68 68 HIS N N 68 118.380 118.380 119.541 -1.161 17919 112586 1 274 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.137 0.103 17919 112587 1 274 . 1 1 68 68 HIS C C 68 173.150 173.150 174.076 -0.926 17919 112588 1 274 . 1 1 68 68 HIS CA C 68 55.000 55.000 55.340 -0.340 17919 112589 1 274 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.729 -2.199 17919 112590 1 274 . 1 1 68 68 HIS H H 68 9.230 9.230 8.318 0.912 17919 112591 1 274 . 1 1 69 69 LEU N N 69 124.460 124.460 128.864 -4.404 17919 112592 1 274 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.643 0.547 17919 112593 1 274 . 1 1 69 69 LEU C C 69 175.270 175.270 174.908 0.362 17919 112594 1 274 . 1 1 69 69 LEU CA C 69 53.890 53.890 55.156 -1.266 17919 112595 1 274 . 1 1 69 69 LEU CB C 69 44.380 44.380 42.763 1.617 17919 112596 1 274 . 1 1 69 69 LEU H H 69 8.340 8.340 8.537 -0.197 17919 112597 1 274 . 1 1 70 70 VAL N N 70 126.940 126.940 125.661 1.279 17919 112598 1 274 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.285 0.065 17919 112599 1 274 . 1 1 70 70 VAL C C 70 174.000 174.000 174.753 -0.753 17919 112600 1 274 . 1 1 70 70 VAL CA C 70 60.800 60.800 61.095 -0.295 17919 112601 1 274 . 1 1 70 70 VAL CB C 70 34.910 34.910 34.364 0.546 17919 112602 1 274 . 1 1 70 70 VAL H H 70 9.200 9.200 8.736 0.464 17919 112603 1 274 . 1 1 71 71 LEU N N 71 123.130 123.130 125.080 -1.950 17919 112604 1 274 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.113 -0.053 17919 112605 1 274 . 1 1 71 71 LEU C C 71 177.830 177.830 177.238 0.592 17919 112606 1 274 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.574 0.366 17919 112607 1 274 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.692 0.158 17919 112608 1 274 . 1 1 71 71 LEU H H 71 8.120 8.120 8.368 -0.248 17919 112609 1 274 . 1 1 72 72 ARG N N 72 123.490 123.490 126.073 -2.583 17919 112610 1 274 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.461 -0.160 17919 112611 1 274 . 1 1 72 72 ARG C C 72 175.350 175.350 176.024 -0.674 17919 112612 1 274 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.513 0.097 17919 112613 1 274 . 1 1 72 72 ARG CB C 72 31.350 31.350 29.664 1.686 17919 112614 1 274 . 1 1 72 72 ARG H H 72 8.580 8.580 8.689 -0.109 17919 112615 1 275 . 1 1 2 2 GLN N N 2 123.220 123.220 121.441 1.779 17919 112616 1 275 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.124 0.125 17919 112617 1 275 . 1 1 2 2 GLN C C 2 175.920 175.920 175.899 0.021 17919 112618 1 275 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.514 0.567 17919 112619 1 275 . 1 1 2 2 GLN CB C 2 30.760 30.760 29.133 1.627 17919 112620 1 275 . 1 1 2 2 GLN H H 2 8.900 8.900 8.436 0.464 17919 112621 1 275 . 1 1 3 3 ILE N N 3 115.340 115.340 117.248 -1.908 17919 112622 1 275 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.233 -0.020 17919 112623 1 275 . 1 1 3 3 ILE C C 3 172.450 172.450 173.655 -1.205 17919 112624 1 275 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.219 0.351 17919 112625 1 275 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.816 0.394 17919 112626 1 275 . 1 1 3 3 ILE H H 3 8.320 8.320 8.278 0.042 17919 112627 1 275 . 1 1 4 4 PHE N N 4 118.110 118.110 118.628 -0.518 17919 112628 1 275 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.329 0.301 17919 112629 1 275 . 1 1 4 4 PHE C C 4 175.320 175.320 175.148 0.172 17919 112630 1 275 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.618 -0.408 17919 112631 1 275 . 1 1 4 4 PHE CB C 4 41.480 41.480 40.720 0.760 17919 112632 1 275 . 1 1 4 4 PHE H H 4 8.610 8.610 8.306 0.304 17919 112633 1 275 . 1 1 5 5 VAL N N 5 121.000 121.000 123.312 -2.312 17919 112634 1 275 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.686 0.039 17919 112635 1 275 . 1 1 5 5 VAL C C 5 174.870 174.870 174.669 0.201 17919 112636 1 275 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.297 -0.677 17919 112637 1 275 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.041 0.189 17919 112638 1 275 . 1 1 5 5 VAL H H 5 9.300 9.300 9.323 -0.023 17919 112639 1 275 . 1 1 6 6 LYS N N 6 127.520 127.520 128.442 -0.922 17919 112640 1 275 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.112 0.255 17919 112641 1 275 . 1 1 6 6 LYS C C 6 177.140 177.140 176.271 0.869 17919 112642 1 275 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.560 -0.040 17919 112643 1 275 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.854 -0.804 17919 112644 1 275 . 1 1 6 6 LYS H H 6 8.820 8.820 9.234 -0.414 17919 112645 1 275 . 1 1 7 7 THR N N 7 115.400 115.400 117.598 -2.198 17919 112646 1 275 . 1 1 7 7 THR HA H 7 4.970 4.970 4.926 0.044 17919 112647 1 275 . 1 1 7 7 THR C C 7 176.910 176.910 174.939 1.971 17919 112648 1 275 . 1 1 7 7 THR CA C 7 60.470 60.470 60.373 0.097 17919 112649 1 275 . 1 1 7 7 THR CB C 7 70.630 70.630 71.006 -0.376 17919 112650 1 275 . 1 1 7 7 THR H H 7 8.730 8.730 8.560 0.170 17919 112651 1 275 . 1 1 8 8 LEU N N 8 121.330 121.330 120.089 1.241 17919 112652 1 275 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.426 -0.116 17919 112653 1 275 . 1 1 8 8 LEU C C 8 178.800 178.800 177.981 0.819 17919 112654 1 275 . 1 1 8 8 LEU CA C 8 57.580 57.580 55.959 1.621 17919 112655 1 275 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.922 0.048 17919 112656 1 275 . 1 1 8 8 LEU H H 8 9.100 9.100 8.613 0.487 17919 112657 1 275 . 1 1 9 9 THR N N 9 105.590 105.590 110.296 -4.706 17919 112658 1 275 . 1 1 9 9 THR HA H 9 4.428 4.428 4.306 0.122 17919 112659 1 275 . 1 1 9 9 THR C C 9 175.520 175.520 175.581 -0.061 17919 112660 1 275 . 1 1 9 9 THR CA C 9 61.400 61.400 62.604 -1.204 17919 112661 1 275 . 1 1 9 9 THR CB C 9 69.140 69.140 69.459 -0.319 17919 112662 1 275 . 1 1 9 9 THR H H 9 7.630 7.630 7.579 0.051 17919 112663 1 275 . 1 1 10 10 GLY N N 10 108.890 108.890 109.170 -0.280 17919 112664 1 275 . 1 1 10 10 GLY C C 10 174.070 174.070 174.264 -0.194 17919 112665 1 275 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.530 0.930 17919 112666 1 275 . 1 1 10 10 GLY H H 10 7.810 7.810 7.510 0.300 17919 112667 1 275 . 1 1 11 11 LYS N N 11 121.600 121.600 122.178 -0.578 17919 112668 1 275 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.391 -0.030 17919 112669 1 275 . 1 1 11 11 LYS C C 11 175.940 175.940 175.511 0.429 17919 112670 1 275 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.952 -0.672 17919 112671 1 275 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.379 -0.179 17919 112672 1 275 . 1 1 11 11 LYS H H 11 7.280 7.280 7.969 -0.689 17919 112673 1 275 . 1 1 12 12 THR N N 12 120.440 120.440 120.239 0.201 17919 112674 1 275 . 1 1 12 12 THR HA H 12 5.046 5.046 5.205 -0.159 17919 112675 1 275 . 1 1 12 12 THR C C 12 174.320 174.320 173.925 0.395 17919 112676 1 275 . 1 1 12 12 THR CA C 12 62.390 62.390 61.164 1.226 17919 112677 1 275 . 1 1 12 12 THR CB C 12 69.910 69.910 70.600 -0.690 17919 112678 1 275 . 1 1 12 12 THR H H 12 8.650 8.650 8.178 0.472 17919 112679 1 275 . 1 1 13 13 ILE N N 13 127.110 127.110 122.985 4.125 17919 112680 1 275 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.748 -0.204 17919 112681 1 275 . 1 1 13 13 ILE C C 13 175.220 175.220 175.078 0.142 17919 112682 1 275 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.483 0.497 17919 112683 1 275 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.354 0.596 17919 112684 1 275 . 1 1 13 13 ILE H H 13 9.450 9.450 9.138 0.312 17919 112685 1 275 . 1 1 14 14 THR N N 14 121.520 121.520 122.428 -0.908 17919 112686 1 275 . 1 1 14 14 THR HA H 14 4.964 4.964 5.253 -0.289 17919 112687 1 275 . 1 1 14 14 THR C C 14 173.790 173.790 174.067 -0.277 17919 112688 1 275 . 1 1 14 14 THR CA C 14 61.940 61.940 62.302 -0.362 17919 112689 1 275 . 1 1 14 14 THR CB C 14 69.650 69.650 69.926 -0.276 17919 112690 1 275 . 1 1 14 14 THR H H 14 8.710 8.710 8.594 0.116 17919 112691 1 275 . 1 1 15 15 LEU N N 15 124.800 124.800 125.374 -0.574 17919 112692 1 275 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.738 0.042 17919 112693 1 275 . 1 1 15 15 LEU C C 15 174.670 174.670 175.157 -0.487 17919 112694 1 275 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.781 -0.951 17919 112695 1 275 . 1 1 15 15 LEU CB C 15 47.070 47.070 44.848 2.222 17919 112696 1 275 . 1 1 15 15 LEU H H 15 8.710 8.710 8.727 -0.017 17919 112697 1 275 . 1 1 16 16 GLU N N 16 122.160 122.160 125.099 -2.939 17919 112698 1 275 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.890 0.027 17919 112699 1 275 . 1 1 16 16 GLU C C 16 175.860 175.860 176.038 -0.178 17919 112700 1 275 . 1 1 16 16 GLU CA C 16 54.820 54.820 56.066 -1.246 17919 112701 1 275 . 1 1 16 16 GLU CB C 16 29.450 29.450 29.430 0.020 17919 112702 1 275 . 1 1 16 16 GLU H H 16 8.140 8.140 8.755 -0.615 17919 112703 1 275 . 1 1 17 17 VAL N N 17 117.210 117.210 119.466 -2.256 17919 112704 1 275 . 1 1 17 17 VAL HA H 17 4.714 4.714 5.119 -0.405 17919 112705 1 275 . 1 1 17 17 VAL C C 17 174.160 174.160 174.422 -0.262 17919 112706 1 275 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.908 -0.478 17919 112707 1 275 . 1 1 17 17 VAL CB C 17 36.400 36.400 36.373 0.027 17919 112708 1 275 . 1 1 17 17 VAL H H 17 8.900 8.900 8.763 0.137 17919 112709 1 275 . 1 1 18 18 GLU N N 18 118.990 118.990 120.473 -1.483 17919 112710 1 275 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.858 0.221 17919 112711 1 275 . 1 1 18 18 GLU C C 18 176.160 176.160 175.047 1.113 17919 112712 1 275 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.959 -0.239 17919 112713 1 275 . 1 1 18 18 GLU CB C 18 30.310 30.310 29.884 0.426 17919 112714 1 275 . 1 1 18 18 GLU H H 18 8.640 8.640 9.121 -0.481 17919 112715 1 275 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.307 -0.166 17919 112716 1 275 . 1 1 19 19 PRO C C 19 175.310 175.310 177.803 -2.493 17919 112717 1 275 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.446 0.024 17919 112718 1 275 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.832 0.118 17919 112719 1 275 . 1 1 20 20 SER N N 20 103.400 103.400 110.747 -7.347 17919 112720 1 275 . 1 1 20 20 SER HA H 20 4.370 4.370 4.366 0.004 17919 112721 1 275 . 1 1 20 20 SER C C 20 174.660 174.660 174.573 0.087 17919 112722 1 275 . 1 1 20 20 SER CA C 20 57.400 57.400 58.496 -1.096 17919 112723 1 275 . 1 1 20 20 SER CB C 20 63.370 63.370 63.079 0.291 17919 112724 1 275 . 1 1 20 20 SER H H 20 7.040 7.040 8.071 -1.031 17919 112725 1 275 . 1 1 21 21 ASP N N 21 123.480 123.480 122.632 0.848 17919 112726 1 275 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.639 0.056 17919 112727 1 275 . 1 1 21 21 ASP C C 21 176.360 176.360 175.909 0.451 17919 112728 1 275 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.639 0.061 17919 112729 1 275 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.600 -0.800 17919 112730 1 275 . 1 1 21 21 ASP H H 21 8.030 8.030 7.574 0.456 17919 112731 1 275 . 1 1 22 22 THR N N 22 108.800 108.800 111.524 -2.724 17919 112732 1 275 . 1 1 22 22 THR HA H 22 4.920 4.920 4.762 0.158 17919 112733 1 275 . 1 1 22 22 THR C C 22 176.750 176.750 175.977 0.773 17919 112734 1 275 . 1 1 22 22 THR CA C 22 59.690 59.690 60.414 -0.724 17919 112735 1 275 . 1 1 22 22 THR CB C 22 71.200 71.200 71.087 0.113 17919 112736 1 275 . 1 1 22 22 THR H H 22 7.900 7.900 8.143 -0.243 17919 112737 1 275 . 1 1 23 23 ILE N N 23 121.190 121.190 121.750 -0.560 17919 112738 1 275 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.813 -0.156 17919 112739 1 275 . 1 1 23 23 ILE C C 23 179.040 179.040 177.807 1.233 17919 112740 1 275 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.987 -0.728 17919 112741 1 275 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.412 -2.062 17919 112742 1 275 . 1 1 23 23 ILE H H 23 8.560 8.560 8.474 0.086 17919 112743 1 275 . 1 1 24 24 GLU N N 24 120.830 120.830 121.134 -0.304 17919 112744 1 275 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.876 0.041 17919 112745 1 275 . 1 1 24 24 GLU C C 24 178.640 178.640 178.240 0.400 17919 112746 1 275 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.309 -0.089 17919 112747 1 275 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.533 -1.253 17919 112748 1 275 . 1 1 24 24 GLU H H 24 9.760 9.760 8.318 1.442 17919 112749 1 275 . 1 1 25 25 ASN N N 25 120.570 120.570 118.145 2.425 17919 112750 1 275 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.495 0.030 17919 112751 1 275 . 1 1 25 25 ASN C C 25 178.380 178.380 177.967 0.413 17919 112752 1 275 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.139 -0.079 17919 112753 1 275 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.825 -0.375 17919 112754 1 275 . 1 1 25 25 ASN H H 25 7.920 7.920 7.946 -0.026 17919 112755 1 275 . 1 1 26 26 VAL N N 26 121.710 121.710 120.951 0.759 17919 112756 1 275 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.538 -0.141 17919 112757 1 275 . 1 1 26 26 VAL C C 26 177.950 177.950 177.661 0.289 17919 112758 1 275 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.996 0.664 17919 112759 1 275 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.656 -0.816 17919 112760 1 275 . 1 1 26 26 VAL H H 26 8.070 8.070 8.509 -0.439 17919 112761 1 275 . 1 1 27 27 LYS N N 27 118.860 118.860 120.045 -1.185 17919 112762 1 275 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.109 0.471 17919 112763 1 275 . 1 1 27 27 LYS C C 27 180.550 180.550 179.057 1.493 17919 112764 1 275 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.788 -0.538 17919 112765 1 275 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.243 1.487 17919 112766 1 275 . 1 1 27 27 LYS H H 27 8.560 8.560 8.088 0.472 17919 112767 1 275 . 1 1 28 28 ALA N N 28 123.440 123.440 121.056 2.384 17919 112768 1 275 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.120 0.040 17919 112769 1 275 . 1 1 28 28 ALA C C 28 180.300 180.300 179.344 0.956 17919 112770 1 275 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.866 0.504 17919 112771 1 275 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.454 -0.744 17919 112772 1 275 . 1 1 28 28 ALA H H 28 8.060 8.060 7.733 0.327 17919 112773 1 275 . 1 1 29 29 LYS N N 29 119.940 119.940 119.310 0.630 17919 112774 1 275 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.008 0.199 17919 112775 1 275 . 1 1 29 29 LYS C C 29 180.320 180.320 179.021 1.299 17919 112776 1 275 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.400 0.250 17919 112777 1 275 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.343 0.947 17919 112778 1 275 . 1 1 29 29 LYS H H 29 7.850 7.850 7.873 -0.023 17919 112779 1 275 . 1 1 30 30 ILE N N 30 121.080 121.080 120.455 0.625 17919 112780 1 275 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.596 -0.089 17919 112781 1 275 . 1 1 30 30 ILE C C 30 178.310 178.310 177.228 1.082 17919 112782 1 275 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.416 0.734 17919 112783 1 275 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.652 -0.852 17919 112784 1 275 . 1 1 30 30 ILE H H 30 8.280 8.280 8.342 -0.062 17919 112785 1 275 . 1 1 31 31 GLN N N 31 123.490 123.490 120.770 2.720 17919 112786 1 275 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.830 -0.001 17919 112787 1 275 . 1 1 31 31 GLN C C 31 178.890 178.890 178.080 0.810 17919 112788 1 275 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.699 0.301 17919 112789 1 275 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.380 -0.660 17919 112790 1 275 . 1 1 31 31 GLN H H 31 8.580 8.580 8.090 0.490 17919 112791 1 275 . 1 1 32 32 ASP N N 32 119.360 119.360 119.107 0.253 17919 112792 1 275 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.324 0.030 17919 112793 1 275 . 1 1 32 32 ASP C C 32 177.250 177.250 178.213 -0.963 17919 112794 1 275 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.926 0.264 17919 112795 1 275 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.733 -0.153 17919 112796 1 275 . 1 1 32 32 ASP H H 32 8.010 8.010 7.812 0.198 17919 112797 1 275 . 1 1 33 33 LYS N N 33 115.130 115.130 118.888 -3.758 17919 112798 1 275 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.126 0.211 17919 112799 1 275 . 1 1 33 33 LYS C C 33 177.870 177.870 178.543 -0.673 17919 112800 1 275 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.467 -0.417 17919 112801 1 275 . 1 1 33 33 LYS CB C 33 34.170 34.170 32.705 1.465 17919 112802 1 275 . 1 1 33 33 LYS H H 33 7.430 7.430 7.589 -0.159 17919 112803 1 275 . 1 1 34 34 GLU N N 34 113.870 113.870 115.278 -1.408 17919 112804 1 275 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.428 0.197 17919 112805 1 275 . 1 1 34 34 GLU C C 34 177.840 177.840 177.440 0.400 17919 112806 1 275 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.902 -0.732 17919 112807 1 275 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.594 1.066 17919 112808 1 275 . 1 1 34 34 GLU H H 34 8.740 8.740 8.093 0.647 17919 112809 1 275 . 1 1 35 35 GLY N N 35 108.650 108.650 108.461 0.189 17919 112810 1 275 . 1 1 35 35 GLY C C 35 173.960 173.960 174.269 -0.309 17919 112811 1 275 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.609 0.471 17919 112812 1 275 . 1 1 35 35 GLY H H 35 8.530 8.530 8.521 0.009 17919 112813 1 275 . 1 1 36 36 ILE N N 36 119.880 119.880 122.884 -3.004 17919 112814 1 275 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.281 0.164 17919 112815 1 275 . 1 1 36 36 ILE C C 36 173.590 173.590 174.367 -0.777 17919 112816 1 275 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.102 -0.352 17919 112817 1 275 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.571 2.009 17919 112818 1 275 . 1 1 36 36 ILE H H 36 6.150 6.150 7.654 -1.504 17919 112819 1 275 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.632 0.002 17919 112820 1 275 . 1 1 37 37 PRO C C 37 176.940 176.940 176.006 0.934 17919 112821 1 275 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.207 0.453 17919 112822 1 275 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.480 0.370 17919 112823 1 275 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.210 -0.093 17919 112824 1 275 . 1 1 38 38 PRO C C 38 178.320 178.320 177.812 0.508 17919 112825 1 275 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.525 0.735 17919 112826 1 275 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.911 0.979 17919 112827 1 275 . 1 1 39 39 ASP N N 39 113.380 113.380 115.547 -2.167 17919 112828 1 275 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.404 0.026 17919 112829 1 275 . 1 1 39 39 ASP C C 39 177.090 177.090 177.902 -0.812 17919 112830 1 275 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.722 -1.082 17919 112831 1 275 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.654 -1.115 17919 112832 1 275 . 1 1 39 39 ASP H H 39 8.550 8.550 8.378 0.172 17919 112833 1 275 . 1 1 40 40 GLN N N 40 116.780 116.780 117.044 -0.264 17919 112834 1 275 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.334 0.130 17919 112835 1 275 . 1 1 40 40 GLN C C 40 175.380 175.380 176.273 -0.893 17919 112836 1 275 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.096 -0.456 17919 112837 1 275 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.257 0.883 17919 112838 1 275 . 1 1 40 40 GLN H H 40 7.820 7.820 8.258 -0.438 17919 112839 1 275 . 1 1 41 41 GLN N N 41 117.720 117.720 118.971 -1.251 17919 112840 1 275 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.320 -0.076 17919 112841 1 275 . 1 1 41 41 GLN C C 41 176.300 176.300 175.515 0.785 17919 112842 1 275 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.287 0.183 17919 112843 1 275 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.458 2.192 17919 112844 1 275 . 1 1 41 41 GLN H H 41 7.480 7.480 7.349 0.131 17919 112845 1 275 . 1 1 42 42 ARG N N 42 122.680 122.680 126.210 -3.530 17919 112846 1 275 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.625 -0.125 17919 112847 1 275 . 1 1 42 42 ARG C C 42 174.050 174.050 174.128 -0.078 17919 112848 1 275 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.862 0.188 17919 112849 1 275 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.275 -0.525 17919 112850 1 275 . 1 1 42 42 ARG H H 42 8.530 8.530 8.929 -0.399 17919 112851 1 275 . 1 1 43 43 LEU N N 43 124.040 124.040 127.891 -3.851 17919 112852 1 275 . 1 1 43 43 LEU C C 43 175.290 175.290 175.639 -0.349 17919 112853 1 275 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.202 -1.222 17919 112854 1 275 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.373 2.417 17919 112855 1 275 . 1 1 43 43 LEU H H 43 8.820 8.820 8.800 0.020 17919 112856 1 275 . 1 1 44 44 ILE N N 44 121.920 121.920 122.301 -0.381 17919 112857 1 275 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.948 0.044 17919 112858 1 275 . 1 1 44 44 ILE C C 44 176.060 176.060 174.314 1.746 17919 112859 1 275 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.421 -1.441 17919 112860 1 275 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.239 0.181 17919 112861 1 275 . 1 1 44 44 ILE H H 44 9.030 9.030 9.005 0.025 17919 112862 1 275 . 1 1 45 45 PHE N N 45 125.390 125.390 126.199 -0.809 17919 112863 1 275 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.006 0.039 17919 112864 1 275 . 1 1 45 45 PHE C C 45 174.470 174.470 174.540 -0.070 17919 112865 1 275 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.885 0.135 17919 112866 1 275 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.576 0.184 17919 112867 1 275 . 1 1 45 45 PHE H H 45 8.830 8.830 9.074 -0.244 17919 112868 1 275 . 1 1 46 46 ALA N N 46 132.200 132.200 129.142 3.058 17919 112869 1 275 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.642 0.048 17919 112870 1 275 . 1 1 46 46 ALA C C 46 177.290 177.290 178.085 -0.795 17919 112871 1 275 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.471 0.069 17919 112872 1 275 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.699 -0.129 17919 112873 1 275 . 1 1 46 46 ALA H H 46 8.810 8.810 8.775 0.035 17919 112874 1 275 . 1 1 47 47 GLY N N 47 102.340 102.340 102.386 -0.046 17919 112875 1 275 . 1 1 47 47 GLY C C 47 173.810 173.810 174.489 -0.679 17919 112876 1 275 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.191 0.159 17919 112877 1 275 . 1 1 47 47 GLY H H 47 8.130 8.130 8.459 -0.329 17919 112878 1 275 . 1 1 48 48 LYS N N 48 121.570 121.570 122.230 -0.660 17919 112879 1 275 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.509 0.113 17919 112880 1 275 . 1 1 48 48 LYS C C 48 174.700 174.700 175.884 -1.184 17919 112881 1 275 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.182 -0.632 17919 112882 1 275 . 1 1 48 48 LYS CB C 48 34.530 34.530 33.350 1.180 17919 112883 1 275 . 1 1 48 48 LYS H H 48 7.980 7.980 8.044 -0.064 17919 112884 1 275 . 1 1 49 49 GLN N N 49 122.410 122.410 123.514 -1.104 17919 112885 1 275 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.545 0.015 17919 112886 1 275 . 1 1 49 49 GLN C C 49 175.670 175.670 176.023 -0.353 17919 112887 1 275 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.657 0.083 17919 112888 1 275 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.487 -0.487 17919 112889 1 275 . 1 1 49 49 GLN H H 49 8.600 8.600 8.558 0.042 17919 112890 1 275 . 1 1 50 50 LEU N N 50 125.520 125.520 126.653 -1.133 17919 112891 1 275 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.395 -0.305 17919 112892 1 275 . 1 1 50 50 LEU C C 50 176.660 176.660 176.892 -0.232 17919 112893 1 275 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.353 -0.113 17919 112894 1 275 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.060 -0.490 17919 112895 1 275 . 1 1 50 50 LEU H H 50 8.530 8.530 8.107 0.423 17919 112896 1 275 . 1 1 51 51 GLU N N 51 122.940 122.940 123.877 -0.937 17919 112897 1 275 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.439 0.049 17919 112898 1 275 . 1 1 51 51 GLU C C 51 175.870 175.870 176.995 -1.125 17919 112899 1 275 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.831 0.128 17919 112900 1 275 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.552 0.018 17919 112901 1 275 . 1 1 51 51 GLU H H 51 8.400 8.400 8.579 -0.179 17919 112902 1 275 . 1 1 52 52 ASP N N 52 120.030 120.030 127.154 -7.124 17919 112903 1 275 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.439 -0.080 17919 112904 1 275 . 1 1 52 52 ASP C C 52 177.330 177.330 177.471 -0.141 17919 112905 1 275 . 1 1 52 52 ASP CA C 52 56.960 56.960 56.843 0.117 17919 112906 1 275 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.703 0.146 17919 112907 1 275 . 1 1 52 52 ASP H H 52 8.160 8.160 8.909 -0.749 17919 112908 1 275 . 1 1 53 53 GLY N N 53 106.660 106.660 105.055 1.605 17919 112909 1 275 . 1 1 53 53 GLY C C 53 174.870 174.870 174.172 0.698 17919 112910 1 275 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.964 0.206 17919 112911 1 275 . 1 1 53 53 GLY H H 53 9.390 9.390 8.584 0.806 17919 112912 1 275 . 1 1 54 54 ARG N N 54 119.050 119.050 120.845 -1.795 17919 112913 1 275 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.656 0.039 17919 112914 1 275 . 1 1 54 54 ARG C C 54 175.350 175.350 175.540 -0.190 17919 112915 1 275 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.204 0.186 17919 112916 1 275 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.242 0.408 17919 112917 1 275 . 1 1 54 54 ARG H H 54 7.460 7.460 7.432 0.028 17919 112918 1 275 . 1 1 55 55 THR N N 55 108.400 108.400 112.823 -4.423 17919 112919 1 275 . 1 1 55 55 THR HA H 55 5.240 5.240 5.076 0.164 17919 112920 1 275 . 1 1 55 55 THR C C 55 176.560 176.560 175.955 0.605 17919 112921 1 275 . 1 1 55 55 THR CA C 55 59.690 59.690 60.646 -0.956 17919 112922 1 275 . 1 1 55 55 THR CB C 55 72.260 72.260 70.725 1.534 17919 112923 1 275 . 1 1 55 55 THR H H 55 8.730 8.730 8.960 -0.230 17919 112924 1 275 . 1 1 56 56 LEU N N 56 117.920 117.920 121.501 -3.581 17919 112925 1 275 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.232 -0.172 17919 112926 1 275 . 1 1 56 56 LEU C C 56 180.810 180.810 179.083 1.727 17919 112927 1 275 . 1 1 56 56 LEU CA C 56 58.710 58.710 57.620 1.090 17919 112928 1 275 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.033 -0.663 17919 112929 1 275 . 1 1 56 56 LEU H H 56 8.140 8.140 8.582 -0.442 17919 112930 1 275 . 1 1 57 57 SER N N 57 113.330 113.330 115.103 -1.773 17919 112931 1 275 . 1 1 57 57 SER HA H 57 4.370 4.370 4.147 0.223 17919 112932 1 275 . 1 1 57 57 SER C C 57 178.310 178.310 176.918 1.392 17919 112933 1 275 . 1 1 57 57 SER CA C 57 61.080 61.080 61.755 -0.675 17919 112934 1 275 . 1 1 57 57 SER CB C 57 62.530 62.530 62.667 -0.137 17919 112935 1 275 . 1 1 57 57 SER H H 57 8.470 8.470 8.549 -0.079 17919 112936 1 275 . 1 1 58 58 ASP N N 58 124.190 124.190 121.904 2.286 17919 112937 1 275 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.405 -0.109 17919 112938 1 275 . 1 1 58 58 ASP C C 58 177.400 177.400 177.256 0.144 17919 112939 1 275 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.568 0.612 17919 112940 1 275 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.399 -0.299 17919 112941 1 275 . 1 1 58 58 ASP H H 58 7.930 7.930 7.765 0.165 17919 112942 1 275 . 1 1 59 59 TYR N N 59 115.510 115.510 115.738 -0.228 17919 112943 1 275 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.662 0.008 17919 112944 1 275 . 1 1 59 59 TYR C C 59 174.700 174.700 174.962 -0.262 17919 112945 1 275 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.640 0.610 17919 112946 1 275 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.630 1.440 17919 112947 1 275 . 1 1 59 59 TYR H H 59 7.250 7.250 7.429 -0.179 17919 112948 1 275 . 1 1 60 60 ASN N N 60 115.900 115.900 117.168 -1.268 17919 112949 1 275 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.365 -0.010 17919 112950 1 275 . 1 1 60 60 ASN C C 60 174.340 174.340 174.854 -0.514 17919 112951 1 275 . 1 1 60 60 ASN CA C 60 54.120 54.120 53.964 0.156 17919 112952 1 275 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.360 0.050 17919 112953 1 275 . 1 1 60 60 ASN H H 60 8.150 8.150 7.620 0.530 17919 112954 1 275 . 1 1 61 61 ILE N N 61 118.600 118.600 120.554 -1.954 17919 112955 1 275 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.878 -0.485 17919 112956 1 275 . 1 1 61 61 ILE C C 61 174.610 174.610 175.025 -0.415 17919 112957 1 275 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.300 0.120 17919 112958 1 275 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.510 -0.770 17919 112959 1 275 . 1 1 61 61 ILE H H 61 7.250 7.250 7.750 -0.500 17919 112960 1 275 . 1 1 62 62 GLN N N 62 124.740 124.740 124.824 -0.084 17919 112961 1 275 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.758 -0.252 17919 112962 1 275 . 1 1 62 62 GLN C C 62 175.970 175.970 175.768 0.202 17919 112963 1 275 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.381 0.279 17919 112964 1 275 . 1 1 62 62 GLN CB C 62 31.650 31.650 32.170 -0.521 17919 112965 1 275 . 1 1 62 62 GLN H H 62 7.610 7.610 7.807 -0.197 17919 112966 1 275 . 1 1 63 63 LYS N N 63 120.300 120.300 121.834 -1.534 17919 112967 1 275 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.994 0.007 17919 112968 1 275 . 1 1 63 63 LYS C C 63 175.810 175.810 177.423 -1.613 17919 112969 1 275 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.206 -0.416 17919 112970 1 275 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.517 0.133 17919 112971 1 275 . 1 1 63 63 LYS H H 63 8.490 8.490 8.675 -0.185 17919 112972 1 275 . 1 1 64 64 GLU N N 64 113.950 113.950 120.474 -6.524 17919 112973 1 275 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.693 -0.228 17919 112974 1 275 . 1 1 64 64 GLU C C 64 175.250 175.250 175.882 -0.632 17919 112975 1 275 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.929 -0.039 17919 112976 1 275 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.702 -2.802 17919 112977 1 275 . 1 1 64 64 GLU H H 64 9.280 9.280 8.545 0.735 17919 112978 1 275 . 1 1 65 65 SER N N 65 114.730 114.730 115.831 -1.101 17919 112979 1 275 . 1 1 65 65 SER HA H 65 4.640 4.640 4.564 0.076 17919 112980 1 275 . 1 1 65 65 SER C C 65 172.160 172.160 173.670 -1.510 17919 112981 1 275 . 1 1 65 65 SER CA C 65 60.890 60.890 60.527 0.363 17919 112982 1 275 . 1 1 65 65 SER CB C 65 64.910 64.910 63.968 0.942 17919 112983 1 275 . 1 1 65 65 SER H H 65 7.670 7.670 7.728 -0.058 17919 112984 1 275 . 1 1 66 66 THR N N 66 117.110 117.110 118.967 -1.857 17919 112985 1 275 . 1 1 66 66 THR HA H 66 5.270 5.270 5.219 0.051 17919 112986 1 275 . 1 1 66 66 THR C C 66 173.950 173.950 173.888 0.062 17919 112987 1 275 . 1 1 66 66 THR CA C 66 62.340 62.340 62.121 0.219 17919 112988 1 275 . 1 1 66 66 THR CB C 66 70.080 70.080 69.975 0.105 17919 112989 1 275 . 1 1 66 66 THR H H 66 8.730 8.730 8.359 0.371 17919 112990 1 275 . 1 1 67 67 LEU N N 67 127.110 127.110 126.120 0.990 17919 112991 1 275 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.832 0.228 17919 112992 1 275 . 1 1 67 67 LEU C C 67 175.770 175.770 175.088 0.682 17919 112993 1 275 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.852 0.048 17919 112994 1 275 . 1 1 67 67 LEU CB C 67 44.260 44.260 45.133 -0.873 17919 112995 1 275 . 1 1 67 67 LEU H H 67 9.410 9.410 9.211 0.199 17919 112996 1 275 . 1 1 68 68 HIS N N 68 118.380 118.380 121.944 -3.564 17919 112997 1 275 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.561 -0.321 17919 112998 1 275 . 1 1 68 68 HIS C C 68 173.150 173.150 173.372 -0.222 17919 112999 1 275 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.213 0.787 17919 113000 1 275 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.804 -2.274 17919 113001 1 275 . 1 1 68 68 HIS H H 68 9.230 9.230 8.479 0.751 17919 113002 1 275 . 1 1 69 69 LEU N N 69 124.460 124.460 129.256 -4.796 17919 113003 1 275 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.199 -0.009 17919 113004 1 275 . 1 1 69 69 LEU C C 69 175.270 175.270 174.264 1.006 17919 113005 1 275 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.301 0.589 17919 113006 1 275 . 1 1 69 69 LEU CB C 69 44.380 44.380 45.535 -1.155 17919 113007 1 275 . 1 1 69 69 LEU H H 69 8.340 8.340 8.019 0.321 17919 113008 1 275 . 1 1 70 70 VAL N N 70 126.940 126.940 120.797 6.143 17919 113009 1 275 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.520 -0.170 17919 113010 1 275 . 1 1 70 70 VAL C C 70 174.000 174.000 173.576 0.424 17919 113011 1 275 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.331 0.469 17919 113012 1 275 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.870 -0.960 17919 113013 1 275 . 1 1 70 70 VAL H H 70 9.200 9.200 8.678 0.522 17919 113014 1 275 . 1 1 71 71 LEU N N 71 123.130 123.130 122.196 0.934 17919 113015 1 275 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.208 -0.148 17919 113016 1 275 . 1 1 71 71 LEU C C 71 177.830 177.830 178.096 -0.266 17919 113017 1 275 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.636 0.304 17919 113018 1 275 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.375 -0.525 17919 113019 1 275 . 1 1 71 71 LEU H H 71 8.120 8.120 8.453 -0.333 17919 113020 1 275 . 1 1 72 72 ARG N N 72 123.490 123.490 122.334 1.156 17919 113021 1 275 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.330 -0.029 17919 113022 1 275 . 1 1 72 72 ARG C C 72 175.350 175.350 176.085 -0.735 17919 113023 1 275 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.498 0.112 17919 113024 1 275 . 1 1 72 72 ARG CB C 72 31.350 31.350 27.951 3.399 17919 113025 1 275 . 1 1 72 72 ARG H H 72 8.580 8.580 8.470 0.110 17919 113026 1 276 . 1 1 2 2 GLN N N 2 123.220 123.220 120.687 2.533 17919 113027 1 276 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.472 -0.223 17919 113028 1 276 . 1 1 2 2 GLN C C 2 175.920 175.920 174.618 1.302 17919 113029 1 276 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.403 0.677 17919 113030 1 276 . 1 1 2 2 GLN CB C 2 30.760 30.760 31.701 -0.941 17919 113031 1 276 . 1 1 2 2 GLN H H 2 8.900 8.900 8.342 0.558 17919 113032 1 276 . 1 1 3 3 ILE N N 3 115.340 115.340 117.666 -2.326 17919 113033 1 276 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.314 -0.101 17919 113034 1 276 . 1 1 3 3 ILE C C 3 172.450 172.450 173.260 -0.810 17919 113035 1 276 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.693 -0.123 17919 113036 1 276 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.964 0.246 17919 113037 1 276 . 1 1 3 3 ILE H H 3 8.320 8.320 8.512 -0.192 17919 113038 1 276 . 1 1 4 4 PHE N N 4 118.110 118.110 120.980 -2.870 17919 113039 1 276 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.268 0.362 17919 113040 1 276 . 1 1 4 4 PHE C C 4 175.320 175.320 174.919 0.401 17919 113041 1 276 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.012 0.198 17919 113042 1 276 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.050 0.430 17919 113043 1 276 . 1 1 4 4 PHE H H 4 8.610 8.610 8.740 -0.130 17919 113044 1 276 . 1 1 5 5 VAL N N 5 121.000 121.000 122.539 -1.539 17919 113045 1 276 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.697 0.028 17919 113046 1 276 . 1 1 5 5 VAL C C 5 174.870 174.870 174.950 -0.080 17919 113047 1 276 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.350 -0.730 17919 113048 1 276 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.503 0.727 17919 113049 1 276 . 1 1 5 5 VAL H H 5 9.300 9.300 9.438 -0.138 17919 113050 1 276 . 1 1 6 6 LYS N N 6 127.520 127.520 129.177 -1.657 17919 113051 1 276 . 1 1 6 6 LYS HA H 6 5.367 5.367 4.590 0.777 17919 113052 1 276 . 1 1 6 6 LYS C C 6 177.140 177.140 175.770 1.370 17919 113053 1 276 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.956 -0.436 17919 113054 1 276 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.056 -0.007 17919 113055 1 276 . 1 1 6 6 LYS H H 6 8.820 8.820 9.288 -0.468 17919 113056 1 276 . 1 1 7 7 THR N N 7 115.400 115.400 116.597 -1.197 17919 113057 1 276 . 1 1 7 7 THR HA H 7 4.970 4.970 4.957 0.013 17919 113058 1 276 . 1 1 7 7 THR C C 7 176.910 176.910 175.934 0.976 17919 113059 1 276 . 1 1 7 7 THR CA C 7 60.470 60.470 59.932 0.538 17919 113060 1 276 . 1 1 7 7 THR CB C 7 70.630 70.630 70.636 -0.006 17919 113061 1 276 . 1 1 7 7 THR H H 7 8.730 8.730 8.226 0.504 17919 113062 1 276 . 1 1 8 8 LEU N N 8 121.330 121.330 120.317 1.013 17919 113063 1 276 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.598 -0.288 17919 113064 1 276 . 1 1 8 8 LEU C C 8 178.800 178.800 177.568 1.232 17919 113065 1 276 . 1 1 8 8 LEU CA C 8 57.580 57.580 56.940 0.640 17919 113066 1 276 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.835 0.135 17919 113067 1 276 . 1 1 8 8 LEU H H 8 9.100 9.100 8.814 0.286 17919 113068 1 276 . 1 1 9 9 THR N N 9 105.590 105.590 109.931 -4.341 17919 113069 1 276 . 1 1 9 9 THR HA H 9 4.428 4.428 4.293 0.135 17919 113070 1 276 . 1 1 9 9 THR C C 9 175.520 175.520 175.541 -0.021 17919 113071 1 276 . 1 1 9 9 THR CA C 9 61.400 61.400 62.292 -0.892 17919 113072 1 276 . 1 1 9 9 THR CB C 9 69.140 69.140 69.153 -0.013 17919 113073 1 276 . 1 1 9 9 THR H H 9 7.630 7.630 7.795 -0.165 17919 113074 1 276 . 1 1 10 10 GLY N N 10 108.890 108.890 110.887 -1.997 17919 113075 1 276 . 1 1 10 10 GLY C C 10 174.070 174.070 173.436 0.634 17919 113076 1 276 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.863 0.597 17919 113077 1 276 . 1 1 10 10 GLY H H 10 7.810 7.810 7.551 0.259 17919 113078 1 276 . 1 1 11 11 LYS N N 11 121.600 121.600 122.784 -1.184 17919 113079 1 276 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.488 -0.127 17919 113080 1 276 . 1 1 11 11 LYS C C 11 175.940 175.940 176.124 -0.184 17919 113081 1 276 . 1 1 11 11 LYS CA C 11 56.280 56.280 55.194 1.086 17919 113082 1 276 . 1 1 11 11 LYS CB C 11 33.200 33.200 32.818 0.382 17919 113083 1 276 . 1 1 11 11 LYS H H 11 7.280 7.280 7.582 -0.302 17919 113084 1 276 . 1 1 12 12 THR N N 12 120.440 120.440 123.478 -3.038 17919 113085 1 276 . 1 1 12 12 THR HA H 12 5.046 5.046 4.391 0.655 17919 113086 1 276 . 1 1 12 12 THR C C 12 174.320 174.320 175.059 -0.739 17919 113087 1 276 . 1 1 12 12 THR CA C 12 62.390 62.390 64.087 -1.697 17919 113088 1 276 . 1 1 12 12 THR CB C 12 69.910 69.910 68.659 1.251 17919 113089 1 276 . 1 1 12 12 THR H H 12 8.650 8.650 8.417 0.233 17919 113090 1 276 . 1 1 13 13 ILE N N 13 127.110 127.110 122.585 4.525 17919 113091 1 276 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.688 -0.144 17919 113092 1 276 . 1 1 13 13 ILE C C 13 175.220 175.220 174.850 0.370 17919 113093 1 276 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.804 0.176 17919 113094 1 276 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.311 0.639 17919 113095 1 276 . 1 1 13 13 ILE H H 13 9.450 9.450 8.985 0.465 17919 113096 1 276 . 1 1 14 14 THR N N 14 121.520 121.520 122.051 -0.531 17919 113097 1 276 . 1 1 14 14 THR HA H 14 4.964 4.964 4.996 -0.032 17919 113098 1 276 . 1 1 14 14 THR C C 14 173.790 173.790 173.467 0.323 17919 113099 1 276 . 1 1 14 14 THR CA C 14 61.940 61.940 61.987 -0.047 17919 113100 1 276 . 1 1 14 14 THR CB C 14 69.650 69.650 69.990 -0.340 17919 113101 1 276 . 1 1 14 14 THR H H 14 8.710 8.710 8.445 0.265 17919 113102 1 276 . 1 1 15 15 LEU N N 15 124.800 124.800 126.656 -1.856 17919 113103 1 276 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.759 0.021 17919 113104 1 276 . 1 1 15 15 LEU C C 15 174.670 174.670 175.178 -0.508 17919 113105 1 276 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.697 -0.867 17919 113106 1 276 . 1 1 15 15 LEU CB C 15 47.070 47.070 46.209 0.861 17919 113107 1 276 . 1 1 15 15 LEU H H 15 8.710 8.710 8.576 0.134 17919 113108 1 276 . 1 1 16 16 GLU N N 16 122.160 122.160 123.027 -0.867 17919 113109 1 276 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.334 -0.417 17919 113110 1 276 . 1 1 16 16 GLU C C 16 175.860 175.860 175.825 0.035 17919 113111 1 276 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.616 -0.796 17919 113112 1 276 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.996 -1.546 17919 113113 1 276 . 1 1 16 16 GLU H H 16 8.140 8.140 8.761 -0.621 17919 113114 1 276 . 1 1 17 17 VAL N N 17 117.210 117.210 119.613 -2.403 17919 113115 1 276 . 1 1 17 17 VAL HA H 17 4.714 4.714 5.019 -0.305 17919 113116 1 276 . 1 1 17 17 VAL C C 17 174.160 174.160 174.703 -0.543 17919 113117 1 276 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.061 -0.631 17919 113118 1 276 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.972 0.428 17919 113119 1 276 . 1 1 17 17 VAL H H 17 8.900 8.900 8.943 -0.043 17919 113120 1 276 . 1 1 18 18 GLU N N 18 118.990 118.990 122.047 -3.057 17919 113121 1 276 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.856 0.223 17919 113122 1 276 . 1 1 18 18 GLU C C 18 176.160 176.160 175.236 0.924 17919 113123 1 276 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.494 0.226 17919 113124 1 276 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.171 0.140 17919 113125 1 276 . 1 1 18 18 GLU H H 18 8.640 8.640 8.613 0.027 17919 113126 1 276 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.337 -0.196 17919 113127 1 276 . 1 1 19 19 PRO C C 19 175.310 175.310 177.625 -2.315 17919 113128 1 276 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.294 0.176 17919 113129 1 276 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.932 0.018 17919 113130 1 276 . 1 1 20 20 SER N N 20 103.400 103.400 110.700 -7.300 17919 113131 1 276 . 1 1 20 20 SER HA H 20 4.370 4.370 4.270 0.100 17919 113132 1 276 . 1 1 20 20 SER C C 20 174.660 174.660 174.546 0.114 17919 113133 1 276 . 1 1 20 20 SER CA C 20 57.400 57.400 58.610 -1.210 17919 113134 1 276 . 1 1 20 20 SER CB C 20 63.370 63.370 62.587 0.784 17919 113135 1 276 . 1 1 20 20 SER H H 20 7.040 7.040 8.258 -1.218 17919 113136 1 276 . 1 1 21 21 ASP N N 21 123.480 123.480 124.146 -0.666 17919 113137 1 276 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.781 -0.086 17919 113138 1 276 . 1 1 21 21 ASP C C 21 176.360 176.360 176.075 0.285 17919 113139 1 276 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.857 0.843 17919 113140 1 276 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.778 -0.978 17919 113141 1 276 . 1 1 21 21 ASP H H 21 8.030 8.030 7.861 0.169 17919 113142 1 276 . 1 1 22 22 THR N N 22 108.800 108.800 113.046 -4.246 17919 113143 1 276 . 1 1 22 22 THR HA H 22 4.920 4.920 4.690 0.230 17919 113144 1 276 . 1 1 22 22 THR C C 22 176.750 176.750 176.149 0.601 17919 113145 1 276 . 1 1 22 22 THR CA C 22 59.690 59.690 61.137 -1.447 17919 113146 1 276 . 1 1 22 22 THR CB C 22 71.200 71.200 70.496 0.703 17919 113147 1 276 . 1 1 22 22 THR H H 22 7.900 7.900 8.173 -0.273 17919 113148 1 276 . 1 1 23 23 ILE N N 23 121.190 121.190 121.753 -0.563 17919 113149 1 276 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.857 -0.200 17919 113150 1 276 . 1 1 23 23 ILE C C 23 179.040 179.040 177.734 1.306 17919 113151 1 276 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.552 -0.292 17919 113152 1 276 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.079 -1.729 17919 113153 1 276 . 1 1 23 23 ILE H H 23 8.560 8.560 8.709 -0.149 17919 113154 1 276 . 1 1 24 24 GLU N N 24 120.830 120.830 121.990 -1.160 17919 113155 1 276 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.926 -0.009 17919 113156 1 276 . 1 1 24 24 GLU C C 24 178.640 178.640 178.359 0.281 17919 113157 1 276 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.953 0.267 17919 113158 1 276 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.585 -1.305 17919 113159 1 276 . 1 1 24 24 GLU H H 24 9.760 9.760 8.500 1.260 17919 113160 1 276 . 1 1 25 25 ASN N N 25 120.570 120.570 118.010 2.560 17919 113161 1 276 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.511 0.014 17919 113162 1 276 . 1 1 25 25 ASN C C 25 178.380 178.380 177.991 0.389 17919 113163 1 276 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.004 0.056 17919 113164 1 276 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.759 -0.309 17919 113165 1 276 . 1 1 25 25 ASN H H 25 7.920 7.920 7.806 0.114 17919 113166 1 276 . 1 1 26 26 VAL N N 26 121.710 121.710 120.835 0.875 17919 113167 1 276 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.565 -0.168 17919 113168 1 276 . 1 1 26 26 VAL C C 26 177.950 177.950 177.689 0.261 17919 113169 1 276 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.686 0.974 17919 113170 1 276 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.533 -0.693 17919 113171 1 276 . 1 1 26 26 VAL H H 26 8.070 8.070 8.187 -0.117 17919 113172 1 276 . 1 1 27 27 LYS N N 27 118.860 118.860 119.923 -1.063 17919 113173 1 276 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.218 0.362 17919 113174 1 276 . 1 1 27 27 LYS C C 27 180.550 180.550 179.037 1.513 17919 113175 1 276 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.698 -0.448 17919 113176 1 276 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.278 1.452 17919 113177 1 276 . 1 1 27 27 LYS H H 27 8.560 8.560 8.070 0.490 17919 113178 1 276 . 1 1 28 28 ALA N N 28 123.440 123.440 121.822 1.618 17919 113179 1 276 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.051 0.109 17919 113180 1 276 . 1 1 28 28 ALA C C 28 180.300 180.300 179.136 1.164 17919 113181 1 276 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.096 0.274 17919 113182 1 276 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.331 -0.621 17919 113183 1 276 . 1 1 28 28 ALA H H 28 8.060 8.060 8.189 -0.129 17919 113184 1 276 . 1 1 29 29 LYS N N 29 119.940 119.940 119.573 0.367 17919 113185 1 276 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.000 0.207 17919 113186 1 276 . 1 1 29 29 LYS C C 29 180.320 180.320 179.061 1.259 17919 113187 1 276 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.249 0.401 17919 113188 1 276 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.376 0.914 17919 113189 1 276 . 1 1 29 29 LYS H H 29 7.850 7.850 7.671 0.179 17919 113190 1 276 . 1 1 30 30 ILE N N 30 121.080 121.080 120.460 0.620 17919 113191 1 276 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.575 -0.068 17919 113192 1 276 . 1 1 30 30 ILE C C 30 178.310 178.310 177.345 0.965 17919 113193 1 276 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.082 1.068 17919 113194 1 276 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.675 -0.875 17919 113195 1 276 . 1 1 30 30 ILE H H 30 8.280 8.280 8.433 -0.153 17919 113196 1 276 . 1 1 31 31 GLN N N 31 123.490 123.490 120.827 2.663 17919 113197 1 276 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.129 -0.300 17919 113198 1 276 . 1 1 31 31 GLN C C 31 178.890 178.890 178.398 0.492 17919 113199 1 276 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.261 0.739 17919 113200 1 276 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.443 -0.723 17919 113201 1 276 . 1 1 31 31 GLN H H 31 8.580 8.580 7.937 0.643 17919 113202 1 276 . 1 1 32 32 ASP N N 32 119.360 119.360 118.322 1.038 17919 113203 1 276 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.440 -0.086 17919 113204 1 276 . 1 1 32 32 ASP C C 32 177.250 177.250 177.698 -0.448 17919 113205 1 276 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.463 0.727 17919 113206 1 276 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.718 -0.138 17919 113207 1 276 . 1 1 32 32 ASP H H 32 8.010 8.010 7.862 0.148 17919 113208 1 276 . 1 1 33 33 LYS N N 33 115.130 115.130 118.813 -3.683 17919 113209 1 276 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.288 0.049 17919 113210 1 276 . 1 1 33 33 LYS C C 33 177.870 177.870 178.350 -0.480 17919 113211 1 276 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.303 -0.253 17919 113212 1 276 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.241 0.929 17919 113213 1 276 . 1 1 33 33 LYS H H 33 7.430 7.430 7.492 -0.062 17919 113214 1 276 . 1 1 34 34 GLU N N 34 113.870 113.870 115.409 -1.539 17919 113215 1 276 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.420 0.205 17919 113216 1 276 . 1 1 34 34 GLU C C 34 177.840 177.840 177.594 0.246 17919 113217 1 276 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.116 -0.946 17919 113218 1 276 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.200 1.460 17919 113219 1 276 . 1 1 34 34 GLU H H 34 8.740 8.740 8.029 0.711 17919 113220 1 276 . 1 1 35 35 GLY N N 35 108.650 108.650 108.537 0.113 17919 113221 1 276 . 1 1 35 35 GLY C C 35 173.960 173.960 174.175 -0.215 17919 113222 1 276 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.573 0.507 17919 113223 1 276 . 1 1 35 35 GLY H H 35 8.530 8.530 8.445 0.085 17919 113224 1 276 . 1 1 36 36 ILE N N 36 119.880 119.880 122.180 -2.300 17919 113225 1 276 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.334 0.111 17919 113226 1 276 . 1 1 36 36 ILE C C 36 173.590 173.590 174.101 -0.511 17919 113227 1 276 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.941 -0.191 17919 113228 1 276 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.348 2.232 17919 113229 1 276 . 1 1 36 36 ILE H H 36 6.150 6.150 7.712 -1.562 17919 113230 1 276 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.785 -0.151 17919 113231 1 276 . 1 1 37 37 PRO C C 37 176.940 176.940 176.218 0.722 17919 113232 1 276 . 1 1 37 37 PRO CA C 37 61.660 61.660 62.019 -0.359 17919 113233 1 276 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.206 0.644 17919 113234 1 276 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.182 -0.065 17919 113235 1 276 . 1 1 38 38 PRO C C 38 178.320 178.320 178.336 -0.016 17919 113236 1 276 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.636 0.624 17919 113237 1 276 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.791 1.099 17919 113238 1 276 . 1 1 39 39 ASP N N 39 113.380 113.380 117.411 -4.031 17919 113239 1 276 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.338 0.092 17919 113240 1 276 . 1 1 39 39 ASP C C 39 177.090 177.090 177.091 -0.001 17919 113241 1 276 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.863 -1.223 17919 113242 1 276 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.368 -0.828 17919 113243 1 276 . 1 1 39 39 ASP H H 39 8.550 8.550 8.843 -0.293 17919 113244 1 276 . 1 1 40 40 GLN N N 40 116.780 116.780 116.773 0.007 17919 113245 1 276 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.672 -0.208 17919 113246 1 276 . 1 1 40 40 GLN C C 40 175.380 175.380 175.755 -0.375 17919 113247 1 276 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.142 0.498 17919 113248 1 276 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.375 0.765 17919 113249 1 276 . 1 1 40 40 GLN H H 40 7.820 7.820 7.719 0.101 17919 113250 1 276 . 1 1 41 41 GLN N N 41 117.720 117.720 120.058 -2.338 17919 113251 1 276 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.600 -0.356 17919 113252 1 276 . 1 1 41 41 GLN C C 41 176.300 176.300 174.485 1.815 17919 113253 1 276 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.517 0.953 17919 113254 1 276 . 1 1 41 41 GLN CB C 41 31.650 31.650 30.789 0.861 17919 113255 1 276 . 1 1 41 41 GLN H H 41 7.480 7.480 7.481 -0.001 17919 113256 1 276 . 1 1 42 42 ARG N N 42 122.680 122.680 125.581 -2.901 17919 113257 1 276 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.707 -0.207 17919 113258 1 276 . 1 1 42 42 ARG C C 42 174.050 174.050 173.653 0.397 17919 113259 1 276 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.870 0.180 17919 113260 1 276 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.742 -0.992 17919 113261 1 276 . 1 1 42 42 ARG H H 42 8.530 8.530 8.857 -0.327 17919 113262 1 276 . 1 1 43 43 LEU N N 43 124.040 124.040 128.178 -4.138 17919 113263 1 276 . 1 1 43 43 LEU C C 43 175.290 175.290 175.715 -0.425 17919 113264 1 276 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.789 -0.809 17919 113265 1 276 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.928 1.862 17919 113266 1 276 . 1 1 43 43 LEU H H 43 8.820 8.820 8.781 0.039 17919 113267 1 276 . 1 1 44 44 ILE N N 44 121.920 121.920 122.904 -0.984 17919 113268 1 276 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.815 0.177 17919 113269 1 276 . 1 1 44 44 ILE C C 44 176.060 176.060 174.327 1.733 17919 113270 1 276 . 1 1 44 44 ILE CA C 44 58.980 58.980 58.813 0.167 17919 113271 1 276 . 1 1 44 44 ILE CB C 44 41.420 41.420 39.021 2.399 17919 113272 1 276 . 1 1 44 44 ILE H H 44 9.030 9.030 8.969 0.061 17919 113273 1 276 . 1 1 45 45 PHE N N 45 125.390 125.390 127.763 -2.373 17919 113274 1 276 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.963 0.082 17919 113275 1 276 . 1 1 45 45 PHE C C 45 174.470 174.470 174.373 0.097 17919 113276 1 276 . 1 1 45 45 PHE CA C 45 57.020 57.020 55.888 1.133 17919 113277 1 276 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.570 1.190 17919 113278 1 276 . 1 1 45 45 PHE H H 45 8.830 8.830 9.068 -0.238 17919 113279 1 276 . 1 1 46 46 ALA N N 46 132.200 132.200 130.830 1.370 17919 113280 1 276 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.816 -0.126 17919 113281 1 276 . 1 1 46 46 ALA C C 46 177.290 177.290 177.676 -0.386 17919 113282 1 276 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.301 0.239 17919 113283 1 276 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.491 0.079 17919 113284 1 276 . 1 1 46 46 ALA H H 46 8.810 8.810 8.965 -0.155 17919 113285 1 276 . 1 1 47 47 GLY N N 47 102.340 102.340 104.646 -2.306 17919 113286 1 276 . 1 1 47 47 GLY C C 47 173.810 173.810 174.078 -0.268 17919 113287 1 276 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.044 0.306 17919 113288 1 276 . 1 1 47 47 GLY H H 47 8.130 8.130 8.514 -0.384 17919 113289 1 276 . 1 1 48 48 LYS N N 48 121.570 121.570 120.701 0.869 17919 113290 1 276 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.595 0.027 17919 113291 1 276 . 1 1 48 48 LYS C C 48 174.700 174.700 175.259 -0.559 17919 113292 1 276 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.291 0.259 17919 113293 1 276 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.439 0.091 17919 113294 1 276 . 1 1 48 48 LYS H H 48 7.980 7.980 7.759 0.221 17919 113295 1 276 . 1 1 49 49 GLN N N 49 122.410 122.410 124.193 -1.783 17919 113296 1 276 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.826 -0.266 17919 113297 1 276 . 1 1 49 49 GLN C C 49 175.670 175.670 175.937 -0.267 17919 113298 1 276 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.958 -0.218 17919 113299 1 276 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.358 -0.358 17919 113300 1 276 . 1 1 49 49 GLN H H 49 8.600 8.600 8.562 0.038 17919 113301 1 276 . 1 1 50 50 LEU N N 50 125.520 125.520 127.460 -1.940 17919 113302 1 276 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.352 -0.262 17919 113303 1 276 . 1 1 50 50 LEU C C 50 176.660 176.660 176.141 0.519 17919 113304 1 276 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.891 0.349 17919 113305 1 276 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.917 -1.347 17919 113306 1 276 . 1 1 50 50 LEU H H 50 8.530 8.530 8.416 0.114 17919 113307 1 276 . 1 1 51 51 GLU N N 51 122.940 122.940 121.666 1.274 17919 113308 1 276 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.543 -0.055 17919 113309 1 276 . 1 1 51 51 GLU C C 51 175.870 175.870 177.172 -1.302 17919 113310 1 276 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.448 0.512 17919 113311 1 276 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.670 -0.100 17919 113312 1 276 . 1 1 51 51 GLU H H 51 8.400 8.400 8.600 -0.200 17919 113313 1 276 . 1 1 52 52 ASP N N 52 120.030 120.030 126.647 -6.617 17919 113314 1 276 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.432 -0.073 17919 113315 1 276 . 1 1 52 52 ASP C C 52 177.330 177.330 177.742 -0.412 17919 113316 1 276 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.882 -0.922 17919 113317 1 276 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.737 0.112 17919 113318 1 276 . 1 1 52 52 ASP H H 52 8.160 8.160 8.901 -0.741 17919 113319 1 276 . 1 1 53 53 GLY N N 53 106.660 106.660 104.563 2.097 17919 113320 1 276 . 1 1 53 53 GLY C C 53 174.870 174.870 174.169 0.701 17919 113321 1 276 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.790 0.380 17919 113322 1 276 . 1 1 53 53 GLY H H 53 9.390 9.390 8.409 0.981 17919 113323 1 276 . 1 1 54 54 ARG N N 54 119.050 119.050 120.435 -1.385 17919 113324 1 276 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.738 -0.043 17919 113325 1 276 . 1 1 54 54 ARG C C 54 175.350 175.350 175.777 -0.427 17919 113326 1 276 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.046 0.344 17919 113327 1 276 . 1 1 54 54 ARG CB C 54 32.650 32.650 31.820 0.830 17919 113328 1 276 . 1 1 54 54 ARG H H 54 7.460 7.460 7.556 -0.096 17919 113329 1 276 . 1 1 55 55 THR N N 55 108.400 108.400 112.216 -3.816 17919 113330 1 276 . 1 1 55 55 THR HA H 55 5.240 5.240 4.832 0.408 17919 113331 1 276 . 1 1 55 55 THR C C 55 176.560 176.560 176.053 0.507 17919 113332 1 276 . 1 1 55 55 THR CA C 55 59.690 59.690 60.877 -1.188 17919 113333 1 276 . 1 1 55 55 THR CB C 55 72.260 72.260 70.842 1.418 17919 113334 1 276 . 1 1 55 55 THR H H 55 8.730 8.730 8.974 -0.244 17919 113335 1 276 . 1 1 56 56 LEU N N 56 117.920 117.920 123.106 -5.186 17919 113336 1 276 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.960 0.100 17919 113337 1 276 . 1 1 56 56 LEU C C 56 180.810 180.810 178.991 1.819 17919 113338 1 276 . 1 1 56 56 LEU CA C 56 58.710 58.710 59.033 -0.323 17919 113339 1 276 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.545 -1.175 17919 113340 1 276 . 1 1 56 56 LEU H H 56 8.140 8.140 8.348 -0.208 17919 113341 1 276 . 1 1 57 57 SER N N 57 113.330 113.330 115.669 -2.339 17919 113342 1 276 . 1 1 57 57 SER HA H 57 4.370 4.370 4.106 0.264 17919 113343 1 276 . 1 1 57 57 SER C C 57 178.310 178.310 176.757 1.553 17919 113344 1 276 . 1 1 57 57 SER CA C 57 61.080 61.080 62.296 -1.216 17919 113345 1 276 . 1 1 57 57 SER CB C 57 62.530 62.530 62.619 -0.089 17919 113346 1 276 . 1 1 57 57 SER H H 57 8.470 8.470 7.998 0.472 17919 113347 1 276 . 1 1 58 58 ASP N N 58 124.190 124.190 121.109 3.081 17919 113348 1 276 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.362 -0.066 17919 113349 1 276 . 1 1 58 58 ASP C C 58 177.400 177.400 177.180 0.220 17919 113350 1 276 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.766 0.414 17919 113351 1 276 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.488 -0.388 17919 113352 1 276 . 1 1 58 58 ASP H H 58 7.930 7.930 8.099 -0.169 17919 113353 1 276 . 1 1 59 59 TYR N N 59 115.510 115.510 115.852 -0.342 17919 113354 1 276 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.729 -0.059 17919 113355 1 276 . 1 1 59 59 TYR C C 59 174.700 174.700 174.999 -0.299 17919 113356 1 276 . 1 1 59 59 TYR CA C 59 58.250 58.250 56.416 1.834 17919 113357 1 276 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.457 1.613 17919 113358 1 276 . 1 1 59 59 TYR H H 59 7.250 7.250 7.319 -0.069 17919 113359 1 276 . 1 1 60 60 ASN N N 60 115.900 115.900 119.260 -3.360 17919 113360 1 276 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.345 0.010 17919 113361 1 276 . 1 1 60 60 ASN C C 60 174.340 174.340 174.961 -0.621 17919 113362 1 276 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.321 -0.201 17919 113363 1 276 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.541 -0.131 17919 113364 1 276 . 1 1 60 60 ASN H H 60 8.150 8.150 7.858 0.292 17919 113365 1 276 . 1 1 61 61 ILE N N 61 118.600 118.600 119.747 -1.147 17919 113366 1 276 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.902 -0.509 17919 113367 1 276 . 1 1 61 61 ILE C C 61 174.610 174.610 174.830 -0.220 17919 113368 1 276 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.351 0.069 17919 113369 1 276 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.706 -0.966 17919 113370 1 276 . 1 1 61 61 ILE H H 61 7.250 7.250 7.824 -0.574 17919 113371 1 276 . 1 1 62 62 GLN N N 62 124.740 124.740 124.682 0.058 17919 113372 1 276 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.740 -0.234 17919 113373 1 276 . 1 1 62 62 GLN C C 62 175.970 175.970 175.434 0.536 17919 113374 1 276 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.287 0.373 17919 113375 1 276 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.289 0.361 17919 113376 1 276 . 1 1 62 62 GLN H H 62 7.610 7.610 7.981 -0.371 17919 113377 1 276 . 1 1 63 63 LYS N N 63 120.300 120.300 121.778 -1.478 17919 113378 1 276 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.983 0.018 17919 113379 1 276 . 1 1 63 63 LYS C C 63 175.810 175.810 176.766 -0.956 17919 113380 1 276 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.790 0.000 17919 113381 1 276 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.433 0.217 17919 113382 1 276 . 1 1 63 63 LYS H H 63 8.490 8.490 8.560 -0.070 17919 113383 1 276 . 1 1 64 64 GLU N N 64 113.950 113.950 122.207 -8.257 17919 113384 1 276 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.309 0.156 17919 113385 1 276 . 1 1 64 64 GLU C C 64 175.250 175.250 175.709 -0.459 17919 113386 1 276 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.314 0.576 17919 113387 1 276 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.300 -2.400 17919 113388 1 276 . 1 1 64 64 GLU H H 64 9.280 9.280 8.734 0.546 17919 113389 1 276 . 1 1 65 65 SER N N 65 114.730 114.730 114.352 0.378 17919 113390 1 276 . 1 1 65 65 SER HA H 65 4.640 4.640 4.432 0.208 17919 113391 1 276 . 1 1 65 65 SER C C 65 172.160 172.160 173.991 -1.831 17919 113392 1 276 . 1 1 65 65 SER CA C 65 60.890 60.890 60.175 0.715 17919 113393 1 276 . 1 1 65 65 SER CB C 65 64.910 64.910 64.209 0.701 17919 113394 1 276 . 1 1 65 65 SER H H 65 7.670 7.670 7.439 0.231 17919 113395 1 276 . 1 1 66 66 THR N N 66 117.110 117.110 118.695 -1.585 17919 113396 1 276 . 1 1 66 66 THR HA H 66 5.270 5.270 5.347 -0.077 17919 113397 1 276 . 1 1 66 66 THR C C 66 173.950 173.950 174.163 -0.213 17919 113398 1 276 . 1 1 66 66 THR CA C 66 62.340 62.340 61.969 0.371 17919 113399 1 276 . 1 1 66 66 THR CB C 66 70.080 70.080 69.975 0.105 17919 113400 1 276 . 1 1 66 66 THR H H 66 8.730 8.730 8.441 0.289 17919 113401 1 276 . 1 1 67 67 LEU N N 67 127.110 127.110 126.694 0.416 17919 113402 1 276 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.808 0.252 17919 113403 1 276 . 1 1 67 67 LEU C C 67 175.770 175.770 175.071 0.699 17919 113404 1 276 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.672 0.228 17919 113405 1 276 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.189 0.071 17919 113406 1 276 . 1 1 67 67 LEU H H 67 9.410 9.410 9.244 0.166 17919 113407 1 276 . 1 1 68 68 HIS N N 68 118.380 118.380 122.366 -3.986 17919 113408 1 276 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.347 -0.107 17919 113409 1 276 . 1 1 68 68 HIS C C 68 173.150 173.150 173.179 -0.029 17919 113410 1 276 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.778 0.223 17919 113411 1 276 . 1 1 68 68 HIS CB C 68 30.530 30.530 33.136 -2.606 17919 113412 1 276 . 1 1 68 68 HIS H H 68 9.230 9.230 8.528 0.702 17919 113413 1 276 . 1 1 69 69 LEU N N 69 124.460 124.460 128.830 -4.370 17919 113414 1 276 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.132 0.058 17919 113415 1 276 . 1 1 69 69 LEU C C 69 175.270 175.270 174.217 1.053 17919 113416 1 276 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.033 0.857 17919 113417 1 276 . 1 1 69 69 LEU CB C 69 44.380 44.380 45.015 -0.635 17919 113418 1 276 . 1 1 69 69 LEU H H 69 8.340 8.340 8.600 -0.260 17919 113419 1 276 . 1 1 70 70 VAL N N 70 126.940 126.940 122.137 4.803 17919 113420 1 276 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.623 -0.273 17919 113421 1 276 . 1 1 70 70 VAL C C 70 174.000 174.000 174.085 -0.085 17919 113422 1 276 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.609 1.191 17919 113423 1 276 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.847 -0.937 17919 113424 1 276 . 1 1 70 70 VAL H H 70 9.200 9.200 9.159 0.041 17919 113425 1 276 . 1 1 71 71 LEU N N 71 123.130 123.130 121.772 1.358 17919 113426 1 276 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.923 0.137 17919 113427 1 276 . 1 1 71 71 LEU C C 71 177.830 177.830 176.886 0.944 17919 113428 1 276 . 1 1 71 71 LEU CA C 71 53.940 53.940 54.504 -0.564 17919 113429 1 276 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.224 0.626 17919 113430 1 276 . 1 1 71 71 LEU H H 71 8.120 8.120 8.344 -0.224 17919 113431 1 276 . 1 1 72 72 ARG N N 72 123.490 123.490 121.902 1.588 17919 113432 1 276 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.690 -0.389 17919 113433 1 276 . 1 1 72 72 ARG C C 72 175.350 175.350 174.796 0.554 17919 113434 1 276 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.370 0.241 17919 113435 1 276 . 1 1 72 72 ARG CB C 72 31.350 31.350 34.055 -2.705 17919 113436 1 276 . 1 1 72 72 ARG H H 72 8.580 8.580 8.656 -0.076 17919 113437 1 277 . 1 1 2 2 GLN N N 2 123.220 123.220 125.594 -2.374 17919 113438 1 277 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.320 -0.071 17919 113439 1 277 . 1 1 2 2 GLN C C 2 175.920 175.920 175.376 0.544 17919 113440 1 277 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.805 0.275 17919 113441 1 277 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.760 -0.000 17919 113442 1 277 . 1 1 2 2 GLN H H 2 8.900 8.900 8.534 0.366 17919 113443 1 277 . 1 1 3 3 ILE N N 3 115.340 115.340 116.902 -1.562 17919 113444 1 277 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.550 -0.337 17919 113445 1 277 . 1 1 3 3 ILE C C 3 172.450 172.450 173.828 -1.378 17919 113446 1 277 . 1 1 3 3 ILE CA C 3 59.570 59.570 58.941 0.628 17919 113447 1 277 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.789 0.421 17919 113448 1 277 . 1 1 3 3 ILE H H 3 8.320 8.320 8.080 0.240 17919 113449 1 277 . 1 1 4 4 PHE N N 4 118.110 118.110 118.460 -0.350 17919 113450 1 277 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.621 0.009 17919 113451 1 277 . 1 1 4 4 PHE C C 4 175.320 175.320 175.149 0.171 17919 113452 1 277 . 1 1 4 4 PHE CA C 4 55.210 55.210 54.240 0.970 17919 113453 1 277 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.842 -0.362 17919 113454 1 277 . 1 1 4 4 PHE H H 4 8.610 8.610 8.347 0.263 17919 113455 1 277 . 1 1 5 5 VAL N N 5 121.000 121.000 121.314 -0.314 17919 113456 1 277 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.948 -0.223 17919 113457 1 277 . 1 1 5 5 VAL C C 5 174.870 174.870 175.042 -0.172 17919 113458 1 277 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.247 -0.627 17919 113459 1 277 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.754 0.476 17919 113460 1 277 . 1 1 5 5 VAL H H 5 9.300 9.300 9.356 -0.056 17919 113461 1 277 . 1 1 6 6 LYS N N 6 127.520 127.520 129.860 -2.340 17919 113462 1 277 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.341 0.026 17919 113463 1 277 . 1 1 6 6 LYS C C 6 177.140 177.140 176.128 1.012 17919 113464 1 277 . 1 1 6 6 LYS CA C 6 54.520 54.520 53.817 0.703 17919 113465 1 277 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.988 0.062 17919 113466 1 277 . 1 1 6 6 LYS H H 6 8.820 8.820 9.414 -0.594 17919 113467 1 277 . 1 1 7 7 THR N N 7 115.400 115.400 117.782 -2.382 17919 113468 1 277 . 1 1 7 7 THR HA H 7 4.970 4.970 4.903 0.067 17919 113469 1 277 . 1 1 7 7 THR C C 7 176.910 176.910 175.942 0.968 17919 113470 1 277 . 1 1 7 7 THR CA C 7 60.470 60.470 60.553 -0.083 17919 113471 1 277 . 1 1 7 7 THR CB C 7 70.630 70.630 70.629 0.001 17919 113472 1 277 . 1 1 7 7 THR H H 7 8.730 8.730 9.071 -0.341 17919 113473 1 277 . 1 1 8 8 LEU N N 8 121.330 121.330 122.394 -1.064 17919 113474 1 277 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.358 -0.048 17919 113475 1 277 . 1 1 8 8 LEU C C 8 178.800 178.800 177.562 1.238 17919 113476 1 277 . 1 1 8 8 LEU CA C 8 57.580 57.580 56.978 0.602 17919 113477 1 277 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.147 -0.177 17919 113478 1 277 . 1 1 8 8 LEU H H 8 9.100 9.100 8.596 0.504 17919 113479 1 277 . 1 1 9 9 THR N N 9 105.590 105.590 109.366 -3.776 17919 113480 1 277 . 1 1 9 9 THR HA H 9 4.428 4.428 4.342 0.086 17919 113481 1 277 . 1 1 9 9 THR C C 9 175.520 175.520 175.619 -0.099 17919 113482 1 277 . 1 1 9 9 THR CA C 9 61.400 61.400 61.824 -0.424 17919 113483 1 277 . 1 1 9 9 THR CB C 9 69.140 69.140 69.502 -0.362 17919 113484 1 277 . 1 1 9 9 THR H H 9 7.630 7.630 7.606 0.024 17919 113485 1 277 . 1 1 10 10 GLY N N 10 108.890 108.890 111.162 -2.272 17919 113486 1 277 . 1 1 10 10 GLY C C 10 174.070 174.070 174.060 0.010 17919 113487 1 277 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.072 0.388 17919 113488 1 277 . 1 1 10 10 GLY H H 10 7.810 7.810 8.182 -0.372 17919 113489 1 277 . 1 1 11 11 LYS N N 11 121.600 121.600 121.679 -0.079 17919 113490 1 277 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.321 0.040 17919 113491 1 277 . 1 1 11 11 LYS C C 11 175.940 175.940 175.582 0.358 17919 113492 1 277 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.571 -0.291 17919 113493 1 277 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.392 -0.192 17919 113494 1 277 . 1 1 11 11 LYS H H 11 7.280 7.280 7.661 -0.381 17919 113495 1 277 . 1 1 12 12 THR N N 12 120.440 120.440 117.164 3.276 17919 113496 1 277 . 1 1 12 12 THR HA H 12 5.046 5.046 5.215 -0.169 17919 113497 1 277 . 1 1 12 12 THR C C 12 174.320 174.320 173.937 0.383 17919 113498 1 277 . 1 1 12 12 THR CA C 12 62.390 62.390 61.076 1.314 17919 113499 1 277 . 1 1 12 12 THR CB C 12 69.910 69.910 70.996 -1.086 17919 113500 1 277 . 1 1 12 12 THR H H 12 8.650 8.650 8.257 0.393 17919 113501 1 277 . 1 1 13 13 ILE N N 13 127.110 127.110 125.942 1.168 17919 113502 1 277 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.415 0.129 17919 113503 1 277 . 1 1 13 13 ILE C C 13 175.220 175.220 174.611 0.609 17919 113504 1 277 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.259 -0.279 17919 113505 1 277 . 1 1 13 13 ILE CB C 13 40.950 40.950 42.719 -1.769 17919 113506 1 277 . 1 1 13 13 ILE H H 13 9.450 9.450 8.839 0.611 17919 113507 1 277 . 1 1 14 14 THR N N 14 121.520 121.520 122.376 -0.856 17919 113508 1 277 . 1 1 14 14 THR HA H 14 4.964 4.964 5.175 -0.211 17919 113509 1 277 . 1 1 14 14 THR C C 14 173.790 173.790 173.622 0.168 17919 113510 1 277 . 1 1 14 14 THR CA C 14 61.940 61.940 62.251 -0.311 17919 113511 1 277 . 1 1 14 14 THR CB C 14 69.650 69.650 69.748 -0.098 17919 113512 1 277 . 1 1 14 14 THR H H 14 8.710 8.710 8.552 0.158 17919 113513 1 277 . 1 1 15 15 LEU N N 15 124.800 124.800 126.240 -1.440 17919 113514 1 277 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.814 -0.034 17919 113515 1 277 . 1 1 15 15 LEU C C 15 174.670 174.670 175.908 -1.238 17919 113516 1 277 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.244 -0.414 17919 113517 1 277 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.019 2.051 17919 113518 1 277 . 1 1 15 15 LEU H H 15 8.710 8.710 8.975 -0.265 17919 113519 1 277 . 1 1 16 16 GLU N N 16 122.160 122.160 122.422 -0.262 17919 113520 1 277 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.957 -0.040 17919 113521 1 277 . 1 1 16 16 GLU C C 16 175.860 175.860 175.877 -0.017 17919 113522 1 277 . 1 1 16 16 GLU CA C 16 54.820 54.820 54.939 -0.119 17919 113523 1 277 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.318 -0.868 17919 113524 1 277 . 1 1 16 16 GLU H H 16 8.140 8.140 8.584 -0.444 17919 113525 1 277 . 1 1 17 17 VAL N N 17 117.210 117.210 119.339 -2.129 17919 113526 1 277 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.931 -0.217 17919 113527 1 277 . 1 1 17 17 VAL C C 17 174.160 174.160 174.698 -0.538 17919 113528 1 277 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.671 -0.241 17919 113529 1 277 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.374 1.026 17919 113530 1 277 . 1 1 17 17 VAL H H 17 8.900 8.900 8.955 -0.055 17919 113531 1 277 . 1 1 18 18 GLU N N 18 118.990 118.990 122.531 -3.541 17919 113532 1 277 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.774 0.305 17919 113533 1 277 . 1 1 18 18 GLU C C 18 176.160 176.160 175.666 0.494 17919 113534 1 277 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.261 0.459 17919 113535 1 277 . 1 1 18 18 GLU CB C 18 30.310 30.310 31.195 -0.885 17919 113536 1 277 . 1 1 18 18 GLU H H 18 8.640 8.640 8.344 0.296 17919 113537 1 277 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.288 -0.147 17919 113538 1 277 . 1 1 19 19 PRO C C 19 175.310 175.310 177.117 -1.807 17919 113539 1 277 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.043 0.427 17919 113540 1 277 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.895 0.055 17919 113541 1 277 . 1 1 20 20 SER N N 20 103.400 103.400 108.964 -5.564 17919 113542 1 277 . 1 1 20 20 SER HA H 20 4.370 4.370 4.374 -0.004 17919 113543 1 277 . 1 1 20 20 SER C C 20 174.660 174.660 174.031 0.629 17919 113544 1 277 . 1 1 20 20 SER CA C 20 57.400 57.400 58.103 -0.703 17919 113545 1 277 . 1 1 20 20 SER CB C 20 63.370 63.370 62.959 0.411 17919 113546 1 277 . 1 1 20 20 SER H H 20 7.040 7.040 7.980 -0.940 17919 113547 1 277 . 1 1 21 21 ASP N N 21 123.480 123.480 124.394 -0.914 17919 113548 1 277 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.632 0.063 17919 113549 1 277 . 1 1 21 21 ASP C C 21 176.360 176.360 176.506 -0.146 17919 113550 1 277 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.000 0.700 17919 113551 1 277 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.222 -0.422 17919 113552 1 277 . 1 1 21 21 ASP H H 21 8.030 8.030 7.521 0.509 17919 113553 1 277 . 1 1 22 22 THR N N 22 108.800 108.800 113.936 -5.136 17919 113554 1 277 . 1 1 22 22 THR HA H 22 4.920 4.920 4.512 0.408 17919 113555 1 277 . 1 1 22 22 THR C C 22 176.750 176.750 176.202 0.548 17919 113556 1 277 . 1 1 22 22 THR CA C 22 59.690 59.690 61.936 -2.246 17919 113557 1 277 . 1 1 22 22 THR CB C 22 71.200 71.200 70.539 0.661 17919 113558 1 277 . 1 1 22 22 THR H H 22 7.900 7.900 8.271 -0.371 17919 113559 1 277 . 1 1 23 23 ILE N N 23 121.190 121.190 122.954 -1.764 17919 113560 1 277 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.840 -0.183 17919 113561 1 277 . 1 1 23 23 ILE C C 23 179.040 179.040 177.832 1.208 17919 113562 1 277 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.556 -0.297 17919 113563 1 277 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.196 -1.846 17919 113564 1 277 . 1 1 23 23 ILE H H 23 8.560 8.560 8.901 -0.341 17919 113565 1 277 . 1 1 24 24 GLU N N 24 120.830 120.830 121.935 -1.105 17919 113566 1 277 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.939 -0.022 17919 113567 1 277 . 1 1 24 24 GLU C C 24 178.640 178.640 178.333 0.307 17919 113568 1 277 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.024 0.196 17919 113569 1 277 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.677 -1.397 17919 113570 1 277 . 1 1 24 24 GLU H H 24 9.760 9.760 8.793 0.967 17919 113571 1 277 . 1 1 25 25 ASN N N 25 120.570 120.570 118.524 2.046 17919 113572 1 277 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.495 0.030 17919 113573 1 277 . 1 1 25 25 ASN C C 25 178.380 178.380 177.841 0.539 17919 113574 1 277 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.265 -0.205 17919 113575 1 277 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.867 -0.417 17919 113576 1 277 . 1 1 25 25 ASN H H 25 7.920 7.920 7.813 0.107 17919 113577 1 277 . 1 1 26 26 VAL N N 26 121.710 121.710 120.834 0.876 17919 113578 1 277 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.599 -0.202 17919 113579 1 277 . 1 1 26 26 VAL C C 26 177.950 177.950 177.659 0.291 17919 113580 1 277 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.673 0.987 17919 113581 1 277 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.714 -0.874 17919 113582 1 277 . 1 1 26 26 VAL H H 26 8.070 8.070 8.576 -0.506 17919 113583 1 277 . 1 1 27 27 LYS N N 27 118.860 118.860 120.102 -1.242 17919 113584 1 277 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.000 0.580 17919 113585 1 277 . 1 1 27 27 LYS C C 27 180.550 180.550 178.935 1.615 17919 113586 1 277 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.852 -0.602 17919 113587 1 277 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.282 1.448 17919 113588 1 277 . 1 1 27 27 LYS H H 27 8.560 8.560 8.254 0.306 17919 113589 1 277 . 1 1 28 28 ALA N N 28 123.440 123.440 122.190 1.250 17919 113590 1 277 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.086 0.074 17919 113591 1 277 . 1 1 28 28 ALA C C 28 180.300 180.300 179.420 0.880 17919 113592 1 277 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.097 0.273 17919 113593 1 277 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.279 -0.569 17919 113594 1 277 . 1 1 28 28 ALA H H 28 8.060 8.060 8.272 -0.212 17919 113595 1 277 . 1 1 29 29 LYS N N 29 119.940 119.940 119.701 0.239 17919 113596 1 277 . 1 1 29 29 LYS HA H 29 4.207 4.207 3.937 0.270 17919 113597 1 277 . 1 1 29 29 LYS C C 29 180.320 180.320 179.170 1.150 17919 113598 1 277 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.696 -0.046 17919 113599 1 277 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.289 1.001 17919 113600 1 277 . 1 1 29 29 LYS H H 29 7.850 7.850 7.935 -0.085 17919 113601 1 277 . 1 1 30 30 ILE N N 30 121.080 121.080 120.225 0.855 17919 113602 1 277 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.584 -0.077 17919 113603 1 277 . 1 1 30 30 ILE C C 30 178.310 178.310 177.631 0.679 17919 113604 1 277 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.145 1.005 17919 113605 1 277 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.565 -0.765 17919 113606 1 277 . 1 1 30 30 ILE H H 30 8.280 8.280 7.997 0.283 17919 113607 1 277 . 1 1 31 31 GLN N N 31 123.490 123.490 120.450 3.040 17919 113608 1 277 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.946 -0.117 17919 113609 1 277 . 1 1 31 31 GLN C C 31 178.890 178.890 178.604 0.286 17919 113610 1 277 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.199 0.801 17919 113611 1 277 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.462 -0.742 17919 113612 1 277 . 1 1 31 31 GLN H H 31 8.580 8.580 8.437 0.143 17919 113613 1 277 . 1 1 32 32 ASP N N 32 119.360 119.360 118.659 0.701 17919 113614 1 277 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.421 -0.067 17919 113615 1 277 . 1 1 32 32 ASP C C 32 177.250 177.250 178.103 -0.853 17919 113616 1 277 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.727 0.463 17919 113617 1 277 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.907 -0.327 17919 113618 1 277 . 1 1 32 32 ASP H H 32 8.010 8.010 8.301 -0.291 17919 113619 1 277 . 1 1 33 33 LYS N N 33 115.130 115.130 117.649 -2.519 17919 113620 1 277 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.291 0.046 17919 113621 1 277 . 1 1 33 33 LYS C C 33 177.870 177.870 177.948 -0.078 17919 113622 1 277 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.052 -0.002 17919 113623 1 277 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.817 0.353 17919 113624 1 277 . 1 1 33 33 LYS H H 33 7.430 7.430 7.610 -0.180 17919 113625 1 277 . 1 1 34 34 GLU N N 34 113.870 113.870 114.689 -0.819 17919 113626 1 277 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.500 0.125 17919 113627 1 277 . 1 1 34 34 GLU C C 34 177.840 177.840 176.507 1.333 17919 113628 1 277 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.857 -0.687 17919 113629 1 277 . 1 1 34 34 GLU CB C 34 32.660 32.660 30.902 1.758 17919 113630 1 277 . 1 1 34 34 GLU H H 34 8.740 8.740 8.085 0.655 17919 113631 1 277 . 1 1 35 35 GLY N N 35 108.650 108.650 108.699 -0.049 17919 113632 1 277 . 1 1 35 35 GLY C C 35 173.960 173.960 174.606 -0.646 17919 113633 1 277 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.719 0.361 17919 113634 1 277 . 1 1 35 35 GLY H H 35 8.530 8.530 7.994 0.536 17919 113635 1 277 . 1 1 36 36 ILE N N 36 119.880 119.880 121.858 -1.978 17919 113636 1 277 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.253 0.192 17919 113637 1 277 . 1 1 36 36 ILE C C 36 173.590 173.590 174.032 -0.442 17919 113638 1 277 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.451 -0.701 17919 113639 1 277 . 1 1 36 36 ILE CB C 36 40.580 40.580 37.795 2.785 17919 113640 1 277 . 1 1 36 36 ILE H H 36 6.150 6.150 7.679 -1.529 17919 113641 1 277 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.469 0.165 17919 113642 1 277 . 1 1 37 37 PRO C C 37 176.940 176.940 176.368 0.572 17919 113643 1 277 . 1 1 37 37 PRO CA C 37 61.660 61.660 62.058 -0.398 17919 113644 1 277 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.280 0.570 17919 113645 1 277 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.196 -0.079 17919 113646 1 277 . 1 1 38 38 PRO C C 38 178.320 178.320 178.605 -0.285 17919 113647 1 277 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.710 0.549 17919 113648 1 277 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.940 0.950 17919 113649 1 277 . 1 1 39 39 ASP N N 39 113.380 113.380 116.362 -2.982 17919 113650 1 277 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.395 0.035 17919 113651 1 277 . 1 1 39 39 ASP C C 39 177.090 177.090 176.938 0.152 17919 113652 1 277 . 1 1 39 39 ASP CA C 39 55.640 55.640 55.962 -0.322 17919 113653 1 277 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.298 -0.758 17919 113654 1 277 . 1 1 39 39 ASP H H 39 8.550 8.550 8.507 0.043 17919 113655 1 277 . 1 1 40 40 GLN N N 40 116.780 116.780 116.011 0.769 17919 113656 1 277 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.190 0.274 17919 113657 1 277 . 1 1 40 40 GLN C C 40 175.380 175.380 176.415 -1.035 17919 113658 1 277 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.361 -0.722 17919 113659 1 277 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.077 1.063 17919 113660 1 277 . 1 1 40 40 GLN H H 40 7.820 7.820 7.584 0.236 17919 113661 1 277 . 1 1 41 41 GLN N N 41 117.720 117.720 119.118 -1.398 17919 113662 1 277 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.442 -0.198 17919 113663 1 277 . 1 1 41 41 GLN C C 41 176.300 176.300 175.192 1.108 17919 113664 1 277 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.074 0.396 17919 113665 1 277 . 1 1 41 41 GLN CB C 41 31.650 31.650 30.047 1.603 17919 113666 1 277 . 1 1 41 41 GLN H H 41 7.480 7.480 7.517 -0.037 17919 113667 1 277 . 1 1 42 42 ARG N N 42 122.680 122.680 122.574 0.106 17919 113668 1 277 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.621 -0.121 17919 113669 1 277 . 1 1 42 42 ARG C C 42 174.050 174.050 174.281 -0.231 17919 113670 1 277 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.839 0.211 17919 113671 1 277 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.779 -1.029 17919 113672 1 277 . 1 1 42 42 ARG H H 42 8.530 8.530 8.192 0.338 17919 113673 1 277 . 1 1 43 43 LEU N N 43 124.040 124.040 125.763 -1.723 17919 113674 1 277 . 1 1 43 43 LEU C C 43 175.290 175.290 175.846 -0.556 17919 113675 1 277 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.301 -1.321 17919 113676 1 277 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.526 2.264 17919 113677 1 277 . 1 1 43 43 LEU H H 43 8.820 8.820 8.719 0.101 17919 113678 1 277 . 1 1 44 44 ILE N N 44 121.920 121.920 122.482 -0.562 17919 113679 1 277 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.104 -0.112 17919 113680 1 277 . 1 1 44 44 ILE C C 44 176.060 176.060 174.167 1.893 17919 113681 1 277 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.372 -1.392 17919 113682 1 277 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.484 -0.065 17919 113683 1 277 . 1 1 44 44 ILE H H 44 9.030 9.030 8.912 0.118 17919 113684 1 277 . 1 1 45 45 PHE N N 45 125.390 125.390 127.162 -1.772 17919 113685 1 277 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.982 0.063 17919 113686 1 277 . 1 1 45 45 PHE C C 45 174.470 174.470 173.991 0.479 17919 113687 1 277 . 1 1 45 45 PHE CA C 45 57.020 57.020 57.003 0.017 17919 113688 1 277 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.258 0.502 17919 113689 1 277 . 1 1 45 45 PHE H H 45 8.830 8.830 9.053 -0.223 17919 113690 1 277 . 1 1 46 46 ALA N N 46 132.200 132.200 128.380 3.820 17919 113691 1 277 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.609 0.081 17919 113692 1 277 . 1 1 46 46 ALA C C 46 177.290 177.290 177.855 -0.565 17919 113693 1 277 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.597 -0.057 17919 113694 1 277 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.683 -0.114 17919 113695 1 277 . 1 1 46 46 ALA H H 46 8.810 8.810 8.608 0.202 17919 113696 1 277 . 1 1 47 47 GLY N N 47 102.340 102.340 103.635 -1.295 17919 113697 1 277 . 1 1 47 47 GLY C C 47 173.810 173.810 174.534 -0.724 17919 113698 1 277 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.082 0.268 17919 113699 1 277 . 1 1 47 47 GLY H H 47 8.130 8.130 8.346 -0.216 17919 113700 1 277 . 1 1 48 48 LYS N N 48 121.570 121.570 121.369 0.201 17919 113701 1 277 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.571 0.051 17919 113702 1 277 . 1 1 48 48 LYS C C 48 174.700 174.700 175.427 -0.727 17919 113703 1 277 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.420 0.129 17919 113704 1 277 . 1 1 48 48 LYS CB C 48 34.530 34.530 33.753 0.777 17919 113705 1 277 . 1 1 48 48 LYS H H 48 7.980 7.980 7.925 0.055 17919 113706 1 277 . 1 1 49 49 GLN N N 49 122.410 122.410 122.235 0.175 17919 113707 1 277 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.563 -0.003 17919 113708 1 277 . 1 1 49 49 GLN C C 49 175.670 175.670 175.726 -0.056 17919 113709 1 277 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.803 -0.063 17919 113710 1 277 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.679 -0.679 17919 113711 1 277 . 1 1 49 49 GLN H H 49 8.600 8.600 8.607 -0.007 17919 113712 1 277 . 1 1 50 50 LEU N N 50 125.520 125.520 127.326 -1.806 17919 113713 1 277 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.270 -0.180 17919 113714 1 277 . 1 1 50 50 LEU C C 50 176.660 176.660 176.277 0.383 17919 113715 1 277 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.849 0.391 17919 113716 1 277 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.427 -0.857 17919 113717 1 277 . 1 1 50 50 LEU H H 50 8.530 8.530 8.770 -0.240 17919 113718 1 277 . 1 1 51 51 GLU N N 51 122.940 122.940 122.835 0.105 17919 113719 1 277 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.592 -0.104 17919 113720 1 277 . 1 1 51 51 GLU C C 51 175.870 175.870 177.313 -1.443 17919 113721 1 277 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.315 0.645 17919 113722 1 277 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.120 0.450 17919 113723 1 277 . 1 1 51 51 GLU H H 51 8.400 8.400 8.649 -0.249 17919 113724 1 277 . 1 1 52 52 ASP N N 52 120.030 120.030 125.700 -5.670 17919 113725 1 277 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.319 0.040 17919 113726 1 277 . 1 1 52 52 ASP C C 52 177.330 177.330 177.871 -0.541 17919 113727 1 277 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.816 -0.857 17919 113728 1 277 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.587 0.263 17919 113729 1 277 . 1 1 52 52 ASP H H 52 8.160 8.160 8.858 -0.698 17919 113730 1 277 . 1 1 53 53 GLY N N 53 106.660 106.660 106.327 0.333 17919 113731 1 277 . 1 1 53 53 GLY C C 53 174.870 174.870 173.891 0.979 17919 113732 1 277 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.967 0.203 17919 113733 1 277 . 1 1 53 53 GLY H H 53 9.390 9.390 8.689 0.701 17919 113734 1 277 . 1 1 54 54 ARG N N 54 119.050 119.050 119.820 -0.770 17919 113735 1 277 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.773 -0.078 17919 113736 1 277 . 1 1 54 54 ARG C C 54 175.350 175.350 175.204 0.146 17919 113737 1 277 . 1 1 54 54 ARG CA C 54 54.390 54.390 53.732 0.658 17919 113738 1 277 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.520 -0.870 17919 113739 1 277 . 1 1 54 54 ARG H H 54 7.460 7.460 7.434 0.026 17919 113740 1 277 . 1 1 55 55 THR N N 55 108.400 108.400 111.850 -3.450 17919 113741 1 277 . 1 1 55 55 THR HA H 55 5.240 5.240 5.170 0.070 17919 113742 1 277 . 1 1 55 55 THR C C 55 176.560 176.560 176.173 0.387 17919 113743 1 277 . 1 1 55 55 THR CA C 55 59.690 59.690 60.048 -0.358 17919 113744 1 277 . 1 1 55 55 THR CB C 55 72.260 72.260 71.340 0.920 17919 113745 1 277 . 1 1 55 55 THR H H 55 8.730 8.730 8.893 -0.163 17919 113746 1 277 . 1 1 56 56 LEU N N 56 117.920 117.920 122.902 -4.982 17919 113747 1 277 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.962 0.098 17919 113748 1 277 . 1 1 56 56 LEU C C 56 180.810 180.810 178.891 1.919 17919 113749 1 277 . 1 1 56 56 LEU CA C 56 58.710 58.710 59.412 -0.702 17919 113750 1 277 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.582 -1.212 17919 113751 1 277 . 1 1 56 56 LEU H H 56 8.140 8.140 8.653 -0.513 17919 113752 1 277 . 1 1 57 57 SER N N 57 113.330 113.330 112.491 0.839 17919 113753 1 277 . 1 1 57 57 SER HA H 57 4.370 4.370 4.191 0.179 17919 113754 1 277 . 1 1 57 57 SER C C 57 178.310 178.310 176.007 2.303 17919 113755 1 277 . 1 1 57 57 SER CA C 57 61.080 61.080 61.237 -0.157 17919 113756 1 277 . 1 1 57 57 SER CB C 57 62.530 62.530 62.754 -0.224 17919 113757 1 277 . 1 1 57 57 SER H H 57 8.470 8.470 8.246 0.224 17919 113758 1 277 . 1 1 58 58 ASP N N 58 124.190 124.190 122.399 1.791 17919 113759 1 277 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.411 -0.115 17919 113760 1 277 . 1 1 58 58 ASP C C 58 177.400 177.400 177.442 -0.042 17919 113761 1 277 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.754 0.426 17919 113762 1 277 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.857 -0.757 17919 113763 1 277 . 1 1 58 58 ASP H H 58 7.930 7.930 7.617 0.313 17919 113764 1 277 . 1 1 59 59 TYR N N 59 115.510 115.510 117.260 -1.750 17919 113765 1 277 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.524 0.146 17919 113766 1 277 . 1 1 59 59 TYR C C 59 174.700 174.700 174.835 -0.135 17919 113767 1 277 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.717 0.533 17919 113768 1 277 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.254 1.816 17919 113769 1 277 . 1 1 59 59 TYR H H 59 7.250 7.250 7.639 -0.389 17919 113770 1 277 . 1 1 60 60 ASN N N 60 115.900 115.900 117.559 -1.659 17919 113771 1 277 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.383 -0.028 17919 113772 1 277 . 1 1 60 60 ASN C C 60 174.340 174.340 174.232 0.108 17919 113773 1 277 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.210 -0.090 17919 113774 1 277 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.132 0.278 17919 113775 1 277 . 1 1 60 60 ASN H H 60 8.150 8.150 8.175 -0.025 17919 113776 1 277 . 1 1 61 61 ILE N N 61 118.600 118.600 119.007 -0.407 17919 113777 1 277 . 1 1 61 61 ILE HA H 61 3.393 3.393 4.135 -0.742 17919 113778 1 277 . 1 1 61 61 ILE C C 61 174.610 174.610 174.856 -0.246 17919 113779 1 277 . 1 1 61 61 ILE CA C 61 62.420 62.420 60.863 1.557 17919 113780 1 277 . 1 1 61 61 ILE CB C 61 36.740 36.740 38.717 -1.976 17919 113781 1 277 . 1 1 61 61 ILE H H 61 7.250 7.250 8.041 -0.791 17919 113782 1 277 . 1 1 62 62 GLN N N 62 124.740 124.740 125.571 -0.831 17919 113783 1 277 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.786 -0.280 17919 113784 1 277 . 1 1 62 62 GLN C C 62 175.970 175.970 175.761 0.209 17919 113785 1 277 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.390 0.270 17919 113786 1 277 . 1 1 62 62 GLN CB C 62 31.650 31.650 32.176 -0.526 17919 113787 1 277 . 1 1 62 62 GLN H H 62 7.610 7.610 8.198 -0.588 17919 113788 1 277 . 1 1 63 63 LYS N N 63 120.300 120.300 120.751 -0.451 17919 113789 1 277 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.023 -0.022 17919 113790 1 277 . 1 1 63 63 LYS C C 63 175.810 175.810 176.839 -1.029 17919 113791 1 277 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.785 0.005 17919 113792 1 277 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.418 1.232 17919 113793 1 277 . 1 1 63 63 LYS H H 63 8.490 8.490 8.724 -0.234 17919 113794 1 277 . 1 1 64 64 GLU N N 64 113.950 113.950 118.643 -4.693 17919 113795 1 277 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.075 0.390 17919 113796 1 277 . 1 1 64 64 GLU C C 64 175.250 175.250 175.365 -0.115 17919 113797 1 277 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.442 0.448 17919 113798 1 277 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.937 -3.037 17919 113799 1 277 . 1 1 64 64 GLU H H 64 9.280 9.280 8.808 0.472 17919 113800 1 277 . 1 1 65 65 SER N N 65 114.730 114.730 115.299 -0.569 17919 113801 1 277 . 1 1 65 65 SER HA H 65 4.640 4.640 4.408 0.232 17919 113802 1 277 . 1 1 65 65 SER C C 65 172.160 172.160 173.566 -1.406 17919 113803 1 277 . 1 1 65 65 SER CA C 65 60.890 60.890 59.904 0.987 17919 113804 1 277 . 1 1 65 65 SER CB C 65 64.910 64.910 64.254 0.656 17919 113805 1 277 . 1 1 65 65 SER H H 65 7.670 7.670 7.225 0.445 17919 113806 1 277 . 1 1 66 66 THR N N 66 117.110 117.110 119.272 -2.162 17919 113807 1 277 . 1 1 66 66 THR HA H 66 5.270 5.270 4.979 0.291 17919 113808 1 277 . 1 1 66 66 THR C C 66 173.950 173.950 174.321 -0.371 17919 113809 1 277 . 1 1 66 66 THR CA C 66 62.340 62.340 62.038 0.302 17919 113810 1 277 . 1 1 66 66 THR CB C 66 70.080 70.080 70.729 -0.649 17919 113811 1 277 . 1 1 66 66 THR H H 66 8.730 8.730 8.471 0.259 17919 113812 1 277 . 1 1 67 67 LEU N N 67 127.110 127.110 126.529 0.581 17919 113813 1 277 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.732 0.328 17919 113814 1 277 . 1 1 67 67 LEU C C 67 175.770 175.770 175.418 0.352 17919 113815 1 277 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.438 -0.538 17919 113816 1 277 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.753 0.507 17919 113817 1 277 . 1 1 67 67 LEU H H 67 9.410 9.410 9.045 0.365 17919 113818 1 277 . 1 1 68 68 HIS N N 68 118.380 118.380 122.319 -3.939 17919 113819 1 277 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.429 -0.189 17919 113820 1 277 . 1 1 68 68 HIS C C 68 173.150 173.150 173.733 -0.583 17919 113821 1 277 . 1 1 68 68 HIS CA C 68 55.000 55.000 53.791 1.209 17919 113822 1 277 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.002 -1.472 17919 113823 1 277 . 1 1 68 68 HIS H H 68 9.230 9.230 9.268 -0.038 17919 113824 1 277 . 1 1 69 69 LEU N N 69 124.460 124.460 129.758 -5.298 17919 113825 1 277 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.993 0.197 17919 113826 1 277 . 1 1 69 69 LEU C C 69 175.270 175.270 174.189 1.081 17919 113827 1 277 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.443 0.447 17919 113828 1 277 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.980 -0.600 17919 113829 1 277 . 1 1 69 69 LEU H H 69 8.340 8.340 8.869 -0.529 17919 113830 1 277 . 1 1 70 70 VAL N N 70 126.940 126.940 126.000 0.940 17919 113831 1 277 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.303 0.047 17919 113832 1 277 . 1 1 70 70 VAL C C 70 174.000 174.000 174.418 -0.418 17919 113833 1 277 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.826 -0.026 17919 113834 1 277 . 1 1 70 70 VAL CB C 70 34.910 34.910 34.990 -0.080 17919 113835 1 277 . 1 1 70 70 VAL H H 70 9.200 9.200 8.573 0.627 17919 113836 1 277 . 1 1 71 71 LEU N N 71 123.130 123.130 123.906 -0.776 17919 113837 1 277 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.794 0.266 17919 113838 1 277 . 1 1 71 71 LEU C C 71 177.830 177.830 177.068 0.762 17919 113839 1 277 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.620 0.320 17919 113840 1 277 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.277 -0.427 17919 113841 1 277 . 1 1 71 71 LEU H H 71 8.120 8.120 8.308 -0.188 17919 113842 1 277 . 1 1 72 72 ARG N N 72 123.490 123.490 124.456 -0.966 17919 113843 1 277 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.189 0.112 17919 113844 1 277 . 1 1 72 72 ARG C C 72 175.350 175.350 176.243 -0.893 17919 113845 1 277 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.370 -0.760 17919 113846 1 277 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.631 0.719 17919 113847 1 277 . 1 1 72 72 ARG H H 72 8.580 8.580 8.008 0.572 17919 113848 1 278 . 1 1 2 2 GLN N N 2 123.220 123.220 120.667 2.553 17919 113849 1 278 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.241 0.008 17919 113850 1 278 . 1 1 2 2 GLN C C 2 175.920 175.920 175.607 0.313 17919 113851 1 278 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.785 0.295 17919 113852 1 278 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.659 0.101 17919 113853 1 278 . 1 1 2 2 GLN H H 2 8.900 8.900 8.345 0.555 17919 113854 1 278 . 1 1 3 3 ILE N N 3 115.340 115.340 115.968 -0.628 17919 113855 1 278 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.440 -0.227 17919 113856 1 278 . 1 1 3 3 ILE C C 3 172.450 172.450 173.633 -1.183 17919 113857 1 278 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.712 -0.142 17919 113858 1 278 . 1 1 3 3 ILE CB C 3 42.210 42.210 42.179 0.031 17919 113859 1 278 . 1 1 3 3 ILE H H 3 8.320 8.320 8.799 -0.479 17919 113860 1 278 . 1 1 4 4 PHE N N 4 118.110 118.110 119.485 -1.375 17919 113861 1 278 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.545 0.085 17919 113862 1 278 . 1 1 4 4 PHE C C 4 175.320 175.320 175.441 -0.121 17919 113863 1 278 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.788 -0.578 17919 113864 1 278 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.630 -0.150 17919 113865 1 278 . 1 1 4 4 PHE H H 4 8.610 8.610 8.975 -0.365 17919 113866 1 278 . 1 1 5 5 VAL N N 5 121.000 121.000 121.720 -0.720 17919 113867 1 278 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.821 -0.096 17919 113868 1 278 . 1 1 5 5 VAL C C 5 174.870 174.870 174.606 0.264 17919 113869 1 278 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.221 -0.602 17919 113870 1 278 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.179 0.051 17919 113871 1 278 . 1 1 5 5 VAL H H 5 9.300 9.300 9.353 -0.053 17919 113872 1 278 . 1 1 6 6 LYS N N 6 127.520 127.520 128.837 -1.317 17919 113873 1 278 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.415 -0.048 17919 113874 1 278 . 1 1 6 6 LYS C C 6 177.140 177.140 176.646 0.494 17919 113875 1 278 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.299 0.221 17919 113876 1 278 . 1 1 6 6 LYS CB C 6 35.050 35.050 36.036 -0.986 17919 113877 1 278 . 1 1 6 6 LYS H H 6 8.820 8.820 9.395 -0.575 17919 113878 1 278 . 1 1 7 7 THR N N 7 115.400 115.400 118.854 -3.454 17919 113879 1 278 . 1 1 7 7 THR HA H 7 4.970 4.970 4.612 0.358 17919 113880 1 278 . 1 1 7 7 THR C C 7 176.910 176.910 176.317 0.593 17919 113881 1 278 . 1 1 7 7 THR CA C 7 60.470 60.470 61.709 -1.239 17919 113882 1 278 . 1 1 7 7 THR CB C 7 70.630 70.630 70.008 0.621 17919 113883 1 278 . 1 1 7 7 THR H H 7 8.730 8.730 8.971 -0.241 17919 113884 1 278 . 1 1 8 8 LEU N N 8 121.330 121.330 122.747 -1.417 17919 113885 1 278 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.306 0.004 17919 113886 1 278 . 1 1 8 8 LEU C C 8 178.800 178.800 177.777 1.023 17919 113887 1 278 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.097 0.483 17919 113888 1 278 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.178 -0.208 17919 113889 1 278 . 1 1 8 8 LEU H H 8 9.100 9.100 8.463 0.637 17919 113890 1 278 . 1 1 9 9 THR N N 9 105.590 105.590 110.045 -4.455 17919 113891 1 278 . 1 1 9 9 THR HA H 9 4.428 4.428 4.333 0.095 17919 113892 1 278 . 1 1 9 9 THR C C 9 175.520 175.520 175.188 0.332 17919 113893 1 278 . 1 1 9 9 THR CA C 9 61.400 61.400 62.114 -0.714 17919 113894 1 278 . 1 1 9 9 THR CB C 9 69.140 69.140 69.127 0.013 17919 113895 1 278 . 1 1 9 9 THR H H 9 7.630 7.630 7.833 -0.203 17919 113896 1 278 . 1 1 10 10 GLY N N 10 108.890 108.890 111.189 -2.299 17919 113897 1 278 . 1 1 10 10 GLY C C 10 174.070 174.070 173.691 0.379 17919 113898 1 278 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.925 0.535 17919 113899 1 278 . 1 1 10 10 GLY H H 10 7.810 7.810 7.965 -0.155 17919 113900 1 278 . 1 1 11 11 LYS N N 11 121.600 121.600 121.712 -0.112 17919 113901 1 278 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.399 -0.038 17919 113902 1 278 . 1 1 11 11 LYS C C 11 175.940 175.940 175.522 0.418 17919 113903 1 278 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.386 -0.106 17919 113904 1 278 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.362 -0.162 17919 113905 1 278 . 1 1 11 11 LYS H H 11 7.280 7.280 8.142 -0.862 17919 113906 1 278 . 1 1 12 12 THR N N 12 120.440 120.440 121.397 -0.957 17919 113907 1 278 . 1 1 12 12 THR HA H 12 5.046 5.046 4.688 0.358 17919 113908 1 278 . 1 1 12 12 THR C C 12 174.320 174.320 174.403 -0.083 17919 113909 1 278 . 1 1 12 12 THR CA C 12 62.390 62.390 62.073 0.317 17919 113910 1 278 . 1 1 12 12 THR CB C 12 69.910 69.910 69.385 0.525 17919 113911 1 278 . 1 1 12 12 THR H H 12 8.650 8.650 8.350 0.300 17919 113912 1 278 . 1 1 13 13 ILE N N 13 127.110 127.110 122.007 5.103 17919 113913 1 278 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.722 -0.178 17919 113914 1 278 . 1 1 13 13 ILE C C 13 175.220 175.220 174.691 0.529 17919 113915 1 278 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.426 0.554 17919 113916 1 278 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.871 0.079 17919 113917 1 278 . 1 1 13 13 ILE H H 13 9.450 9.450 8.943 0.507 17919 113918 1 278 . 1 1 14 14 THR N N 14 121.520 121.520 121.965 -0.445 17919 113919 1 278 . 1 1 14 14 THR HA H 14 4.964 4.964 5.124 -0.160 17919 113920 1 278 . 1 1 14 14 THR C C 14 173.790 173.790 173.786 0.004 17919 113921 1 278 . 1 1 14 14 THR CA C 14 61.940 61.940 62.170 -0.230 17919 113922 1 278 . 1 1 14 14 THR CB C 14 69.650 69.650 69.544 0.106 17919 113923 1 278 . 1 1 14 14 THR H H 14 8.710 8.710 8.681 0.029 17919 113924 1 278 . 1 1 15 15 LEU N N 15 124.800 124.800 126.741 -1.941 17919 113925 1 278 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.810 -0.030 17919 113926 1 278 . 1 1 15 15 LEU C C 15 174.670 174.670 175.689 -1.019 17919 113927 1 278 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.347 -0.517 17919 113928 1 278 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.035 2.035 17919 113929 1 278 . 1 1 15 15 LEU H H 15 8.710 8.710 8.714 -0.004 17919 113930 1 278 . 1 1 16 16 GLU N N 16 122.160 122.160 121.746 0.414 17919 113931 1 278 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.283 -0.366 17919 113932 1 278 . 1 1 16 16 GLU C C 16 175.860 175.860 176.326 -0.466 17919 113933 1 278 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.294 -0.473 17919 113934 1 278 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.734 -1.284 17919 113935 1 278 . 1 1 16 16 GLU H H 16 8.140 8.140 8.504 -0.364 17919 113936 1 278 . 1 1 17 17 VAL N N 17 117.210 117.210 119.278 -2.068 17919 113937 1 278 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.867 -0.153 17919 113938 1 278 . 1 1 17 17 VAL C C 17 174.160 174.160 174.860 -0.700 17919 113939 1 278 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.316 -0.886 17919 113940 1 278 . 1 1 17 17 VAL CB C 17 36.400 36.400 34.995 1.405 17919 113941 1 278 . 1 1 17 17 VAL H H 17 8.900 8.900 8.752 0.148 17919 113942 1 278 . 1 1 18 18 GLU N N 18 118.990 118.990 120.989 -1.999 17919 113943 1 278 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.845 0.234 17919 113944 1 278 . 1 1 18 18 GLU C C 18 176.160 176.160 175.411 0.749 17919 113945 1 278 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.624 0.096 17919 113946 1 278 . 1 1 18 18 GLU CB C 18 30.310 30.310 29.592 0.718 17919 113947 1 278 . 1 1 18 18 GLU H H 18 8.640 8.640 8.864 -0.224 17919 113948 1 278 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.257 -0.116 17919 113949 1 278 . 1 1 19 19 PRO C C 19 175.310 175.310 177.791 -2.481 17919 113950 1 278 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.787 -0.316 17919 113951 1 278 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.866 0.084 17919 113952 1 278 . 1 1 20 20 SER N N 20 103.400 103.400 110.535 -7.135 17919 113953 1 278 . 1 1 20 20 SER HA H 20 4.370 4.370 4.308 0.062 17919 113954 1 278 . 1 1 20 20 SER C C 20 174.660 174.660 174.209 0.451 17919 113955 1 278 . 1 1 20 20 SER CA C 20 57.400 57.400 58.904 -1.504 17919 113956 1 278 . 1 1 20 20 SER CB C 20 63.370 63.370 62.869 0.501 17919 113957 1 278 . 1 1 20 20 SER H H 20 7.040 7.040 8.374 -1.334 17919 113958 1 278 . 1 1 21 21 ASP N N 21 123.480 123.480 122.222 1.258 17919 113959 1 278 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.796 -0.101 17919 113960 1 278 . 1 1 21 21 ASP C C 21 176.360 176.360 175.942 0.418 17919 113961 1 278 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.537 1.163 17919 113962 1 278 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.731 -0.931 17919 113963 1 278 . 1 1 21 21 ASP H H 21 8.030 8.030 7.618 0.412 17919 113964 1 278 . 1 1 22 22 THR N N 22 108.800 108.800 111.898 -3.098 17919 113965 1 278 . 1 1 22 22 THR HA H 22 4.920 4.920 4.980 -0.060 17919 113966 1 278 . 1 1 22 22 THR C C 22 176.750 176.750 175.994 0.756 17919 113967 1 278 . 1 1 22 22 THR CA C 22 59.690 59.690 59.923 -0.233 17919 113968 1 278 . 1 1 22 22 THR CB C 22 71.200 71.200 71.553 -0.353 17919 113969 1 278 . 1 1 22 22 THR H H 22 7.900 7.900 8.917 -1.017 17919 113970 1 278 . 1 1 23 23 ILE N N 23 121.190 121.190 121.683 -0.493 17919 113971 1 278 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.853 -0.196 17919 113972 1 278 . 1 1 23 23 ILE C C 23 179.040 179.040 177.669 1.371 17919 113973 1 278 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.312 -0.052 17919 113974 1 278 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.337 -1.987 17919 113975 1 278 . 1 1 23 23 ILE H H 23 8.560 8.560 8.440 0.120 17919 113976 1 278 . 1 1 24 24 GLU N N 24 120.830 120.830 121.918 -1.088 17919 113977 1 278 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.863 0.054 17919 113978 1 278 . 1 1 24 24 GLU C C 24 178.640 178.640 178.437 0.203 17919 113979 1 278 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.469 -0.249 17919 113980 1 278 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.407 -1.127 17919 113981 1 278 . 1 1 24 24 GLU H H 24 9.760 9.760 8.521 1.239 17919 113982 1 278 . 1 1 25 25 ASN N N 25 120.570 120.570 117.704 2.866 17919 113983 1 278 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.444 0.081 17919 113984 1 278 . 1 1 25 25 ASN C C 25 178.380 178.380 178.221 0.159 17919 113985 1 278 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.841 0.219 17919 113986 1 278 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.396 0.054 17919 113987 1 278 . 1 1 25 25 ASN H H 25 7.920 7.920 7.706 0.214 17919 113988 1 278 . 1 1 26 26 VAL N N 26 121.710 121.710 121.484 0.226 17919 113989 1 278 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.514 -0.117 17919 113990 1 278 . 1 1 26 26 VAL C C 26 177.950 177.950 177.540 0.410 17919 113991 1 278 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.765 0.895 17919 113992 1 278 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.633 -0.793 17919 113993 1 278 . 1 1 26 26 VAL H H 26 8.070 8.070 7.936 0.134 17919 113994 1 278 . 1 1 27 27 LYS N N 27 118.860 118.860 120.232 -1.372 17919 113995 1 278 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.237 0.343 17919 113996 1 278 . 1 1 27 27 LYS C C 27 180.550 180.550 179.043 1.507 17919 113997 1 278 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.691 -0.440 17919 113998 1 278 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.374 1.356 17919 113999 1 278 . 1 1 27 27 LYS H H 27 8.560 8.560 8.252 0.308 17919 114000 1 278 . 1 1 28 28 ALA N N 28 123.440 123.440 120.621 2.819 17919 114001 1 278 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.150 0.010 17919 114002 1 278 . 1 1 28 28 ALA C C 28 180.300 180.300 179.101 1.199 17919 114003 1 278 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.826 0.544 17919 114004 1 278 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.329 -0.619 17919 114005 1 278 . 1 1 28 28 ALA H H 28 8.060 8.060 8.311 -0.251 17919 114006 1 278 . 1 1 29 29 LYS N N 29 119.940 119.940 119.313 0.627 17919 114007 1 278 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.045 0.162 17919 114008 1 278 . 1 1 29 29 LYS C C 29 180.320 180.320 179.066 1.254 17919 114009 1 278 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.286 0.364 17919 114010 1 278 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.267 1.023 17919 114011 1 278 . 1 1 29 29 LYS H H 29 7.850 7.850 7.470 0.380 17919 114012 1 278 . 1 1 30 30 ILE N N 30 121.080 121.080 121.063 0.017 17919 114013 1 278 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.624 -0.117 17919 114014 1 278 . 1 1 30 30 ILE C C 30 178.310 178.310 177.491 0.819 17919 114015 1 278 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.243 0.907 17919 114016 1 278 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.731 -0.931 17919 114017 1 278 . 1 1 30 30 ILE H H 30 8.280 8.280 7.799 0.481 17919 114018 1 278 . 1 1 31 31 GLN N N 31 123.490 123.490 121.237 2.253 17919 114019 1 278 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.077 -0.248 17919 114020 1 278 . 1 1 31 31 GLN C C 31 178.890 178.890 178.216 0.674 17919 114021 1 278 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.287 0.713 17919 114022 1 278 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.565 -0.845 17919 114023 1 278 . 1 1 31 31 GLN H H 31 8.580 8.580 8.359 0.221 17919 114024 1 278 . 1 1 32 32 ASP N N 32 119.360 119.360 119.025 0.335 17919 114025 1 278 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.394 -0.040 17919 114026 1 278 . 1 1 32 32 ASP C C 32 177.250 177.250 178.322 -1.072 17919 114027 1 278 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.837 0.353 17919 114028 1 278 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.903 -0.323 17919 114029 1 278 . 1 1 32 32 ASP H H 32 8.010 8.010 8.373 -0.363 17919 114030 1 278 . 1 1 33 33 LYS N N 33 115.130 115.130 117.914 -2.784 17919 114031 1 278 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.265 0.072 17919 114032 1 278 . 1 1 33 33 LYS C C 33 177.870 177.870 178.253 -0.383 17919 114033 1 278 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.541 -0.491 17919 114034 1 278 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.034 1.136 17919 114035 1 278 . 1 1 33 33 LYS H H 33 7.430 7.430 7.695 -0.265 17919 114036 1 278 . 1 1 34 34 GLU N N 34 113.870 113.870 115.184 -1.314 17919 114037 1 278 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.402 0.223 17919 114038 1 278 . 1 1 34 34 GLU C C 34 177.840 177.840 177.612 0.228 17919 114039 1 278 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.141 -0.971 17919 114040 1 278 . 1 1 34 34 GLU CB C 34 32.660 32.660 30.720 1.940 17919 114041 1 278 . 1 1 34 34 GLU H H 34 8.740 8.740 8.222 0.518 17919 114042 1 278 . 1 1 35 35 GLY N N 35 108.650 108.650 108.274 0.376 17919 114043 1 278 . 1 1 35 35 GLY C C 35 173.960 173.960 174.242 -0.282 17919 114044 1 278 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.336 0.744 17919 114045 1 278 . 1 1 35 35 GLY H H 35 8.530 8.530 8.190 0.340 17919 114046 1 278 . 1 1 36 36 ILE N N 36 119.880 119.880 122.602 -2.722 17919 114047 1 278 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.410 0.035 17919 114048 1 278 . 1 1 36 36 ILE C C 36 173.590 173.590 174.457 -0.867 17919 114049 1 278 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.626 0.124 17919 114050 1 278 . 1 1 36 36 ILE CB C 36 40.580 40.580 39.001 1.579 17919 114051 1 278 . 1 1 36 36 ILE H H 36 6.150 6.150 7.505 -1.355 17919 114052 1 278 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.577 0.057 17919 114053 1 278 . 1 1 37 37 PRO C C 37 176.940 176.940 176.107 0.833 17919 114054 1 278 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.843 -0.183 17919 114055 1 278 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.053 0.797 17919 114056 1 278 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.170 -0.053 17919 114057 1 278 . 1 1 38 38 PRO C C 38 178.320 178.320 178.615 -0.295 17919 114058 1 278 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.646 0.614 17919 114059 1 278 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.792 1.098 17919 114060 1 278 . 1 1 39 39 ASP N N 39 113.380 113.380 116.799 -3.419 17919 114061 1 278 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.378 0.052 17919 114062 1 278 . 1 1 39 39 ASP C C 39 177.090 177.090 177.833 -0.743 17919 114063 1 278 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.639 -0.999 17919 114064 1 278 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.333 -0.793 17919 114065 1 278 . 1 1 39 39 ASP H H 39 8.550 8.550 8.583 -0.033 17919 114066 1 278 . 1 1 40 40 GLN N N 40 116.780 116.780 117.132 -0.352 17919 114067 1 278 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.100 0.364 17919 114068 1 278 . 1 1 40 40 GLN C C 40 175.380 175.380 176.313 -0.933 17919 114069 1 278 . 1 1 40 40 GLN CA C 40 55.640 55.640 57.677 -2.037 17919 114070 1 278 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.127 1.013 17919 114071 1 278 . 1 1 40 40 GLN H H 40 7.820 7.820 7.926 -0.106 17919 114072 1 278 . 1 1 41 41 GLN N N 41 117.720 117.720 118.673 -0.953 17919 114073 1 278 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.687 -0.443 17919 114074 1 278 . 1 1 41 41 GLN C C 41 176.300 176.300 175.358 0.942 17919 114075 1 278 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.753 0.717 17919 114076 1 278 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.815 1.835 17919 114077 1 278 . 1 1 41 41 GLN H H 41 7.480 7.480 7.698 -0.218 17919 114078 1 278 . 1 1 42 42 ARG N N 42 122.680 122.680 124.005 -1.325 17919 114079 1 278 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.637 -0.137 17919 114080 1 278 . 1 1 42 42 ARG C C 42 174.050 174.050 174.452 -0.402 17919 114081 1 278 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.747 0.303 17919 114082 1 278 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.283 -0.534 17919 114083 1 278 . 1 1 42 42 ARG H H 42 8.530 8.530 8.954 -0.424 17919 114084 1 278 . 1 1 43 43 LEU N N 43 124.040 124.040 125.889 -1.849 17919 114085 1 278 . 1 1 43 43 LEU C C 43 175.290 175.290 176.277 -0.987 17919 114086 1 278 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.870 -0.890 17919 114087 1 278 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.120 2.670 17919 114088 1 278 . 1 1 43 43 LEU H H 43 8.820 8.820 8.830 -0.010 17919 114089 1 278 . 1 1 44 44 ILE N N 44 121.920 121.920 122.247 -0.327 17919 114090 1 278 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.163 -0.171 17919 114091 1 278 . 1 1 44 44 ILE C C 44 176.060 176.060 174.279 1.781 17919 114092 1 278 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.226 -1.246 17919 114093 1 278 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.542 -0.122 17919 114094 1 278 . 1 1 44 44 ILE H H 44 9.030 9.030 9.120 -0.090 17919 114095 1 278 . 1 1 45 45 PHE N N 45 125.390 125.390 126.659 -1.269 17919 114096 1 278 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.986 0.059 17919 114097 1 278 . 1 1 45 45 PHE C C 45 174.470 174.470 174.410 0.060 17919 114098 1 278 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.764 0.256 17919 114099 1 278 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.442 0.318 17919 114100 1 278 . 1 1 45 45 PHE H H 45 8.830 8.830 9.148 -0.318 17919 114101 1 278 . 1 1 46 46 ALA N N 46 132.200 132.200 129.257 2.943 17919 114102 1 278 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.647 0.043 17919 114103 1 278 . 1 1 46 46 ALA C C 46 177.290 177.290 177.684 -0.394 17919 114104 1 278 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.342 0.198 17919 114105 1 278 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.466 0.104 17919 114106 1 278 . 1 1 46 46 ALA H H 46 8.810 8.810 8.630 0.180 17919 114107 1 278 . 1 1 47 47 GLY N N 47 102.340 102.340 103.893 -1.553 17919 114108 1 278 . 1 1 47 47 GLY C C 47 173.810 173.810 174.316 -0.506 17919 114109 1 278 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.998 0.352 17919 114110 1 278 . 1 1 47 47 GLY H H 47 8.130 8.130 8.474 -0.344 17919 114111 1 278 . 1 1 48 48 LYS N N 48 121.570 121.570 121.387 0.183 17919 114112 1 278 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.577 0.045 17919 114113 1 278 . 1 1 48 48 LYS C C 48 174.700 174.700 175.402 -0.702 17919 114114 1 278 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.999 -0.449 17919 114115 1 278 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.271 0.259 17919 114116 1 278 . 1 1 48 48 LYS H H 48 7.980 7.980 7.935 0.045 17919 114117 1 278 . 1 1 49 49 GLN N N 49 122.410 122.410 124.032 -1.622 17919 114118 1 278 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.502 0.058 17919 114119 1 278 . 1 1 49 49 GLN C C 49 175.670 175.670 175.949 -0.279 17919 114120 1 278 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.987 -0.247 17919 114121 1 278 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.334 -0.334 17919 114122 1 278 . 1 1 49 49 GLN H H 49 8.600 8.600 8.604 -0.004 17919 114123 1 278 . 1 1 50 50 LEU N N 50 125.520 125.520 128.567 -3.047 17919 114124 1 278 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.394 -0.304 17919 114125 1 278 . 1 1 50 50 LEU C C 50 176.660 176.660 177.016 -0.356 17919 114126 1 278 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.640 -0.400 17919 114127 1 278 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.489 -0.919 17919 114128 1 278 . 1 1 50 50 LEU H H 50 8.530 8.530 8.231 0.299 17919 114129 1 278 . 1 1 51 51 GLU N N 51 122.940 122.940 121.795 1.145 17919 114130 1 278 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.602 -0.114 17919 114131 1 278 . 1 1 51 51 GLU C C 51 175.870 175.870 177.128 -1.258 17919 114132 1 278 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.556 0.404 17919 114133 1 278 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.410 0.160 17919 114134 1 278 . 1 1 51 51 GLU H H 51 8.400 8.400 8.814 -0.414 17919 114135 1 278 . 1 1 52 52 ASP N N 52 120.030 120.030 124.130 -4.100 17919 114136 1 278 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.361 -0.002 17919 114137 1 278 . 1 1 52 52 ASP C C 52 177.330 177.330 177.735 -0.405 17919 114138 1 278 . 1 1 52 52 ASP CA C 52 56.960 56.960 58.009 -1.049 17919 114139 1 278 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.707 0.143 17919 114140 1 278 . 1 1 52 52 ASP H H 52 8.160 8.160 8.862 -0.702 17919 114141 1 278 . 1 1 53 53 GLY N N 53 106.660 106.660 103.028 3.632 17919 114142 1 278 . 1 1 53 53 GLY C C 53 174.870 174.870 173.767 1.103 17919 114143 1 278 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.388 0.782 17919 114144 1 278 . 1 1 53 53 GLY H H 53 9.390 9.390 8.247 1.143 17919 114145 1 278 . 1 1 54 54 ARG N N 54 119.050 119.050 121.037 -1.987 17919 114146 1 278 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.627 0.068 17919 114147 1 278 . 1 1 54 54 ARG C C 54 175.350 175.350 175.629 -0.279 17919 114148 1 278 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.557 -0.167 17919 114149 1 278 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.564 0.086 17919 114150 1 278 . 1 1 54 54 ARG H H 54 7.460 7.460 7.490 -0.030 17919 114151 1 278 . 1 1 55 55 THR N N 55 108.400 108.400 115.516 -7.116 17919 114152 1 278 . 1 1 55 55 THR HA H 55 5.240 5.240 4.805 0.435 17919 114153 1 278 . 1 1 55 55 THR C C 55 176.560 176.560 175.978 0.582 17919 114154 1 278 . 1 1 55 55 THR CA C 55 59.690 59.690 61.276 -1.586 17919 114155 1 278 . 1 1 55 55 THR CB C 55 72.260 72.260 70.106 2.154 17919 114156 1 278 . 1 1 55 55 THR H H 55 8.730 8.730 8.437 0.293 17919 114157 1 278 . 1 1 56 56 LEU N N 56 117.920 117.920 123.766 -5.846 17919 114158 1 278 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.190 -0.130 17919 114159 1 278 . 1 1 56 56 LEU C C 56 180.810 180.810 178.966 1.844 17919 114160 1 278 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.249 0.461 17919 114161 1 278 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.349 -0.979 17919 114162 1 278 . 1 1 56 56 LEU H H 56 8.140 8.140 8.703 -0.563 17919 114163 1 278 . 1 1 57 57 SER N N 57 113.330 113.330 114.794 -1.464 17919 114164 1 278 . 1 1 57 57 SER HA H 57 4.370 4.370 4.131 0.239 17919 114165 1 278 . 1 1 57 57 SER C C 57 178.310 178.310 176.962 1.348 17919 114166 1 278 . 1 1 57 57 SER CA C 57 61.080 61.080 61.298 -0.218 17919 114167 1 278 . 1 1 57 57 SER CB C 57 62.530 62.530 62.672 -0.142 17919 114168 1 278 . 1 1 57 57 SER H H 57 8.470 8.470 8.342 0.128 17919 114169 1 278 . 1 1 58 58 ASP N N 58 124.190 124.190 122.778 1.412 17919 114170 1 278 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.353 -0.057 17919 114171 1 278 . 1 1 58 58 ASP C C 58 177.400 177.400 177.187 0.213 17919 114172 1 278 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.249 0.931 17919 114173 1 278 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.629 -0.529 17919 114174 1 278 . 1 1 58 58 ASP H H 58 7.930 7.930 7.749 0.181 17919 114175 1 278 . 1 1 59 59 TYR N N 59 115.510 115.510 115.973 -0.463 17919 114176 1 278 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.479 0.191 17919 114177 1 278 . 1 1 59 59 TYR C C 59 174.700 174.700 175.332 -0.632 17919 114178 1 278 . 1 1 59 59 TYR CA C 59 58.250 58.250 58.175 0.075 17919 114179 1 278 . 1 1 59 59 TYR CB C 59 40.070 40.070 37.938 2.131 17919 114180 1 278 . 1 1 59 59 TYR H H 59 7.250 7.250 7.349 -0.099 17919 114181 1 278 . 1 1 60 60 ASN N N 60 115.900 115.900 116.688 -0.788 17919 114182 1 278 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.411 -0.056 17919 114183 1 278 . 1 1 60 60 ASN C C 60 174.340 174.340 175.051 -0.711 17919 114184 1 278 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.311 -0.191 17919 114185 1 278 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.209 0.201 17919 114186 1 278 . 1 1 60 60 ASN H H 60 8.150 8.150 8.082 0.068 17919 114187 1 278 . 1 1 61 61 ILE N N 61 118.600 118.600 119.273 -0.673 17919 114188 1 278 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.821 -0.428 17919 114189 1 278 . 1 1 61 61 ILE C C 61 174.610 174.610 175.623 -1.013 17919 114190 1 278 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.233 0.187 17919 114191 1 278 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.778 -1.038 17919 114192 1 278 . 1 1 61 61 ILE H H 61 7.250 7.250 7.923 -0.673 17919 114193 1 278 . 1 1 62 62 GLN N N 62 124.740 124.740 125.382 -0.642 17919 114194 1 278 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.659 -0.153 17919 114195 1 278 . 1 1 62 62 GLN C C 62 175.970 175.970 176.221 -0.251 17919 114196 1 278 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.158 0.502 17919 114197 1 278 . 1 1 62 62 GLN CB C 62 31.650 31.650 30.518 1.132 17919 114198 1 278 . 1 1 62 62 GLN H H 62 7.610 7.610 8.322 -0.712 17919 114199 1 278 . 1 1 63 63 LYS N N 63 120.300 120.300 122.555 -2.255 17919 114200 1 278 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.036 -0.035 17919 114201 1 278 . 1 1 63 63 LYS C C 63 175.810 175.810 176.970 -1.160 17919 114202 1 278 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.018 -0.228 17919 114203 1 278 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.334 0.316 17919 114204 1 278 . 1 1 63 63 LYS H H 63 8.490 8.490 8.731 -0.241 17919 114205 1 278 . 1 1 64 64 GLU N N 64 113.950 113.950 121.298 -7.348 17919 114206 1 278 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.661 -0.196 17919 114207 1 278 . 1 1 64 64 GLU C C 64 175.250 175.250 176.004 -0.754 17919 114208 1 278 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.977 -0.087 17919 114209 1 278 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.899 -2.999 17919 114210 1 278 . 1 1 64 64 GLU H H 64 9.280 9.280 8.903 0.377 17919 114211 1 278 . 1 1 65 65 SER N N 65 114.730 114.730 115.474 -0.744 17919 114212 1 278 . 1 1 65 65 SER HA H 65 4.640 4.640 4.476 0.164 17919 114213 1 278 . 1 1 65 65 SER C C 65 172.160 172.160 174.309 -2.149 17919 114214 1 278 . 1 1 65 65 SER CA C 65 60.890 60.890 60.423 0.466 17919 114215 1 278 . 1 1 65 65 SER CB C 65 64.910 64.910 63.886 1.024 17919 114216 1 278 . 1 1 65 65 SER H H 65 7.670 7.670 7.815 -0.145 17919 114217 1 278 . 1 1 66 66 THR N N 66 117.110 117.110 119.655 -2.545 17919 114218 1 278 . 1 1 66 66 THR HA H 66 5.270 5.270 4.954 0.316 17919 114219 1 278 . 1 1 66 66 THR C C 66 173.950 173.950 174.188 -0.238 17919 114220 1 278 . 1 1 66 66 THR CA C 66 62.340 62.340 62.248 0.092 17919 114221 1 278 . 1 1 66 66 THR CB C 66 70.080 70.080 69.906 0.174 17919 114222 1 278 . 1 1 66 66 THR H H 66 8.730 8.730 8.405 0.325 17919 114223 1 278 . 1 1 67 67 LEU N N 67 127.110 127.110 126.123 0.987 17919 114224 1 278 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.817 0.243 17919 114225 1 278 . 1 1 67 67 LEU C C 67 175.770 175.770 175.161 0.609 17919 114226 1 278 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.672 0.228 17919 114227 1 278 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.498 -0.238 17919 114228 1 278 . 1 1 67 67 LEU H H 67 9.410 9.410 9.038 0.372 17919 114229 1 278 . 1 1 68 68 HIS N N 68 118.380 118.380 121.859 -3.479 17919 114230 1 278 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.439 -0.199 17919 114231 1 278 . 1 1 68 68 HIS C C 68 173.150 173.150 173.692 -0.542 17919 114232 1 278 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.158 0.842 17919 114233 1 278 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.284 -1.754 17919 114234 1 278 . 1 1 68 68 HIS H H 68 9.230 9.230 9.005 0.225 17919 114235 1 278 . 1 1 69 69 LEU N N 69 124.460 124.460 130.565 -6.105 17919 114236 1 278 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.741 0.449 17919 114237 1 278 . 1 1 69 69 LEU C C 69 175.270 175.270 173.973 1.297 17919 114238 1 278 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.522 0.368 17919 114239 1 278 . 1 1 69 69 LEU CB C 69 44.380 44.380 43.811 0.569 17919 114240 1 278 . 1 1 69 69 LEU H H 69 8.340 8.340 8.628 -0.288 17919 114241 1 278 . 1 1 70 70 VAL N N 70 126.940 126.940 127.341 -0.401 17919 114242 1 278 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.386 -0.036 17919 114243 1 278 . 1 1 70 70 VAL C C 70 174.000 174.000 174.586 -0.586 17919 114244 1 278 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.605 0.195 17919 114245 1 278 . 1 1 70 70 VAL CB C 70 34.910 34.910 34.440 0.470 17919 114246 1 278 . 1 1 70 70 VAL H H 70 9.200 9.200 9.105 0.095 17919 114247 1 278 . 1 1 71 71 LEU N N 71 123.130 123.130 124.658 -1.528 17919 114248 1 278 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.939 0.121 17919 114249 1 278 . 1 1 71 71 LEU C C 71 177.830 177.830 176.933 0.897 17919 114250 1 278 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.466 0.474 17919 114251 1 278 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.567 -0.717 17919 114252 1 278 . 1 1 71 71 LEU H H 71 8.120 8.120 8.484 -0.364 17919 114253 1 278 . 1 1 72 72 ARG N N 72 123.490 123.490 121.047 2.443 17919 114254 1 278 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.356 -0.055 17919 114255 1 278 . 1 1 72 72 ARG C C 72 175.350 175.350 175.964 -0.614 17919 114256 1 278 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.949 -0.339 17919 114257 1 278 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.852 0.498 17919 114258 1 278 . 1 1 72 72 ARG H H 72 8.580 8.580 8.103 0.477 17919 114259 1 279 . 1 1 2 2 GLN N N 2 123.220 123.220 119.954 3.266 17919 114260 1 279 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.503 -0.254 17919 114261 1 279 . 1 1 2 2 GLN C C 2 175.920 175.920 175.782 0.138 17919 114262 1 279 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.494 0.586 17919 114263 1 279 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.417 0.343 17919 114264 1 279 . 1 1 2 2 GLN H H 2 8.900 8.900 8.360 0.540 17919 114265 1 279 . 1 1 3 3 ILE N N 3 115.340 115.340 116.623 -1.283 17919 114266 1 279 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.356 -0.143 17919 114267 1 279 . 1 1 3 3 ILE C C 3 172.450 172.450 173.843 -1.393 17919 114268 1 279 . 1 1 3 3 ILE CA C 3 59.570 59.570 58.696 0.874 17919 114269 1 279 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.359 0.851 17919 114270 1 279 . 1 1 3 3 ILE H H 3 8.320 8.320 8.025 0.295 17919 114271 1 279 . 1 1 4 4 PHE N N 4 118.110 118.110 118.687 -0.577 17919 114272 1 279 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.300 0.330 17919 114273 1 279 . 1 1 4 4 PHE C C 4 175.320 175.320 175.073 0.247 17919 114274 1 279 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.395 -0.185 17919 114275 1 279 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.615 -0.135 17919 114276 1 279 . 1 1 4 4 PHE H H 4 8.610 8.610 8.099 0.511 17919 114277 1 279 . 1 1 5 5 VAL N N 5 121.000 121.000 122.270 -1.270 17919 114278 1 279 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.776 -0.051 17919 114279 1 279 . 1 1 5 5 VAL C C 5 174.870 174.870 174.541 0.329 17919 114280 1 279 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.183 -0.563 17919 114281 1 279 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.989 0.241 17919 114282 1 279 . 1 1 5 5 VAL H H 5 9.300 9.300 9.348 -0.048 17919 114283 1 279 . 1 1 6 6 LYS N N 6 127.520 127.520 128.873 -1.353 17919 114284 1 279 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.180 0.187 17919 114285 1 279 . 1 1 6 6 LYS C C 6 177.140 177.140 175.958 1.182 17919 114286 1 279 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.084 0.436 17919 114287 1 279 . 1 1 6 6 LYS CB C 6 35.050 35.050 36.048 -0.998 17919 114288 1 279 . 1 1 6 6 LYS H H 6 8.820 8.820 9.102 -0.282 17919 114289 1 279 . 1 1 7 7 THR N N 7 115.400 115.400 116.698 -1.298 17919 114290 1 279 . 1 1 7 7 THR HA H 7 4.970 4.970 4.932 0.038 17919 114291 1 279 . 1 1 7 7 THR C C 7 176.910 176.910 176.445 0.465 17919 114292 1 279 . 1 1 7 7 THR CA C 7 60.470 60.470 60.241 0.229 17919 114293 1 279 . 1 1 7 7 THR CB C 7 70.630 70.630 70.906 -0.276 17919 114294 1 279 . 1 1 7 7 THR H H 7 8.730 8.730 8.583 0.147 17919 114295 1 279 . 1 1 8 8 LEU N N 8 121.330 121.330 123.726 -2.396 17919 114296 1 279 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.395 -0.085 17919 114297 1 279 . 1 1 8 8 LEU C C 8 178.800 178.800 177.589 1.211 17919 114298 1 279 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.915 -0.335 17919 114299 1 279 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.110 -0.140 17919 114300 1 279 . 1 1 8 8 LEU H H 8 9.100 9.100 8.928 0.172 17919 114301 1 279 . 1 1 9 9 THR N N 9 105.590 105.590 109.593 -4.003 17919 114302 1 279 . 1 1 9 9 THR HA H 9 4.428 4.428 4.388 0.040 17919 114303 1 279 . 1 1 9 9 THR C C 9 175.520 175.520 175.363 0.157 17919 114304 1 279 . 1 1 9 9 THR CA C 9 61.400 61.400 61.574 -0.174 17919 114305 1 279 . 1 1 9 9 THR CB C 9 69.140 69.140 69.104 0.036 17919 114306 1 279 . 1 1 9 9 THR H H 9 7.630 7.630 7.632 -0.002 17919 114307 1 279 . 1 1 10 10 GLY N N 10 108.890 108.890 110.346 -1.456 17919 114308 1 279 . 1 1 10 10 GLY C C 10 174.070 174.070 173.585 0.485 17919 114309 1 279 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.013 0.447 17919 114310 1 279 . 1 1 10 10 GLY H H 10 7.810 7.810 8.152 -0.342 17919 114311 1 279 . 1 1 11 11 LYS N N 11 121.600 121.600 122.528 -0.928 17919 114312 1 279 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.389 -0.028 17919 114313 1 279 . 1 1 11 11 LYS C C 11 175.940 175.940 176.065 -0.125 17919 114314 1 279 . 1 1 11 11 LYS CA C 11 56.280 56.280 55.919 0.361 17919 114315 1 279 . 1 1 11 11 LYS CB C 11 33.200 33.200 32.983 0.217 17919 114316 1 279 . 1 1 11 11 LYS H H 11 7.280 7.280 7.945 -0.665 17919 114317 1 279 . 1 1 12 12 THR N N 12 120.440 120.440 123.201 -2.761 17919 114318 1 279 . 1 1 12 12 THR HA H 12 5.046 5.046 4.847 0.199 17919 114319 1 279 . 1 1 12 12 THR C C 12 174.320 174.320 174.885 -0.565 17919 114320 1 279 . 1 1 12 12 THR CA C 12 62.390 62.390 62.749 -0.359 17919 114321 1 279 . 1 1 12 12 THR CB C 12 69.910 69.910 69.379 0.531 17919 114322 1 279 . 1 1 12 12 THR H H 12 8.650 8.650 8.368 0.282 17919 114323 1 279 . 1 1 13 13 ILE N N 13 127.110 127.110 121.966 5.144 17919 114324 1 279 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.736 -0.192 17919 114325 1 279 . 1 1 13 13 ILE C C 13 175.220 175.220 174.111 1.109 17919 114326 1 279 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.491 0.489 17919 114327 1 279 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.680 0.270 17919 114328 1 279 . 1 1 13 13 ILE H H 13 9.450 9.450 8.912 0.538 17919 114329 1 279 . 1 1 14 14 THR N N 14 121.520 121.520 122.119 -0.599 17919 114330 1 279 . 1 1 14 14 THR HA H 14 4.964 4.964 5.240 -0.276 17919 114331 1 279 . 1 1 14 14 THR C C 14 173.790 173.790 174.248 -0.458 17919 114332 1 279 . 1 1 14 14 THR CA C 14 61.940 61.940 62.181 -0.241 17919 114333 1 279 . 1 1 14 14 THR CB C 14 69.650 69.650 69.800 -0.150 17919 114334 1 279 . 1 1 14 14 THR H H 14 8.710 8.710 8.449 0.261 17919 114335 1 279 . 1 1 15 15 LEU N N 15 124.800 124.800 125.887 -1.087 17919 114336 1 279 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.719 0.061 17919 114337 1 279 . 1 1 15 15 LEU C C 15 174.670 174.670 175.676 -1.006 17919 114338 1 279 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.990 -1.160 17919 114339 1 279 . 1 1 15 15 LEU CB C 15 47.070 47.070 43.921 3.149 17919 114340 1 279 . 1 1 15 15 LEU H H 15 8.710 8.710 8.251 0.459 17919 114341 1 279 . 1 1 16 16 GLU N N 16 122.160 122.160 121.849 0.311 17919 114342 1 279 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.349 -0.432 17919 114343 1 279 . 1 1 16 16 GLU C C 16 175.860 175.860 176.154 -0.294 17919 114344 1 279 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.503 -0.683 17919 114345 1 279 . 1 1 16 16 GLU CB C 16 29.450 29.450 31.069 -1.619 17919 114346 1 279 . 1 1 16 16 GLU H H 16 8.140 8.140 8.667 -0.527 17919 114347 1 279 . 1 1 17 17 VAL N N 17 117.210 117.210 119.377 -2.167 17919 114348 1 279 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.939 -0.225 17919 114349 1 279 . 1 1 17 17 VAL C C 17 174.160 174.160 175.103 -0.943 17919 114350 1 279 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.872 -0.442 17919 114351 1 279 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.647 0.753 17919 114352 1 279 . 1 1 17 17 VAL H H 17 8.900 8.900 8.784 0.116 17919 114353 1 279 . 1 1 18 18 GLU N N 18 118.990 118.990 122.265 -3.275 17919 114354 1 279 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.672 0.407 17919 114355 1 279 . 1 1 18 18 GLU C C 18 176.160 176.160 175.287 0.873 17919 114356 1 279 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.351 -0.631 17919 114357 1 279 . 1 1 18 18 GLU CB C 18 30.310 30.310 29.773 0.537 17919 114358 1 279 . 1 1 18 18 GLU H H 18 8.640 8.640 8.970 -0.330 17919 114359 1 279 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.224 -0.083 17919 114360 1 279 . 1 1 19 19 PRO C C 19 175.310 175.310 177.949 -2.639 17919 114361 1 279 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.436 0.034 17919 114362 1 279 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.715 0.235 17919 114363 1 279 . 1 1 20 20 SER N N 20 103.400 103.400 109.381 -5.981 17919 114364 1 279 . 1 1 20 20 SER HA H 20 4.370 4.370 4.221 0.149 17919 114365 1 279 . 1 1 20 20 SER C C 20 174.660 174.660 174.676 -0.016 17919 114366 1 279 . 1 1 20 20 SER CA C 20 57.400 57.400 59.280 -1.880 17919 114367 1 279 . 1 1 20 20 SER CB C 20 63.370 63.370 62.508 0.862 17919 114368 1 279 . 1 1 20 20 SER H H 20 7.040 7.040 8.158 -1.118 17919 114369 1 279 . 1 1 21 21 ASP N N 21 123.480 123.480 123.905 -0.425 17919 114370 1 279 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.628 0.067 17919 114371 1 279 . 1 1 21 21 ASP C C 21 176.360 176.360 176.421 -0.061 17919 114372 1 279 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.877 0.823 17919 114373 1 279 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.540 -0.740 17919 114374 1 279 . 1 1 21 21 ASP H H 21 8.030 8.030 7.672 0.358 17919 114375 1 279 . 1 1 22 22 THR N N 22 108.800 108.800 112.742 -3.942 17919 114376 1 279 . 1 1 22 22 THR HA H 22 4.920 4.920 4.884 0.036 17919 114377 1 279 . 1 1 22 22 THR C C 22 176.750 176.750 176.453 0.297 17919 114378 1 279 . 1 1 22 22 THR CA C 22 59.690 59.690 61.771 -2.081 17919 114379 1 279 . 1 1 22 22 THR CB C 22 71.200 71.200 70.805 0.395 17919 114380 1 279 . 1 1 22 22 THR H H 22 7.900 7.900 8.220 -0.320 17919 114381 1 279 . 1 1 23 23 ILE N N 23 121.190 121.190 121.604 -0.414 17919 114382 1 279 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.908 -0.251 17919 114383 1 279 . 1 1 23 23 ILE C C 23 179.040 179.040 177.840 1.200 17919 114384 1 279 . 1 1 23 23 ILE CA C 23 62.260 62.260 61.359 0.901 17919 114385 1 279 . 1 1 23 23 ILE CB C 23 34.350 34.350 35.803 -1.453 17919 114386 1 279 . 1 1 23 23 ILE H H 23 8.560 8.560 8.859 -0.299 17919 114387 1 279 . 1 1 24 24 GLU N N 24 120.830 120.830 121.875 -1.045 17919 114388 1 279 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.897 0.020 17919 114389 1 279 . 1 1 24 24 GLU C C 24 178.640 178.640 178.409 0.231 17919 114390 1 279 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.140 0.080 17919 114391 1 279 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.600 -1.320 17919 114392 1 279 . 1 1 24 24 GLU H H 24 9.760 9.760 8.418 1.343 17919 114393 1 279 . 1 1 25 25 ASN N N 25 120.570 120.570 118.526 2.044 17919 114394 1 279 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.476 0.049 17919 114395 1 279 . 1 1 25 25 ASN C C 25 178.380 178.380 177.716 0.664 17919 114396 1 279 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.363 -0.303 17919 114397 1 279 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.826 -0.376 17919 114398 1 279 . 1 1 25 25 ASN H H 25 7.920 7.920 7.958 -0.038 17919 114399 1 279 . 1 1 26 26 VAL N N 26 121.710 121.710 120.462 1.248 17919 114400 1 279 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.598 -0.201 17919 114401 1 279 . 1 1 26 26 VAL C C 26 177.950 177.950 177.823 0.127 17919 114402 1 279 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.913 0.747 17919 114403 1 279 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.574 -0.734 17919 114404 1 279 . 1 1 26 26 VAL H H 26 8.070 8.070 8.348 -0.278 17919 114405 1 279 . 1 1 27 27 LYS N N 27 118.860 118.860 120.097 -1.237 17919 114406 1 279 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.165 0.415 17919 114407 1 279 . 1 1 27 27 LYS C C 27 180.550 180.550 179.176 1.374 17919 114408 1 279 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.732 -0.482 17919 114409 1 279 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.244 1.486 17919 114410 1 279 . 1 1 27 27 LYS H H 27 8.560 8.560 8.367 0.193 17919 114411 1 279 . 1 1 28 28 ALA N N 28 123.440 123.440 121.188 2.252 17919 114412 1 279 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.148 0.012 17919 114413 1 279 . 1 1 28 28 ALA C C 28 180.300 180.300 179.326 0.974 17919 114414 1 279 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.724 0.646 17919 114415 1 279 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.433 -0.723 17919 114416 1 279 . 1 1 28 28 ALA H H 28 8.060 8.060 8.009 0.051 17919 114417 1 279 . 1 1 29 29 LYS N N 29 119.940 119.940 119.283 0.657 17919 114418 1 279 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.054 0.153 17919 114419 1 279 . 1 1 29 29 LYS C C 29 180.320 180.320 179.042 1.278 17919 114420 1 279 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.232 0.418 17919 114421 1 279 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.410 0.880 17919 114422 1 279 . 1 1 29 29 LYS H H 29 7.850 7.850 8.070 -0.220 17919 114423 1 279 . 1 1 30 30 ILE N N 30 121.080 121.080 120.537 0.543 17919 114424 1 279 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.674 -0.167 17919 114425 1 279 . 1 1 30 30 ILE C C 30 178.310 178.310 177.137 1.173 17919 114426 1 279 . 1 1 30 30 ILE CA C 30 66.150 66.150 64.927 1.224 17919 114427 1 279 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.788 -0.987 17919 114428 1 279 . 1 1 30 30 ILE H H 30 8.280 8.280 7.968 0.312 17919 114429 1 279 . 1 1 31 31 GLN N N 31 123.490 123.490 121.160 2.330 17919 114430 1 279 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.912 -0.083 17919 114431 1 279 . 1 1 31 31 GLN C C 31 178.890 178.890 178.240 0.650 17919 114432 1 279 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.341 0.659 17919 114433 1 279 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.448 -0.728 17919 114434 1 279 . 1 1 31 31 GLN H H 31 8.580 8.580 7.860 0.720 17919 114435 1 279 . 1 1 32 32 ASP N N 32 119.360 119.360 118.532 0.828 17919 114436 1 279 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.406 -0.052 17919 114437 1 279 . 1 1 32 32 ASP C C 32 177.250 177.250 177.724 -0.474 17919 114438 1 279 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.651 0.539 17919 114439 1 279 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.679 -0.099 17919 114440 1 279 . 1 1 32 32 ASP H H 32 8.010 8.010 7.809 0.201 17919 114441 1 279 . 1 1 33 33 LYS N N 33 115.130 115.130 118.752 -3.622 17919 114442 1 279 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.181 0.156 17919 114443 1 279 . 1 1 33 33 LYS C C 33 177.870 177.870 178.335 -0.465 17919 114444 1 279 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.466 -0.416 17919 114445 1 279 . 1 1 33 33 LYS CB C 33 34.170 34.170 32.961 1.209 17919 114446 1 279 . 1 1 33 33 LYS H H 33 7.430 7.430 7.616 -0.186 17919 114447 1 279 . 1 1 34 34 GLU N N 34 113.870 113.870 114.572 -0.702 17919 114448 1 279 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.469 0.156 17919 114449 1 279 . 1 1 34 34 GLU C C 34 177.840 177.840 177.454 0.386 17919 114450 1 279 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.739 -0.569 17919 114451 1 279 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.337 1.323 17919 114452 1 279 . 1 1 34 34 GLU H H 34 8.740 8.740 8.038 0.702 17919 114453 1 279 . 1 1 35 35 GLY N N 35 108.650 108.650 109.911 -1.261 17919 114454 1 279 . 1 1 35 35 GLY C C 35 173.960 173.960 174.304 -0.344 17919 114455 1 279 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.877 0.203 17919 114456 1 279 . 1 1 35 35 GLY H H 35 8.530 8.530 8.373 0.157 17919 114457 1 279 . 1 1 36 36 ILE N N 36 119.880 119.880 116.974 2.906 17919 114458 1 279 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.555 -0.110 17919 114459 1 279 . 1 1 36 36 ILE C C 36 173.590 173.590 174.127 -0.537 17919 114460 1 279 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.528 0.222 17919 114461 1 279 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.650 1.930 17919 114462 1 279 . 1 1 36 36 ILE H H 36 6.150 6.150 7.471 -1.321 17919 114463 1 279 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.637 -0.003 17919 114464 1 279 . 1 1 37 37 PRO C C 37 176.940 176.940 176.006 0.934 17919 114465 1 279 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.489 0.171 17919 114466 1 279 . 1 1 37 37 PRO CB C 37 31.850 31.850 30.874 0.976 17919 114467 1 279 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.166 -0.049 17919 114468 1 279 . 1 1 38 38 PRO C C 38 178.320 178.320 178.559 -0.239 17919 114469 1 279 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.808 0.452 17919 114470 1 279 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.905 0.985 17919 114471 1 279 . 1 1 39 39 ASP N N 39 113.380 113.380 115.797 -2.417 17919 114472 1 279 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.364 0.066 17919 114473 1 279 . 1 1 39 39 ASP C C 39 177.090 177.090 177.824 -0.734 17919 114474 1 279 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.879 -1.239 17919 114475 1 279 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.407 -0.867 17919 114476 1 279 . 1 1 39 39 ASP H H 39 8.550 8.550 8.678 -0.128 17919 114477 1 279 . 1 1 40 40 GLN N N 40 116.780 116.780 115.982 0.798 17919 114478 1 279 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.461 0.003 17919 114479 1 279 . 1 1 40 40 GLN C C 40 175.380 175.380 175.579 -0.199 17919 114480 1 279 . 1 1 40 40 GLN CA C 40 55.640 55.640 54.956 0.684 17919 114481 1 279 . 1 1 40 40 GLN CB C 40 30.140 30.140 28.850 1.290 17919 114482 1 279 . 1 1 40 40 GLN H H 40 7.820 7.820 7.977 -0.157 17919 114483 1 279 . 1 1 41 41 GLN N N 41 117.720 117.720 119.878 -2.158 17919 114484 1 279 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.439 -0.195 17919 114485 1 279 . 1 1 41 41 GLN C C 41 176.300 176.300 175.765 0.535 17919 114486 1 279 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.106 0.364 17919 114487 1 279 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.417 2.233 17919 114488 1 279 . 1 1 41 41 GLN H H 41 7.480 7.480 7.357 0.123 17919 114489 1 279 . 1 1 42 42 ARG N N 42 122.680 122.680 126.500 -3.820 17919 114490 1 279 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.614 -0.114 17919 114491 1 279 . 1 1 42 42 ARG C C 42 174.050 174.050 173.888 0.162 17919 114492 1 279 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.663 0.387 17919 114493 1 279 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.000 -0.250 17919 114494 1 279 . 1 1 42 42 ARG H H 42 8.530 8.530 8.869 -0.339 17919 114495 1 279 . 1 1 43 43 LEU N N 43 124.040 124.040 128.353 -4.313 17919 114496 1 279 . 1 1 43 43 LEU C C 43 175.290 175.290 175.477 -0.187 17919 114497 1 279 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.242 -1.262 17919 114498 1 279 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.864 1.926 17919 114499 1 279 . 1 1 43 43 LEU H H 43 8.820 8.820 8.808 0.012 17919 114500 1 279 . 1 1 44 44 ILE N N 44 121.920 121.920 124.058 -2.138 17919 114501 1 279 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.241 -0.249 17919 114502 1 279 . 1 1 44 44 ILE C C 44 176.060 176.060 174.742 1.318 17919 114503 1 279 . 1 1 44 44 ILE CA C 44 58.980 58.980 58.374 0.606 17919 114504 1 279 . 1 1 44 44 ILE CB C 44 41.420 41.420 39.191 2.229 17919 114505 1 279 . 1 1 44 44 ILE H H 44 9.030 9.030 9.120 -0.090 17919 114506 1 279 . 1 1 45 45 PHE N N 45 125.390 125.390 127.583 -2.193 17919 114507 1 279 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.935 0.110 17919 114508 1 279 . 1 1 45 45 PHE C C 45 174.470 174.470 174.355 0.115 17919 114509 1 279 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.058 0.962 17919 114510 1 279 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.989 0.771 17919 114511 1 279 . 1 1 45 45 PHE H H 45 8.830 8.830 8.776 0.054 17919 114512 1 279 . 1 1 46 46 ALA N N 46 132.200 132.200 128.838 3.362 17919 114513 1 279 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.590 0.100 17919 114514 1 279 . 1 1 46 46 ALA C C 46 177.290 177.290 177.616 -0.326 17919 114515 1 279 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.486 0.054 17919 114516 1 279 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.247 0.324 17919 114517 1 279 . 1 1 46 46 ALA H H 46 8.810 8.810 8.921 -0.111 17919 114518 1 279 . 1 1 47 47 GLY N N 47 102.340 102.340 104.124 -1.784 17919 114519 1 279 . 1 1 47 47 GLY C C 47 173.810 173.810 174.327 -0.517 17919 114520 1 279 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.855 0.495 17919 114521 1 279 . 1 1 47 47 GLY H H 47 8.130 8.130 8.425 -0.295 17919 114522 1 279 . 1 1 48 48 LYS N N 48 121.570 121.570 121.358 0.212 17919 114523 1 279 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.575 0.047 17919 114524 1 279 . 1 1 48 48 LYS C C 48 174.700 174.700 175.181 -0.481 17919 114525 1 279 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.925 -0.375 17919 114526 1 279 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.708 -0.178 17919 114527 1 279 . 1 1 48 48 LYS H H 48 7.980 7.980 7.831 0.149 17919 114528 1 279 . 1 1 49 49 GLN N N 49 122.410 122.410 123.425 -1.015 17919 114529 1 279 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.530 0.030 17919 114530 1 279 . 1 1 49 49 GLN C C 49 175.670 175.670 175.903 -0.233 17919 114531 1 279 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.057 -0.317 17919 114532 1 279 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.243 -0.243 17919 114533 1 279 . 1 1 49 49 GLN H H 49 8.600 8.600 8.542 0.058 17919 114534 1 279 . 1 1 50 50 LEU N N 50 125.520 125.520 129.378 -3.858 17919 114535 1 279 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.239 -0.149 17919 114536 1 279 . 1 1 50 50 LEU C C 50 176.660 176.660 176.228 0.432 17919 114537 1 279 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.527 -0.287 17919 114538 1 279 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.303 -0.733 17919 114539 1 279 . 1 1 50 50 LEU H H 50 8.530 8.530 8.959 -0.429 17919 114540 1 279 . 1 1 51 51 GLU N N 51 122.940 122.940 120.044 2.896 17919 114541 1 279 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.683 -0.195 17919 114542 1 279 . 1 1 51 51 GLU C C 51 175.870 175.870 176.719 -0.849 17919 114543 1 279 . 1 1 51 51 GLU CA C 51 55.960 55.960 54.736 1.224 17919 114544 1 279 . 1 1 51 51 GLU CB C 51 31.570 31.570 33.462 -1.892 17919 114545 1 279 . 1 1 51 51 GLU H H 51 8.400 8.400 8.196 0.204 17919 114546 1 279 . 1 1 52 52 ASP N N 52 120.030 120.030 123.938 -3.908 17919 114547 1 279 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.348 0.011 17919 114548 1 279 . 1 1 52 52 ASP C C 52 177.330 177.330 177.524 -0.194 17919 114549 1 279 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.515 -0.555 17919 114550 1 279 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.884 -0.034 17919 114551 1 279 . 1 1 52 52 ASP H H 52 8.160 8.160 8.861 -0.701 17919 114552 1 279 . 1 1 53 53 GLY N N 53 106.660 106.660 105.743 0.917 17919 114553 1 279 . 1 1 53 53 GLY C C 53 174.870 174.870 173.712 1.158 17919 114554 1 279 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.182 -0.012 17919 114555 1 279 . 1 1 53 53 GLY H H 53 9.390 9.390 8.550 0.840 17919 114556 1 279 . 1 1 54 54 ARG N N 54 119.050 119.050 119.195 -0.145 17919 114557 1 279 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.602 0.093 17919 114558 1 279 . 1 1 54 54 ARG C C 54 175.350 175.350 175.449 -0.099 17919 114559 1 279 . 1 1 54 54 ARG CA C 54 54.390 54.390 52.913 1.477 17919 114560 1 279 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.728 -0.078 17919 114561 1 279 . 1 1 54 54 ARG H H 54 7.460 7.460 7.518 -0.058 17919 114562 1 279 . 1 1 55 55 THR N N 55 108.400 108.400 111.933 -3.533 17919 114563 1 279 . 1 1 55 55 THR HA H 55 5.240 5.240 5.060 0.180 17919 114564 1 279 . 1 1 55 55 THR C C 55 176.560 176.560 176.607 -0.047 17919 114565 1 279 . 1 1 55 55 THR CA C 55 59.690 59.690 60.261 -0.571 17919 114566 1 279 . 1 1 55 55 THR CB C 55 72.260 72.260 70.485 1.775 17919 114567 1 279 . 1 1 55 55 THR H H 55 8.730 8.730 8.779 -0.049 17919 114568 1 279 . 1 1 56 56 LEU N N 56 117.920 117.920 120.760 -2.840 17919 114569 1 279 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.998 0.062 17919 114570 1 279 . 1 1 56 56 LEU C C 56 180.810 180.810 178.864 1.946 17919 114571 1 279 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.856 -0.146 17919 114572 1 279 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.273 -0.903 17919 114573 1 279 . 1 1 56 56 LEU H H 56 8.140 8.140 8.802 -0.662 17919 114574 1 279 . 1 1 57 57 SER N N 57 113.330 113.330 114.328 -0.998 17919 114575 1 279 . 1 1 57 57 SER HA H 57 4.370 4.370 4.272 0.098 17919 114576 1 279 . 1 1 57 57 SER C C 57 178.310 178.310 176.934 1.376 17919 114577 1 279 . 1 1 57 57 SER CA C 57 61.080 61.080 61.669 -0.589 17919 114578 1 279 . 1 1 57 57 SER CB C 57 62.530 62.530 62.519 0.011 17919 114579 1 279 . 1 1 57 57 SER H H 57 8.470 8.470 8.026 0.444 17919 114580 1 279 . 1 1 58 58 ASP N N 58 124.190 124.190 122.545 1.645 17919 114581 1 279 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.325 -0.029 17919 114582 1 279 . 1 1 58 58 ASP C C 58 177.400 177.400 177.253 0.147 17919 114583 1 279 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.999 0.181 17919 114584 1 279 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.627 -0.527 17919 114585 1 279 . 1 1 58 58 ASP H H 58 7.930 7.930 7.854 0.076 17919 114586 1 279 . 1 1 59 59 TYR N N 59 115.510 115.510 115.606 -0.096 17919 114587 1 279 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.666 0.004 17919 114588 1 279 . 1 1 59 59 TYR C C 59 174.700 174.700 174.820 -0.120 17919 114589 1 279 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.172 1.078 17919 114590 1 279 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.148 1.922 17919 114591 1 279 . 1 1 59 59 TYR H H 59 7.250 7.250 7.430 -0.180 17919 114592 1 279 . 1 1 60 60 ASN N N 60 115.900 115.900 116.621 -0.721 17919 114593 1 279 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.436 -0.081 17919 114594 1 279 . 1 1 60 60 ASN C C 60 174.340 174.340 174.729 -0.389 17919 114595 1 279 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.058 0.062 17919 114596 1 279 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.664 -0.254 17919 114597 1 279 . 1 1 60 60 ASN H H 60 8.150 8.150 7.826 0.324 17919 114598 1 279 . 1 1 61 61 ILE N N 61 118.600 118.600 119.287 -0.687 17919 114599 1 279 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.834 -0.441 17919 114600 1 279 . 1 1 61 61 ILE C C 61 174.610 174.610 175.607 -0.997 17919 114601 1 279 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.132 1.288 17919 114602 1 279 . 1 1 61 61 ILE CB C 61 36.740 36.740 36.815 -0.075 17919 114603 1 279 . 1 1 61 61 ILE H H 61 7.250 7.250 7.929 -0.679 17919 114604 1 279 . 1 1 62 62 GLN N N 62 124.740 124.740 124.974 -0.234 17919 114605 1 279 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.659 -0.153 17919 114606 1 279 . 1 1 62 62 GLN C C 62 175.970 175.970 175.724 0.246 17919 114607 1 279 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.930 -0.270 17919 114608 1 279 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.597 0.053 17919 114609 1 279 . 1 1 62 62 GLN H H 62 7.610 7.610 7.954 -0.344 17919 114610 1 279 . 1 1 63 63 LYS N N 63 120.300 120.300 121.169 -0.869 17919 114611 1 279 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.762 0.239 17919 114612 1 279 . 1 1 63 63 LYS C C 63 175.810 175.810 177.416 -1.606 17919 114613 1 279 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.624 -0.834 17919 114614 1 279 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.412 0.238 17919 114615 1 279 . 1 1 63 63 LYS H H 63 8.490 8.490 8.526 -0.036 17919 114616 1 279 . 1 1 64 64 GLU N N 64 113.950 113.950 121.015 -7.065 17919 114617 1 279 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.718 -0.253 17919 114618 1 279 . 1 1 64 64 GLU C C 64 175.250 175.250 175.960 -0.710 17919 114619 1 279 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.956 -0.066 17919 114620 1 279 . 1 1 64 64 GLU CB C 64 25.900 25.900 29.074 -3.174 17919 114621 1 279 . 1 1 64 64 GLU H H 64 9.280 9.280 9.031 0.249 17919 114622 1 279 . 1 1 65 65 SER N N 65 114.730 114.730 115.610 -0.880 17919 114623 1 279 . 1 1 65 65 SER HA H 65 4.640 4.640 4.453 0.187 17919 114624 1 279 . 1 1 65 65 SER C C 65 172.160 172.160 173.754 -1.594 17919 114625 1 279 . 1 1 65 65 SER CA C 65 60.890 60.890 60.912 -0.022 17919 114626 1 279 . 1 1 65 65 SER CB C 65 64.910 64.910 63.868 1.042 17919 114627 1 279 . 1 1 65 65 SER H H 65 7.670 7.670 7.627 0.043 17919 114628 1 279 . 1 1 66 66 THR N N 66 117.110 117.110 118.436 -1.326 17919 114629 1 279 . 1 1 66 66 THR HA H 66 5.270 5.270 5.121 0.149 17919 114630 1 279 . 1 1 66 66 THR C C 66 173.950 173.950 173.777 0.173 17919 114631 1 279 . 1 1 66 66 THR CA C 66 62.340 62.340 61.743 0.597 17919 114632 1 279 . 1 1 66 66 THR CB C 66 70.080 70.080 70.097 -0.017 17919 114633 1 279 . 1 1 66 66 THR H H 66 8.730 8.730 8.229 0.501 17919 114634 1 279 . 1 1 67 67 LEU N N 67 127.110 127.110 127.229 -0.119 17919 114635 1 279 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.922 0.138 17919 114636 1 279 . 1 1 67 67 LEU C C 67 175.770 175.770 175.041 0.729 17919 114637 1 279 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.186 -0.286 17919 114638 1 279 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.448 -0.188 17919 114639 1 279 . 1 1 67 67 LEU H H 67 9.410 9.410 9.130 0.280 17919 114640 1 279 . 1 1 68 68 HIS N N 68 118.380 118.380 122.187 -3.807 17919 114641 1 279 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.312 -0.072 17919 114642 1 279 . 1 1 68 68 HIS C C 68 173.150 173.150 173.190 -0.040 17919 114643 1 279 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.596 0.404 17919 114644 1 279 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.846 -2.316 17919 114645 1 279 . 1 1 68 68 HIS H H 68 9.230 9.230 9.207 0.023 17919 114646 1 279 . 1 1 69 69 LEU N N 69 124.460 124.460 129.642 -5.182 17919 114647 1 279 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.242 -0.052 17919 114648 1 279 . 1 1 69 69 LEU C C 69 175.270 175.270 174.355 0.915 17919 114649 1 279 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.196 0.694 17919 114650 1 279 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.995 -0.615 17919 114651 1 279 . 1 1 69 69 LEU H H 69 8.340 8.340 8.464 -0.124 17919 114652 1 279 . 1 1 70 70 VAL N N 70 126.940 126.940 124.559 2.381 17919 114653 1 279 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.493 -0.143 17919 114654 1 279 . 1 1 70 70 VAL C C 70 174.000 174.000 174.320 -0.320 17919 114655 1 279 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.806 -0.006 17919 114656 1 279 . 1 1 70 70 VAL CB C 70 34.910 34.910 36.271 -1.361 17919 114657 1 279 . 1 1 70 70 VAL H H 70 9.200 9.200 9.022 0.178 17919 114658 1 279 . 1 1 71 71 LEU N N 71 123.130 123.130 122.785 0.345 17919 114659 1 279 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.136 -0.076 17919 114660 1 279 . 1 1 71 71 LEU C C 71 177.830 177.830 177.358 0.472 17919 114661 1 279 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.535 0.405 17919 114662 1 279 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.246 -0.396 17919 114663 1 279 . 1 1 71 71 LEU H H 71 8.120 8.120 8.454 -0.334 17919 114664 1 279 . 1 1 72 72 ARG N N 72 123.490 123.490 120.803 2.687 17919 114665 1 279 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.461 -0.160 17919 114666 1 279 . 1 1 72 72 ARG C C 72 175.350 175.350 174.812 0.538 17919 114667 1 279 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.759 -0.149 17919 114668 1 279 . 1 1 72 72 ARG CB C 72 31.350 31.350 31.251 0.099 17919 114669 1 279 . 1 1 72 72 ARG H H 72 8.580 8.580 8.322 0.258 17919 114670 1 280 . 1 1 2 2 GLN N N 2 123.220 123.220 124.385 -1.165 17919 114671 1 280 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.379 -0.130 17919 114672 1 280 . 1 1 2 2 GLN C C 2 175.920 175.920 174.810 1.110 17919 114673 1 280 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.804 0.276 17919 114674 1 280 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.932 -0.172 17919 114675 1 280 . 1 1 2 2 GLN H H 2 8.900 8.900 8.540 0.360 17919 114676 1 280 . 1 1 3 3 ILE N N 3 115.340 115.340 118.482 -3.142 17919 114677 1 280 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.767 -0.554 17919 114678 1 280 . 1 1 3 3 ILE C C 3 172.450 172.450 173.495 -1.045 17919 114679 1 280 . 1 1 3 3 ILE CA C 3 59.570 59.570 58.861 0.709 17919 114680 1 280 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.947 0.263 17919 114681 1 280 . 1 1 3 3 ILE H H 3 8.320 8.320 8.864 -0.544 17919 114682 1 280 . 1 1 4 4 PHE N N 4 118.110 118.110 119.316 -1.206 17919 114683 1 280 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.271 0.359 17919 114684 1 280 . 1 1 4 4 PHE C C 4 175.320 175.320 175.205 0.115 17919 114685 1 280 . 1 1 4 4 PHE CA C 4 55.210 55.210 56.257 -1.046 17919 114686 1 280 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.825 -0.345 17919 114687 1 280 . 1 1 4 4 PHE H H 4 8.610 8.610 8.537 0.073 17919 114688 1 280 . 1 1 5 5 VAL N N 5 121.000 121.000 121.734 -0.734 17919 114689 1 280 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.642 0.083 17919 114690 1 280 . 1 1 5 5 VAL C C 5 174.870 174.870 174.337 0.533 17919 114691 1 280 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.848 -1.228 17919 114692 1 280 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.963 0.267 17919 114693 1 280 . 1 1 5 5 VAL H H 5 9.300 9.300 9.385 -0.085 17919 114694 1 280 . 1 1 6 6 LYS N N 6 127.520 127.520 127.639 -0.119 17919 114695 1 280 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.521 -0.154 17919 114696 1 280 . 1 1 6 6 LYS C C 6 177.140 177.140 175.381 1.759 17919 114697 1 280 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.093 0.427 17919 114698 1 280 . 1 1 6 6 LYS CB C 6 35.050 35.050 36.857 -1.807 17919 114699 1 280 . 1 1 6 6 LYS H H 6 8.820 8.820 9.303 -0.483 17919 114700 1 280 . 1 1 7 7 THR N N 7 115.400 115.400 115.147 0.253 17919 114701 1 280 . 1 1 7 7 THR HA H 7 4.970 4.970 4.746 0.224 17919 114702 1 280 . 1 1 7 7 THR C C 7 176.910 176.910 175.947 0.963 17919 114703 1 280 . 1 1 7 7 THR CA C 7 60.470 60.470 59.534 0.936 17919 114704 1 280 . 1 1 7 7 THR CB C 7 70.630 70.630 71.250 -0.620 17919 114705 1 280 . 1 1 7 7 THR H H 7 8.730 8.730 8.593 0.137 17919 114706 1 280 . 1 1 8 8 LEU N N 8 121.330 121.330 121.955 -0.625 17919 114707 1 280 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.454 -0.144 17919 114708 1 280 . 1 1 8 8 LEU C C 8 178.800 178.800 177.587 1.213 17919 114709 1 280 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.187 0.394 17919 114710 1 280 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.984 -0.014 17919 114711 1 280 . 1 1 8 8 LEU H H 8 9.100 9.100 8.616 0.484 17919 114712 1 280 . 1 1 9 9 THR N N 9 105.590 105.590 108.863 -3.273 17919 114713 1 280 . 1 1 9 9 THR HA H 9 4.428 4.428 4.358 0.070 17919 114714 1 280 . 1 1 9 9 THR C C 9 175.520 175.520 175.490 0.030 17919 114715 1 280 . 1 1 9 9 THR CA C 9 61.400 61.400 61.972 -0.572 17919 114716 1 280 . 1 1 9 9 THR CB C 9 69.140 69.140 70.044 -0.904 17919 114717 1 280 . 1 1 9 9 THR H H 9 7.630 7.630 7.759 -0.129 17919 114718 1 280 . 1 1 10 10 GLY N N 10 108.890 108.890 110.968 -2.078 17919 114719 1 280 . 1 1 10 10 GLY C C 10 174.070 174.070 173.643 0.427 17919 114720 1 280 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.791 0.669 17919 114721 1 280 . 1 1 10 10 GLY H H 10 7.810 7.810 7.581 0.229 17919 114722 1 280 . 1 1 11 11 LYS N N 11 121.600 121.600 121.904 -0.304 17919 114723 1 280 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.441 -0.080 17919 114724 1 280 . 1 1 11 11 LYS C C 11 175.940 175.940 175.449 0.491 17919 114725 1 280 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.264 0.016 17919 114726 1 280 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.677 -0.477 17919 114727 1 280 . 1 1 11 11 LYS H H 11 7.280 7.280 7.691 -0.411 17919 114728 1 280 . 1 1 12 12 THR N N 12 120.440 120.440 119.668 0.772 17919 114729 1 280 . 1 1 12 12 THR HA H 12 5.046 5.046 5.528 -0.482 17919 114730 1 280 . 1 1 12 12 THR C C 12 174.320 174.320 174.060 0.260 17919 114731 1 280 . 1 1 12 12 THR CA C 12 62.390 62.390 60.226 2.164 17919 114732 1 280 . 1 1 12 12 THR CB C 12 69.910 69.910 71.162 -1.252 17919 114733 1 280 . 1 1 12 12 THR H H 12 8.650 8.650 8.168 0.482 17919 114734 1 280 . 1 1 13 13 ILE N N 13 127.110 127.110 120.354 6.756 17919 114735 1 280 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.838 -0.294 17919 114736 1 280 . 1 1 13 13 ILE C C 13 175.220 175.220 173.760 1.460 17919 114737 1 280 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.515 0.465 17919 114738 1 280 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.282 -0.332 17919 114739 1 280 . 1 1 13 13 ILE H H 13 9.450 9.450 8.992 0.458 17919 114740 1 280 . 1 1 14 14 THR N N 14 121.520 121.520 119.996 1.524 17919 114741 1 280 . 1 1 14 14 THR HA H 14 4.964 4.964 5.089 -0.125 17919 114742 1 280 . 1 1 14 14 THR C C 14 173.790 173.790 173.678 0.112 17919 114743 1 280 . 1 1 14 14 THR CA C 14 61.940 61.940 61.562 0.378 17919 114744 1 280 . 1 1 14 14 THR CB C 14 69.650 69.650 70.363 -0.713 17919 114745 1 280 . 1 1 14 14 THR H H 14 8.710 8.710 8.288 0.422 17919 114746 1 280 . 1 1 15 15 LEU N N 15 124.800 124.800 126.667 -1.867 17919 114747 1 280 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.691 0.089 17919 114748 1 280 . 1 1 15 15 LEU C C 15 174.670 174.670 174.724 -0.054 17919 114749 1 280 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.917 -1.087 17919 114750 1 280 . 1 1 15 15 LEU CB C 15 47.070 47.070 46.435 0.635 17919 114751 1 280 . 1 1 15 15 LEU H H 15 8.710 8.710 9.078 -0.368 17919 114752 1 280 . 1 1 16 16 GLU N N 16 122.160 122.160 122.899 -0.739 17919 114753 1 280 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.991 -0.074 17919 114754 1 280 . 1 1 16 16 GLU C C 16 175.860 175.860 175.425 0.435 17919 114755 1 280 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.543 -0.723 17919 114756 1 280 . 1 1 16 16 GLU CB C 16 29.450 29.450 31.438 -1.988 17919 114757 1 280 . 1 1 16 16 GLU H H 16 8.140 8.140 8.642 -0.502 17919 114758 1 280 . 1 1 17 17 VAL N N 17 117.210 117.210 121.232 -4.022 17919 114759 1 280 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.896 -0.182 17919 114760 1 280 . 1 1 17 17 VAL C C 17 174.160 174.160 174.463 -0.303 17919 114761 1 280 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.159 -0.729 17919 114762 1 280 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.473 0.927 17919 114763 1 280 . 1 1 17 17 VAL H H 17 8.900 8.900 8.694 0.206 17919 114764 1 280 . 1 1 18 18 GLU N N 18 118.990 118.990 121.099 -2.109 17919 114765 1 280 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.813 0.266 17919 114766 1 280 . 1 1 18 18 GLU C C 18 176.160 176.160 175.984 0.176 17919 114767 1 280 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.437 -0.717 17919 114768 1 280 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.333 -0.023 17919 114769 1 280 . 1 1 18 18 GLU H H 18 8.640 8.640 8.655 -0.015 17919 114770 1 280 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.275 -0.134 17919 114771 1 280 . 1 1 19 19 PRO C C 19 175.310 175.310 177.889 -2.579 17919 114772 1 280 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.412 0.058 17919 114773 1 280 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.947 0.003 17919 114774 1 280 . 1 1 20 20 SER N N 20 103.400 103.400 109.753 -6.353 17919 114775 1 280 . 1 1 20 20 SER HA H 20 4.370 4.370 4.278 0.092 17919 114776 1 280 . 1 1 20 20 SER C C 20 174.660 174.660 174.383 0.277 17919 114777 1 280 . 1 1 20 20 SER CA C 20 57.400 57.400 59.219 -1.819 17919 114778 1 280 . 1 1 20 20 SER CB C 20 63.370 63.370 62.603 0.767 17919 114779 1 280 . 1 1 20 20 SER H H 20 7.040 7.040 8.107 -1.067 17919 114780 1 280 . 1 1 21 21 ASP N N 21 123.480 123.480 124.313 -0.833 17919 114781 1 280 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.622 0.073 17919 114782 1 280 . 1 1 21 21 ASP C C 21 176.360 176.360 176.278 0.082 17919 114783 1 280 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.783 0.917 17919 114784 1 280 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.480 -0.680 17919 114785 1 280 . 1 1 21 21 ASP H H 21 8.030 8.030 7.574 0.456 17919 114786 1 280 . 1 1 22 22 THR N N 22 108.800 108.800 112.940 -4.140 17919 114787 1 280 . 1 1 22 22 THR HA H 22 4.920 4.920 4.863 0.057 17919 114788 1 280 . 1 1 22 22 THR C C 22 176.750 176.750 176.105 0.645 17919 114789 1 280 . 1 1 22 22 THR CA C 22 59.690 59.690 61.012 -1.322 17919 114790 1 280 . 1 1 22 22 THR CB C 22 71.200 71.200 70.539 0.661 17919 114791 1 280 . 1 1 22 22 THR H H 22 7.900 7.900 8.323 -0.423 17919 114792 1 280 . 1 1 23 23 ILE N N 23 121.190 121.190 123.269 -2.079 17919 114793 1 280 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.813 -0.156 17919 114794 1 280 . 1 1 23 23 ILE C C 23 179.040 179.040 177.799 1.241 17919 114795 1 280 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.253 0.007 17919 114796 1 280 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.249 -1.899 17919 114797 1 280 . 1 1 23 23 ILE H H 23 8.560 8.560 8.644 -0.084 17919 114798 1 280 . 1 1 24 24 GLU N N 24 120.830 120.830 121.492 -0.662 17919 114799 1 280 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.839 0.078 17919 114800 1 280 . 1 1 24 24 GLU C C 24 178.640 178.640 178.390 0.250 17919 114801 1 280 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.216 0.004 17919 114802 1 280 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.416 -1.136 17919 114803 1 280 . 1 1 24 24 GLU H H 24 9.760 9.760 8.417 1.343 17919 114804 1 280 . 1 1 25 25 ASN N N 25 120.570 120.570 117.579 2.991 17919 114805 1 280 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.492 0.033 17919 114806 1 280 . 1 1 25 25 ASN C C 25 178.380 178.380 177.948 0.432 17919 114807 1 280 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.986 0.074 17919 114808 1 280 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.602 -0.152 17919 114809 1 280 . 1 1 25 25 ASN H H 25 7.920 7.920 7.588 0.332 17919 114810 1 280 . 1 1 26 26 VAL N N 26 121.710 121.710 120.397 1.313 17919 114811 1 280 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.655 -0.258 17919 114812 1 280 . 1 1 26 26 VAL C C 26 177.950 177.950 177.593 0.357 17919 114813 1 280 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.761 0.899 17919 114814 1 280 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.540 -0.700 17919 114815 1 280 . 1 1 26 26 VAL H H 26 8.070 8.070 8.147 -0.077 17919 114816 1 280 . 1 1 27 27 LYS N N 27 118.860 118.860 120.528 -1.668 17919 114817 1 280 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.173 0.407 17919 114818 1 280 . 1 1 27 27 LYS C C 27 180.550 180.550 179.052 1.498 17919 114819 1 280 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.634 -0.384 17919 114820 1 280 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.236 1.494 17919 114821 1 280 . 1 1 27 27 LYS H H 27 8.560 8.560 8.038 0.522 17919 114822 1 280 . 1 1 28 28 ALA N N 28 123.440 123.440 122.397 1.043 17919 114823 1 280 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.070 0.090 17919 114824 1 280 . 1 1 28 28 ALA C C 28 180.300 180.300 179.531 0.769 17919 114825 1 280 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.152 0.218 17919 114826 1 280 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.317 -0.607 17919 114827 1 280 . 1 1 28 28 ALA H H 28 8.060 8.060 8.221 -0.161 17919 114828 1 280 . 1 1 29 29 LYS N N 29 119.940 119.940 119.013 0.927 17919 114829 1 280 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.049 0.158 17919 114830 1 280 . 1 1 29 29 LYS C C 29 180.320 180.320 179.267 1.053 17919 114831 1 280 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.145 0.505 17919 114832 1 280 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.403 0.887 17919 114833 1 280 . 1 1 29 29 LYS H H 29 7.850 7.850 7.752 0.098 17919 114834 1 280 . 1 1 30 30 ILE N N 30 121.080 121.080 120.466 0.614 17919 114835 1 280 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.629 -0.122 17919 114836 1 280 . 1 1 30 30 ILE C C 30 178.310 178.310 177.252 1.058 17919 114837 1 280 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.180 0.970 17919 114838 1 280 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.905 -1.105 17919 114839 1 280 . 1 1 30 30 ILE H H 30 8.280 8.280 8.102 0.178 17919 114840 1 280 . 1 1 31 31 GLN N N 31 123.490 123.490 120.079 3.411 17919 114841 1 280 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.923 -0.094 17919 114842 1 280 . 1 1 31 31 GLN C C 31 178.890 178.890 178.278 0.612 17919 114843 1 280 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.238 0.762 17919 114844 1 280 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.496 -0.776 17919 114845 1 280 . 1 1 31 31 GLN H H 31 8.580 8.580 8.289 0.291 17919 114846 1 280 . 1 1 32 32 ASP N N 32 119.360 119.360 119.772 -0.412 17919 114847 1 280 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.378 -0.024 17919 114848 1 280 . 1 1 32 32 ASP C C 32 177.250 177.250 177.853 -0.603 17919 114849 1 280 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.875 0.315 17919 114850 1 280 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.807 -0.227 17919 114851 1 280 . 1 1 32 32 ASP H H 32 8.010 8.010 7.904 0.106 17919 114852 1 280 . 1 1 33 33 LYS N N 33 115.130 115.130 116.019 -0.889 17919 114853 1 280 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.424 -0.087 17919 114854 1 280 . 1 1 33 33 LYS C C 33 177.870 177.870 177.353 0.517 17919 114855 1 280 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.478 0.572 17919 114856 1 280 . 1 1 33 33 LYS CB C 33 34.170 34.170 34.102 0.068 17919 114857 1 280 . 1 1 33 33 LYS H H 33 7.430 7.430 7.508 -0.078 17919 114858 1 280 . 1 1 34 34 GLU N N 34 113.870 113.870 115.101 -1.231 17919 114859 1 280 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.452 0.173 17919 114860 1 280 . 1 1 34 34 GLU C C 34 177.840 177.840 177.222 0.618 17919 114861 1 280 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.412 -1.242 17919 114862 1 280 . 1 1 34 34 GLU CB C 34 32.660 32.660 32.396 0.264 17919 114863 1 280 . 1 1 34 34 GLU H H 34 8.740 8.740 8.135 0.605 17919 114864 1 280 . 1 1 35 35 GLY N N 35 108.650 108.650 109.229 -0.579 17919 114865 1 280 . 1 1 35 35 GLY C C 35 173.960 173.960 173.965 -0.005 17919 114866 1 280 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.810 0.270 17919 114867 1 280 . 1 1 35 35 GLY H H 35 8.530 8.530 8.470 0.060 17919 114868 1 280 . 1 1 36 36 ILE N N 36 119.880 119.880 122.209 -2.329 17919 114869 1 280 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.314 0.131 17919 114870 1 280 . 1 1 36 36 ILE C C 36 173.590 173.590 174.166 -0.576 17919 114871 1 280 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.219 -0.469 17919 114872 1 280 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.831 1.749 17919 114873 1 280 . 1 1 36 36 ILE H H 36 6.150 6.150 7.623 -1.473 17919 114874 1 280 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.851 -0.217 17919 114875 1 280 . 1 1 37 37 PRO C C 37 176.940 176.940 176.256 0.684 17919 114876 1 280 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.532 0.128 17919 114877 1 280 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.160 0.690 17919 114878 1 280 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.218 -0.101 17919 114879 1 280 . 1 1 38 38 PRO C C 38 178.320 178.320 178.280 0.040 17919 114880 1 280 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.811 0.449 17919 114881 1 280 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.966 0.924 17919 114882 1 280 . 1 1 39 39 ASP N N 39 113.380 113.380 116.849 -3.469 17919 114883 1 280 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.470 -0.040 17919 114884 1 280 . 1 1 39 39 ASP C C 39 177.090 177.090 178.206 -1.116 17919 114885 1 280 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.415 -0.775 17919 114886 1 280 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.194 -0.654 17919 114887 1 280 . 1 1 39 39 ASP H H 39 8.550 8.550 8.634 -0.084 17919 114888 1 280 . 1 1 40 40 GLN N N 40 116.780 116.780 117.809 -1.029 17919 114889 1 280 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.344 0.120 17919 114890 1 280 . 1 1 40 40 GLN C C 40 175.380 175.380 176.271 -0.891 17919 114891 1 280 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.199 -0.559 17919 114892 1 280 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.404 0.736 17919 114893 1 280 . 1 1 40 40 GLN H H 40 7.820 7.820 7.848 -0.028 17919 114894 1 280 . 1 1 41 41 GLN N N 41 117.720 117.720 119.811 -2.091 17919 114895 1 280 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.448 -0.204 17919 114896 1 280 . 1 1 41 41 GLN C C 41 176.300 176.300 174.745 1.555 17919 114897 1 280 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.909 0.561 17919 114898 1 280 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.060 2.590 17919 114899 1 280 . 1 1 41 41 GLN H H 41 7.480 7.480 7.471 0.009 17919 114900 1 280 . 1 1 42 42 ARG N N 42 122.680 122.680 126.114 -3.434 17919 114901 1 280 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.540 -0.040 17919 114902 1 280 . 1 1 42 42 ARG C C 42 174.050 174.050 174.126 -0.076 17919 114903 1 280 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.223 -0.173 17919 114904 1 280 . 1 1 42 42 ARG CB C 42 31.750 31.750 31.697 0.053 17919 114905 1 280 . 1 1 42 42 ARG H H 42 8.530 8.530 8.671 -0.141 17919 114906 1 280 . 1 1 43 43 LEU N N 43 124.040 124.040 127.818 -3.778 17919 114907 1 280 . 1 1 43 43 LEU C C 43 175.290 175.290 176.026 -0.736 17919 114908 1 280 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.537 -1.557 17919 114909 1 280 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.766 2.024 17919 114910 1 280 . 1 1 43 43 LEU H H 43 8.820 8.820 8.751 0.069 17919 114911 1 280 . 1 1 44 44 ILE N N 44 121.920 121.920 122.328 -0.408 17919 114912 1 280 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.832 0.160 17919 114913 1 280 . 1 1 44 44 ILE C C 44 176.060 176.060 174.204 1.856 17919 114914 1 280 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.174 -0.194 17919 114915 1 280 . 1 1 44 44 ILE CB C 44 41.420 41.420 40.119 1.301 17919 114916 1 280 . 1 1 44 44 ILE H H 44 9.030 9.030 9.167 -0.137 17919 114917 1 280 . 1 1 45 45 PHE N N 45 125.390 125.390 127.330 -1.940 17919 114918 1 280 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.970 0.075 17919 114919 1 280 . 1 1 45 45 PHE C C 45 174.470 174.470 174.614 -0.144 17919 114920 1 280 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.374 0.646 17919 114921 1 280 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.614 1.146 17919 114922 1 280 . 1 1 45 45 PHE H H 45 8.830 8.830 9.054 -0.224 17919 114923 1 280 . 1 1 46 46 ALA N N 46 132.200 132.200 130.406 1.794 17919 114924 1 280 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.720 -0.030 17919 114925 1 280 . 1 1 46 46 ALA C C 46 177.290 177.290 177.373 -0.083 17919 114926 1 280 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.653 -0.112 17919 114927 1 280 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.509 0.061 17919 114928 1 280 . 1 1 46 46 ALA H H 46 8.810 8.810 8.558 0.252 17919 114929 1 280 . 1 1 47 47 GLY N N 47 102.340 102.340 103.420 -1.080 17919 114930 1 280 . 1 1 47 47 GLY C C 47 173.810 173.810 174.033 -0.223 17919 114931 1 280 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.908 0.442 17919 114932 1 280 . 1 1 47 47 GLY H H 47 8.130 8.130 8.359 -0.229 17919 114933 1 280 . 1 1 48 48 LYS N N 48 121.570 121.570 121.558 0.012 17919 114934 1 280 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.634 -0.012 17919 114935 1 280 . 1 1 48 48 LYS C C 48 174.700 174.700 174.697 0.003 17919 114936 1 280 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.058 -0.508 17919 114937 1 280 . 1 1 48 48 LYS CB C 48 34.530 34.530 35.041 -0.511 17919 114938 1 280 . 1 1 48 48 LYS H H 48 7.980 7.980 7.828 0.152 17919 114939 1 280 . 1 1 49 49 GLN N N 49 122.410 122.410 126.694 -4.284 17919 114940 1 280 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.535 0.025 17919 114941 1 280 . 1 1 49 49 GLN C C 49 175.670 175.670 175.354 0.316 17919 114942 1 280 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.090 -0.350 17919 114943 1 280 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.235 -0.235 17919 114944 1 280 . 1 1 49 49 GLN H H 49 8.600 8.600 8.612 -0.012 17919 114945 1 280 . 1 1 50 50 LEU N N 50 125.520 125.520 129.572 -4.052 17919 114946 1 280 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.037 0.053 17919 114947 1 280 . 1 1 50 50 LEU C C 50 176.660 176.660 176.222 0.438 17919 114948 1 280 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.375 -0.135 17919 114949 1 280 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.362 -0.792 17919 114950 1 280 . 1 1 50 50 LEU H H 50 8.530 8.530 8.374 0.156 17919 114951 1 280 . 1 1 51 51 GLU N N 51 122.940 122.940 121.971 0.969 17919 114952 1 280 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.620 -0.132 17919 114953 1 280 . 1 1 51 51 GLU C C 51 175.870 175.870 176.519 -0.649 17919 114954 1 280 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.083 0.877 17919 114955 1 280 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.838 -1.268 17919 114956 1 280 . 1 1 51 51 GLU H H 51 8.400 8.400 8.689 -0.289 17919 114957 1 280 . 1 1 52 52 ASP N N 52 120.030 120.030 123.927 -3.897 17919 114958 1 280 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.487 -0.128 17919 114959 1 280 . 1 1 52 52 ASP C C 52 177.330 177.330 177.437 -0.107 17919 114960 1 280 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.054 -0.094 17919 114961 1 280 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.812 0.038 17919 114962 1 280 . 1 1 52 52 ASP H H 52 8.160 8.160 8.844 -0.684 17919 114963 1 280 . 1 1 53 53 GLY N N 53 106.660 106.660 105.389 1.271 17919 114964 1 280 . 1 1 53 53 GLY C C 53 174.870 174.870 174.189 0.681 17919 114965 1 280 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.905 0.265 17919 114966 1 280 . 1 1 53 53 GLY H H 53 9.390 9.390 8.493 0.897 17919 114967 1 280 . 1 1 54 54 ARG N N 54 119.050 119.050 120.893 -1.843 17919 114968 1 280 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.899 -0.204 17919 114969 1 280 . 1 1 54 54 ARG C C 54 175.350 175.350 175.313 0.037 17919 114970 1 280 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.381 0.009 17919 114971 1 280 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.822 -1.172 17919 114972 1 280 . 1 1 54 54 ARG H H 54 7.460 7.460 7.465 -0.005 17919 114973 1 280 . 1 1 55 55 THR N N 55 108.400 108.400 112.844 -4.444 17919 114974 1 280 . 1 1 55 55 THR HA H 55 5.240 5.240 4.978 0.262 17919 114975 1 280 . 1 1 55 55 THR C C 55 176.560 176.560 176.329 0.231 17919 114976 1 280 . 1 1 55 55 THR CA C 55 59.690 59.690 60.570 -0.880 17919 114977 1 280 . 1 1 55 55 THR CB C 55 72.260 72.260 70.754 1.506 17919 114978 1 280 . 1 1 55 55 THR H H 55 8.730 8.730 9.260 -0.530 17919 114979 1 280 . 1 1 56 56 LEU N N 56 117.920 117.920 122.564 -4.644 17919 114980 1 280 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.777 0.283 17919 114981 1 280 . 1 1 56 56 LEU C C 56 180.810 180.810 178.877 1.933 17919 114982 1 280 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.565 0.145 17919 114983 1 280 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.290 -0.920 17919 114984 1 280 . 1 1 56 56 LEU H H 56 8.140 8.140 8.741 -0.601 17919 114985 1 280 . 1 1 57 57 SER N N 57 113.330 113.330 114.654 -1.324 17919 114986 1 280 . 1 1 57 57 SER HA H 57 4.370 4.370 4.108 0.262 17919 114987 1 280 . 1 1 57 57 SER C C 57 178.310 178.310 176.907 1.403 17919 114988 1 280 . 1 1 57 57 SER CA C 57 61.080 61.080 62.166 -1.086 17919 114989 1 280 . 1 1 57 57 SER CB C 57 62.530 62.530 62.652 -0.122 17919 114990 1 280 . 1 1 57 57 SER H H 57 8.470 8.470 8.196 0.274 17919 114991 1 280 . 1 1 58 58 ASP N N 58 124.190 124.190 121.375 2.815 17919 114992 1 280 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.342 -0.046 17919 114993 1 280 . 1 1 58 58 ASP C C 58 177.400 177.400 177.047 0.353 17919 114994 1 280 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.586 0.594 17919 114995 1 280 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.327 -0.227 17919 114996 1 280 . 1 1 58 58 ASP H H 58 7.930 7.930 7.771 0.159 17919 114997 1 280 . 1 1 59 59 TYR N N 59 115.510 115.510 115.967 -0.457 17919 114998 1 280 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.536 0.134 17919 114999 1 280 . 1 1 59 59 TYR C C 59 174.700 174.700 174.812 -0.112 17919 115000 1 280 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.418 0.832 17919 115001 1 280 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.657 1.413 17919 115002 1 280 . 1 1 59 59 TYR H H 59 7.250 7.250 7.264 -0.014 17919 115003 1 280 . 1 1 60 60 ASN N N 60 115.900 115.900 116.533 -0.633 17919 115004 1 280 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.381 -0.026 17919 115005 1 280 . 1 1 60 60 ASN C C 60 174.340 174.340 174.343 -0.003 17919 115006 1 280 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.138 -0.018 17919 115007 1 280 . 1 1 60 60 ASN CB C 60 37.410 37.410 36.527 0.883 17919 115008 1 280 . 1 1 60 60 ASN H H 60 8.150 8.150 7.876 0.274 17919 115009 1 280 . 1 1 61 61 ILE N N 61 118.600 118.600 119.362 -0.762 17919 115010 1 280 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.888 -0.495 17919 115011 1 280 . 1 1 61 61 ILE C C 61 174.610 174.610 175.298 -0.688 17919 115012 1 280 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.258 1.162 17919 115013 1 280 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.700 -0.960 17919 115014 1 280 . 1 1 61 61 ILE H H 61 7.250 7.250 8.201 -0.951 17919 115015 1 280 . 1 1 62 62 GLN N N 62 124.740 124.740 125.563 -0.823 17919 115016 1 280 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.777 -0.271 17919 115017 1 280 . 1 1 62 62 GLN C C 62 175.970 175.970 175.938 0.032 17919 115018 1 280 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.304 0.356 17919 115019 1 280 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.856 -0.206 17919 115020 1 280 . 1 1 62 62 GLN H H 62 7.610 7.610 7.966 -0.356 17919 115021 1 280 . 1 1 63 63 LYS N N 63 120.300 120.300 120.808 -0.508 17919 115022 1 280 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.985 0.016 17919 115023 1 280 . 1 1 63 63 LYS C C 63 175.810 175.810 177.314 -1.504 17919 115024 1 280 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.035 -0.245 17919 115025 1 280 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.903 0.747 17919 115026 1 280 . 1 1 63 63 LYS H H 63 8.490 8.490 8.737 -0.247 17919 115027 1 280 . 1 1 64 64 GLU N N 64 113.950 113.950 118.338 -4.388 17919 115028 1 280 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.864 -0.399 17919 115029 1 280 . 1 1 64 64 GLU C C 64 175.250 175.250 175.870 -0.620 17919 115030 1 280 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.847 0.043 17919 115031 1 280 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.605 -2.705 17919 115032 1 280 . 1 1 64 64 GLU H H 64 9.280 9.280 9.254 0.026 17919 115033 1 280 . 1 1 65 65 SER N N 65 114.730 114.730 116.490 -1.760 17919 115034 1 280 . 1 1 65 65 SER HA H 65 4.640 4.640 4.559 0.081 17919 115035 1 280 . 1 1 65 65 SER C C 65 172.160 172.160 174.022 -1.862 17919 115036 1 280 . 1 1 65 65 SER CA C 65 60.890 60.890 60.165 0.725 17919 115037 1 280 . 1 1 65 65 SER CB C 65 64.910 64.910 64.208 0.702 17919 115038 1 280 . 1 1 65 65 SER H H 65 7.670 7.670 7.409 0.261 17919 115039 1 280 . 1 1 66 66 THR N N 66 117.110 117.110 120.563 -3.453 17919 115040 1 280 . 1 1 66 66 THR HA H 66 5.270 5.270 5.303 -0.033 17919 115041 1 280 . 1 1 66 66 THR C C 66 173.950 173.950 174.498 -0.548 17919 115042 1 280 . 1 1 66 66 THR CA C 66 62.340 62.340 62.094 0.246 17919 115043 1 280 . 1 1 66 66 THR CB C 66 70.080 70.080 70.134 -0.054 17919 115044 1 280 . 1 1 66 66 THR H H 66 8.730 8.730 8.607 0.123 17919 115045 1 280 . 1 1 67 67 LEU N N 67 127.110 127.110 125.565 1.545 17919 115046 1 280 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.781 0.279 17919 115047 1 280 . 1 1 67 67 LEU C C 67 175.770 175.770 175.520 0.250 17919 115048 1 280 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.258 -0.358 17919 115049 1 280 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.395 0.865 17919 115050 1 280 . 1 1 67 67 LEU H H 67 9.410 9.410 9.142 0.268 17919 115051 1 280 . 1 1 68 68 HIS N N 68 118.380 118.380 123.085 -4.705 17919 115052 1 280 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.597 -0.357 17919 115053 1 280 . 1 1 68 68 HIS C C 68 173.150 173.150 173.546 -0.396 17919 115054 1 280 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.524 0.476 17919 115055 1 280 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.642 -2.112 17919 115056 1 280 . 1 1 68 68 HIS H H 68 9.230 9.230 8.725 0.505 17919 115057 1 280 . 1 1 69 69 LEU N N 69 124.460 124.460 129.523 -5.063 17919 115058 1 280 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.131 0.059 17919 115059 1 280 . 1 1 69 69 LEU C C 69 175.270 175.270 174.265 1.005 17919 115060 1 280 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.157 0.733 17919 115061 1 280 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.879 -0.499 17919 115062 1 280 . 1 1 69 69 LEU H H 69 8.340 8.340 7.911 0.429 17919 115063 1 280 . 1 1 70 70 VAL N N 70 126.940 126.940 121.166 5.774 17919 115064 1 280 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.676 -0.326 17919 115065 1 280 . 1 1 70 70 VAL C C 70 174.000 174.000 173.813 0.187 17919 115066 1 280 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.606 1.194 17919 115067 1 280 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.975 -1.065 17919 115068 1 280 . 1 1 70 70 VAL H H 70 9.200 9.200 9.051 0.149 17919 115069 1 280 . 1 1 71 71 LEU N N 71 123.130 123.130 122.520 0.610 17919 115070 1 280 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.172 -0.112 17919 115071 1 280 . 1 1 71 71 LEU C C 71 177.830 177.830 177.602 0.228 17919 115072 1 280 . 1 1 71 71 LEU CA C 71 53.940 53.940 52.886 1.054 17919 115073 1 280 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.313 0.537 17919 115074 1 280 . 1 1 71 71 LEU H H 71 8.120 8.120 8.500 -0.380 17919 115075 1 280 . 1 1 72 72 ARG N N 72 123.490 123.490 124.885 -1.395 17919 115076 1 280 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.539 -0.238 17919 115077 1 280 . 1 1 72 72 ARG C C 72 175.350 175.350 176.110 -0.760 17919 115078 1 280 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.406 -0.796 17919 115079 1 280 . 1 1 72 72 ARG CB C 72 31.350 31.350 29.241 2.109 17919 115080 1 280 . 1 1 72 72 ARG H H 72 8.580 8.580 8.641 -0.061 17919 115081 1 281 . 1 1 2 2 GLN N N 2 123.220 123.220 123.835 -0.615 17919 115082 1 281 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.339 -0.090 17919 115083 1 281 . 1 1 2 2 GLN C C 2 175.920 175.920 175.981 -0.061 17919 115084 1 281 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.077 1.003 17919 115085 1 281 . 1 1 2 2 GLN CB C 2 30.760 30.760 29.627 1.133 17919 115086 1 281 . 1 1 2 2 GLN H H 2 8.900 8.900 8.451 0.449 17919 115087 1 281 . 1 1 3 3 ILE N N 3 115.340 115.340 116.554 -1.214 17919 115088 1 281 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.436 -0.223 17919 115089 1 281 . 1 1 3 3 ILE C C 3 172.450 172.450 173.785 -1.335 17919 115090 1 281 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.049 0.521 17919 115091 1 281 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.700 0.510 17919 115092 1 281 . 1 1 3 3 ILE H H 3 8.320 8.320 8.673 -0.353 17919 115093 1 281 . 1 1 4 4 PHE N N 4 118.110 118.110 118.851 -0.741 17919 115094 1 281 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.647 -0.017 17919 115095 1 281 . 1 1 4 4 PHE C C 4 175.320 175.320 175.611 -0.291 17919 115096 1 281 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.489 -0.279 17919 115097 1 281 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.645 -0.165 17919 115098 1 281 . 1 1 4 4 PHE H H 4 8.610 8.610 8.673 -0.063 17919 115099 1 281 . 1 1 5 5 VAL N N 5 121.000 121.000 121.557 -0.557 17919 115100 1 281 . 1 1 5 5 VAL HA H 5 4.725 4.725 5.054 -0.329 17919 115101 1 281 . 1 1 5 5 VAL C C 5 174.870 174.870 174.777 0.093 17919 115102 1 281 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.188 -0.568 17919 115103 1 281 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.818 0.412 17919 115104 1 281 . 1 1 5 5 VAL H H 5 9.300 9.300 9.235 0.065 17919 115105 1 281 . 1 1 6 6 LYS N N 6 127.520 127.520 129.342 -1.822 17919 115106 1 281 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.532 -0.165 17919 115107 1 281 . 1 1 6 6 LYS C C 6 177.140 177.140 176.446 0.694 17919 115108 1 281 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.324 0.196 17919 115109 1 281 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.691 -0.641 17919 115110 1 281 . 1 1 6 6 LYS H H 6 8.820 8.820 9.082 -0.262 17919 115111 1 281 . 1 1 7 7 THR N N 7 115.400 115.400 117.641 -2.241 17919 115112 1 281 . 1 1 7 7 THR HA H 7 4.970 4.970 4.890 0.080 17919 115113 1 281 . 1 1 7 7 THR C C 7 176.910 176.910 176.090 0.820 17919 115114 1 281 . 1 1 7 7 THR CA C 7 60.470 60.470 60.301 0.169 17919 115115 1 281 . 1 1 7 7 THR CB C 7 70.630 70.630 70.575 0.055 17919 115116 1 281 . 1 1 7 7 THR H H 7 8.730 8.730 8.814 -0.084 17919 115117 1 281 . 1 1 8 8 LEU N N 8 121.330 121.330 121.201 0.129 17919 115118 1 281 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.646 -0.336 17919 115119 1 281 . 1 1 8 8 LEU C C 8 178.800 178.800 177.379 1.421 17919 115120 1 281 . 1 1 8 8 LEU CA C 8 57.580 57.580 56.257 1.323 17919 115121 1 281 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.313 -0.343 17919 115122 1 281 . 1 1 8 8 LEU H H 8 9.100 9.100 8.802 0.298 17919 115123 1 281 . 1 1 9 9 THR N N 9 105.590 105.590 110.375 -4.785 17919 115124 1 281 . 1 1 9 9 THR HA H 9 4.428 4.428 4.365 0.063 17919 115125 1 281 . 1 1 9 9 THR C C 9 175.520 175.520 175.416 0.104 17919 115126 1 281 . 1 1 9 9 THR CA C 9 61.400 61.400 61.714 -0.314 17919 115127 1 281 . 1 1 9 9 THR CB C 9 69.140 69.140 69.084 0.056 17919 115128 1 281 . 1 1 9 9 THR H H 9 7.630 7.630 7.601 0.029 17919 115129 1 281 . 1 1 10 10 GLY N N 10 108.890 108.890 110.139 -1.249 17919 115130 1 281 . 1 1 10 10 GLY C C 10 174.070 174.070 174.055 0.015 17919 115131 1 281 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.060 0.400 17919 115132 1 281 . 1 1 10 10 GLY H H 10 7.810 7.810 7.597 0.213 17919 115133 1 281 . 1 1 11 11 LYS N N 11 121.600 121.600 121.839 -0.239 17919 115134 1 281 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.309 0.052 17919 115135 1 281 . 1 1 11 11 LYS C C 11 175.940 175.940 175.837 0.103 17919 115136 1 281 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.873 -0.593 17919 115137 1 281 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.445 -0.245 17919 115138 1 281 . 1 1 11 11 LYS H H 11 7.280 7.280 7.671 -0.391 17919 115139 1 281 . 1 1 12 12 THR N N 12 120.440 120.440 116.542 3.898 17919 115140 1 281 . 1 1 12 12 THR HA H 12 5.046 5.046 5.282 -0.236 17919 115141 1 281 . 1 1 12 12 THR C C 12 174.320 174.320 174.528 -0.208 17919 115142 1 281 . 1 1 12 12 THR CA C 12 62.390 62.390 60.084 2.305 17919 115143 1 281 . 1 1 12 12 THR CB C 12 69.910 69.910 70.060 -0.150 17919 115144 1 281 . 1 1 12 12 THR H H 12 8.650 8.650 8.086 0.564 17919 115145 1 281 . 1 1 13 13 ILE N N 13 127.110 127.110 127.230 -0.120 17919 115146 1 281 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.442 0.102 17919 115147 1 281 . 1 1 13 13 ILE C C 13 175.220 175.220 175.637 -0.417 17919 115148 1 281 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.308 -0.328 17919 115149 1 281 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.654 0.296 17919 115150 1 281 . 1 1 13 13 ILE H H 13 9.450 9.450 9.002 0.448 17919 115151 1 281 . 1 1 14 14 THR N N 14 121.520 121.520 123.337 -1.817 17919 115152 1 281 . 1 1 14 14 THR HA H 14 4.964 4.964 5.060 -0.096 17919 115153 1 281 . 1 1 14 14 THR C C 14 173.790 173.790 173.889 -0.099 17919 115154 1 281 . 1 1 14 14 THR CA C 14 61.940 61.940 62.347 -0.408 17919 115155 1 281 . 1 1 14 14 THR CB C 14 69.650 69.650 69.600 0.050 17919 115156 1 281 . 1 1 14 14 THR H H 14 8.710 8.710 8.518 0.192 17919 115157 1 281 . 1 1 15 15 LEU N N 15 124.800 124.800 126.613 -1.813 17919 115158 1 281 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.739 0.041 17919 115159 1 281 . 1 1 15 15 LEU C C 15 174.670 174.670 175.125 -0.455 17919 115160 1 281 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.547 -0.717 17919 115161 1 281 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.515 1.555 17919 115162 1 281 . 1 1 15 15 LEU H H 15 8.710 8.710 8.756 -0.046 17919 115163 1 281 . 1 1 16 16 GLU N N 16 122.160 122.160 122.949 -0.789 17919 115164 1 281 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.461 -0.544 17919 115165 1 281 . 1 1 16 16 GLU C C 16 175.860 175.860 175.975 -0.115 17919 115166 1 281 . 1 1 16 16 GLU CA C 16 54.820 54.820 54.802 0.018 17919 115167 1 281 . 1 1 16 16 GLU CB C 16 29.450 29.450 31.258 -1.808 17919 115168 1 281 . 1 1 16 16 GLU H H 16 8.140 8.140 8.599 -0.459 17919 115169 1 281 . 1 1 17 17 VAL N N 17 117.210 117.210 119.102 -1.892 17919 115170 1 281 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.603 0.111 17919 115171 1 281 . 1 1 17 17 VAL C C 17 174.160 174.160 174.680 -0.520 17919 115172 1 281 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.756 -0.326 17919 115173 1 281 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.119 1.281 17919 115174 1 281 . 1 1 17 17 VAL H H 17 8.900 8.900 8.922 -0.022 17919 115175 1 281 . 1 1 18 18 GLU N N 18 118.990 118.990 121.665 -2.675 17919 115176 1 281 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.724 0.355 17919 115177 1 281 . 1 1 18 18 GLU C C 18 176.160 176.160 175.410 0.750 17919 115178 1 281 . 1 1 18 18 GLU CA C 18 52.720 52.720 54.152 -1.432 17919 115179 1 281 . 1 1 18 18 GLU CB C 18 30.310 30.310 29.855 0.455 17919 115180 1 281 . 1 1 18 18 GLU H H 18 8.640 8.640 8.662 -0.022 17919 115181 1 281 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.295 -0.154 17919 115182 1 281 . 1 1 19 19 PRO C C 19 175.310 175.310 177.532 -2.222 17919 115183 1 281 . 1 1 19 19 PRO CA C 19 65.470 65.470 64.947 0.523 17919 115184 1 281 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.057 -0.107 17919 115185 1 281 . 1 1 20 20 SER N N 20 103.400 103.400 108.806 -5.406 17919 115186 1 281 . 1 1 20 20 SER HA H 20 4.370 4.370 4.304 0.066 17919 115187 1 281 . 1 1 20 20 SER C C 20 174.660 174.660 174.304 0.356 17919 115188 1 281 . 1 1 20 20 SER CA C 20 57.400 57.400 58.108 -0.708 17919 115189 1 281 . 1 1 20 20 SER CB C 20 63.370 63.370 62.887 0.483 17919 115190 1 281 . 1 1 20 20 SER H H 20 7.040 7.040 8.026 -0.986 17919 115191 1 281 . 1 1 21 21 ASP N N 21 123.480 123.480 123.286 0.194 17919 115192 1 281 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.551 0.144 17919 115193 1 281 . 1 1 21 21 ASP C C 21 176.360 176.360 176.235 0.125 17919 115194 1 281 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.175 0.525 17919 115195 1 281 . 1 1 21 21 ASP CB C 21 40.800 40.800 42.017 -1.217 17919 115196 1 281 . 1 1 21 21 ASP H H 21 8.030 8.030 7.465 0.565 17919 115197 1 281 . 1 1 22 22 THR N N 22 108.800 108.800 115.184 -6.384 17919 115198 1 281 . 1 1 22 22 THR HA H 22 4.920 4.920 4.766 0.154 17919 115199 1 281 . 1 1 22 22 THR C C 22 176.750 176.750 175.440 1.310 17919 115200 1 281 . 1 1 22 22 THR CA C 22 59.690 59.690 60.996 -1.306 17919 115201 1 281 . 1 1 22 22 THR CB C 22 71.200 71.200 70.888 0.312 17919 115202 1 281 . 1 1 22 22 THR H H 22 7.900 7.900 8.095 -0.195 17919 115203 1 281 . 1 1 23 23 ILE N N 23 121.190 121.190 122.747 -1.557 17919 115204 1 281 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.796 -0.139 17919 115205 1 281 . 1 1 23 23 ILE C C 23 179.040 179.040 177.797 1.243 17919 115206 1 281 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.629 -0.369 17919 115207 1 281 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.492 -2.142 17919 115208 1 281 . 1 1 23 23 ILE H H 23 8.560 8.560 9.011 -0.451 17919 115209 1 281 . 1 1 24 24 GLU N N 24 120.830 120.830 121.085 -0.255 17919 115210 1 281 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.826 0.091 17919 115211 1 281 . 1 1 24 24 GLU C C 24 178.640 178.640 178.792 -0.152 17919 115212 1 281 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.053 0.167 17919 115213 1 281 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.402 -1.122 17919 115214 1 281 . 1 1 24 24 GLU H H 24 9.760 9.760 8.155 1.605 17919 115215 1 281 . 1 1 25 25 ASN N N 25 120.570 120.570 117.201 3.369 17919 115216 1 281 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.560 -0.035 17919 115217 1 281 . 1 1 25 25 ASN C C 25 178.380 178.380 177.899 0.481 17919 115218 1 281 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.471 0.589 17919 115219 1 281 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.456 -0.006 17919 115220 1 281 . 1 1 25 25 ASN H H 25 7.920 7.920 7.702 0.218 17919 115221 1 281 . 1 1 26 26 VAL N N 26 121.710 121.710 121.501 0.209 17919 115222 1 281 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.449 -0.052 17919 115223 1 281 . 1 1 26 26 VAL C C 26 177.950 177.950 177.779 0.171 17919 115224 1 281 . 1 1 26 26 VAL CA C 26 67.660 67.660 67.118 0.542 17919 115225 1 281 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.558 -0.718 17919 115226 1 281 . 1 1 26 26 VAL H H 26 8.070 8.070 7.768 0.302 17919 115227 1 281 . 1 1 27 27 LYS N N 27 118.860 118.860 119.659 -0.799 17919 115228 1 281 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.070 0.510 17919 115229 1 281 . 1 1 27 27 LYS C C 27 180.550 180.550 179.232 1.318 17919 115230 1 281 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.656 -0.406 17919 115231 1 281 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.153 1.577 17919 115232 1 281 . 1 1 27 27 LYS H H 27 8.560 8.560 8.260 0.300 17919 115233 1 281 . 1 1 28 28 ALA N N 28 123.440 123.440 121.182 2.258 17919 115234 1 281 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.112 0.048 17919 115235 1 281 . 1 1 28 28 ALA C C 28 180.300 180.300 179.385 0.915 17919 115236 1 281 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.007 0.363 17919 115237 1 281 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.478 -0.768 17919 115238 1 281 . 1 1 28 28 ALA H H 28 8.060 8.060 7.966 0.094 17919 115239 1 281 . 1 1 29 29 LYS N N 29 119.940 119.940 118.677 1.263 17919 115240 1 281 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.114 0.093 17919 115241 1 281 . 1 1 29 29 LYS C C 29 180.320 180.320 178.762 1.558 17919 115242 1 281 . 1 1 29 29 LYS CA C 29 59.650 59.650 58.918 0.732 17919 115243 1 281 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.538 0.752 17919 115244 1 281 . 1 1 29 29 LYS H H 29 7.850 7.850 7.563 0.287 17919 115245 1 281 . 1 1 30 30 ILE N N 30 121.080 121.080 119.457 1.623 17919 115246 1 281 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.686 -0.179 17919 115247 1 281 . 1 1 30 30 ILE C C 30 178.310 178.310 177.727 0.583 17919 115248 1 281 . 1 1 30 30 ILE CA C 30 66.150 66.150 64.786 1.364 17919 115249 1 281 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.887 -1.087 17919 115250 1 281 . 1 1 30 30 ILE H H 30 8.280 8.280 8.266 0.014 17919 115251 1 281 . 1 1 31 31 GLN N N 31 123.490 123.490 120.269 3.221 17919 115252 1 281 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.936 -0.107 17919 115253 1 281 . 1 1 31 31 GLN C C 31 178.890 178.890 178.162 0.728 17919 115254 1 281 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.211 0.789 17919 115255 1 281 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.420 -0.700 17919 115256 1 281 . 1 1 31 31 GLN H H 31 8.580 8.580 8.127 0.453 17919 115257 1 281 . 1 1 32 32 ASP N N 32 119.360 119.360 119.472 -0.112 17919 115258 1 281 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.405 -0.051 17919 115259 1 281 . 1 1 32 32 ASP C C 32 177.250 177.250 177.677 -0.427 17919 115260 1 281 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.581 0.609 17919 115261 1 281 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.757 -0.177 17919 115262 1 281 . 1 1 32 32 ASP H H 32 8.010 8.010 7.851 0.159 17919 115263 1 281 . 1 1 33 33 LYS N N 33 115.130 115.130 116.418 -1.288 17919 115264 1 281 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.518 -0.181 17919 115265 1 281 . 1 1 33 33 LYS C C 33 177.870 177.870 177.827 0.043 17919 115266 1 281 . 1 1 33 33 LYS CA C 33 58.050 58.050 56.960 1.090 17919 115267 1 281 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.738 0.432 17919 115268 1 281 . 1 1 33 33 LYS H H 33 7.430 7.430 7.800 -0.370 17919 115269 1 281 . 1 1 34 34 GLU N N 34 113.870 113.870 116.956 -3.086 17919 115270 1 281 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.419 0.206 17919 115271 1 281 . 1 1 34 34 GLU C C 34 177.840 177.840 177.610 0.230 17919 115272 1 281 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.698 -1.528 17919 115273 1 281 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.440 1.220 17919 115274 1 281 . 1 1 34 34 GLU H H 34 8.740 8.740 7.802 0.938 17919 115275 1 281 . 1 1 35 35 GLY N N 35 108.650 108.650 109.063 -0.413 17919 115276 1 281 . 1 1 35 35 GLY C C 35 173.960 173.960 173.971 -0.011 17919 115277 1 281 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.432 0.648 17919 115278 1 281 . 1 1 35 35 GLY H H 35 8.530 8.530 8.136 0.394 17919 115279 1 281 . 1 1 36 36 ILE N N 36 119.880 119.880 121.535 -1.655 17919 115280 1 281 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.255 0.190 17919 115281 1 281 . 1 1 36 36 ILE C C 36 173.590 173.590 173.997 -0.407 17919 115282 1 281 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.983 -0.233 17919 115283 1 281 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.399 2.181 17919 115284 1 281 . 1 1 36 36 ILE H H 36 6.150 6.150 7.724 -1.574 17919 115285 1 281 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.426 0.208 17919 115286 1 281 . 1 1 37 37 PRO C C 37 176.940 176.940 176.166 0.774 17919 115287 1 281 . 1 1 37 37 PRO CA C 37 61.660 61.660 62.264 -0.604 17919 115288 1 281 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.383 0.467 17919 115289 1 281 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.142 -0.025 17919 115290 1 281 . 1 1 38 38 PRO C C 38 178.320 178.320 178.656 -0.336 17919 115291 1 281 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.875 0.385 17919 115292 1 281 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.821 1.069 17919 115293 1 281 . 1 1 39 39 ASP N N 39 113.380 113.380 114.851 -1.471 17919 115294 1 281 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.380 0.050 17919 115295 1 281 . 1 1 39 39 ASP C C 39 177.090 177.090 176.967 0.123 17919 115296 1 281 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.310 -0.670 17919 115297 1 281 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.487 -0.947 17919 115298 1 281 . 1 1 39 39 ASP H H 39 8.550 8.550 8.749 -0.199 17919 115299 1 281 . 1 1 40 40 GLN N N 40 116.780 116.780 115.876 0.904 17919 115300 1 281 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.413 0.051 17919 115301 1 281 . 1 1 40 40 GLN C C 40 175.380 175.380 175.579 -0.199 17919 115302 1 281 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.205 0.435 17919 115303 1 281 . 1 1 40 40 GLN CB C 40 30.140 30.140 30.066 0.074 17919 115304 1 281 . 1 1 40 40 GLN H H 40 7.820 7.820 7.954 -0.134 17919 115305 1 281 . 1 1 41 41 GLN N N 41 117.720 117.720 119.477 -1.757 17919 115306 1 281 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.359 -0.115 17919 115307 1 281 . 1 1 41 41 GLN C C 41 176.300 176.300 174.814 1.486 17919 115308 1 281 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.307 0.163 17919 115309 1 281 . 1 1 41 41 GLN CB C 41 31.650 31.650 30.099 1.551 17919 115310 1 281 . 1 1 41 41 GLN H H 41 7.480 7.480 7.372 0.108 17919 115311 1 281 . 1 1 42 42 ARG N N 42 122.680 122.680 120.324 2.356 17919 115312 1 281 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.682 -0.182 17919 115313 1 281 . 1 1 42 42 ARG C C 42 174.050 174.050 173.963 0.087 17919 115314 1 281 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.680 0.370 17919 115315 1 281 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.464 -0.714 17919 115316 1 281 . 1 1 42 42 ARG H H 42 8.530 8.530 8.528 0.002 17919 115317 1 281 . 1 1 43 43 LEU N N 43 124.040 124.040 126.400 -2.360 17919 115318 1 281 . 1 1 43 43 LEU C C 43 175.290 175.290 175.847 -0.557 17919 115319 1 281 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.348 -1.368 17919 115320 1 281 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.288 2.502 17919 115321 1 281 . 1 1 43 43 LEU H H 43 8.820 8.820 8.857 -0.037 17919 115322 1 281 . 1 1 44 44 ILE N N 44 121.920 121.920 122.452 -0.532 17919 115323 1 281 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.820 0.172 17919 115324 1 281 . 1 1 44 44 ILE C C 44 176.060 176.060 174.272 1.788 17919 115325 1 281 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.305 -1.325 17919 115326 1 281 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.045 0.375 17919 115327 1 281 . 1 1 44 44 ILE H H 44 9.030 9.030 8.824 0.206 17919 115328 1 281 . 1 1 45 45 PHE N N 45 125.390 125.390 127.749 -2.359 17919 115329 1 281 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.023 0.022 17919 115330 1 281 . 1 1 45 45 PHE C C 45 174.470 174.470 174.755 -0.285 17919 115331 1 281 . 1 1 45 45 PHE CA C 45 57.020 57.020 55.583 1.438 17919 115332 1 281 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.807 0.953 17919 115333 1 281 . 1 1 45 45 PHE H H 45 8.830 8.830 9.134 -0.304 17919 115334 1 281 . 1 1 46 46 ALA N N 46 132.200 132.200 131.050 1.150 17919 115335 1 281 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.687 0.003 17919 115336 1 281 . 1 1 46 46 ALA C C 46 177.290 177.290 177.240 0.050 17919 115337 1 281 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.949 -0.409 17919 115338 1 281 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.452 0.118 17919 115339 1 281 . 1 1 46 46 ALA H H 46 8.810 8.810 9.226 -0.416 17919 115340 1 281 . 1 1 47 47 GLY N N 47 102.340 102.340 103.326 -0.986 17919 115341 1 281 . 1 1 47 47 GLY C C 47 173.810 173.810 174.205 -0.395 17919 115342 1 281 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.835 0.515 17919 115343 1 281 . 1 1 47 47 GLY H H 47 8.130 8.130 8.236 -0.106 17919 115344 1 281 . 1 1 48 48 LYS N N 48 121.570 121.570 119.939 1.631 17919 115345 1 281 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.546 0.076 17919 115346 1 281 . 1 1 48 48 LYS C C 48 174.700 174.700 174.427 0.273 17919 115347 1 281 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.645 -0.096 17919 115348 1 281 . 1 1 48 48 LYS CB C 48 34.530 34.530 35.412 -0.882 17919 115349 1 281 . 1 1 48 48 LYS H H 48 7.980 7.980 8.395 -0.415 17919 115350 1 281 . 1 1 49 49 GLN N N 49 122.410 122.410 126.053 -3.643 17919 115351 1 281 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.568 -0.008 17919 115352 1 281 . 1 1 49 49 GLN C C 49 175.670 175.670 175.632 0.038 17919 115353 1 281 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.897 -0.156 17919 115354 1 281 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.466 -0.466 17919 115355 1 281 . 1 1 49 49 GLN H H 49 8.600 8.600 8.641 -0.041 17919 115356 1 281 . 1 1 50 50 LEU N N 50 125.520 125.520 129.780 -4.260 17919 115357 1 281 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.100 -0.010 17919 115358 1 281 . 1 1 50 50 LEU C C 50 176.660 176.660 176.001 0.659 17919 115359 1 281 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.407 -0.167 17919 115360 1 281 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.357 0.213 17919 115361 1 281 . 1 1 50 50 LEU H H 50 8.530 8.530 8.941 -0.411 17919 115362 1 281 . 1 1 51 51 GLU N N 51 122.940 122.940 123.281 -0.341 17919 115363 1 281 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.649 -0.161 17919 115364 1 281 . 1 1 51 51 GLU C C 51 175.870 175.870 176.697 -0.827 17919 115365 1 281 . 1 1 51 51 GLU CA C 51 55.960 55.960 54.831 1.129 17919 115366 1 281 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.051 -0.481 17919 115367 1 281 . 1 1 51 51 GLU H H 51 8.400 8.400 8.713 -0.313 17919 115368 1 281 . 1 1 52 52 ASP N N 52 120.030 120.030 124.859 -4.829 17919 115369 1 281 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.380 -0.021 17919 115370 1 281 . 1 1 52 52 ASP C C 52 177.330 177.330 177.855 -0.525 17919 115371 1 281 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.941 -0.981 17919 115372 1 281 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.782 0.067 17919 115373 1 281 . 1 1 52 52 ASP H H 52 8.160 8.160 8.830 -0.670 17919 115374 1 281 . 1 1 53 53 GLY N N 53 106.660 106.660 105.436 1.224 17919 115375 1 281 . 1 1 53 53 GLY C C 53 174.870 174.870 174.185 0.685 17919 115376 1 281 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.829 0.341 17919 115377 1 281 . 1 1 53 53 GLY H H 53 9.390 9.390 8.621 0.769 17919 115378 1 281 . 1 1 54 54 ARG N N 54 119.050 119.050 119.586 -0.536 17919 115379 1 281 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.622 0.073 17919 115380 1 281 . 1 1 54 54 ARG C C 54 175.350 175.350 175.839 -0.489 17919 115381 1 281 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.371 0.019 17919 115382 1 281 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.434 0.216 17919 115383 1 281 . 1 1 54 54 ARG H H 54 7.460 7.460 7.519 -0.059 17919 115384 1 281 . 1 1 55 55 THR N N 55 108.400 108.400 112.201 -3.801 17919 115385 1 281 . 1 1 55 55 THR HA H 55 5.240 5.240 4.883 0.357 17919 115386 1 281 . 1 1 55 55 THR C C 55 176.560 176.560 176.389 0.171 17919 115387 1 281 . 1 1 55 55 THR CA C 55 59.690 59.690 60.266 -0.576 17919 115388 1 281 . 1 1 55 55 THR CB C 55 72.260 72.260 71.049 1.210 17919 115389 1 281 . 1 1 55 55 THR H H 55 8.730 8.730 9.195 -0.465 17919 115390 1 281 . 1 1 56 56 LEU N N 56 117.920 117.920 121.675 -3.755 17919 115391 1 281 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.939 0.121 17919 115392 1 281 . 1 1 56 56 LEU C C 56 180.810 180.810 179.031 1.779 17919 115393 1 281 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.244 0.466 17919 115394 1 281 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.416 -1.046 17919 115395 1 281 . 1 1 56 56 LEU H H 56 8.140 8.140 8.851 -0.711 17919 115396 1 281 . 1 1 57 57 SER N N 57 113.330 113.330 114.649 -1.319 17919 115397 1 281 . 1 1 57 57 SER HA H 57 4.370 4.370 4.295 0.075 17919 115398 1 281 . 1 1 57 57 SER C C 57 178.310 178.310 176.835 1.475 17919 115399 1 281 . 1 1 57 57 SER CA C 57 61.080 61.080 61.453 -0.373 17919 115400 1 281 . 1 1 57 57 SER CB C 57 62.530 62.530 62.475 0.055 17919 115401 1 281 . 1 1 57 57 SER H H 57 8.470 8.470 7.962 0.508 17919 115402 1 281 . 1 1 58 58 ASP N N 58 124.190 124.190 122.678 1.512 17919 115403 1 281 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.289 0.007 17919 115404 1 281 . 1 1 58 58 ASP C C 58 177.400 177.400 177.226 0.174 17919 115405 1 281 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.856 0.324 17919 115406 1 281 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.277 -0.177 17919 115407 1 281 . 1 1 58 58 ASP H H 58 7.930 7.930 7.729 0.201 17919 115408 1 281 . 1 1 59 59 TYR N N 59 115.510 115.510 115.347 0.163 17919 115409 1 281 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.598 0.072 17919 115410 1 281 . 1 1 59 59 TYR C C 59 174.700 174.700 175.154 -0.454 17919 115411 1 281 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.104 1.146 17919 115412 1 281 . 1 1 59 59 TYR CB C 59 40.070 40.070 37.907 2.163 17919 115413 1 281 . 1 1 59 59 TYR H H 59 7.250 7.250 7.399 -0.149 17919 115414 1 281 . 1 1 60 60 ASN N N 60 115.900 115.900 118.000 -2.100 17919 115415 1 281 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.400 -0.045 17919 115416 1 281 . 1 1 60 60 ASN C C 60 174.340 174.340 174.662 -0.322 17919 115417 1 281 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.238 -0.118 17919 115418 1 281 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.007 0.403 17919 115419 1 281 . 1 1 60 60 ASN H H 60 8.150 8.150 7.876 0.274 17919 115420 1 281 . 1 1 61 61 ILE N N 61 118.600 118.600 119.655 -1.055 17919 115421 1 281 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.806 -0.413 17919 115422 1 281 . 1 1 61 61 ILE C C 61 174.610 174.610 175.480 -0.870 17919 115423 1 281 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.934 0.486 17919 115424 1 281 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.783 -1.043 17919 115425 1 281 . 1 1 61 61 ILE H H 61 7.250 7.250 7.676 -0.426 17919 115426 1 281 . 1 1 62 62 GLN N N 62 124.740 124.740 125.842 -1.102 17919 115427 1 281 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.799 -0.293 17919 115428 1 281 . 1 1 62 62 GLN C C 62 175.970 175.970 175.515 0.455 17919 115429 1 281 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.649 0.011 17919 115430 1 281 . 1 1 62 62 GLN CB C 62 31.650 31.650 32.859 -1.209 17919 115431 1 281 . 1 1 62 62 GLN H H 62 7.610 7.610 8.041 -0.431 17919 115432 1 281 . 1 1 63 63 LYS N N 63 120.300 120.300 121.099 -0.799 17919 115433 1 281 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.112 -0.111 17919 115434 1 281 . 1 1 63 63 LYS C C 63 175.810 175.810 176.730 -0.920 17919 115435 1 281 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.420 0.370 17919 115436 1 281 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.261 0.389 17919 115437 1 281 . 1 1 63 63 LYS H H 63 8.490 8.490 8.572 -0.082 17919 115438 1 281 . 1 1 64 64 GLU N N 64 113.950 113.950 118.571 -4.621 17919 115439 1 281 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.468 -0.003 17919 115440 1 281 . 1 1 64 64 GLU C C 64 175.250 175.250 176.524 -1.274 17919 115441 1 281 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.523 0.367 17919 115442 1 281 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.209 -2.309 17919 115443 1 281 . 1 1 64 64 GLU H H 64 9.280 9.280 8.967 0.313 17919 115444 1 281 . 1 1 65 65 SER N N 65 114.730 114.730 116.200 -1.470 17919 115445 1 281 . 1 1 65 65 SER HA H 65 4.640 4.640 4.402 0.238 17919 115446 1 281 . 1 1 65 65 SER C C 65 172.160 172.160 173.930 -1.770 17919 115447 1 281 . 1 1 65 65 SER CA C 65 60.890 60.890 61.055 -0.165 17919 115448 1 281 . 1 1 65 65 SER CB C 65 64.910 64.910 63.850 1.060 17919 115449 1 281 . 1 1 65 65 SER H H 65 7.670 7.670 7.678 -0.008 17919 115450 1 281 . 1 1 66 66 THR N N 66 117.110 117.110 118.620 -1.510 17919 115451 1 281 . 1 1 66 66 THR HA H 66 5.270 5.270 5.162 0.108 17919 115452 1 281 . 1 1 66 66 THR C C 66 173.950 173.950 173.544 0.406 17919 115453 1 281 . 1 1 66 66 THR CA C 66 62.340 62.340 62.250 0.090 17919 115454 1 281 . 1 1 66 66 THR CB C 66 70.080 70.080 70.363 -0.283 17919 115455 1 281 . 1 1 66 66 THR H H 66 8.730 8.730 8.267 0.463 17919 115456 1 281 . 1 1 67 67 LEU N N 67 127.110 127.110 126.335 0.775 17919 115457 1 281 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.915 0.145 17919 115458 1 281 . 1 1 67 67 LEU C C 67 175.770 175.770 174.970 0.800 17919 115459 1 281 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.903 -0.003 17919 115460 1 281 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.401 -0.141 17919 115461 1 281 . 1 1 67 67 LEU H H 67 9.410 9.410 9.275 0.135 17919 115462 1 281 . 1 1 68 68 HIS N N 68 118.380 118.380 123.420 -5.040 17919 115463 1 281 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.416 -0.176 17919 115464 1 281 . 1 1 68 68 HIS C C 68 173.150 173.150 173.572 -0.422 17919 115465 1 281 . 1 1 68 68 HIS CA C 68 55.000 55.000 53.847 1.153 17919 115466 1 281 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.899 -2.369 17919 115467 1 281 . 1 1 68 68 HIS H H 68 9.230 9.230 9.215 0.015 17919 115468 1 281 . 1 1 69 69 LEU N N 69 124.460 124.460 130.293 -5.833 17919 115469 1 281 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.798 0.392 17919 115470 1 281 . 1 1 69 69 LEU C C 69 175.270 175.270 174.436 0.834 17919 115471 1 281 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.461 0.429 17919 115472 1 281 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.220 0.160 17919 115473 1 281 . 1 1 69 69 LEU H H 69 8.340 8.340 8.001 0.340 17919 115474 1 281 . 1 1 70 70 VAL N N 70 126.940 126.940 123.410 3.530 17919 115475 1 281 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.513 -0.163 17919 115476 1 281 . 1 1 70 70 VAL C C 70 174.000 174.000 173.332 0.668 17919 115477 1 281 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.544 1.256 17919 115478 1 281 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.859 -0.949 17919 115479 1 281 . 1 1 70 70 VAL H H 70 9.200 9.200 8.362 0.838 17919 115480 1 281 . 1 1 71 71 LEU N N 71 123.130 123.130 122.798 0.332 17919 115481 1 281 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.771 0.289 17919 115482 1 281 . 1 1 71 71 LEU C C 71 177.830 177.830 176.549 1.281 17919 115483 1 281 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.767 0.173 17919 115484 1 281 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.079 -0.229 17919 115485 1 281 . 1 1 71 71 LEU H H 71 8.120 8.120 8.343 -0.223 17919 115486 1 281 . 1 1 72 72 ARG N N 72 123.490 123.490 127.575 -4.085 17919 115487 1 281 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.210 0.091 17919 115488 1 281 . 1 1 72 72 ARG C C 72 175.350 175.350 175.827 -0.477 17919 115489 1 281 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.254 -0.644 17919 115490 1 281 . 1 1 72 72 ARG CB C 72 31.350 31.350 29.766 1.584 17919 115491 1 281 . 1 1 72 72 ARG H H 72 8.580 8.580 8.363 0.217 17919 115492 1 282 . 1 1 2 2 GLN N N 2 123.220 123.220 122.569 0.651 17919 115493 1 282 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.490 -0.241 17919 115494 1 282 . 1 1 2 2 GLN C C 2 175.920 175.920 174.254 1.666 17919 115495 1 282 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.553 0.527 17919 115496 1 282 . 1 1 2 2 GLN CB C 2 30.760 30.760 31.032 -0.272 17919 115497 1 282 . 1 1 2 2 GLN H H 2 8.900 8.900 8.315 0.585 17919 115498 1 282 . 1 1 3 3 ILE N N 3 115.340 115.340 120.054 -4.714 17919 115499 1 282 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.341 -0.128 17919 115500 1 282 . 1 1 3 3 ILE C C 3 172.450 172.450 173.105 -0.655 17919 115501 1 282 . 1 1 3 3 ILE CA C 3 59.570 59.570 58.969 0.601 17919 115502 1 282 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.542 0.668 17919 115503 1 282 . 1 1 3 3 ILE H H 3 8.320 8.320 8.556 -0.236 17919 115504 1 282 . 1 1 4 4 PHE N N 4 118.110 118.110 120.228 -2.118 17919 115505 1 282 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.311 0.319 17919 115506 1 282 . 1 1 4 4 PHE C C 4 175.320 175.320 175.258 0.062 17919 115507 1 282 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.991 -0.781 17919 115508 1 282 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.858 -0.378 17919 115509 1 282 . 1 1 4 4 PHE H H 4 8.610 8.610 8.212 0.398 17919 115510 1 282 . 1 1 5 5 VAL N N 5 121.000 121.000 122.289 -1.289 17919 115511 1 282 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.905 -0.180 17919 115512 1 282 . 1 1 5 5 VAL C C 5 174.870 174.870 174.546 0.324 17919 115513 1 282 . 1 1 5 5 VAL CA C 5 60.620 60.620 60.950 -0.330 17919 115514 1 282 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.227 0.003 17919 115515 1 282 . 1 1 5 5 VAL H H 5 9.300 9.300 9.241 0.059 17919 115516 1 282 . 1 1 6 6 LYS N N 6 127.520 127.520 128.993 -1.473 17919 115517 1 282 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.105 0.262 17919 115518 1 282 . 1 1 6 6 LYS C C 6 177.140 177.140 176.573 0.567 17919 115519 1 282 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.401 0.119 17919 115520 1 282 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.242 -0.192 17919 115521 1 282 . 1 1 6 6 LYS H H 6 8.820 8.820 9.060 -0.240 17919 115522 1 282 . 1 1 7 7 THR N N 7 115.400 115.400 118.058 -2.658 17919 115523 1 282 . 1 1 7 7 THR HA H 7 4.970 4.970 4.397 0.573 17919 115524 1 282 . 1 1 7 7 THR C C 7 176.910 176.910 175.717 1.193 17919 115525 1 282 . 1 1 7 7 THR CA C 7 60.470 60.470 61.873 -1.403 17919 115526 1 282 . 1 1 7 7 THR CB C 7 70.630 70.630 69.955 0.675 17919 115527 1 282 . 1 1 7 7 THR H H 7 8.730 8.730 8.965 -0.235 17919 115528 1 282 . 1 1 8 8 LEU N N 8 121.330 121.330 123.159 -1.829 17919 115529 1 282 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.294 0.016 17919 115530 1 282 . 1 1 8 8 LEU C C 8 178.800 178.800 177.293 1.507 17919 115531 1 282 . 1 1 8 8 LEU CA C 8 57.580 57.580 56.912 0.668 17919 115532 1 282 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.196 -0.226 17919 115533 1 282 . 1 1 8 8 LEU H H 8 9.100 9.100 8.882 0.218 17919 115534 1 282 . 1 1 9 9 THR N N 9 105.590 105.590 109.430 -3.840 17919 115535 1 282 . 1 1 9 9 THR HA H 9 4.428 4.428 4.371 0.057 17919 115536 1 282 . 1 1 9 9 THR C C 9 175.520 175.520 175.400 0.120 17919 115537 1 282 . 1 1 9 9 THR CA C 9 61.400 61.400 61.487 -0.087 17919 115538 1 282 . 1 1 9 9 THR CB C 9 69.140 69.140 68.703 0.437 17919 115539 1 282 . 1 1 9 9 THR H H 9 7.630 7.630 7.470 0.160 17919 115540 1 282 . 1 1 10 10 GLY N N 10 108.890 108.890 111.658 -2.768 17919 115541 1 282 . 1 1 10 10 GLY C C 10 174.070 174.070 173.826 0.244 17919 115542 1 282 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.596 -0.136 17919 115543 1 282 . 1 1 10 10 GLY H H 10 7.810 7.810 8.129 -0.319 17919 115544 1 282 . 1 1 11 11 LYS N N 11 121.600 121.600 121.038 0.562 17919 115545 1 282 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.441 -0.080 17919 115546 1 282 . 1 1 11 11 LYS C C 11 175.940 175.940 176.063 -0.123 17919 115547 1 282 . 1 1 11 11 LYS CA C 11 56.280 56.280 55.957 0.323 17919 115548 1 282 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.114 0.086 17919 115549 1 282 . 1 1 11 11 LYS H H 11 7.280 7.280 7.587 -0.307 17919 115550 1 282 . 1 1 12 12 THR N N 12 120.440 120.440 120.492 -0.052 17919 115551 1 282 . 1 1 12 12 THR HA H 12 5.046 5.046 4.667 0.379 17919 115552 1 282 . 1 1 12 12 THR C C 12 174.320 174.320 174.764 -0.444 17919 115553 1 282 . 1 1 12 12 THR CA C 12 62.390 62.390 62.892 -0.503 17919 115554 1 282 . 1 1 12 12 THR CB C 12 69.910 69.910 69.488 0.422 17919 115555 1 282 . 1 1 12 12 THR H H 12 8.650 8.650 8.334 0.316 17919 115556 1 282 . 1 1 13 13 ILE N N 13 127.110 127.110 122.162 4.948 17919 115557 1 282 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.810 -0.266 17919 115558 1 282 . 1 1 13 13 ILE C C 13 175.220 175.220 174.492 0.728 17919 115559 1 282 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.444 0.536 17919 115560 1 282 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.813 -0.863 17919 115561 1 282 . 1 1 13 13 ILE H H 13 9.450 9.450 9.075 0.375 17919 115562 1 282 . 1 1 14 14 THR N N 14 121.520 121.520 121.151 0.369 17919 115563 1 282 . 1 1 14 14 THR HA H 14 4.964 4.964 5.355 -0.391 17919 115564 1 282 . 1 1 14 14 THR C C 14 173.790 173.790 174.148 -0.358 17919 115565 1 282 . 1 1 14 14 THR CA C 14 61.940 61.940 61.679 0.261 17919 115566 1 282 . 1 1 14 14 THR CB C 14 69.650 69.650 69.806 -0.156 17919 115567 1 282 . 1 1 14 14 THR H H 14 8.710 8.710 8.286 0.424 17919 115568 1 282 . 1 1 15 15 LEU N N 15 124.800 124.800 121.121 3.679 17919 115569 1 282 . 1 1 15 15 LEU HA H 15 4.780 4.780 5.025 -0.245 17919 115570 1 282 . 1 1 15 15 LEU C C 15 174.670 174.670 174.358 0.312 17919 115571 1 282 . 1 1 15 15 LEU CA C 15 52.830 52.830 52.679 0.151 17919 115572 1 282 . 1 1 15 15 LEU CB C 15 47.070 47.070 44.845 2.225 17919 115573 1 282 . 1 1 15 15 LEU H H 15 8.710 8.710 8.666 0.044 17919 115574 1 282 . 1 1 16 16 GLU N N 16 122.160 122.160 120.348 1.812 17919 115575 1 282 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.091 -0.174 17919 115576 1 282 . 1 1 16 16 GLU C C 16 175.860 175.860 176.006 -0.146 17919 115577 1 282 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.521 -0.701 17919 115578 1 282 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.988 -1.538 17919 115579 1 282 . 1 1 16 16 GLU H H 16 8.140 8.140 8.400 -0.260 17919 115580 1 282 . 1 1 17 17 VAL N N 17 117.210 117.210 120.323 -3.113 17919 115581 1 282 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.930 -0.216 17919 115582 1 282 . 1 1 17 17 VAL C C 17 174.160 174.160 174.580 -0.420 17919 115583 1 282 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.524 -1.094 17919 115584 1 282 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.078 1.322 17919 115585 1 282 . 1 1 17 17 VAL H H 17 8.900 8.900 8.764 0.136 17919 115586 1 282 . 1 1 18 18 GLU N N 18 118.990 118.990 121.994 -3.004 17919 115587 1 282 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.908 0.171 17919 115588 1 282 . 1 1 18 18 GLU C C 18 176.160 176.160 175.185 0.975 17919 115589 1 282 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.467 0.253 17919 115590 1 282 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.448 -0.138 17919 115591 1 282 . 1 1 18 18 GLU H H 18 8.640 8.640 8.750 -0.110 17919 115592 1 282 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.315 -0.174 17919 115593 1 282 . 1 1 19 19 PRO C C 19 175.310 175.310 177.377 -2.067 17919 115594 1 282 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.296 0.174 17919 115595 1 282 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.862 0.088 17919 115596 1 282 . 1 1 20 20 SER N N 20 103.400 103.400 109.453 -6.053 17919 115597 1 282 . 1 1 20 20 SER HA H 20 4.370 4.370 4.288 0.082 17919 115598 1 282 . 1 1 20 20 SER C C 20 174.660 174.660 174.618 0.042 17919 115599 1 282 . 1 1 20 20 SER CA C 20 57.400 57.400 58.999 -1.599 17919 115600 1 282 . 1 1 20 20 SER CB C 20 63.370 63.370 62.156 1.214 17919 115601 1 282 . 1 1 20 20 SER H H 20 7.040 7.040 7.982 -0.942 17919 115602 1 282 . 1 1 21 21 ASP N N 21 123.480 123.480 125.131 -1.651 17919 115603 1 282 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.606 0.089 17919 115604 1 282 . 1 1 21 21 ASP C C 21 176.360 176.360 175.699 0.661 17919 115605 1 282 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.789 -0.089 17919 115606 1 282 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.239 -0.439 17919 115607 1 282 . 1 1 21 21 ASP H H 21 8.030 8.030 7.727 0.303 17919 115608 1 282 . 1 1 22 22 THR N N 22 108.800 108.800 112.994 -4.194 17919 115609 1 282 . 1 1 22 22 THR HA H 22 4.920 4.920 5.154 -0.234 17919 115610 1 282 . 1 1 22 22 THR C C 22 176.750 176.750 176.129 0.621 17919 115611 1 282 . 1 1 22 22 THR CA C 22 59.690 59.690 60.339 -0.649 17919 115612 1 282 . 1 1 22 22 THR CB C 22 71.200 71.200 71.203 -0.003 17919 115613 1 282 . 1 1 22 22 THR H H 22 7.900 7.900 8.139 -0.239 17919 115614 1 282 . 1 1 23 23 ILE N N 23 121.190 121.190 121.625 -0.435 17919 115615 1 282 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.813 -0.156 17919 115616 1 282 . 1 1 23 23 ILE C C 23 179.040 179.040 177.767 1.273 17919 115617 1 282 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.653 -0.393 17919 115618 1 282 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.254 -1.904 17919 115619 1 282 . 1 1 23 23 ILE H H 23 8.560 8.560 8.481 0.079 17919 115620 1 282 . 1 1 24 24 GLU N N 24 120.830 120.830 121.356 -0.526 17919 115621 1 282 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.841 0.076 17919 115622 1 282 . 1 1 24 24 GLU C C 24 178.640 178.640 178.631 0.009 17919 115623 1 282 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.193 0.027 17919 115624 1 282 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.425 -1.145 17919 115625 1 282 . 1 1 24 24 GLU H H 24 9.760 9.760 8.172 1.588 17919 115626 1 282 . 1 1 25 25 ASN N N 25 120.570 120.570 117.330 3.240 17919 115627 1 282 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.543 -0.018 17919 115628 1 282 . 1 1 25 25 ASN C C 25 178.380 178.380 178.008 0.372 17919 115629 1 282 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.916 0.144 17919 115630 1 282 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.872 -0.422 17919 115631 1 282 . 1 1 25 25 ASN H H 25 7.920 7.920 7.539 0.381 17919 115632 1 282 . 1 1 26 26 VAL N N 26 121.710 121.710 120.879 0.831 17919 115633 1 282 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.618 -0.221 17919 115634 1 282 . 1 1 26 26 VAL C C 26 177.950 177.950 177.840 0.110 17919 115635 1 282 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.780 0.880 17919 115636 1 282 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.204 -0.364 17919 115637 1 282 . 1 1 26 26 VAL H H 26 8.070 8.070 8.382 -0.312 17919 115638 1 282 . 1 1 27 27 LYS N N 27 118.860 118.860 118.853 0.007 17919 115639 1 282 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.050 0.530 17919 115640 1 282 . 1 1 27 27 LYS C C 27 180.550 180.550 179.048 1.502 17919 115641 1 282 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.498 -0.248 17919 115642 1 282 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.199 1.531 17919 115643 1 282 . 1 1 27 27 LYS H H 27 8.560 8.560 8.547 0.013 17919 115644 1 282 . 1 1 28 28 ALA N N 28 123.440 123.440 121.851 1.589 17919 115645 1 282 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.350 -0.190 17919 115646 1 282 . 1 1 28 28 ALA C C 28 180.300 180.300 178.976 1.324 17919 115647 1 282 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.294 1.076 17919 115648 1 282 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.618 -0.908 17919 115649 1 282 . 1 1 28 28 ALA H H 28 8.060 8.060 8.341 -0.281 17919 115650 1 282 . 1 1 29 29 LYS N N 29 119.940 119.940 119.828 0.112 17919 115651 1 282 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.070 0.137 17919 115652 1 282 . 1 1 29 29 LYS C C 29 180.320 180.320 179.189 1.131 17919 115653 1 282 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.267 0.383 17919 115654 1 282 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.335 0.955 17919 115655 1 282 . 1 1 29 29 LYS H H 29 7.850 7.850 7.651 0.199 17919 115656 1 282 . 1 1 30 30 ILE N N 30 121.080 121.080 120.964 0.116 17919 115657 1 282 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.643 -0.136 17919 115658 1 282 . 1 1 30 30 ILE C C 30 178.310 178.310 177.266 1.044 17919 115659 1 282 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.230 0.920 17919 115660 1 282 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.729 -0.929 17919 115661 1 282 . 1 1 30 30 ILE H H 30 8.280 8.280 7.868 0.412 17919 115662 1 282 . 1 1 31 31 GLN N N 31 123.490 123.490 120.597 2.893 17919 115663 1 282 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.045 -0.216 17919 115664 1 282 . 1 1 31 31 GLN C C 31 178.890 178.890 178.088 0.802 17919 115665 1 282 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.051 0.949 17919 115666 1 282 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.622 -0.902 17919 115667 1 282 . 1 1 31 31 GLN H H 31 8.580 8.580 8.078 0.502 17919 115668 1 282 . 1 1 32 32 ASP N N 32 119.360 119.360 118.959 0.401 17919 115669 1 282 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.482 -0.128 17919 115670 1 282 . 1 1 32 32 ASP C C 32 177.250 177.250 178.106 -0.856 17919 115671 1 282 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.408 0.782 17919 115672 1 282 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.896 -0.316 17919 115673 1 282 . 1 1 32 32 ASP H H 32 8.010 8.010 8.208 -0.198 17919 115674 1 282 . 1 1 33 33 LYS N N 33 115.130 115.130 117.911 -2.781 17919 115675 1 282 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.307 0.030 17919 115676 1 282 . 1 1 33 33 LYS C C 33 177.870 177.870 177.865 0.005 17919 115677 1 282 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.628 -0.578 17919 115678 1 282 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.623 0.547 17919 115679 1 282 . 1 1 33 33 LYS H H 33 7.430 7.430 7.631 -0.201 17919 115680 1 282 . 1 1 34 34 GLU N N 34 113.870 113.870 113.726 0.144 17919 115681 1 282 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.530 0.095 17919 115682 1 282 . 1 1 34 34 GLU C C 34 177.840 177.840 176.423 1.417 17919 115683 1 282 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.727 -0.557 17919 115684 1 282 . 1 1 34 34 GLU CB C 34 32.660 32.660 32.129 0.531 17919 115685 1 282 . 1 1 34 34 GLU H H 34 8.740 8.740 8.185 0.555 17919 115686 1 282 . 1 1 35 35 GLY N N 35 108.650 108.650 109.079 -0.429 17919 115687 1 282 . 1 1 35 35 GLY C C 35 173.960 173.960 174.579 -0.619 17919 115688 1 282 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.971 0.109 17919 115689 1 282 . 1 1 35 35 GLY H H 35 8.530 8.530 7.768 0.762 17919 115690 1 282 . 1 1 36 36 ILE N N 36 119.880 119.880 121.523 -1.643 17919 115691 1 282 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.245 0.200 17919 115692 1 282 . 1 1 36 36 ILE C C 36 173.590 173.590 174.097 -0.507 17919 115693 1 282 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.181 -0.431 17919 115694 1 282 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.463 2.117 17919 115695 1 282 . 1 1 36 36 ILE H H 36 6.150 6.150 7.607 -1.457 17919 115696 1 282 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.628 0.006 17919 115697 1 282 . 1 1 37 37 PRO C C 37 176.940 176.940 176.320 0.620 17919 115698 1 282 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.355 0.305 17919 115699 1 282 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.205 0.645 17919 115700 1 282 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.205 -0.088 17919 115701 1 282 . 1 1 38 38 PRO C C 38 178.320 178.320 177.797 0.523 17919 115702 1 282 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.574 0.686 17919 115703 1 282 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.781 1.109 17919 115704 1 282 . 1 1 39 39 ASP N N 39 113.380 113.380 114.754 -1.374 17919 115705 1 282 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.374 0.056 17919 115706 1 282 . 1 1 39 39 ASP C C 39 177.090 177.090 177.096 -0.006 17919 115707 1 282 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.590 -0.950 17919 115708 1 282 . 1 1 39 39 ASP CB C 39 39.540 39.540 39.244 0.296 17919 115709 1 282 . 1 1 39 39 ASP H H 39 8.550 8.550 8.658 -0.108 17919 115710 1 282 . 1 1 40 40 GLN N N 40 116.780 116.780 116.253 0.527 17919 115711 1 282 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.474 -0.010 17919 115712 1 282 . 1 1 40 40 GLN C C 40 175.380 175.380 175.540 -0.160 17919 115713 1 282 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.216 0.424 17919 115714 1 282 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.430 0.710 17919 115715 1 282 . 1 1 40 40 GLN H H 40 7.820 7.820 7.852 -0.032 17919 115716 1 282 . 1 1 41 41 GLN N N 41 117.720 117.720 118.512 -0.792 17919 115717 1 282 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.547 -0.303 17919 115718 1 282 . 1 1 41 41 GLN C C 41 176.300 176.300 175.608 0.692 17919 115719 1 282 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.466 1.004 17919 115720 1 282 . 1 1 41 41 GLN CB C 41 31.650 31.650 30.483 1.167 17919 115721 1 282 . 1 1 41 41 GLN H H 41 7.480 7.480 7.345 0.135 17919 115722 1 282 . 1 1 42 42 ARG N N 42 122.680 122.680 124.877 -2.197 17919 115723 1 282 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.655 -0.155 17919 115724 1 282 . 1 1 42 42 ARG C C 42 174.050 174.050 173.916 0.134 17919 115725 1 282 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.970 0.080 17919 115726 1 282 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.507 -1.757 17919 115727 1 282 . 1 1 42 42 ARG H H 42 8.530 8.530 8.831 -0.301 17919 115728 1 282 . 1 1 43 43 LEU N N 43 124.040 124.040 126.882 -2.842 17919 115729 1 282 . 1 1 43 43 LEU C C 43 175.290 175.290 175.548 -0.258 17919 115730 1 282 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.706 -0.727 17919 115731 1 282 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.608 1.182 17919 115732 1 282 . 1 1 43 43 LEU H H 43 8.820 8.820 8.824 -0.004 17919 115733 1 282 . 1 1 44 44 ILE N N 44 121.920 121.920 121.070 0.850 17919 115734 1 282 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.134 -0.142 17919 115735 1 282 . 1 1 44 44 ILE C C 44 176.060 176.060 174.227 1.833 17919 115736 1 282 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.013 -1.033 17919 115737 1 282 . 1 1 44 44 ILE CB C 44 41.420 41.420 42.676 -1.256 17919 115738 1 282 . 1 1 44 44 ILE H H 44 9.030 9.030 8.838 0.192 17919 115739 1 282 . 1 1 45 45 PHE N N 45 125.390 125.390 125.732 -0.342 17919 115740 1 282 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.108 -0.063 17919 115741 1 282 . 1 1 45 45 PHE C C 45 174.470 174.470 174.666 -0.196 17919 115742 1 282 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.350 0.670 17919 115743 1 282 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.985 0.775 17919 115744 1 282 . 1 1 45 45 PHE H H 45 8.830 8.830 8.857 -0.027 17919 115745 1 282 . 1 1 46 46 ALA N N 46 132.200 132.200 130.716 1.484 17919 115746 1 282 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.708 -0.018 17919 115747 1 282 . 1 1 46 46 ALA C C 46 177.290 177.290 177.416 -0.126 17919 115748 1 282 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.792 -0.252 17919 115749 1 282 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.519 0.051 17919 115750 1 282 . 1 1 46 46 ALA H H 46 8.810 8.810 9.267 -0.457 17919 115751 1 282 . 1 1 47 47 GLY N N 47 102.340 102.340 102.839 -0.499 17919 115752 1 282 . 1 1 47 47 GLY C C 47 173.810 173.810 174.509 -0.699 17919 115753 1 282 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.175 0.175 17919 115754 1 282 . 1 1 47 47 GLY H H 47 8.130 8.130 8.590 -0.460 17919 115755 1 282 . 1 1 48 48 LYS N N 48 121.570 121.570 120.068 1.502 17919 115756 1 282 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.529 0.093 17919 115757 1 282 . 1 1 48 48 LYS C C 48 174.700 174.700 175.412 -0.712 17919 115758 1 282 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.743 -0.194 17919 115759 1 282 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.743 -0.213 17919 115760 1 282 . 1 1 48 48 LYS H H 48 7.980 7.980 7.997 -0.017 17919 115761 1 282 . 1 1 49 49 GLN N N 49 122.410 122.410 122.566 -0.156 17919 115762 1 282 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.305 0.255 17919 115763 1 282 . 1 1 49 49 GLN C C 49 175.670 175.670 175.707 -0.037 17919 115764 1 282 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.013 -0.273 17919 115765 1 282 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.479 -0.479 17919 115766 1 282 . 1 1 49 49 GLN H H 49 8.600 8.600 8.564 0.036 17919 115767 1 282 . 1 1 50 50 LEU N N 50 125.520 125.520 127.399 -1.879 17919 115768 1 282 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.374 -0.284 17919 115769 1 282 . 1 1 50 50 LEU C C 50 176.660 176.660 175.664 0.996 17919 115770 1 282 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.648 0.592 17919 115771 1 282 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.620 -0.049 17919 115772 1 282 . 1 1 50 50 LEU H H 50 8.530 8.530 8.686 -0.156 17919 115773 1 282 . 1 1 51 51 GLU N N 51 122.940 122.940 124.609 -1.669 17919 115774 1 282 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.370 0.118 17919 115775 1 282 . 1 1 51 51 GLU C C 51 175.870 175.870 176.795 -0.925 17919 115776 1 282 . 1 1 51 51 GLU CA C 51 55.960 55.960 54.931 1.029 17919 115777 1 282 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.632 -1.062 17919 115778 1 282 . 1 1 51 51 GLU H H 51 8.400 8.400 8.548 -0.148 17919 115779 1 282 . 1 1 52 52 ASP N N 52 120.030 120.030 122.962 -2.932 17919 115780 1 282 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.469 -0.110 17919 115781 1 282 . 1 1 52 52 ASP C C 52 177.330 177.330 178.477 -1.147 17919 115782 1 282 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.814 -0.854 17919 115783 1 282 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.556 0.293 17919 115784 1 282 . 1 1 52 52 ASP H H 52 8.160 8.160 8.724 -0.564 17919 115785 1 282 . 1 1 53 53 GLY N N 53 106.660 106.660 105.350 1.310 17919 115786 1 282 . 1 1 53 53 GLY C C 53 174.870 174.870 174.570 0.300 17919 115787 1 282 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.349 -0.179 17919 115788 1 282 . 1 1 53 53 GLY H H 53 9.390 9.390 8.439 0.951 17919 115789 1 282 . 1 1 54 54 ARG N N 54 119.050 119.050 119.412 -0.362 17919 115790 1 282 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.687 0.008 17919 115791 1 282 . 1 1 54 54 ARG C C 54 175.350 175.350 175.395 -0.045 17919 115792 1 282 . 1 1 54 54 ARG CA C 54 54.390 54.390 53.408 0.982 17919 115793 1 282 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.101 -0.451 17919 115794 1 282 . 1 1 54 54 ARG H H 54 7.460 7.460 7.499 -0.039 17919 115795 1 282 . 1 1 55 55 THR N N 55 108.400 108.400 112.330 -3.930 17919 115796 1 282 . 1 1 55 55 THR HA H 55 5.240 5.240 4.952 0.288 17919 115797 1 282 . 1 1 55 55 THR C C 55 176.560 176.560 176.239 0.321 17919 115798 1 282 . 1 1 55 55 THR CA C 55 59.690 59.690 60.855 -1.165 17919 115799 1 282 . 1 1 55 55 THR CB C 55 72.260 72.260 70.164 2.096 17919 115800 1 282 . 1 1 55 55 THR H H 55 8.730 8.730 8.836 -0.106 17919 115801 1 282 . 1 1 56 56 LEU N N 56 117.920 117.920 121.872 -3.952 17919 115802 1 282 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.198 -0.138 17919 115803 1 282 . 1 1 56 56 LEU C C 56 180.810 180.810 178.633 2.177 17919 115804 1 282 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.249 0.461 17919 115805 1 282 . 1 1 56 56 LEU CB C 56 40.370 40.370 40.991 -0.621 17919 115806 1 282 . 1 1 56 56 LEU H H 56 8.140 8.140 8.682 -0.542 17919 115807 1 282 . 1 1 57 57 SER N N 57 113.330 113.330 114.982 -1.652 17919 115808 1 282 . 1 1 57 57 SER HA H 57 4.370 4.370 4.054 0.316 17919 115809 1 282 . 1 1 57 57 SER C C 57 178.310 178.310 176.516 1.794 17919 115810 1 282 . 1 1 57 57 SER CA C 57 61.080 61.080 61.523 -0.443 17919 115811 1 282 . 1 1 57 57 SER CB C 57 62.530 62.530 62.695 -0.165 17919 115812 1 282 . 1 1 57 57 SER H H 57 8.470 8.470 7.715 0.755 17919 115813 1 282 . 1 1 58 58 ASP N N 58 124.190 124.190 121.609 2.581 17919 115814 1 282 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.291 0.005 17919 115815 1 282 . 1 1 58 58 ASP C C 58 177.400 177.400 177.030 0.370 17919 115816 1 282 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.625 0.555 17919 115817 1 282 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.466 -0.366 17919 115818 1 282 . 1 1 58 58 ASP H H 58 7.930 7.930 7.841 0.089 17919 115819 1 282 . 1 1 59 59 TYR N N 59 115.510 115.510 115.165 0.345 17919 115820 1 282 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.684 -0.014 17919 115821 1 282 . 1 1 59 59 TYR C C 59 174.700 174.700 174.756 -0.056 17919 115822 1 282 . 1 1 59 59 TYR CA C 59 58.250 58.250 56.995 1.255 17919 115823 1 282 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.311 1.759 17919 115824 1 282 . 1 1 59 59 TYR H H 59 7.250 7.250 7.006 0.244 17919 115825 1 282 . 1 1 60 60 ASN N N 60 115.900 115.900 115.617 0.283 17919 115826 1 282 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.399 -0.044 17919 115827 1 282 . 1 1 60 60 ASN C C 60 174.340 174.340 174.652 -0.312 17919 115828 1 282 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.274 -0.154 17919 115829 1 282 . 1 1 60 60 ASN CB C 60 37.410 37.410 36.505 0.905 17919 115830 1 282 . 1 1 60 60 ASN H H 60 8.150 8.150 8.317 -0.167 17919 115831 1 282 . 1 1 61 61 ILE N N 61 118.600 118.600 119.436 -0.836 17919 115832 1 282 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.822 -0.429 17919 115833 1 282 . 1 1 61 61 ILE C C 61 174.610 174.610 175.354 -0.744 17919 115834 1 282 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.884 0.536 17919 115835 1 282 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.999 -1.259 17919 115836 1 282 . 1 1 61 61 ILE H H 61 7.250 7.250 7.485 -0.235 17919 115837 1 282 . 1 1 62 62 GLN N N 62 124.740 124.740 124.892 -0.152 17919 115838 1 282 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.817 -0.311 17919 115839 1 282 . 1 1 62 62 GLN C C 62 175.970 175.970 175.152 0.818 17919 115840 1 282 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.577 0.083 17919 115841 1 282 . 1 1 62 62 GLN CB C 62 31.650 31.650 32.612 -0.962 17919 115842 1 282 . 1 1 62 62 GLN H H 62 7.610 7.610 8.208 -0.598 17919 115843 1 282 . 1 1 63 63 LYS N N 63 120.300 120.300 119.679 0.621 17919 115844 1 282 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.140 -0.139 17919 115845 1 282 . 1 1 63 63 LYS C C 63 175.810 175.810 176.710 -0.900 17919 115846 1 282 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.676 0.114 17919 115847 1 282 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.385 0.265 17919 115848 1 282 . 1 1 63 63 LYS H H 63 8.490 8.490 8.457 0.033 17919 115849 1 282 . 1 1 64 64 GLU N N 64 113.950 113.950 119.119 -5.169 17919 115850 1 282 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.941 -0.476 17919 115851 1 282 . 1 1 64 64 GLU C C 64 175.250 175.250 175.922 -0.672 17919 115852 1 282 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.648 0.242 17919 115853 1 282 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.140 -2.240 17919 115854 1 282 . 1 1 64 64 GLU H H 64 9.280 9.280 9.045 0.235 17919 115855 1 282 . 1 1 65 65 SER N N 65 114.730 114.730 115.384 -0.654 17919 115856 1 282 . 1 1 65 65 SER HA H 65 4.640 4.640 4.625 0.015 17919 115857 1 282 . 1 1 65 65 SER C C 65 172.160 172.160 173.815 -1.655 17919 115858 1 282 . 1 1 65 65 SER CA C 65 60.890 60.890 60.427 0.463 17919 115859 1 282 . 1 1 65 65 SER CB C 65 64.910 64.910 64.420 0.490 17919 115860 1 282 . 1 1 65 65 SER H H 65 7.670 7.670 7.442 0.228 17919 115861 1 282 . 1 1 66 66 THR N N 66 117.110 117.110 120.233 -3.123 17919 115862 1 282 . 1 1 66 66 THR HA H 66 5.270 5.270 5.285 -0.016 17919 115863 1 282 . 1 1 66 66 THR C C 66 173.950 173.950 174.374 -0.424 17919 115864 1 282 . 1 1 66 66 THR CA C 66 62.340 62.340 61.868 0.472 17919 115865 1 282 . 1 1 66 66 THR CB C 66 70.080 70.080 70.699 -0.619 17919 115866 1 282 . 1 1 66 66 THR H H 66 8.730 8.730 8.563 0.167 17919 115867 1 282 . 1 1 67 67 LEU N N 67 127.110 127.110 127.303 -0.193 17919 115868 1 282 . 1 1 67 67 LEU HA H 67 5.060 5.060 5.093 -0.033 17919 115869 1 282 . 1 1 67 67 LEU C C 67 175.770 175.770 176.004 -0.234 17919 115870 1 282 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.898 0.002 17919 115871 1 282 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.003 0.257 17919 115872 1 282 . 1 1 67 67 LEU H H 67 9.410 9.410 9.069 0.341 17919 115873 1 282 . 1 1 68 68 HIS N N 68 118.380 118.380 119.476 -1.096 17919 115874 1 282 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.153 0.087 17919 115875 1 282 . 1 1 68 68 HIS C C 68 173.150 173.150 174.619 -1.469 17919 115876 1 282 . 1 1 68 68 HIS CA C 68 55.000 55.000 55.669 -0.669 17919 115877 1 282 . 1 1 68 68 HIS CB C 68 30.530 30.530 30.579 -0.049 17919 115878 1 282 . 1 1 68 68 HIS H H 68 9.230 9.230 9.097 0.133 17919 115879 1 282 . 1 1 69 69 LEU N N 69 124.460 124.460 126.301 -1.841 17919 115880 1 282 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.289 -0.099 17919 115881 1 282 . 1 1 69 69 LEU C C 69 175.270 175.270 174.800 0.470 17919 115882 1 282 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.913 -0.023 17919 115883 1 282 . 1 1 69 69 LEU CB C 69 44.380 44.380 43.894 0.486 17919 115884 1 282 . 1 1 69 69 LEU H H 69 8.340 8.340 8.565 -0.225 17919 115885 1 282 . 1 1 70 70 VAL N N 70 126.940 126.940 125.837 1.103 17919 115886 1 282 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.353 -0.003 17919 115887 1 282 . 1 1 70 70 VAL C C 70 174.000 174.000 174.552 -0.552 17919 115888 1 282 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.644 0.156 17919 115889 1 282 . 1 1 70 70 VAL CB C 70 34.910 34.910 34.687 0.223 17919 115890 1 282 . 1 1 70 70 VAL H H 70 9.200 9.200 9.154 0.046 17919 115891 1 282 . 1 1 71 71 LEU N N 71 123.130 123.130 126.321 -3.191 17919 115892 1 282 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.052 0.008 17919 115893 1 282 . 1 1 71 71 LEU C C 71 177.830 177.830 177.614 0.216 17919 115894 1 282 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.105 0.835 17919 115895 1 282 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.994 -0.144 17919 115896 1 282 . 1 1 71 71 LEU H H 71 8.120 8.120 8.466 -0.346 17919 115897 1 282 . 1 1 72 72 ARG N N 72 123.490 123.490 123.481 0.009 17919 115898 1 282 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.659 -0.358 17919 115899 1 282 . 1 1 72 72 ARG C C 72 175.350 175.350 175.540 -0.190 17919 115900 1 282 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.112 0.498 17919 115901 1 282 . 1 1 72 72 ARG CB C 72 31.350 31.350 32.074 -0.724 17919 115902 1 282 . 1 1 72 72 ARG H H 72 8.580 8.580 8.222 0.358 17919 115903 1 283 . 1 1 2 2 GLN N N 2 123.220 123.220 121.123 2.097 17919 115904 1 283 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.380 -0.131 17919 115905 1 283 . 1 1 2 2 GLN C C 2 175.920 175.920 175.971 -0.051 17919 115906 1 283 . 1 1 2 2 GLN CA C 2 55.080 55.080 55.156 -0.076 17919 115907 1 283 . 1 1 2 2 GLN CB C 2 30.760 30.760 29.944 0.817 17919 115908 1 283 . 1 1 2 2 GLN H H 2 8.900 8.900 8.403 0.497 17919 115909 1 283 . 1 1 3 3 ILE N N 3 115.340 115.340 115.625 -0.285 17919 115910 1 283 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.271 -0.058 17919 115911 1 283 . 1 1 3 3 ILE C C 3 172.450 172.450 173.658 -1.208 17919 115912 1 283 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.077 0.493 17919 115913 1 283 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.886 0.324 17919 115914 1 283 . 1 1 3 3 ILE H H 3 8.320 8.320 8.800 -0.480 17919 115915 1 283 . 1 1 4 4 PHE N N 4 118.110 118.110 119.128 -1.018 17919 115916 1 283 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.667 -0.037 17919 115917 1 283 . 1 1 4 4 PHE C C 4 175.320 175.320 174.811 0.509 17919 115918 1 283 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.000 0.210 17919 115919 1 283 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.300 -0.820 17919 115920 1 283 . 1 1 4 4 PHE H H 4 8.610 8.610 8.546 0.064 17919 115921 1 283 . 1 1 5 5 VAL N N 5 121.000 121.000 121.316 -0.316 17919 115922 1 283 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.893 -0.168 17919 115923 1 283 . 1 1 5 5 VAL C C 5 174.870 174.870 174.365 0.505 17919 115924 1 283 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.059 -0.439 17919 115925 1 283 . 1 1 5 5 VAL CB C 5 34.230 34.230 35.628 -1.398 17919 115926 1 283 . 1 1 5 5 VAL H H 5 9.300 9.300 9.400 -0.100 17919 115927 1 283 . 1 1 6 6 LYS N N 6 127.520 127.520 128.351 -0.831 17919 115928 1 283 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.356 0.011 17919 115929 1 283 . 1 1 6 6 LYS C C 6 177.140 177.140 176.168 0.972 17919 115930 1 283 . 1 1 6 6 LYS CA C 6 54.520 54.520 53.805 0.715 17919 115931 1 283 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.938 0.112 17919 115932 1 283 . 1 1 6 6 LYS H H 6 8.820 8.820 9.156 -0.336 17919 115933 1 283 . 1 1 7 7 THR N N 7 115.400 115.400 118.233 -2.833 17919 115934 1 283 . 1 1 7 7 THR HA H 7 4.970 4.970 4.793 0.177 17919 115935 1 283 . 1 1 7 7 THR C C 7 176.910 176.910 176.822 0.088 17919 115936 1 283 . 1 1 7 7 THR CA C 7 60.470 60.470 60.206 0.264 17919 115937 1 283 . 1 1 7 7 THR CB C 7 70.630 70.630 70.894 -0.264 17919 115938 1 283 . 1 1 7 7 THR H H 7 8.730 8.730 8.949 -0.219 17919 115939 1 283 . 1 1 8 8 LEU N N 8 121.330 121.330 120.073 1.257 17919 115940 1 283 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.433 -0.123 17919 115941 1 283 . 1 1 8 8 LEU C C 8 178.800 178.800 177.203 1.597 17919 115942 1 283 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.531 0.049 17919 115943 1 283 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.504 0.466 17919 115944 1 283 . 1 1 8 8 LEU H H 8 9.100 9.100 8.647 0.453 17919 115945 1 283 . 1 1 9 9 THR N N 9 105.590 105.590 110.031 -4.441 17919 115946 1 283 . 1 1 9 9 THR HA H 9 4.428 4.428 4.381 0.047 17919 115947 1 283 . 1 1 9 9 THR C C 9 175.520 175.520 175.830 -0.310 17919 115948 1 283 . 1 1 9 9 THR CA C 9 61.400 61.400 61.533 -0.133 17919 115949 1 283 . 1 1 9 9 THR CB C 9 69.140 69.140 69.486 -0.346 17919 115950 1 283 . 1 1 9 9 THR H H 9 7.630 7.630 7.649 -0.019 17919 115951 1 283 . 1 1 10 10 GLY N N 10 108.890 108.890 111.899 -3.009 17919 115952 1 283 . 1 1 10 10 GLY C C 10 174.070 174.070 173.766 0.304 17919 115953 1 283 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.127 0.333 17919 115954 1 283 . 1 1 10 10 GLY H H 10 7.810 7.810 8.307 -0.497 17919 115955 1 283 . 1 1 11 11 LYS N N 11 121.600 121.600 121.432 0.168 17919 115956 1 283 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.401 -0.040 17919 115957 1 283 . 1 1 11 11 LYS C C 11 175.940 175.940 175.692 0.248 17919 115958 1 283 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.153 0.127 17919 115959 1 283 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.924 -0.724 17919 115960 1 283 . 1 1 11 11 LYS H H 11 7.280 7.280 7.940 -0.660 17919 115961 1 283 . 1 1 12 12 THR N N 12 120.440 120.440 119.934 0.506 17919 115962 1 283 . 1 1 12 12 THR HA H 12 5.046 5.046 5.205 -0.159 17919 115963 1 283 . 1 1 12 12 THR C C 12 174.320 174.320 174.217 0.103 17919 115964 1 283 . 1 1 12 12 THR CA C 12 62.390 62.390 61.578 0.812 17919 115965 1 283 . 1 1 12 12 THR CB C 12 69.910 69.910 70.042 -0.132 17919 115966 1 283 . 1 1 12 12 THR H H 12 8.650 8.650 8.279 0.371 17919 115967 1 283 . 1 1 13 13 ILE N N 13 127.110 127.110 128.278 -1.168 17919 115968 1 283 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.502 0.042 17919 115969 1 283 . 1 1 13 13 ILE C C 13 175.220 175.220 174.824 0.396 17919 115970 1 283 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.374 -0.394 17919 115971 1 283 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.916 0.034 17919 115972 1 283 . 1 1 13 13 ILE H H 13 9.450 9.450 9.185 0.265 17919 115973 1 283 . 1 1 14 14 THR N N 14 121.520 121.520 120.426 1.094 17919 115974 1 283 . 1 1 14 14 THR HA H 14 4.964 4.964 5.224 -0.260 17919 115975 1 283 . 1 1 14 14 THR C C 14 173.790 173.790 174.015 -0.225 17919 115976 1 283 . 1 1 14 14 THR CA C 14 61.940 61.940 61.145 0.795 17919 115977 1 283 . 1 1 14 14 THR CB C 14 69.650 69.650 69.667 -0.017 17919 115978 1 283 . 1 1 14 14 THR H H 14 8.710 8.710 8.429 0.281 17919 115979 1 283 . 1 1 15 15 LEU N N 15 124.800 124.800 128.880 -4.080 17919 115980 1 283 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.702 0.078 17919 115981 1 283 . 1 1 15 15 LEU C C 15 174.670 174.670 175.272 -0.602 17919 115982 1 283 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.912 -1.082 17919 115983 1 283 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.517 1.554 17919 115984 1 283 . 1 1 15 15 LEU H H 15 8.710 8.710 9.114 -0.404 17919 115985 1 283 . 1 1 16 16 GLU N N 16 122.160 122.160 124.120 -1.960 17919 115986 1 283 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.842 0.075 17919 115987 1 283 . 1 1 16 16 GLU C C 16 175.860 175.860 175.522 0.338 17919 115988 1 283 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.301 -0.481 17919 115989 1 283 . 1 1 16 16 GLU CB C 16 29.450 29.450 29.761 -0.311 17919 115990 1 283 . 1 1 16 16 GLU H H 16 8.140 8.140 8.705 -0.565 17919 115991 1 283 . 1 1 17 17 VAL N N 17 117.210 117.210 121.979 -4.769 17919 115992 1 283 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.720 -0.006 17919 115993 1 283 . 1 1 17 17 VAL C C 17 174.160 174.160 174.528 -0.368 17919 115994 1 283 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.687 -1.257 17919 115995 1 283 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.455 0.945 17919 115996 1 283 . 1 1 17 17 VAL H H 17 8.900 8.900 8.709 0.191 17919 115997 1 283 . 1 1 18 18 GLU N N 18 118.990 118.990 121.093 -2.103 17919 115998 1 283 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.680 0.399 17919 115999 1 283 . 1 1 18 18 GLU C C 18 176.160 176.160 175.686 0.474 17919 116000 1 283 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.639 -0.919 17919 116001 1 283 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.526 -0.216 17919 116002 1 283 . 1 1 18 18 GLU H H 18 8.640 8.640 8.684 -0.044 17919 116003 1 283 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.388 -0.247 17919 116004 1 283 . 1 1 19 19 PRO C C 19 175.310 175.310 176.732 -1.422 17919 116005 1 283 . 1 1 19 19 PRO CA C 19 65.470 65.470 64.791 0.679 17919 116006 1 283 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.863 0.087 17919 116007 1 283 . 1 1 20 20 SER N N 20 103.400 103.400 111.627 -8.227 17919 116008 1 283 . 1 1 20 20 SER HA H 20 4.370 4.370 4.480 -0.110 17919 116009 1 283 . 1 1 20 20 SER C C 20 174.660 174.660 174.208 0.452 17919 116010 1 283 . 1 1 20 20 SER CA C 20 57.400 57.400 58.637 -1.237 17919 116011 1 283 . 1 1 20 20 SER CB C 20 63.370 63.370 63.160 0.210 17919 116012 1 283 . 1 1 20 20 SER H H 20 7.040 7.040 8.355 -1.315 17919 116013 1 283 . 1 1 21 21 ASP N N 21 123.480 123.480 123.415 0.065 17919 116014 1 283 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.848 -0.153 17919 116015 1 283 . 1 1 21 21 ASP C C 21 176.360 176.360 175.636 0.724 17919 116016 1 283 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.916 0.784 17919 116017 1 283 . 1 1 21 21 ASP CB C 21 40.800 40.800 42.235 -1.435 17919 116018 1 283 . 1 1 21 21 ASP H H 21 8.030 8.030 7.537 0.493 17919 116019 1 283 . 1 1 22 22 THR N N 22 108.800 108.800 112.433 -3.633 17919 116020 1 283 . 1 1 22 22 THR HA H 22 4.920 4.920 4.959 -0.039 17919 116021 1 283 . 1 1 22 22 THR C C 22 176.750 176.750 176.205 0.545 17919 116022 1 283 . 1 1 22 22 THR CA C 22 59.690 59.690 61.593 -1.903 17919 116023 1 283 . 1 1 22 22 THR CB C 22 71.200 71.200 70.237 0.963 17919 116024 1 283 . 1 1 22 22 THR H H 22 7.900 7.900 8.289 -0.389 17919 116025 1 283 . 1 1 23 23 ILE N N 23 121.190 121.190 122.138 -0.948 17919 116026 1 283 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.896 -0.239 17919 116027 1 283 . 1 1 23 23 ILE C C 23 179.040 179.040 177.829 1.211 17919 116028 1 283 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.455 -0.195 17919 116029 1 283 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.458 -2.108 17919 116030 1 283 . 1 1 23 23 ILE H H 23 8.560 8.560 8.593 -0.033 17919 116031 1 283 . 1 1 24 24 GLU N N 24 120.830 120.830 121.209 -0.379 17919 116032 1 283 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.934 -0.017 17919 116033 1 283 . 1 1 24 24 GLU C C 24 178.640 178.640 178.230 0.410 17919 116034 1 283 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.078 0.142 17919 116035 1 283 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.174 -0.894 17919 116036 1 283 . 1 1 24 24 GLU H H 24 9.760 9.760 8.187 1.573 17919 116037 1 283 . 1 1 25 25 ASN N N 25 120.570 120.570 117.917 2.653 17919 116038 1 283 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.466 0.059 17919 116039 1 283 . 1 1 25 25 ASN C C 25 178.380 178.380 177.741 0.639 17919 116040 1 283 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.245 -0.185 17919 116041 1 283 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.605 -0.155 17919 116042 1 283 . 1 1 25 25 ASN H H 25 7.920 7.920 7.481 0.439 17919 116043 1 283 . 1 1 26 26 VAL N N 26 121.710 121.710 119.909 1.801 17919 116044 1 283 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.566 -0.169 17919 116045 1 283 . 1 1 26 26 VAL C C 26 177.950 177.950 178.077 -0.127 17919 116046 1 283 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.328 1.332 17919 116047 1 283 . 1 1 26 26 VAL CB C 26 30.840 30.840 30.959 -0.119 17919 116048 1 283 . 1 1 26 26 VAL H H 26 8.070 8.070 7.931 0.139 17919 116049 1 283 . 1 1 27 27 LYS N N 27 118.860 118.860 119.450 -0.590 17919 116050 1 283 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.106 0.474 17919 116051 1 283 . 1 1 27 27 LYS C C 27 180.550 180.550 179.267 1.283 17919 116052 1 283 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.624 -0.374 17919 116053 1 283 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.276 1.454 17919 116054 1 283 . 1 1 27 27 LYS H H 27 8.560 8.560 8.414 0.146 17919 116055 1 283 . 1 1 28 28 ALA N N 28 123.440 123.440 121.351 2.089 17919 116056 1 283 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.166 -0.006 17919 116057 1 283 . 1 1 28 28 ALA C C 28 180.300 180.300 179.445 0.855 17919 116058 1 283 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.739 0.631 17919 116059 1 283 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.377 -0.666 17919 116060 1 283 . 1 1 28 28 ALA H H 28 8.060 8.060 8.499 -0.439 17919 116061 1 283 . 1 1 29 29 LYS N N 29 119.940 119.940 118.415 1.525 17919 116062 1 283 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.054 0.153 17919 116063 1 283 . 1 1 29 29 LYS C C 29 180.320 180.320 178.645 1.675 17919 116064 1 283 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.324 0.326 17919 116065 1 283 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.178 1.112 17919 116066 1 283 . 1 1 29 29 LYS H H 29 7.850 7.850 7.684 0.166 17919 116067 1 283 . 1 1 30 30 ILE N N 30 121.080 121.080 119.544 1.536 17919 116068 1 283 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.864 -0.357 17919 116069 1 283 . 1 1 30 30 ILE C C 30 178.310 178.310 177.711 0.599 17919 116070 1 283 . 1 1 30 30 ILE CA C 30 66.150 66.150 64.091 2.059 17919 116071 1 283 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.104 -0.304 17919 116072 1 283 . 1 1 30 30 ILE H H 30 8.280 8.280 7.701 0.579 17919 116073 1 283 . 1 1 31 31 GLN N N 31 123.490 123.490 121.561 1.929 17919 116074 1 283 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.061 -0.232 17919 116075 1 283 . 1 1 31 31 GLN C C 31 178.890 178.890 178.532 0.358 17919 116076 1 283 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.447 0.553 17919 116077 1 283 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.504 -0.784 17919 116078 1 283 . 1 1 31 31 GLN H H 31 8.580 8.580 8.326 0.254 17919 116079 1 283 . 1 1 32 32 ASP N N 32 119.360 119.360 118.566 0.794 17919 116080 1 283 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.432 -0.078 17919 116081 1 283 . 1 1 32 32 ASP C C 32 177.250 177.250 177.761 -0.511 17919 116082 1 283 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.487 0.703 17919 116083 1 283 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.818 -0.238 17919 116084 1 283 . 1 1 32 32 ASP H H 32 8.010 8.010 8.049 -0.039 17919 116085 1 283 . 1 1 33 33 LYS N N 33 115.130 115.130 119.152 -4.022 17919 116086 1 283 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.317 0.020 17919 116087 1 283 . 1 1 33 33 LYS C C 33 177.870 177.870 178.231 -0.361 17919 116088 1 283 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.913 0.137 17919 116089 1 283 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.336 0.834 17919 116090 1 283 . 1 1 33 33 LYS H H 33 7.430 7.430 7.424 0.006 17919 116091 1 283 . 1 1 34 34 GLU N N 34 113.870 113.870 115.656 -1.786 17919 116092 1 283 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.436 0.189 17919 116093 1 283 . 1 1 34 34 GLU C C 34 177.840 177.840 177.444 0.396 17919 116094 1 283 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.205 -1.035 17919 116095 1 283 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.715 0.945 17919 116096 1 283 . 1 1 34 34 GLU H H 34 8.740 8.740 8.301 0.439 17919 116097 1 283 . 1 1 35 35 GLY N N 35 108.650 108.650 108.992 -0.342 17919 116098 1 283 . 1 1 35 35 GLY C C 35 173.960 173.960 174.111 -0.151 17919 116099 1 283 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.630 0.450 17919 116100 1 283 . 1 1 35 35 GLY H H 35 8.530 8.530 8.251 0.279 17919 116101 1 283 . 1 1 36 36 ILE N N 36 119.880 119.880 121.092 -1.212 17919 116102 1 283 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.315 0.130 17919 116103 1 283 . 1 1 36 36 ILE C C 36 173.590 173.590 173.949 -0.359 17919 116104 1 283 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.609 0.141 17919 116105 1 283 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.945 1.635 17919 116106 1 283 . 1 1 36 36 ILE H H 36 6.150 6.150 7.442 -1.292 17919 116107 1 283 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.546 0.088 17919 116108 1 283 . 1 1 37 37 PRO C C 37 176.940 176.940 176.338 0.602 17919 116109 1 283 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.935 -0.275 17919 116110 1 283 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.133 0.717 17919 116111 1 283 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.167 -0.050 17919 116112 1 283 . 1 1 38 38 PRO C C 38 178.320 178.320 177.730 0.590 17919 116113 1 283 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.500 0.760 17919 116114 1 283 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.659 1.231 17919 116115 1 283 . 1 1 39 39 ASP N N 39 113.380 113.380 115.413 -2.033 17919 116116 1 283 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.399 0.031 17919 116117 1 283 . 1 1 39 39 ASP C C 39 177.090 177.090 177.050 0.040 17919 116118 1 283 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.401 -0.761 17919 116119 1 283 . 1 1 39 39 ASP CB C 39 39.540 39.540 39.369 0.171 17919 116120 1 283 . 1 1 39 39 ASP H H 39 8.550 8.550 8.808 -0.258 17919 116121 1 283 . 1 1 40 40 GLN N N 40 116.780 116.780 117.350 -0.570 17919 116122 1 283 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.550 -0.086 17919 116123 1 283 . 1 1 40 40 GLN C C 40 175.380 175.380 175.705 -0.325 17919 116124 1 283 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.591 0.049 17919 116125 1 283 . 1 1 40 40 GLN CB C 40 30.140 30.140 31.013 -0.873 17919 116126 1 283 . 1 1 40 40 GLN H H 40 7.820 7.820 8.024 -0.204 17919 116127 1 283 . 1 1 41 41 GLN N N 41 117.720 117.720 119.833 -2.113 17919 116128 1 283 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.348 -0.104 17919 116129 1 283 . 1 1 41 41 GLN C C 41 176.300 176.300 175.419 0.881 17919 116130 1 283 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.120 0.350 17919 116131 1 283 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.514 2.136 17919 116132 1 283 . 1 1 41 41 GLN H H 41 7.480 7.480 7.378 0.102 17919 116133 1 283 . 1 1 42 42 ARG N N 42 122.680 122.680 126.579 -3.899 17919 116134 1 283 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.613 -0.113 17919 116135 1 283 . 1 1 42 42 ARG C C 42 174.050 174.050 174.261 -0.211 17919 116136 1 283 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.793 0.257 17919 116137 1 283 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.524 -0.774 17919 116138 1 283 . 1 1 42 42 ARG H H 42 8.530 8.530 8.835 -0.305 17919 116139 1 283 . 1 1 43 43 LEU N N 43 124.040 124.040 126.562 -2.522 17919 116140 1 283 . 1 1 43 43 LEU C C 43 175.290 175.290 175.639 -0.349 17919 116141 1 283 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.974 -0.994 17919 116142 1 283 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.935 1.855 17919 116143 1 283 . 1 1 43 43 LEU H H 43 8.820 8.820 8.770 0.050 17919 116144 1 283 . 1 1 44 44 ILE N N 44 121.920 121.920 119.730 2.190 17919 116145 1 283 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.757 0.235 17919 116146 1 283 . 1 1 44 44 ILE C C 44 176.060 176.060 174.763 1.297 17919 116147 1 283 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.798 -1.818 17919 116148 1 283 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.502 -0.082 17919 116149 1 283 . 1 1 44 44 ILE H H 44 9.030 9.030 8.824 0.206 17919 116150 1 283 . 1 1 45 45 PHE N N 45 125.390 125.390 128.370 -2.980 17919 116151 1 283 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.903 0.142 17919 116152 1 283 . 1 1 45 45 PHE C C 45 174.470 174.470 175.566 -1.096 17919 116153 1 283 . 1 1 45 45 PHE CA C 45 57.020 57.020 58.191 -1.171 17919 116154 1 283 . 1 1 45 45 PHE CB C 45 43.760 43.760 41.880 1.880 17919 116155 1 283 . 1 1 45 45 PHE H H 45 8.830 8.830 8.139 0.691 17919 116156 1 283 . 1 1 46 46 ALA N N 46 132.200 132.200 122.196 10.004 17919 116157 1 283 . 1 1 46 46 ALA HA H 46 3.690 3.690 4.531 -0.841 17919 116158 1 283 . 1 1 46 46 ALA C C 46 177.290 177.290 177.280 0.010 17919 116159 1 283 . 1 1 46 46 ALA CA C 46 52.540 52.540 50.876 1.665 17919 116160 1 283 . 1 1 46 46 ALA CB C 46 16.570 16.570 17.505 -0.935 17919 116161 1 283 . 1 1 46 46 ALA H H 46 8.810 8.810 8.438 0.372 17919 116162 1 283 . 1 1 47 47 GLY N N 47 102.340 102.340 106.696 -4.356 17919 116163 1 283 . 1 1 47 47 GLY C C 47 173.810 173.810 173.596 0.214 17919 116164 1 283 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.191 0.159 17919 116165 1 283 . 1 1 47 47 GLY H H 47 8.130 8.130 8.160 -0.030 17919 116166 1 283 . 1 1 48 48 LYS N N 48 121.570 121.570 121.477 0.093 17919 116167 1 283 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.537 0.085 17919 116168 1 283 . 1 1 48 48 LYS C C 48 174.700 174.700 175.294 -0.594 17919 116169 1 283 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.105 -0.555 17919 116170 1 283 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.029 0.501 17919 116171 1 283 . 1 1 48 48 LYS H H 48 7.980 7.980 7.587 0.393 17919 116172 1 283 . 1 1 49 49 GLN N N 49 122.410 122.410 122.549 -0.139 17919 116173 1 283 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.471 0.089 17919 116174 1 283 . 1 1 49 49 GLN C C 49 175.670 175.670 175.243 0.427 17919 116175 1 283 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.192 -0.452 17919 116176 1 283 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.102 -0.102 17919 116177 1 283 . 1 1 49 49 GLN H H 49 8.600 8.600 8.453 0.147 17919 116178 1 283 . 1 1 50 50 LEU N N 50 125.520 125.520 124.194 1.326 17919 116179 1 283 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.222 -0.132 17919 116180 1 283 . 1 1 50 50 LEU C C 50 176.660 176.660 176.852 -0.192 17919 116181 1 283 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.420 -0.180 17919 116182 1 283 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.164 -0.594 17919 116183 1 283 . 1 1 50 50 LEU H H 50 8.530 8.530 8.421 0.110 17919 116184 1 283 . 1 1 51 51 GLU N N 51 122.940 122.940 122.710 0.230 17919 116185 1 283 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.540 -0.052 17919 116186 1 283 . 1 1 51 51 GLU C C 51 175.870 175.870 176.904 -1.034 17919 116187 1 283 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.116 0.844 17919 116188 1 283 . 1 1 51 51 GLU CB C 51 31.570 31.570 30.710 0.859 17919 116189 1 283 . 1 1 51 51 GLU H H 51 8.400 8.400 8.499 -0.099 17919 116190 1 283 . 1 1 52 52 ASP N N 52 120.030 120.030 125.346 -5.316 17919 116191 1 283 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.387 -0.028 17919 116192 1 283 . 1 1 52 52 ASP C C 52 177.330 177.330 177.219 0.111 17919 116193 1 283 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.258 -0.298 17919 116194 1 283 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.826 0.024 17919 116195 1 283 . 1 1 52 52 ASP H H 52 8.160 8.160 8.775 -0.615 17919 116196 1 283 . 1 1 53 53 GLY N N 53 106.660 106.660 105.204 1.456 17919 116197 1 283 . 1 1 53 53 GLY C C 53 174.870 174.870 174.204 0.666 17919 116198 1 283 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.715 0.455 17919 116199 1 283 . 1 1 53 53 GLY H H 53 9.390 9.390 8.408 0.982 17919 116200 1 283 . 1 1 54 54 ARG N N 54 119.050 119.050 120.526 -1.476 17919 116201 1 283 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.746 -0.051 17919 116202 1 283 . 1 1 54 54 ARG C C 54 175.350 175.350 175.326 0.024 17919 116203 1 283 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.482 -0.092 17919 116204 1 283 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.633 -0.983 17919 116205 1 283 . 1 1 54 54 ARG H H 54 7.460 7.460 7.556 -0.096 17919 116206 1 283 . 1 1 55 55 THR N N 55 108.400 108.400 111.525 -3.125 17919 116207 1 283 . 1 1 55 55 THR HA H 55 5.240 5.240 5.028 0.212 17919 116208 1 283 . 1 1 55 55 THR C C 55 176.560 176.560 176.139 0.421 17919 116209 1 283 . 1 1 55 55 THR CA C 55 59.690 59.690 60.353 -0.663 17919 116210 1 283 . 1 1 55 55 THR CB C 55 72.260 72.260 70.833 1.427 17919 116211 1 283 . 1 1 55 55 THR H H 55 8.730 8.730 9.081 -0.351 17919 116212 1 283 . 1 1 56 56 LEU N N 56 117.920 117.920 121.588 -3.668 17919 116213 1 283 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.949 0.111 17919 116214 1 283 . 1 1 56 56 LEU C C 56 180.810 180.810 179.020 1.790 17919 116215 1 283 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.419 0.291 17919 116216 1 283 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.477 -1.107 17919 116217 1 283 . 1 1 56 56 LEU H H 56 8.140 8.140 8.538 -0.398 17919 116218 1 283 . 1 1 57 57 SER N N 57 113.330 113.330 114.551 -1.221 17919 116219 1 283 . 1 1 57 57 SER HA H 57 4.370 4.370 4.184 0.186 17919 116220 1 283 . 1 1 57 57 SER C C 57 178.310 178.310 176.764 1.546 17919 116221 1 283 . 1 1 57 57 SER CA C 57 61.080 61.080 61.801 -0.721 17919 116222 1 283 . 1 1 57 57 SER CB C 57 62.530 62.530 62.459 0.071 17919 116223 1 283 . 1 1 57 57 SER H H 57 8.470 8.470 8.110 0.360 17919 116224 1 283 . 1 1 58 58 ASP N N 58 124.190 124.190 120.603 3.587 17919 116225 1 283 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.311 -0.015 17919 116226 1 283 . 1 1 58 58 ASP C C 58 177.400 177.400 176.448 0.952 17919 116227 1 283 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.301 0.879 17919 116228 1 283 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.350 -0.251 17919 116229 1 283 . 1 1 58 58 ASP H H 58 7.930 7.930 7.734 0.196 17919 116230 1 283 . 1 1 59 59 TYR N N 59 115.510 115.510 115.881 -0.371 17919 116231 1 283 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.626 0.044 17919 116232 1 283 . 1 1 59 59 TYR C C 59 174.700 174.700 174.607 0.093 17919 116233 1 283 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.048 1.202 17919 116234 1 283 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.680 1.390 17919 116235 1 283 . 1 1 59 59 TYR H H 59 7.250 7.250 7.297 -0.047 17919 116236 1 283 . 1 1 60 60 ASN N N 60 115.900 115.900 116.706 -0.806 17919 116237 1 283 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.383 -0.028 17919 116238 1 283 . 1 1 60 60 ASN C C 60 174.340 174.340 174.437 -0.097 17919 116239 1 283 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.481 -0.361 17919 116240 1 283 . 1 1 60 60 ASN CB C 60 37.410 37.410 36.691 0.719 17919 116241 1 283 . 1 1 60 60 ASN H H 60 8.150 8.150 8.165 -0.015 17919 116242 1 283 . 1 1 61 61 ILE N N 61 118.600 118.600 119.474 -0.874 17919 116243 1 283 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.921 -0.528 17919 116244 1 283 . 1 1 61 61 ILE C C 61 174.610 174.610 174.937 -0.327 17919 116245 1 283 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.151 1.268 17919 116246 1 283 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.776 -1.036 17919 116247 1 283 . 1 1 61 61 ILE H H 61 7.250 7.250 7.637 -0.387 17919 116248 1 283 . 1 1 62 62 GLN N N 62 124.740 124.740 125.054 -0.314 17919 116249 1 283 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.872 -0.366 17919 116250 1 283 . 1 1 62 62 GLN C C 62 175.970 175.970 175.432 0.538 17919 116251 1 283 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.149 0.511 17919 116252 1 283 . 1 1 62 62 GLN CB C 62 31.650 31.650 32.310 -0.660 17919 116253 1 283 . 1 1 62 62 GLN H H 62 7.610 7.610 7.763 -0.153 17919 116254 1 283 . 1 1 63 63 LYS N N 63 120.300 120.300 120.226 0.074 17919 116255 1 283 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.093 -0.092 17919 116256 1 283 . 1 1 63 63 LYS C C 63 175.810 175.810 177.449 -1.639 17919 116257 1 283 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.747 0.043 17919 116258 1 283 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.973 0.677 17919 116259 1 283 . 1 1 63 63 LYS H H 63 8.490 8.490 8.606 -0.116 17919 116260 1 283 . 1 1 64 64 GLU N N 64 113.950 113.950 120.042 -6.092 17919 116261 1 283 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.342 0.123 17919 116262 1 283 . 1 1 64 64 GLU C C 64 175.250 175.250 176.281 -1.031 17919 116263 1 283 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.356 0.534 17919 116264 1 283 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.518 -2.618 17919 116265 1 283 . 1 1 64 64 GLU H H 64 9.280 9.280 8.424 0.856 17919 116266 1 283 . 1 1 65 65 SER N N 65 114.730 114.730 114.566 0.164 17919 116267 1 283 . 1 1 65 65 SER HA H 65 4.640 4.640 4.527 0.113 17919 116268 1 283 . 1 1 65 65 SER C C 65 172.160 172.160 173.514 -1.354 17919 116269 1 283 . 1 1 65 65 SER CA C 65 60.890 60.890 60.518 0.372 17919 116270 1 283 . 1 1 65 65 SER CB C 65 64.910 64.910 64.381 0.529 17919 116271 1 283 . 1 1 65 65 SER H H 65 7.670 7.670 7.298 0.372 17919 116272 1 283 . 1 1 66 66 THR N N 66 117.110 117.110 119.291 -2.181 17919 116273 1 283 . 1 1 66 66 THR HA H 66 5.270 5.270 5.267 0.003 17919 116274 1 283 . 1 1 66 66 THR C C 66 173.950 173.950 174.390 -0.440 17919 116275 1 283 . 1 1 66 66 THR CA C 66 62.340 62.340 61.822 0.518 17919 116276 1 283 . 1 1 66 66 THR CB C 66 70.080 70.080 70.647 -0.567 17919 116277 1 283 . 1 1 66 66 THR H H 66 8.730 8.730 8.628 0.102 17919 116278 1 283 . 1 1 67 67 LEU N N 67 127.110 127.110 127.168 -0.058 17919 116279 1 283 . 1 1 67 67 LEU HA H 67 5.060 5.060 5.074 -0.014 17919 116280 1 283 . 1 1 67 67 LEU C C 67 175.770 175.770 175.313 0.457 17919 116281 1 283 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.909 -0.009 17919 116282 1 283 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.767 -0.507 17919 116283 1 283 . 1 1 67 67 LEU H H 67 9.410 9.410 9.238 0.172 17919 116284 1 283 . 1 1 68 68 HIS N N 68 118.380 118.380 122.346 -3.966 17919 116285 1 283 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.348 -0.108 17919 116286 1 283 . 1 1 68 68 HIS C C 68 173.150 173.150 173.453 -0.303 17919 116287 1 283 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.481 0.519 17919 116288 1 283 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.606 -2.076 17919 116289 1 283 . 1 1 68 68 HIS H H 68 9.230 9.230 9.235 -0.005 17919 116290 1 283 . 1 1 69 69 LEU N N 69 124.460 124.460 129.577 -5.117 17919 116291 1 283 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.191 -0.001 17919 116292 1 283 . 1 1 69 69 LEU C C 69 175.270 175.270 174.110 1.160 17919 116293 1 283 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.078 0.812 17919 116294 1 283 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.505 -0.125 17919 116295 1 283 . 1 1 69 69 LEU H H 69 8.340 8.340 7.997 0.343 17919 116296 1 283 . 1 1 70 70 VAL N N 70 126.940 126.940 121.522 5.418 17919 116297 1 283 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.631 -0.281 17919 116298 1 283 . 1 1 70 70 VAL C C 70 174.000 174.000 173.719 0.281 17919 116299 1 283 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.325 1.476 17919 116300 1 283 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.968 -1.058 17919 116301 1 283 . 1 1 70 70 VAL H H 70 9.200 9.200 9.144 0.056 17919 116302 1 283 . 1 1 71 71 LEU N N 71 123.130 123.130 124.178 -1.048 17919 116303 1 283 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.798 0.262 17919 116304 1 283 . 1 1 71 71 LEU C C 71 177.830 177.830 177.385 0.445 17919 116305 1 283 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.523 0.417 17919 116306 1 283 . 1 1 71 71 LEU CB C 71 42.850 42.850 41.841 1.009 17919 116307 1 283 . 1 1 71 71 LEU H H 71 8.120 8.120 8.542 -0.422 17919 116308 1 283 . 1 1 72 72 ARG N N 72 123.490 123.490 127.286 -3.796 17919 116309 1 283 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.325 -0.024 17919 116310 1 283 . 1 1 72 72 ARG C C 72 175.350 175.350 175.171 0.179 17919 116311 1 283 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.363 -0.753 17919 116312 1 283 . 1 1 72 72 ARG CB C 72 31.350 31.350 29.579 1.771 17919 116313 1 283 . 1 1 72 72 ARG H H 72 8.580 8.580 8.196 0.384 17919 116314 1 284 . 1 1 2 2 GLN N N 2 123.220 123.220 121.113 2.107 17919 116315 1 284 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.197 0.052 17919 116316 1 284 . 1 1 2 2 GLN C C 2 175.920 175.920 174.532 1.388 17919 116317 1 284 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.273 0.807 17919 116318 1 284 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.450 0.310 17919 116319 1 284 . 1 1 2 2 GLN H H 2 8.900 8.900 8.330 0.570 17919 116320 1 284 . 1 1 3 3 ILE N N 3 115.340 115.340 118.641 -3.301 17919 116321 1 284 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.519 -0.306 17919 116322 1 284 . 1 1 3 3 ILE C C 3 172.450 172.450 173.291 -0.841 17919 116323 1 284 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.063 0.506 17919 116324 1 284 . 1 1 3 3 ILE CB C 3 42.210 42.210 42.068 0.142 17919 116325 1 284 . 1 1 3 3 ILE H H 3 8.320 8.320 8.932 -0.612 17919 116326 1 284 . 1 1 4 4 PHE N N 4 118.110 118.110 120.109 -1.999 17919 116327 1 284 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.392 0.238 17919 116328 1 284 . 1 1 4 4 PHE C C 4 175.320 175.320 175.180 0.140 17919 116329 1 284 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.599 -0.389 17919 116330 1 284 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.115 0.364 17919 116331 1 284 . 1 1 4 4 PHE H H 4 8.610 8.610 8.517 0.093 17919 116332 1 284 . 1 1 5 5 VAL N N 5 121.000 121.000 122.674 -1.674 17919 116333 1 284 . 1 1 5 5 VAL HA H 5 4.725 4.725 5.037 -0.312 17919 116334 1 284 . 1 1 5 5 VAL C C 5 174.870 174.870 174.756 0.114 17919 116335 1 284 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.046 -0.426 17919 116336 1 284 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.346 -0.116 17919 116337 1 284 . 1 1 5 5 VAL H H 5 9.300 9.300 9.215 0.085 17919 116338 1 284 . 1 1 6 6 LYS N N 6 127.520 127.520 127.414 0.106 17919 116339 1 284 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.400 -0.033 17919 116340 1 284 . 1 1 6 6 LYS C C 6 177.140 177.140 176.674 0.466 17919 116341 1 284 . 1 1 6 6 LYS CA C 6 54.520 54.520 53.909 0.611 17919 116342 1 284 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.988 0.062 17919 116343 1 284 . 1 1 6 6 LYS H H 6 8.820 8.820 9.023 -0.203 17919 116344 1 284 . 1 1 7 7 THR N N 7 115.400 115.400 116.359 -0.959 17919 116345 1 284 . 1 1 7 7 THR HA H 7 4.970 4.970 4.392 0.578 17919 116346 1 284 . 1 1 7 7 THR C C 7 176.910 176.910 176.117 0.793 17919 116347 1 284 . 1 1 7 7 THR CA C 7 60.470 60.470 61.560 -1.091 17919 116348 1 284 . 1 1 7 7 THR CB C 7 70.630 70.630 70.047 0.583 17919 116349 1 284 . 1 1 7 7 THR H H 7 8.730 8.730 9.082 -0.352 17919 116350 1 284 . 1 1 8 8 LEU N N 8 121.330 121.330 122.477 -1.147 17919 116351 1 284 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.631 -0.321 17919 116352 1 284 . 1 1 8 8 LEU C C 8 178.800 178.800 176.842 1.958 17919 116353 1 284 . 1 1 8 8 LEU CA C 8 57.580 57.580 56.578 1.002 17919 116354 1 284 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.172 -0.202 17919 116355 1 284 . 1 1 8 8 LEU H H 8 9.100 9.100 8.464 0.636 17919 116356 1 284 . 1 1 9 9 THR N N 9 105.590 105.590 107.971 -2.381 17919 116357 1 284 . 1 1 9 9 THR HA H 9 4.428 4.428 4.402 0.026 17919 116358 1 284 . 1 1 9 9 THR C C 9 175.520 175.520 175.257 0.263 17919 116359 1 284 . 1 1 9 9 THR CA C 9 61.400 61.400 60.607 0.793 17919 116360 1 284 . 1 1 9 9 THR CB C 9 69.140 69.140 67.981 1.159 17919 116361 1 284 . 1 1 9 9 THR H H 9 7.630 7.630 7.506 0.124 17919 116362 1 284 . 1 1 10 10 GLY N N 10 108.890 108.890 110.155 -1.265 17919 116363 1 284 . 1 1 10 10 GLY C C 10 174.070 174.070 173.351 0.719 17919 116364 1 284 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.247 0.213 17919 116365 1 284 . 1 1 10 10 GLY H H 10 7.810 7.810 7.624 0.186 17919 116366 1 284 . 1 1 11 11 LYS N N 11 121.600 121.600 120.258 1.342 17919 116367 1 284 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.726 -0.365 17919 116368 1 284 . 1 1 11 11 LYS C C 11 175.940 175.940 174.968 0.972 17919 116369 1 284 . 1 1 11 11 LYS CA C 11 56.280 56.280 54.455 1.825 17919 116370 1 284 . 1 1 11 11 LYS CB C 11 33.200 33.200 35.338 -2.138 17919 116371 1 284 . 1 1 11 11 LYS H H 11 7.280 7.280 8.027 -0.747 17919 116372 1 284 . 1 1 12 12 THR N N 12 120.440 120.440 120.353 0.087 17919 116373 1 284 . 1 1 12 12 THR HA H 12 5.046 5.046 5.054 -0.008 17919 116374 1 284 . 1 1 12 12 THR C C 12 174.320 174.320 174.198 0.122 17919 116375 1 284 . 1 1 12 12 THR CA C 12 62.390 62.390 61.497 0.893 17919 116376 1 284 . 1 1 12 12 THR CB C 12 69.910 69.910 70.090 -0.180 17919 116377 1 284 . 1 1 12 12 THR H H 12 8.650 8.650 8.445 0.205 17919 116378 1 284 . 1 1 13 13 ILE N N 13 127.110 127.110 122.122 4.988 17919 116379 1 284 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.747 -0.203 17919 116380 1 284 . 1 1 13 13 ILE C C 13 175.220 175.220 173.908 1.312 17919 116381 1 284 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.221 0.759 17919 116382 1 284 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.582 0.368 17919 116383 1 284 . 1 1 13 13 ILE H H 13 9.450 9.450 9.135 0.315 17919 116384 1 284 . 1 1 14 14 THR N N 14 121.520 121.520 119.733 1.787 17919 116385 1 284 . 1 1 14 14 THR HA H 14 4.964 4.964 5.339 -0.375 17919 116386 1 284 . 1 1 14 14 THR C C 14 173.790 173.790 173.486 0.304 17919 116387 1 284 . 1 1 14 14 THR CA C 14 61.940 61.940 61.818 0.122 17919 116388 1 284 . 1 1 14 14 THR CB C 14 69.650 69.650 70.319 -0.669 17919 116389 1 284 . 1 1 14 14 THR H H 14 8.710 8.710 8.369 0.341 17919 116390 1 284 . 1 1 15 15 LEU N N 15 124.800 124.800 125.511 -0.711 17919 116391 1 284 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.775 0.005 17919 116392 1 284 . 1 1 15 15 LEU C C 15 174.670 174.670 174.628 0.042 17919 116393 1 284 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.224 -0.393 17919 116394 1 284 . 1 1 15 15 LEU CB C 15 47.070 47.070 46.145 0.924 17919 116395 1 284 . 1 1 15 15 LEU H H 15 8.710 8.710 8.595 0.115 17919 116396 1 284 . 1 1 16 16 GLU N N 16 122.160 122.160 122.491 -0.331 17919 116397 1 284 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.232 -0.315 17919 116398 1 284 . 1 1 16 16 GLU C C 16 175.860 175.860 175.654 0.206 17919 116399 1 284 . 1 1 16 16 GLU CA C 16 54.820 54.820 54.909 -0.089 17919 116400 1 284 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.100 -0.650 17919 116401 1 284 . 1 1 16 16 GLU H H 16 8.140 8.140 8.464 -0.324 17919 116402 1 284 . 1 1 17 17 VAL N N 17 117.210 117.210 116.137 1.073 17919 116403 1 284 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.731 -0.017 17919 116404 1 284 . 1 1 17 17 VAL C C 17 174.160 174.160 174.943 -0.783 17919 116405 1 284 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.416 -0.987 17919 116406 1 284 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.404 0.997 17919 116407 1 284 . 1 1 17 17 VAL H H 17 8.900 8.900 8.679 0.221 17919 116408 1 284 . 1 1 18 18 GLU N N 18 118.990 118.990 120.397 -1.407 17919 116409 1 284 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.838 0.241 17919 116410 1 284 . 1 1 18 18 GLU C C 18 176.160 176.160 176.104 0.056 17919 116411 1 284 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.447 0.273 17919 116412 1 284 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.813 -0.503 17919 116413 1 284 . 1 1 18 18 GLU H H 18 8.640 8.640 8.590 0.050 17919 116414 1 284 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.307 -0.166 17919 116415 1 284 . 1 1 19 19 PRO C C 19 175.310 175.310 178.028 -2.718 17919 116416 1 284 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.085 0.385 17919 116417 1 284 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.229 -0.279 17919 116418 1 284 . 1 1 20 20 SER N N 20 103.400 103.400 112.118 -8.718 17919 116419 1 284 . 1 1 20 20 SER HA H 20 4.370 4.370 4.277 0.093 17919 116420 1 284 . 1 1 20 20 SER C C 20 174.660 174.660 174.026 0.634 17919 116421 1 284 . 1 1 20 20 SER CA C 20 57.400 57.400 59.058 -1.658 17919 116422 1 284 . 1 1 20 20 SER CB C 20 63.370 63.370 62.839 0.531 17919 116423 1 284 . 1 1 20 20 SER H H 20 7.040 7.040 8.262 -1.222 17919 116424 1 284 . 1 1 21 21 ASP N N 21 123.480 123.480 122.365 1.115 17919 116425 1 284 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.818 -0.123 17919 116426 1 284 . 1 1 21 21 ASP C C 21 176.360 176.360 175.923 0.437 17919 116427 1 284 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.574 1.126 17919 116428 1 284 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.852 -1.052 17919 116429 1 284 . 1 1 21 21 ASP H H 21 8.030 8.030 7.662 0.368 17919 116430 1 284 . 1 1 22 22 THR N N 22 108.800 108.800 113.908 -5.108 17919 116431 1 284 . 1 1 22 22 THR HA H 22 4.920 4.920 4.931 -0.011 17919 116432 1 284 . 1 1 22 22 THR C C 22 176.750 176.750 176.516 0.234 17919 116433 1 284 . 1 1 22 22 THR CA C 22 59.690 59.690 61.925 -2.235 17919 116434 1 284 . 1 1 22 22 THR CB C 22 71.200 71.200 70.823 0.377 17919 116435 1 284 . 1 1 22 22 THR H H 22 7.900 7.900 8.227 -0.327 17919 116436 1 284 . 1 1 23 23 ILE N N 23 121.190 121.190 123.184 -1.994 17919 116437 1 284 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.788 -0.131 17919 116438 1 284 . 1 1 23 23 ILE C C 23 179.040 179.040 177.967 1.073 17919 116439 1 284 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.113 -0.853 17919 116440 1 284 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.384 -2.034 17919 116441 1 284 . 1 1 23 23 ILE H H 23 8.560 8.560 8.549 0.011 17919 116442 1 284 . 1 1 24 24 GLU N N 24 120.830 120.830 120.958 -0.128 17919 116443 1 284 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.834 0.083 17919 116444 1 284 . 1 1 24 24 GLU C C 24 178.640 178.640 178.516 0.124 17919 116445 1 284 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.122 0.098 17919 116446 1 284 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.411 -1.131 17919 116447 1 284 . 1 1 24 24 GLU H H 24 9.760 9.760 8.310 1.450 17919 116448 1 284 . 1 1 25 25 ASN N N 25 120.570 120.570 118.014 2.556 17919 116449 1 284 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.470 0.055 17919 116450 1 284 . 1 1 25 25 ASN C C 25 178.380 178.380 177.900 0.480 17919 116451 1 284 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.250 -0.190 17919 116452 1 284 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.591 -0.141 17919 116453 1 284 . 1 1 25 25 ASN H H 25 7.920 7.920 7.610 0.310 17919 116454 1 284 . 1 1 26 26 VAL N N 26 121.710 121.710 119.381 2.329 17919 116455 1 284 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.674 -0.277 17919 116456 1 284 . 1 1 26 26 VAL C C 26 177.950 177.950 178.124 -0.174 17919 116457 1 284 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.076 1.584 17919 116458 1 284 . 1 1 26 26 VAL CB C 26 30.840 30.840 30.790 0.050 17919 116459 1 284 . 1 1 26 26 VAL H H 26 8.070 8.070 8.201 -0.131 17919 116460 1 284 . 1 1 27 27 LYS N N 27 118.860 118.860 120.111 -1.251 17919 116461 1 284 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.281 0.299 17919 116462 1 284 . 1 1 27 27 LYS C C 27 180.550 180.550 179.057 1.493 17919 116463 1 284 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.668 -0.418 17919 116464 1 284 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.151 1.579 17919 116465 1 284 . 1 1 27 27 LYS H H 27 8.560 8.560 8.356 0.204 17919 116466 1 284 . 1 1 28 28 ALA N N 28 123.440 123.440 121.743 1.697 17919 116467 1 284 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.277 -0.117 17919 116468 1 284 . 1 1 28 28 ALA C C 28 180.300 180.300 179.016 1.284 17919 116469 1 284 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.411 0.959 17919 116470 1 284 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.488 -0.778 17919 116471 1 284 . 1 1 28 28 ALA H H 28 8.060 8.060 8.118 -0.058 17919 116472 1 284 . 1 1 29 29 LYS N N 29 119.940 119.940 119.872 0.068 17919 116473 1 284 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.056 0.151 17919 116474 1 284 . 1 1 29 29 LYS C C 29 180.320 180.320 179.063 1.257 17919 116475 1 284 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.414 0.236 17919 116476 1 284 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.334 0.957 17919 116477 1 284 . 1 1 29 29 LYS H H 29 7.850 7.850 7.865 -0.015 17919 116478 1 284 . 1 1 30 30 ILE N N 30 121.080 121.080 121.035 0.045 17919 116479 1 284 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.623 -0.116 17919 116480 1 284 . 1 1 30 30 ILE C C 30 178.310 178.310 177.432 0.878 17919 116481 1 284 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.334 0.816 17919 116482 1 284 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.722 -0.922 17919 116483 1 284 . 1 1 30 30 ILE H H 30 8.280 8.280 8.225 0.055 17919 116484 1 284 . 1 1 31 31 GLN N N 31 123.490 123.490 120.581 2.909 17919 116485 1 284 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.055 -0.226 17919 116486 1 284 . 1 1 31 31 GLN C C 31 178.890 178.890 178.385 0.505 17919 116487 1 284 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.331 0.669 17919 116488 1 284 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.473 -0.753 17919 116489 1 284 . 1 1 31 31 GLN H H 31 8.580 8.580 8.101 0.479 17919 116490 1 284 . 1 1 32 32 ASP N N 32 119.360 119.360 119.823 -0.463 17919 116491 1 284 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.365 -0.011 17919 116492 1 284 . 1 1 32 32 ASP C C 32 177.250 177.250 177.889 -0.639 17919 116493 1 284 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.929 0.261 17919 116494 1 284 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.844 -0.264 17919 116495 1 284 . 1 1 32 32 ASP H H 32 8.010 8.010 8.351 -0.341 17919 116496 1 284 . 1 1 33 33 LYS N N 33 115.130 115.130 117.574 -2.444 17919 116497 1 284 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.209 0.128 17919 116498 1 284 . 1 1 33 33 LYS C C 33 177.870 177.870 177.882 -0.012 17919 116499 1 284 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.489 -0.439 17919 116500 1 284 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.179 0.991 17919 116501 1 284 . 1 1 33 33 LYS H H 33 7.430 7.430 7.658 -0.228 17919 116502 1 284 . 1 1 34 34 GLU N N 34 113.870 113.870 114.162 -0.292 17919 116503 1 284 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.458 0.167 17919 116504 1 284 . 1 1 34 34 GLU C C 34 177.840 177.840 176.839 1.001 17919 116505 1 284 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.107 -0.937 17919 116506 1 284 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.963 0.697 17919 116507 1 284 . 1 1 34 34 GLU H H 34 8.740 8.740 8.152 0.588 17919 116508 1 284 . 1 1 35 35 GLY N N 35 108.650 108.650 108.174 0.476 17919 116509 1 284 . 1 1 35 35 GLY C C 35 173.960 173.960 174.237 -0.277 17919 116510 1 284 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.384 0.696 17919 116511 1 284 . 1 1 35 35 GLY H H 35 8.530 8.530 8.412 0.118 17919 116512 1 284 . 1 1 36 36 ILE N N 36 119.880 119.880 123.028 -3.148 17919 116513 1 284 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.325 0.120 17919 116514 1 284 . 1 1 36 36 ILE C C 36 173.590 173.590 174.150 -0.560 17919 116515 1 284 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.677 -0.927 17919 116516 1 284 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.379 2.201 17919 116517 1 284 . 1 1 36 36 ILE H H 36 6.150 6.150 7.848 -1.698 17919 116518 1 284 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.653 -0.019 17919 116519 1 284 . 1 1 37 37 PRO C C 37 176.940 176.940 176.158 0.782 17919 116520 1 284 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.903 -0.243 17919 116521 1 284 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.347 0.503 17919 116522 1 284 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.251 -0.134 17919 116523 1 284 . 1 1 38 38 PRO C C 38 178.320 178.320 178.670 -0.350 17919 116524 1 284 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.398 0.862 17919 116525 1 284 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.862 1.028 17919 116526 1 284 . 1 1 39 39 ASP N N 39 113.380 113.380 119.279 -5.899 17919 116527 1 284 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.335 0.095 17919 116528 1 284 . 1 1 39 39 ASP C C 39 177.090 177.090 177.907 -0.817 17919 116529 1 284 . 1 1 39 39 ASP CA C 39 55.640 55.640 57.105 -1.465 17919 116530 1 284 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.602 -1.062 17919 116531 1 284 . 1 1 39 39 ASP H H 39 8.550 8.550 8.628 -0.078 17919 116532 1 284 . 1 1 40 40 GLN N N 40 116.780 116.780 116.764 0.016 17919 116533 1 284 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.312 0.152 17919 116534 1 284 . 1 1 40 40 GLN C C 40 175.380 175.380 175.857 -0.477 17919 116535 1 284 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.989 -0.349 17919 116536 1 284 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.266 0.874 17919 116537 1 284 . 1 1 40 40 GLN H H 40 7.820 7.820 7.798 0.022 17919 116538 1 284 . 1 1 41 41 GLN N N 41 117.720 117.720 118.390 -0.670 17919 116539 1 284 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.655 -0.411 17919 116540 1 284 . 1 1 41 41 GLN C C 41 176.300 176.300 175.333 0.967 17919 116541 1 284 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.836 0.634 17919 116542 1 284 . 1 1 41 41 GLN CB C 41 31.650 31.650 30.673 0.977 17919 116543 1 284 . 1 1 41 41 GLN H H 41 7.480 7.480 7.278 0.202 17919 116544 1 284 . 1 1 42 42 ARG N N 42 122.680 122.680 121.057 1.623 17919 116545 1 284 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.712 -0.212 17919 116546 1 284 . 1 1 42 42 ARG C C 42 174.050 174.050 174.252 -0.202 17919 116547 1 284 . 1 1 42 42 ARG CA C 42 55.050 55.050 53.292 1.758 17919 116548 1 284 . 1 1 42 42 ARG CB C 42 31.750 31.750 34.198 -2.448 17919 116549 1 284 . 1 1 42 42 ARG H H 42 8.530 8.530 8.291 0.239 17919 116550 1 284 . 1 1 43 43 LEU N N 43 124.040 124.040 123.726 0.314 17919 116551 1 284 . 1 1 43 43 LEU C C 43 175.290 175.290 175.511 -0.221 17919 116552 1 284 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.622 -0.642 17919 116553 1 284 . 1 1 43 43 LEU CB C 43 45.790 45.790 45.098 0.692 17919 116554 1 284 . 1 1 43 43 LEU H H 43 8.820 8.820 8.757 0.063 17919 116555 1 284 . 1 1 44 44 ILE N N 44 121.920 121.920 122.042 -0.122 17919 116556 1 284 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.244 -0.252 17919 116557 1 284 . 1 1 44 44 ILE C C 44 176.060 176.060 174.690 1.370 17919 116558 1 284 . 1 1 44 44 ILE CA C 44 58.980 58.980 58.653 0.327 17919 116559 1 284 . 1 1 44 44 ILE CB C 44 41.420 41.420 39.087 2.333 17919 116560 1 284 . 1 1 44 44 ILE H H 44 9.030 9.030 9.012 0.018 17919 116561 1 284 . 1 1 45 45 PHE N N 45 125.390 125.390 128.008 -2.618 17919 116562 1 284 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.900 0.145 17919 116563 1 284 . 1 1 45 45 PHE C C 45 174.470 174.470 174.310 0.160 17919 116564 1 284 . 1 1 45 45 PHE CA C 45 57.020 57.020 57.023 -0.003 17919 116565 1 284 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.685 1.075 17919 116566 1 284 . 1 1 45 45 PHE H H 45 8.830 8.830 8.777 0.053 17919 116567 1 284 . 1 1 46 46 ALA N N 46 132.200 132.200 130.245 1.955 17919 116568 1 284 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.650 0.040 17919 116569 1 284 . 1 1 46 46 ALA C C 46 177.290 177.290 177.395 -0.105 17919 116570 1 284 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.067 0.473 17919 116571 1 284 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.520 0.050 17919 116572 1 284 . 1 1 46 46 ALA H H 46 8.810 8.810 8.648 0.162 17919 116573 1 284 . 1 1 47 47 GLY N N 47 102.340 102.340 106.150 -3.810 17919 116574 1 284 . 1 1 47 47 GLY C C 47 173.810 173.810 174.348 -0.538 17919 116575 1 284 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.772 0.578 17919 116576 1 284 . 1 1 47 47 GLY H H 47 8.130 8.130 8.463 -0.333 17919 116577 1 284 . 1 1 48 48 LYS N N 48 121.570 121.570 122.610 -1.040 17919 116578 1 284 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.531 0.091 17919 116579 1 284 . 1 1 48 48 LYS C C 48 174.700 174.700 175.408 -0.708 17919 116580 1 284 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.292 -0.742 17919 116581 1 284 . 1 1 48 48 LYS CB C 48 34.530 34.530 33.968 0.562 17919 116582 1 284 . 1 1 48 48 LYS H H 48 7.980 7.980 7.564 0.416 17919 116583 1 284 . 1 1 49 49 GLN N N 49 122.410 122.410 122.968 -0.558 17919 116584 1 284 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.548 0.012 17919 116585 1 284 . 1 1 49 49 GLN C C 49 175.670 175.670 176.145 -0.475 17919 116586 1 284 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.888 -0.148 17919 116587 1 284 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.044 -0.044 17919 116588 1 284 . 1 1 49 49 GLN H H 49 8.600 8.600 8.491 0.109 17919 116589 1 284 . 1 1 50 50 LEU N N 50 125.520 125.520 127.370 -1.850 17919 116590 1 284 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.149 -0.059 17919 116591 1 284 . 1 1 50 50 LEU C C 50 176.660 176.660 176.696 -0.036 17919 116592 1 284 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.740 -0.500 17919 116593 1 284 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.070 -0.500 17919 116594 1 284 . 1 1 50 50 LEU H H 50 8.530 8.530 8.403 0.127 17919 116595 1 284 . 1 1 51 51 GLU N N 51 122.940 122.940 121.899 1.041 17919 116596 1 284 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.551 -0.063 17919 116597 1 284 . 1 1 51 51 GLU C C 51 175.870 175.870 176.676 -0.806 17919 116598 1 284 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.399 0.561 17919 116599 1 284 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.679 -0.109 17919 116600 1 284 . 1 1 51 51 GLU H H 51 8.400 8.400 8.441 -0.041 17919 116601 1 284 . 1 1 52 52 ASP N N 52 120.030 120.030 128.132 -8.102 17919 116602 1 284 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.464 -0.105 17919 116603 1 284 . 1 1 52 52 ASP C C 52 177.330 177.330 177.082 0.248 17919 116604 1 284 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.396 -0.436 17919 116605 1 284 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.794 0.056 17919 116606 1 284 . 1 1 52 52 ASP H H 52 8.160 8.160 8.842 -0.682 17919 116607 1 284 . 1 1 53 53 GLY N N 53 106.660 106.660 105.278 1.382 17919 116608 1 284 . 1 1 53 53 GLY C C 53 174.870 174.870 174.161 0.709 17919 116609 1 284 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.039 0.131 17919 116610 1 284 . 1 1 53 53 GLY H H 53 9.390 9.390 8.474 0.916 17919 116611 1 284 . 1 1 54 54 ARG N N 54 119.050 119.050 119.736 -0.686 17919 116612 1 284 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.626 0.069 17919 116613 1 284 . 1 1 54 54 ARG C C 54 175.350 175.350 175.023 0.327 17919 116614 1 284 . 1 1 54 54 ARG CA C 54 54.390 54.390 53.955 0.435 17919 116615 1 284 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.494 -0.844 17919 116616 1 284 . 1 1 54 54 ARG H H 54 7.460 7.460 7.599 -0.139 17919 116617 1 284 . 1 1 55 55 THR N N 55 108.400 108.400 111.451 -3.051 17919 116618 1 284 . 1 1 55 55 THR HA H 55 5.240 5.240 4.981 0.259 17919 116619 1 284 . 1 1 55 55 THR C C 55 176.560 176.560 176.400 0.160 17919 116620 1 284 . 1 1 55 55 THR CA C 55 59.690 59.690 59.758 -0.068 17919 116621 1 284 . 1 1 55 55 THR CB C 55 72.260 72.260 70.949 1.311 17919 116622 1 284 . 1 1 55 55 THR H H 55 8.730 8.730 8.722 0.008 17919 116623 1 284 . 1 1 56 56 LEU N N 56 117.920 117.920 121.312 -3.392 17919 116624 1 284 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.933 0.127 17919 116625 1 284 . 1 1 56 56 LEU C C 56 180.810 180.810 178.846 1.964 17919 116626 1 284 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.476 0.234 17919 116627 1 284 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.163 -0.793 17919 116628 1 284 . 1 1 56 56 LEU H H 56 8.140 8.140 8.960 -0.820 17919 116629 1 284 . 1 1 57 57 SER N N 57 113.330 113.330 114.256 -0.926 17919 116630 1 284 . 1 1 57 57 SER HA H 57 4.370 4.370 4.208 0.162 17919 116631 1 284 . 1 1 57 57 SER C C 57 178.310 178.310 177.126 1.184 17919 116632 1 284 . 1 1 57 57 SER CA C 57 61.080 61.080 61.524 -0.444 17919 116633 1 284 . 1 1 57 57 SER CB C 57 62.530 62.530 62.389 0.141 17919 116634 1 284 . 1 1 57 57 SER H H 57 8.470 8.470 8.186 0.284 17919 116635 1 284 . 1 1 58 58 ASP N N 58 124.190 124.190 123.933 0.257 17919 116636 1 284 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.297 -0.001 17919 116637 1 284 . 1 1 58 58 ASP C C 58 177.400 177.400 176.803 0.597 17919 116638 1 284 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.683 0.497 17919 116639 1 284 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.237 -0.137 17919 116640 1 284 . 1 1 58 58 ASP H H 58 7.930 7.930 7.884 0.046 17919 116641 1 284 . 1 1 59 59 TYR N N 59 115.510 115.510 114.665 0.845 17919 116642 1 284 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.575 0.095 17919 116643 1 284 . 1 1 59 59 TYR C C 59 174.700 174.700 175.569 -0.869 17919 116644 1 284 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.088 1.162 17919 116645 1 284 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.313 1.757 17919 116646 1 284 . 1 1 59 59 TYR H H 59 7.250 7.250 7.165 0.085 17919 116647 1 284 . 1 1 60 60 ASN N N 60 115.900 115.900 117.622 -1.722 17919 116648 1 284 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.394 -0.039 17919 116649 1 284 . 1 1 60 60 ASN C C 60 174.340 174.340 174.663 -0.323 17919 116650 1 284 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.291 -0.171 17919 116651 1 284 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.278 0.132 17919 116652 1 284 . 1 1 60 60 ASN H H 60 8.150 8.150 7.822 0.328 17919 116653 1 284 . 1 1 61 61 ILE N N 61 118.600 118.600 119.908 -1.308 17919 116654 1 284 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.562 -0.169 17919 116655 1 284 . 1 1 61 61 ILE C C 61 174.610 174.610 174.585 0.025 17919 116656 1 284 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.487 0.933 17919 116657 1 284 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.752 -1.012 17919 116658 1 284 . 1 1 61 61 ILE H H 61 7.250 7.250 8.020 -0.770 17919 116659 1 284 . 1 1 62 62 GLN N N 62 124.740 124.740 125.579 -0.839 17919 116660 1 284 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.643 -0.137 17919 116661 1 284 . 1 1 62 62 GLN C C 62 175.970 175.970 174.764 1.206 17919 116662 1 284 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.769 -0.109 17919 116663 1 284 . 1 1 62 62 GLN CB C 62 31.650 31.650 32.313 -0.663 17919 116664 1 284 . 1 1 62 62 GLN H H 62 7.610 7.610 7.953 -0.343 17919 116665 1 284 . 1 1 63 63 LYS N N 63 120.300 120.300 120.823 -0.523 17919 116666 1 284 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.968 0.033 17919 116667 1 284 . 1 1 63 63 LYS C C 63 175.810 175.810 177.795 -1.985 17919 116668 1 284 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.463 -0.673 17919 116669 1 284 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.525 0.125 17919 116670 1 284 . 1 1 63 63 LYS H H 63 8.490 8.490 8.544 -0.054 17919 116671 1 284 . 1 1 64 64 GLU N N 64 113.950 113.950 121.557 -7.607 17919 116672 1 284 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.462 0.003 17919 116673 1 284 . 1 1 64 64 GLU C C 64 175.250 175.250 175.767 -0.517 17919 116674 1 284 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.709 0.180 17919 116675 1 284 . 1 1 64 64 GLU CB C 64 25.900 25.900 29.295 -3.395 17919 116676 1 284 . 1 1 64 64 GLU H H 64 9.280 9.280 8.834 0.446 17919 116677 1 284 . 1 1 65 65 SER N N 65 114.730 114.730 114.887 -0.157 17919 116678 1 284 . 1 1 65 65 SER HA H 65 4.640 4.640 4.605 0.035 17919 116679 1 284 . 1 1 65 65 SER C C 65 172.160 172.160 174.343 -2.183 17919 116680 1 284 . 1 1 65 65 SER CA C 65 60.890 60.890 60.149 0.741 17919 116681 1 284 . 1 1 65 65 SER CB C 65 64.910 64.910 64.413 0.497 17919 116682 1 284 . 1 1 65 65 SER H H 65 7.670 7.670 7.723 -0.053 17919 116683 1 284 . 1 1 66 66 THR N N 66 117.110 117.110 120.321 -3.211 17919 116684 1 284 . 1 1 66 66 THR HA H 66 5.270 5.270 5.241 0.029 17919 116685 1 284 . 1 1 66 66 THR C C 66 173.950 173.950 174.035 -0.085 17919 116686 1 284 . 1 1 66 66 THR CA C 66 62.340 62.340 61.926 0.414 17919 116687 1 284 . 1 1 66 66 THR CB C 66 70.080 70.080 70.499 -0.419 17919 116688 1 284 . 1 1 66 66 THR H H 66 8.730 8.730 8.596 0.134 17919 116689 1 284 . 1 1 67 67 LEU N N 67 127.110 127.110 128.099 -0.989 17919 116690 1 284 . 1 1 67 67 LEU HA H 67 5.060 5.060 5.050 0.010 17919 116691 1 284 . 1 1 67 67 LEU C C 67 175.770 175.770 175.282 0.488 17919 116692 1 284 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.299 0.601 17919 116693 1 284 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.858 -0.598 17919 116694 1 284 . 1 1 67 67 LEU H H 67 9.410 9.410 9.252 0.158 17919 116695 1 284 . 1 1 68 68 HIS N N 68 118.380 118.380 122.464 -4.084 17919 116696 1 284 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.277 -0.037 17919 116697 1 284 . 1 1 68 68 HIS C C 68 173.150 173.150 173.560 -0.410 17919 116698 1 284 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.516 0.484 17919 116699 1 284 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.658 -2.128 17919 116700 1 284 . 1 1 68 68 HIS H H 68 9.230 9.230 8.464 0.766 17919 116701 1 284 . 1 1 69 69 LEU N N 69 124.460 124.460 129.859 -5.399 17919 116702 1 284 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.292 -0.102 17919 116703 1 284 . 1 1 69 69 LEU C C 69 175.270 175.270 174.720 0.550 17919 116704 1 284 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.156 0.734 17919 116705 1 284 . 1 1 69 69 LEU CB C 69 44.380 44.380 43.703 0.677 17919 116706 1 284 . 1 1 69 69 LEU H H 69 8.340 8.340 8.007 0.333 17919 116707 1 284 . 1 1 70 70 VAL N N 70 126.940 126.940 127.953 -1.013 17919 116708 1 284 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.443 -0.093 17919 116709 1 284 . 1 1 70 70 VAL C C 70 174.000 174.000 174.547 -0.547 17919 116710 1 284 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.970 -0.170 17919 116711 1 284 . 1 1 70 70 VAL CB C 70 34.910 34.910 33.534 1.376 17919 116712 1 284 . 1 1 70 70 VAL H H 70 9.200 9.200 9.055 0.145 17919 116713 1 284 . 1 1 71 71 LEU N N 71 123.130 123.130 125.569 -2.439 17919 116714 1 284 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.898 0.162 17919 116715 1 284 . 1 1 71 71 LEU C C 71 177.830 177.830 178.086 -0.256 17919 116716 1 284 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.617 0.322 17919 116717 1 284 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.061 -0.211 17919 116718 1 284 . 1 1 71 71 LEU H H 71 8.120 8.120 8.663 -0.543 17919 116719 1 284 . 1 1 72 72 ARG N N 72 123.490 123.490 123.566 -0.076 17919 116720 1 284 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.430 -0.129 17919 116721 1 284 . 1 1 72 72 ARG C C 72 175.350 175.350 175.982 -0.632 17919 116722 1 284 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.725 -0.115 17919 116723 1 284 . 1 1 72 72 ARG CB C 72 31.350 31.350 28.151 3.200 17919 116724 1 284 . 1 1 72 72 ARG H H 72 8.580 8.580 8.644 -0.064 17919 116725 1 285 . 1 1 2 2 GLN N N 2 123.220 123.220 120.822 2.398 17919 116726 1 285 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.127 0.122 17919 116727 1 285 . 1 1 2 2 GLN C C 2 175.920 175.920 175.607 0.313 17919 116728 1 285 . 1 1 2 2 GLN CA C 2 55.080 55.080 55.338 -0.258 17919 116729 1 285 . 1 1 2 2 GLN CB C 2 30.760 30.760 29.992 0.768 17919 116730 1 285 . 1 1 2 2 GLN H H 2 8.900 8.900 8.737 0.163 17919 116731 1 285 . 1 1 3 3 ILE N N 3 115.340 115.340 115.477 -0.137 17919 116732 1 285 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.597 -0.384 17919 116733 1 285 . 1 1 3 3 ILE C C 3 172.450 172.450 173.299 -0.849 17919 116734 1 285 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.063 0.507 17919 116735 1 285 . 1 1 3 3 ILE CB C 3 42.210 42.210 42.362 -0.152 17919 116736 1 285 . 1 1 3 3 ILE H H 3 8.320 8.320 8.301 0.019 17919 116737 1 285 . 1 1 4 4 PHE N N 4 118.110 118.110 119.085 -0.975 17919 116738 1 285 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.583 0.047 17919 116739 1 285 . 1 1 4 4 PHE C C 4 175.320 175.320 175.106 0.214 17919 116740 1 285 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.788 -0.578 17919 116741 1 285 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.717 -0.237 17919 116742 1 285 . 1 1 4 4 PHE H H 4 8.610 8.610 8.419 0.191 17919 116743 1 285 . 1 1 5 5 VAL N N 5 121.000 121.000 122.332 -1.332 17919 116744 1 285 . 1 1 5 5 VAL HA H 5 4.725 4.725 5.139 -0.414 17919 116745 1 285 . 1 1 5 5 VAL C C 5 174.870 174.870 174.709 0.161 17919 116746 1 285 . 1 1 5 5 VAL CA C 5 60.620 60.620 60.861 -0.241 17919 116747 1 285 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.620 -0.390 17919 116748 1 285 . 1 1 5 5 VAL H H 5 9.300 9.300 9.301 -0.001 17919 116749 1 285 . 1 1 6 6 LYS N N 6 127.520 127.520 127.902 -0.382 17919 116750 1 285 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.392 -0.025 17919 116751 1 285 . 1 1 6 6 LYS C C 6 177.140 177.140 175.935 1.205 17919 116752 1 285 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.188 0.332 17919 116753 1 285 . 1 1 6 6 LYS CB C 6 35.050 35.050 36.232 -1.182 17919 116754 1 285 . 1 1 6 6 LYS H H 6 8.820 8.820 9.257 -0.437 17919 116755 1 285 . 1 1 7 7 THR N N 7 115.400 115.400 116.083 -0.683 17919 116756 1 285 . 1 1 7 7 THR HA H 7 4.970 4.970 4.683 0.287 17919 116757 1 285 . 1 1 7 7 THR C C 7 176.910 176.910 176.617 0.293 17919 116758 1 285 . 1 1 7 7 THR CA C 7 60.470 60.470 59.782 0.688 17919 116759 1 285 . 1 1 7 7 THR CB C 7 70.630 70.630 71.213 -0.583 17919 116760 1 285 . 1 1 7 7 THR H H 7 8.730 8.730 8.808 -0.078 17919 116761 1 285 . 1 1 8 8 LEU N N 8 121.330 121.330 120.175 1.155 17919 116762 1 285 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.296 0.014 17919 116763 1 285 . 1 1 8 8 LEU C C 8 178.800 178.800 178.306 0.494 17919 116764 1 285 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.567 0.013 17919 116765 1 285 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.616 0.354 17919 116766 1 285 . 1 1 8 8 LEU H H 8 9.100 9.100 8.929 0.171 17919 116767 1 285 . 1 1 9 9 THR N N 9 105.590 105.590 109.603 -4.013 17919 116768 1 285 . 1 1 9 9 THR HA H 9 4.428 4.428 4.322 0.106 17919 116769 1 285 . 1 1 9 9 THR C C 9 175.520 175.520 175.774 -0.254 17919 116770 1 285 . 1 1 9 9 THR CA C 9 61.400 61.400 61.840 -0.440 17919 116771 1 285 . 1 1 9 9 THR CB C 9 69.140 69.140 68.836 0.304 17919 116772 1 285 . 1 1 9 9 THR H H 9 7.630 7.630 7.740 -0.110 17919 116773 1 285 . 1 1 10 10 GLY N N 10 108.890 108.890 111.646 -2.756 17919 116774 1 285 . 1 1 10 10 GLY C C 10 174.070 174.070 173.586 0.484 17919 116775 1 285 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.268 0.192 17919 116776 1 285 . 1 1 10 10 GLY H H 10 7.810 7.810 8.148 -0.338 17919 116777 1 285 . 1 1 11 11 LYS N N 11 121.600 121.600 120.525 1.075 17919 116778 1 285 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.499 -0.138 17919 116779 1 285 . 1 1 11 11 LYS C C 11 175.940 175.940 175.286 0.654 17919 116780 1 285 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.044 0.236 17919 116781 1 285 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.611 -0.411 17919 116782 1 285 . 1 1 11 11 LYS H H 11 7.280 7.280 8.155 -0.875 17919 116783 1 285 . 1 1 12 12 THR N N 12 120.440 120.440 120.622 -0.182 17919 116784 1 285 . 1 1 12 12 THR HA H 12 5.046 5.046 5.166 -0.120 17919 116785 1 285 . 1 1 12 12 THR C C 12 174.320 174.320 174.367 -0.047 17919 116786 1 285 . 1 1 12 12 THR CA C 12 62.390 62.390 61.805 0.585 17919 116787 1 285 . 1 1 12 12 THR CB C 12 69.910 69.910 70.003 -0.093 17919 116788 1 285 . 1 1 12 12 THR H H 12 8.650 8.650 8.269 0.381 17919 116789 1 285 . 1 1 13 13 ILE N N 13 127.110 127.110 122.238 4.872 17919 116790 1 285 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.763 -0.219 17919 116791 1 285 . 1 1 13 13 ILE C C 13 175.220 175.220 174.748 0.472 17919 116792 1 285 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.246 0.734 17919 116793 1 285 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.403 0.547 17919 116794 1 285 . 1 1 13 13 ILE H H 13 9.450 9.450 9.276 0.174 17919 116795 1 285 . 1 1 14 14 THR N N 14 121.520 121.520 120.811 0.709 17919 116796 1 285 . 1 1 14 14 THR HA H 14 4.964 4.964 5.002 -0.038 17919 116797 1 285 . 1 1 14 14 THR C C 14 173.790 173.790 173.970 -0.180 17919 116798 1 285 . 1 1 14 14 THR CA C 14 61.940 61.940 61.850 0.090 17919 116799 1 285 . 1 1 14 14 THR CB C 14 69.650 69.650 69.917 -0.267 17919 116800 1 285 . 1 1 14 14 THR H H 14 8.710 8.710 8.475 0.235 17919 116801 1 285 . 1 1 15 15 LEU N N 15 124.800 124.800 125.854 -1.054 17919 116802 1 285 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.802 -0.022 17919 116803 1 285 . 1 1 15 15 LEU C C 15 174.670 174.670 174.961 -0.291 17919 116804 1 285 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.414 -0.584 17919 116805 1 285 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.630 1.440 17919 116806 1 285 . 1 1 15 15 LEU H H 15 8.710 8.710 8.991 -0.281 17919 116807 1 285 . 1 1 16 16 GLU N N 16 122.160 122.160 123.015 -0.855 17919 116808 1 285 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.031 -0.114 17919 116809 1 285 . 1 1 16 16 GLU C C 16 175.860 175.860 176.381 -0.521 17919 116810 1 285 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.094 -0.274 17919 116811 1 285 . 1 1 16 16 GLU CB C 16 29.450 29.450 29.888 -0.438 17919 116812 1 285 . 1 1 16 16 GLU H H 16 8.140 8.140 8.570 -0.430 17919 116813 1 285 . 1 1 17 17 VAL N N 17 117.210 117.210 118.899 -1.689 17919 116814 1 285 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.822 -0.108 17919 116815 1 285 . 1 1 17 17 VAL C C 17 174.160 174.160 174.607 -0.447 17919 116816 1 285 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.598 -0.168 17919 116817 1 285 . 1 1 17 17 VAL CB C 17 36.400 36.400 34.959 1.441 17919 116818 1 285 . 1 1 17 17 VAL H H 17 8.900 8.900 8.808 0.092 17919 116819 1 285 . 1 1 18 18 GLU N N 18 118.990 118.990 121.188 -2.198 17919 116820 1 285 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.726 0.353 17919 116821 1 285 . 1 1 18 18 GLU C C 18 176.160 176.160 175.877 0.283 17919 116822 1 285 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.011 -0.291 17919 116823 1 285 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.974 -0.664 17919 116824 1 285 . 1 1 18 18 GLU H H 18 8.640 8.640 8.508 0.132 17919 116825 1 285 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.227 -0.086 17919 116826 1 285 . 1 1 19 19 PRO C C 19 175.310 175.310 177.995 -2.685 17919 116827 1 285 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.587 -0.117 17919 116828 1 285 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.932 0.018 17919 116829 1 285 . 1 1 20 20 SER N N 20 103.400 103.400 110.634 -7.234 17919 116830 1 285 . 1 1 20 20 SER HA H 20 4.370 4.370 4.369 0.001 17919 116831 1 285 . 1 1 20 20 SER C C 20 174.660 174.660 173.993 0.667 17919 116832 1 285 . 1 1 20 20 SER CA C 20 57.400 57.400 58.062 -0.662 17919 116833 1 285 . 1 1 20 20 SER CB C 20 63.370 63.370 63.067 0.303 17919 116834 1 285 . 1 1 20 20 SER H H 20 7.040 7.040 8.088 -1.048 17919 116835 1 285 . 1 1 21 21 ASP N N 21 123.480 123.480 123.159 0.321 17919 116836 1 285 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.658 0.037 17919 116837 1 285 . 1 1 21 21 ASP C C 21 176.360 176.360 176.028 0.332 17919 116838 1 285 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.431 0.269 17919 116839 1 285 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.300 -0.500 17919 116840 1 285 . 1 1 21 21 ASP H H 21 8.030 8.030 7.550 0.480 17919 116841 1 285 . 1 1 22 22 THR N N 22 108.800 108.800 113.993 -5.193 17919 116842 1 285 . 1 1 22 22 THR HA H 22 4.920 4.920 4.609 0.311 17919 116843 1 285 . 1 1 22 22 THR C C 22 176.750 176.750 176.069 0.681 17919 116844 1 285 . 1 1 22 22 THR CA C 22 59.690 59.690 61.873 -2.183 17919 116845 1 285 . 1 1 22 22 THR CB C 22 71.200 71.200 70.785 0.415 17919 116846 1 285 . 1 1 22 22 THR H H 22 7.900 7.900 8.163 -0.263 17919 116847 1 285 . 1 1 23 23 ILE N N 23 121.190 121.190 122.625 -1.435 17919 116848 1 285 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.802 -0.145 17919 116849 1 285 . 1 1 23 23 ILE C C 23 179.040 179.040 177.723 1.317 17919 116850 1 285 . 1 1 23 23 ILE CA C 23 62.260 62.260 61.238 1.022 17919 116851 1 285 . 1 1 23 23 ILE CB C 23 34.350 34.350 35.796 -1.446 17919 116852 1 285 . 1 1 23 23 ILE H H 23 8.560 8.560 8.777 -0.217 17919 116853 1 285 . 1 1 24 24 GLU N N 24 120.830 120.830 121.425 -0.595 17919 116854 1 285 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.877 0.040 17919 116855 1 285 . 1 1 24 24 GLU C C 24 178.640 178.640 178.523 0.117 17919 116856 1 285 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.114 0.106 17919 116857 1 285 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.456 -1.176 17919 116858 1 285 . 1 1 24 24 GLU H H 24 9.760 9.760 8.455 1.305 17919 116859 1 285 . 1 1 25 25 ASN N N 25 120.570 120.570 117.716 2.854 17919 116860 1 285 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.497 0.028 17919 116861 1 285 . 1 1 25 25 ASN C C 25 178.380 178.380 177.820 0.560 17919 116862 1 285 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.158 -0.098 17919 116863 1 285 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.634 -0.184 17919 116864 1 285 . 1 1 25 25 ASN H H 25 7.920 7.920 7.661 0.259 17919 116865 1 285 . 1 1 26 26 VAL N N 26 121.710 121.710 121.458 0.252 17919 116866 1 285 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.562 -0.165 17919 116867 1 285 . 1 1 26 26 VAL C C 26 177.950 177.950 177.782 0.168 17919 116868 1 285 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.777 0.883 17919 116869 1 285 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.517 -0.677 17919 116870 1 285 . 1 1 26 26 VAL H H 26 8.070 8.070 8.249 -0.179 17919 116871 1 285 . 1 1 27 27 LYS N N 27 118.860 118.860 120.149 -1.289 17919 116872 1 285 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.121 0.459 17919 116873 1 285 . 1 1 27 27 LYS C C 27 180.550 180.550 179.073 1.477 17919 116874 1 285 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.883 -0.633 17919 116875 1 285 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.253 1.477 17919 116876 1 285 . 1 1 27 27 LYS H H 27 8.560 8.560 8.504 0.056 17919 116877 1 285 . 1 1 28 28 ALA N N 28 123.440 123.440 121.460 1.980 17919 116878 1 285 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.240 -0.080 17919 116879 1 285 . 1 1 28 28 ALA C C 28 180.300 180.300 179.293 1.007 17919 116880 1 285 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.543 0.827 17919 116881 1 285 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.559 -0.849 17919 116882 1 285 . 1 1 28 28 ALA H H 28 8.060 8.060 8.208 -0.148 17919 116883 1 285 . 1 1 29 29 LYS N N 29 119.940 119.940 120.198 -0.258 17919 116884 1 285 . 1 1 29 29 LYS HA H 29 4.207 4.207 3.997 0.210 17919 116885 1 285 . 1 1 29 29 LYS C C 29 180.320 180.320 179.087 1.233 17919 116886 1 285 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.607 0.043 17919 116887 1 285 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.334 0.956 17919 116888 1 285 . 1 1 29 29 LYS H H 29 7.850 7.850 8.213 -0.363 17919 116889 1 285 . 1 1 30 30 ILE N N 30 121.080 121.080 120.236 0.844 17919 116890 1 285 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.569 -0.062 17919 116891 1 285 . 1 1 30 30 ILE C C 30 178.310 178.310 177.259 1.051 17919 116892 1 285 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.639 0.511 17919 116893 1 285 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.633 -0.834 17919 116894 1 285 . 1 1 30 30 ILE H H 30 8.280 8.280 8.432 -0.152 17919 116895 1 285 . 1 1 31 31 GLN N N 31 123.490 123.490 120.429 3.061 17919 116896 1 285 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.036 -0.207 17919 116897 1 285 . 1 1 31 31 GLN C C 31 178.890 178.890 178.476 0.414 17919 116898 1 285 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.029 0.971 17919 116899 1 285 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.552 -0.832 17919 116900 1 285 . 1 1 31 31 GLN H H 31 8.580 8.580 8.118 0.462 17919 116901 1 285 . 1 1 32 32 ASP N N 32 119.360 119.360 120.282 -0.922 17919 116902 1 285 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.343 0.011 17919 116903 1 285 . 1 1 32 32 ASP C C 32 177.250 177.250 178.223 -0.973 17919 116904 1 285 . 1 1 32 32 ASP CA C 32 57.190 57.190 57.045 0.145 17919 116905 1 285 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.783 -0.203 17919 116906 1 285 . 1 1 32 32 ASP H H 32 8.010 8.010 8.288 -0.278 17919 116907 1 285 . 1 1 33 33 LYS N N 33 115.130 115.130 118.027 -2.897 17919 116908 1 285 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.230 0.107 17919 116909 1 285 . 1 1 33 33 LYS C C 33 177.870 177.870 178.497 -0.627 17919 116910 1 285 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.203 -0.153 17919 116911 1 285 . 1 1 33 33 LYS CB C 33 34.170 34.170 32.896 1.274 17919 116912 1 285 . 1 1 33 33 LYS H H 33 7.430 7.430 7.583 -0.153 17919 116913 1 285 . 1 1 34 34 GLU N N 34 113.870 113.870 114.345 -0.475 17919 116914 1 285 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.478 0.147 17919 116915 1 285 . 1 1 34 34 GLU C C 34 177.840 177.840 177.395 0.445 17919 116916 1 285 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.866 -0.696 17919 116917 1 285 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.919 0.741 17919 116918 1 285 . 1 1 34 34 GLU H H 34 8.740 8.740 7.951 0.789 17919 116919 1 285 . 1 1 35 35 GLY N N 35 108.650 108.650 109.002 -0.352 17919 116920 1 285 . 1 1 35 35 GLY C C 35 173.960 173.960 174.288 -0.328 17919 116921 1 285 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.682 0.398 17919 116922 1 285 . 1 1 35 35 GLY H H 35 8.530 8.530 8.286 0.244 17919 116923 1 285 . 1 1 36 36 ILE N N 36 119.880 119.880 122.913 -3.033 17919 116924 1 285 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.253 0.192 17919 116925 1 285 . 1 1 36 36 ILE C C 36 173.590 173.590 174.333 -0.743 17919 116926 1 285 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.989 -0.239 17919 116927 1 285 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.490 2.090 17919 116928 1 285 . 1 1 36 36 ILE H H 36 6.150 6.150 7.580 -1.430 17919 116929 1 285 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.488 0.146 17919 116930 1 285 . 1 1 37 37 PRO C C 37 176.940 176.940 175.959 0.981 17919 116931 1 285 . 1 1 37 37 PRO CA C 37 61.660 61.660 62.267 -0.607 17919 116932 1 285 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.194 0.656 17919 116933 1 285 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.301 -0.184 17919 116934 1 285 . 1 1 38 38 PRO C C 38 178.320 178.320 177.841 0.479 17919 116935 1 285 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.030 1.230 17919 116936 1 285 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.958 0.932 17919 116937 1 285 . 1 1 39 39 ASP N N 39 113.380 113.380 116.495 -3.115 17919 116938 1 285 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.425 0.005 17919 116939 1 285 . 1 1 39 39 ASP C C 39 177.090 177.090 177.609 -0.519 17919 116940 1 285 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.581 -0.941 17919 116941 1 285 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.544 -1.004 17919 116942 1 285 . 1 1 39 39 ASP H H 39 8.550 8.550 8.547 0.003 17919 116943 1 285 . 1 1 40 40 GLN N N 40 116.780 116.780 117.291 -0.511 17919 116944 1 285 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.393 0.071 17919 116945 1 285 . 1 1 40 40 GLN C C 40 175.380 175.380 175.643 -0.263 17919 116946 1 285 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.487 0.153 17919 116947 1 285 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.154 0.986 17919 116948 1 285 . 1 1 40 40 GLN H H 40 7.820 7.820 7.724 0.096 17919 116949 1 285 . 1 1 41 41 GLN N N 41 117.720 117.720 119.430 -1.710 17919 116950 1 285 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.312 -0.068 17919 116951 1 285 . 1 1 41 41 GLN C C 41 176.300 176.300 175.002 1.298 17919 116952 1 285 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.608 -0.138 17919 116953 1 285 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.627 2.023 17919 116954 1 285 . 1 1 41 41 GLN H H 41 7.480 7.480 7.144 0.336 17919 116955 1 285 . 1 1 42 42 ARG N N 42 122.680 122.680 123.786 -1.106 17919 116956 1 285 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.635 -0.135 17919 116957 1 285 . 1 1 42 42 ARG C C 42 174.050 174.050 173.488 0.562 17919 116958 1 285 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.883 0.167 17919 116959 1 285 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.178 -1.428 17919 116960 1 285 . 1 1 42 42 ARG H H 42 8.530 8.530 8.823 -0.293 17919 116961 1 285 . 1 1 43 43 LEU N N 43 124.040 124.040 128.429 -4.389 17919 116962 1 285 . 1 1 43 43 LEU C C 43 175.290 175.290 174.771 0.519 17919 116963 1 285 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.080 -1.099 17919 116964 1 285 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.885 0.905 17919 116965 1 285 . 1 1 43 43 LEU H H 43 8.820 8.820 8.807 0.013 17919 116966 1 285 . 1 1 44 44 ILE N N 44 121.920 121.920 120.233 1.687 17919 116967 1 285 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.915 0.077 17919 116968 1 285 . 1 1 44 44 ILE C C 44 176.060 176.060 173.377 2.683 17919 116969 1 285 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.552 -0.572 17919 116970 1 285 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.481 -0.061 17919 116971 1 285 . 1 1 44 44 ILE H H 44 9.030 9.030 9.057 -0.027 17919 116972 1 285 . 1 1 45 45 PHE N N 45 125.390 125.390 127.484 -2.094 17919 116973 1 285 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.056 -0.011 17919 116974 1 285 . 1 1 45 45 PHE C C 45 174.470 174.470 175.316 -0.846 17919 116975 1 285 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.086 0.934 17919 116976 1 285 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.045 1.715 17919 116977 1 285 . 1 1 45 45 PHE H H 45 8.830 8.830 8.280 0.550 17919 116978 1 285 . 1 1 46 46 ALA N N 46 132.200 132.200 130.895 1.305 17919 116979 1 285 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.749 -0.059 17919 116980 1 285 . 1 1 46 46 ALA C C 46 177.290 177.290 177.425 -0.135 17919 116981 1 285 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.366 0.174 17919 116982 1 285 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.057 0.513 17919 116983 1 285 . 1 1 46 46 ALA H H 46 8.810 8.810 8.901 -0.091 17919 116984 1 285 . 1 1 47 47 GLY N N 47 102.340 102.340 103.630 -1.290 17919 116985 1 285 . 1 1 47 47 GLY C C 47 173.810 173.810 174.207 -0.397 17919 116986 1 285 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.260 0.090 17919 116987 1 285 . 1 1 47 47 GLY H H 47 8.130 8.130 8.600 -0.470 17919 116988 1 285 . 1 1 48 48 LYS N N 48 121.570 121.570 121.345 0.225 17919 116989 1 285 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.527 0.095 17919 116990 1 285 . 1 1 48 48 LYS C C 48 174.700 174.700 175.437 -0.737 17919 116991 1 285 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.896 -0.346 17919 116992 1 285 . 1 1 48 48 LYS CB C 48 34.530 34.530 33.705 0.825 17919 116993 1 285 . 1 1 48 48 LYS H H 48 7.980 7.980 7.720 0.260 17919 116994 1 285 . 1 1 49 49 GLN N N 49 122.410 122.410 126.187 -3.777 17919 116995 1 285 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.119 0.441 17919 116996 1 285 . 1 1 49 49 GLN C C 49 175.670 175.670 175.581 0.089 17919 116997 1 285 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.450 -0.710 17919 116998 1 285 . 1 1 49 49 GLN CB C 49 29.000 29.000 28.041 0.959 17919 116999 1 285 . 1 1 49 49 GLN H H 49 8.600 8.600 8.619 -0.019 17919 117000 1 285 . 1 1 50 50 LEU N N 50 125.520 125.520 129.529 -4.009 17919 117001 1 285 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.069 0.021 17919 117002 1 285 . 1 1 50 50 LEU C C 50 176.660 176.660 176.370 0.290 17919 117003 1 285 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.733 0.507 17919 117004 1 285 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.116 -0.546 17919 117005 1 285 . 1 1 50 50 LEU H H 50 8.530 8.530 7.836 0.694 17919 117006 1 285 . 1 1 51 51 GLU N N 51 122.940 122.940 123.940 -1.000 17919 117007 1 285 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.499 -0.011 17919 117008 1 285 . 1 1 51 51 GLU C C 51 175.870 175.870 177.008 -1.138 17919 117009 1 285 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.382 0.578 17919 117010 1 285 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.177 -0.607 17919 117011 1 285 . 1 1 51 51 GLU H H 51 8.400 8.400 8.280 0.120 17919 117012 1 285 . 1 1 52 52 ASP N N 52 120.030 120.030 126.761 -6.731 17919 117013 1 285 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.413 -0.054 17919 117014 1 285 . 1 1 52 52 ASP C C 52 177.330 177.330 177.808 -0.478 17919 117015 1 285 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.775 -0.815 17919 117016 1 285 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.638 0.212 17919 117017 1 285 . 1 1 52 52 ASP H H 52 8.160 8.160 8.841 -0.681 17919 117018 1 285 . 1 1 53 53 GLY N N 53 106.660 106.660 105.175 1.485 17919 117019 1 285 . 1 1 53 53 GLY C C 53 174.870 174.870 174.173 0.697 17919 117020 1 285 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.301 -0.131 17919 117021 1 285 . 1 1 53 53 GLY H H 53 9.390 9.390 8.748 0.642 17919 117022 1 285 . 1 1 54 54 ARG N N 54 119.050 119.050 120.276 -1.226 17919 117023 1 285 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.645 0.050 17919 117024 1 285 . 1 1 54 54 ARG C C 54 175.350 175.350 175.876 -0.526 17919 117025 1 285 . 1 1 54 54 ARG CA C 54 54.390 54.390 53.668 0.722 17919 117026 1 285 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.967 -0.317 17919 117027 1 285 . 1 1 54 54 ARG H H 54 7.460 7.460 7.273 0.187 17919 117028 1 285 . 1 1 55 55 THR N N 55 108.400 108.400 113.991 -5.591 17919 117029 1 285 . 1 1 55 55 THR HA H 55 5.240 5.240 4.402 0.838 17919 117030 1 285 . 1 1 55 55 THR C C 55 176.560 176.560 176.435 0.125 17919 117031 1 285 . 1 1 55 55 THR CA C 55 59.690 59.690 62.258 -2.568 17919 117032 1 285 . 1 1 55 55 THR CB C 55 72.260 72.260 69.922 2.338 17919 117033 1 285 . 1 1 55 55 THR H H 55 8.730 8.730 8.980 -0.250 17919 117034 1 285 . 1 1 56 56 LEU N N 56 117.920 117.920 123.505 -5.585 17919 117035 1 285 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.930 0.130 17919 117036 1 285 . 1 1 56 56 LEU C C 56 180.810 180.810 179.011 1.799 17919 117037 1 285 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.679 0.031 17919 117038 1 285 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.108 -0.739 17919 117039 1 285 . 1 1 56 56 LEU H H 56 8.140 8.140 8.889 -0.749 17919 117040 1 285 . 1 1 57 57 SER N N 57 113.330 113.330 114.890 -1.560 17919 117041 1 285 . 1 1 57 57 SER HA H 57 4.370 4.370 4.152 0.218 17919 117042 1 285 . 1 1 57 57 SER C C 57 178.310 178.310 176.824 1.486 17919 117043 1 285 . 1 1 57 57 SER CA C 57 61.080 61.080 62.240 -1.160 17919 117044 1 285 . 1 1 57 57 SER CB C 57 62.530 62.530 62.747 -0.217 17919 117045 1 285 . 1 1 57 57 SER H H 57 8.470 8.470 8.023 0.447 17919 117046 1 285 . 1 1 58 58 ASP N N 58 124.190 124.190 121.727 2.463 17919 117047 1 285 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.258 0.038 17919 117048 1 285 . 1 1 58 58 ASP C C 58 177.400 177.400 177.022 0.378 17919 117049 1 285 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.807 0.373 17919 117050 1 285 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.326 -0.226 17919 117051 1 285 . 1 1 58 58 ASP H H 58 7.930 7.930 8.072 -0.142 17919 117052 1 285 . 1 1 59 59 TYR N N 59 115.510 115.510 115.310 0.200 17919 117053 1 285 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.548 0.122 17919 117054 1 285 . 1 1 59 59 TYR C C 59 174.700 174.700 174.849 -0.149 17919 117055 1 285 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.060 1.190 17919 117056 1 285 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.351 1.719 17919 117057 1 285 . 1 1 59 59 TYR H H 59 7.250 7.250 7.088 0.162 17919 117058 1 285 . 1 1 60 60 ASN N N 60 115.900 115.900 117.536 -1.636 17919 117059 1 285 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.332 0.023 17919 117060 1 285 . 1 1 60 60 ASN C C 60 174.340 174.340 174.373 -0.033 17919 117061 1 285 . 1 1 60 60 ASN CA C 60 54.120 54.120 53.893 0.227 17919 117062 1 285 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.562 -0.152 17919 117063 1 285 . 1 1 60 60 ASN H H 60 8.150 8.150 7.702 0.448 17919 117064 1 285 . 1 1 61 61 ILE N N 61 118.600 118.600 119.570 -0.970 17919 117065 1 285 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.739 -0.346 17919 117066 1 285 . 1 1 61 61 ILE C C 61 174.610 174.610 174.878 -0.268 17919 117067 1 285 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.452 0.968 17919 117068 1 285 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.638 -0.898 17919 117069 1 285 . 1 1 61 61 ILE H H 61 7.250 7.250 7.893 -0.643 17919 117070 1 285 . 1 1 62 62 GLN N N 62 124.740 124.740 125.598 -0.858 17919 117071 1 285 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.654 -0.148 17919 117072 1 285 . 1 1 62 62 GLN C C 62 175.970 175.970 175.505 0.465 17919 117073 1 285 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.861 -0.201 17919 117074 1 285 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.300 0.350 17919 117075 1 285 . 1 1 62 62 GLN H H 62 7.610 7.610 8.192 -0.582 17919 117076 1 285 . 1 1 63 63 LYS N N 63 120.300 120.300 120.431 -0.131 17919 117077 1 285 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.287 -0.286 17919 117078 1 285 . 1 1 63 63 LYS C C 63 175.810 175.810 176.929 -1.119 17919 117079 1 285 . 1 1 63 63 LYS CA C 63 57.790 57.790 56.813 0.977 17919 117080 1 285 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.586 0.064 17919 117081 1 285 . 1 1 63 63 LYS H H 63 8.490 8.490 8.523 -0.033 17919 117082 1 285 . 1 1 64 64 GLU N N 64 113.950 113.950 118.735 -4.785 17919 117083 1 285 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.891 -0.426 17919 117084 1 285 . 1 1 64 64 GLU C C 64 175.250 175.250 176.246 -0.996 17919 117085 1 285 . 1 1 64 64 GLU CA C 64 57.890 57.890 58.373 -0.483 17919 117086 1 285 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.567 -2.667 17919 117087 1 285 . 1 1 64 64 GLU H H 64 9.280 9.280 8.943 0.337 17919 117088 1 285 . 1 1 65 65 SER N N 65 114.730 114.730 116.011 -1.281 17919 117089 1 285 . 1 1 65 65 SER HA H 65 4.640 4.640 4.520 0.120 17919 117090 1 285 . 1 1 65 65 SER C C 65 172.160 172.160 173.906 -1.746 17919 117091 1 285 . 1 1 65 65 SER CA C 65 60.890 60.890 60.405 0.485 17919 117092 1 285 . 1 1 65 65 SER CB C 65 64.910 64.910 64.049 0.861 17919 117093 1 285 . 1 1 65 65 SER H H 65 7.670 7.670 7.641 0.029 17919 117094 1 285 . 1 1 66 66 THR N N 66 117.110 117.110 118.157 -1.047 17919 117095 1 285 . 1 1 66 66 THR HA H 66 5.270 5.270 5.265 0.005 17919 117096 1 285 . 1 1 66 66 THR C C 66 173.950 173.950 173.938 0.012 17919 117097 1 285 . 1 1 66 66 THR CA C 66 62.340 62.340 62.083 0.257 17919 117098 1 285 . 1 1 66 66 THR CB C 66 70.080 70.080 70.287 -0.207 17919 117099 1 285 . 1 1 66 66 THR H H 66 8.730 8.730 8.223 0.507 17919 117100 1 285 . 1 1 67 67 LEU N N 67 127.110 127.110 125.464 1.646 17919 117101 1 285 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.854 0.206 17919 117102 1 285 . 1 1 67 67 LEU C C 67 175.770 175.770 175.003 0.767 17919 117103 1 285 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.118 -0.218 17919 117104 1 285 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.953 -0.693 17919 117105 1 285 . 1 1 67 67 LEU H H 67 9.410 9.410 9.186 0.224 17919 117106 1 285 . 1 1 68 68 HIS N N 68 118.380 118.380 121.655 -3.275 17919 117107 1 285 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.440 -0.200 17919 117108 1 285 . 1 1 68 68 HIS C C 68 173.150 173.150 173.928 -0.778 17919 117109 1 285 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.505 0.495 17919 117110 1 285 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.630 -2.100 17919 117111 1 285 . 1 1 68 68 HIS H H 68 9.230 9.230 9.269 -0.039 17919 117112 1 285 . 1 1 69 69 LEU N N 69 124.460 124.460 128.579 -4.119 17919 117113 1 285 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.980 0.210 17919 117114 1 285 . 1 1 69 69 LEU C C 69 175.270 175.270 174.324 0.946 17919 117115 1 285 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.824 0.066 17919 117116 1 285 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.319 0.061 17919 117117 1 285 . 1 1 69 69 LEU H H 69 8.340 8.340 8.118 0.222 17919 117118 1 285 . 1 1 70 70 VAL N N 70 126.940 126.940 124.867 2.073 17919 117119 1 285 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.357 -0.007 17919 117120 1 285 . 1 1 70 70 VAL C C 70 174.000 174.000 174.618 -0.618 17919 117121 1 285 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.961 -0.161 17919 117122 1 285 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.185 -0.275 17919 117123 1 285 . 1 1 70 70 VAL H H 70 9.200 9.200 9.080 0.120 17919 117124 1 285 . 1 1 71 71 LEU N N 71 123.130 123.130 123.123 0.007 17919 117125 1 285 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.242 -0.182 17919 117126 1 285 . 1 1 71 71 LEU C C 71 177.830 177.830 177.497 0.333 17919 117127 1 285 . 1 1 71 71 LEU CA C 71 53.940 53.940 52.582 1.358 17919 117128 1 285 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.355 -0.505 17919 117129 1 285 . 1 1 71 71 LEU H H 71 8.120 8.120 8.219 -0.099 17919 117130 1 285 . 1 1 72 72 ARG N N 72 123.490 123.490 121.095 2.395 17919 117131 1 285 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.304 -0.003 17919 117132 1 285 . 1 1 72 72 ARG C C 72 175.350 175.350 176.020 -0.670 17919 117133 1 285 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.203 -0.593 17919 117134 1 285 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.779 0.571 17919 117135 1 285 . 1 1 72 72 ARG H H 72 8.580 8.580 8.074 0.506 17919 117136 1 286 . 1 1 2 2 GLN N N 2 123.220 123.220 120.009 3.211 17919 117137 1 286 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.297 -0.048 17919 117138 1 286 . 1 1 2 2 GLN C C 2 175.920 175.920 175.728 0.192 17919 117139 1 286 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.746 0.334 17919 117140 1 286 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.481 0.279 17919 117141 1 286 . 1 1 2 2 GLN H H 2 8.900 8.900 8.348 0.552 17919 117142 1 286 . 1 1 3 3 ILE N N 3 115.340 115.340 115.700 -0.360 17919 117143 1 286 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.243 -0.030 17919 117144 1 286 . 1 1 3 3 ILE C C 3 172.450 172.450 173.506 -1.056 17919 117145 1 286 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.382 0.188 17919 117146 1 286 . 1 1 3 3 ILE CB C 3 42.210 42.210 42.014 0.196 17919 117147 1 286 . 1 1 3 3 ILE H H 3 8.320 8.320 8.753 -0.433 17919 117148 1 286 . 1 1 4 4 PHE N N 4 118.110 118.110 119.593 -1.483 17919 117149 1 286 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.417 0.213 17919 117150 1 286 . 1 1 4 4 PHE C C 4 175.320 175.320 175.209 0.111 17919 117151 1 286 . 1 1 4 4 PHE CA C 4 55.210 55.210 54.714 0.496 17919 117152 1 286 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.174 0.306 17919 117153 1 286 . 1 1 4 4 PHE H H 4 8.610 8.610 8.563 0.047 17919 117154 1 286 . 1 1 5 5 VAL N N 5 121.000 121.000 122.697 -1.697 17919 117155 1 286 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.863 -0.138 17919 117156 1 286 . 1 1 5 5 VAL C C 5 174.870 174.870 174.775 0.095 17919 117157 1 286 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.099 -0.479 17919 117158 1 286 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.273 -0.043 17919 117159 1 286 . 1 1 5 5 VAL H H 5 9.300 9.300 9.280 0.020 17919 117160 1 286 . 1 1 6 6 LYS N N 6 127.520 127.520 127.115 0.405 17919 117161 1 286 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.378 -0.011 17919 117162 1 286 . 1 1 6 6 LYS C C 6 177.140 177.140 176.764 0.376 17919 117163 1 286 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.204 0.316 17919 117164 1 286 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.310 0.740 17919 117165 1 286 . 1 1 6 6 LYS H H 6 8.820 8.820 9.157 -0.337 17919 117166 1 286 . 1 1 7 7 THR N N 7 115.400 115.400 115.136 0.264 17919 117167 1 286 . 1 1 7 7 THR HA H 7 4.970 4.970 4.630 0.340 17919 117168 1 286 . 1 1 7 7 THR C C 7 176.910 176.910 176.745 0.165 17919 117169 1 286 . 1 1 7 7 THR CA C 7 60.470 60.470 61.305 -0.835 17919 117170 1 286 . 1 1 7 7 THR CB C 7 70.630 70.630 70.351 0.279 17919 117171 1 286 . 1 1 7 7 THR H H 7 8.730 8.730 8.938 -0.208 17919 117172 1 286 . 1 1 8 8 LEU N N 8 121.330 121.330 116.087 5.243 17919 117173 1 286 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.616 -0.306 17919 117174 1 286 . 1 1 8 8 LEU C C 8 178.800 178.800 177.206 1.594 17919 117175 1 286 . 1 1 8 8 LEU CA C 8 57.580 57.580 56.700 0.881 17919 117176 1 286 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.772 0.198 17919 117177 1 286 . 1 1 8 8 LEU H H 8 9.100 9.100 8.288 0.812 17919 117178 1 286 . 1 1 9 9 THR N N 9 105.590 105.590 110.896 -5.306 17919 117179 1 286 . 1 1 9 9 THR HA H 9 4.428 4.428 4.442 -0.014 17919 117180 1 286 . 1 1 9 9 THR C C 9 175.520 175.520 175.439 0.081 17919 117181 1 286 . 1 1 9 9 THR CA C 9 61.400 61.400 61.217 0.184 17919 117182 1 286 . 1 1 9 9 THR CB C 9 69.140 69.140 68.903 0.237 17919 117183 1 286 . 1 1 9 9 THR H H 9 7.630 7.630 7.735 -0.105 17919 117184 1 286 . 1 1 10 10 GLY N N 10 108.890 108.890 111.086 -2.196 17919 117185 1 286 . 1 1 10 10 GLY C C 10 174.070 174.070 173.426 0.644 17919 117186 1 286 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.153 0.307 17919 117187 1 286 . 1 1 10 10 GLY H H 10 7.810 7.810 8.393 -0.583 17919 117188 1 286 . 1 1 11 11 LYS N N 11 121.600 121.600 120.575 1.025 17919 117189 1 286 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.771 -0.410 17919 117190 1 286 . 1 1 11 11 LYS C C 11 175.940 175.940 175.055 0.885 17919 117191 1 286 . 1 1 11 11 LYS CA C 11 56.280 56.280 54.615 1.665 17919 117192 1 286 . 1 1 11 11 LYS CB C 11 33.200 33.200 34.617 -1.417 17919 117193 1 286 . 1 1 11 11 LYS H H 11 7.280 7.280 7.621 -0.341 17919 117194 1 286 . 1 1 12 12 THR N N 12 120.440 120.440 119.799 0.641 17919 117195 1 286 . 1 1 12 12 THR HA H 12 5.046 5.046 5.476 -0.430 17919 117196 1 286 . 1 1 12 12 THR C C 12 174.320 174.320 174.571 -0.251 17919 117197 1 286 . 1 1 12 12 THR CA C 12 62.390 62.390 61.646 0.744 17919 117198 1 286 . 1 1 12 12 THR CB C 12 69.910 69.910 70.318 -0.408 17919 117199 1 286 . 1 1 12 12 THR H H 12 8.650 8.650 8.394 0.256 17919 117200 1 286 . 1 1 13 13 ILE N N 13 127.110 127.110 122.444 4.666 17919 117201 1 286 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.716 -0.172 17919 117202 1 286 . 1 1 13 13 ILE C C 13 175.220 175.220 174.549 0.671 17919 117203 1 286 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.687 0.293 17919 117204 1 286 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.965 -1.016 17919 117205 1 286 . 1 1 13 13 ILE H H 13 9.450 9.450 9.154 0.296 17919 117206 1 286 . 1 1 14 14 THR N N 14 121.520 121.520 120.833 0.687 17919 117207 1 286 . 1 1 14 14 THR HA H 14 4.964 4.964 5.353 -0.389 17919 117208 1 286 . 1 1 14 14 THR C C 14 173.790 173.790 173.876 -0.086 17919 117209 1 286 . 1 1 14 14 THR CA C 14 61.940 61.940 62.135 -0.195 17919 117210 1 286 . 1 1 14 14 THR CB C 14 69.650 69.650 70.182 -0.532 17919 117211 1 286 . 1 1 14 14 THR H H 14 8.710 8.710 8.612 0.098 17919 117212 1 286 . 1 1 15 15 LEU N N 15 124.800 124.800 125.349 -0.549 17919 117213 1 286 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.808 -0.028 17919 117214 1 286 . 1 1 15 15 LEU C C 15 174.670 174.670 175.022 -0.352 17919 117215 1 286 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.831 -1.001 17919 117216 1 286 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.359 1.711 17919 117217 1 286 . 1 1 15 15 LEU H H 15 8.710 8.710 8.819 -0.109 17919 117218 1 286 . 1 1 16 16 GLU N N 16 122.160 122.160 122.596 -0.436 17919 117219 1 286 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.461 -0.544 17919 117220 1 286 . 1 1 16 16 GLU C C 16 175.860 175.860 176.188 -0.328 17919 117221 1 286 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.273 -0.453 17919 117222 1 286 . 1 1 16 16 GLU CB C 16 29.450 29.450 31.267 -1.817 17919 117223 1 286 . 1 1 16 16 GLU H H 16 8.140 8.140 8.670 -0.530 17919 117224 1 286 . 1 1 17 17 VAL N N 17 117.210 117.210 118.451 -1.241 17919 117225 1 286 . 1 1 17 17 VAL HA H 17 4.714 4.714 5.051 -0.337 17919 117226 1 286 . 1 1 17 17 VAL C C 17 174.160 174.160 174.396 -0.236 17919 117227 1 286 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.805 -0.375 17919 117228 1 286 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.871 0.529 17919 117229 1 286 . 1 1 17 17 VAL H H 17 8.900 8.900 8.895 0.005 17919 117230 1 286 . 1 1 18 18 GLU N N 18 118.990 118.990 122.017 -3.027 17919 117231 1 286 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.936 0.143 17919 117232 1 286 . 1 1 18 18 GLU C C 18 176.160 176.160 175.181 0.979 17919 117233 1 286 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.074 0.646 17919 117234 1 286 . 1 1 18 18 GLU CB C 18 30.310 30.310 31.622 -1.312 17919 117235 1 286 . 1 1 18 18 GLU H H 18 8.640 8.640 9.009 -0.369 17919 117236 1 286 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.348 -0.207 17919 117237 1 286 . 1 1 19 19 PRO C C 19 175.310 175.310 177.290 -1.980 17919 117238 1 286 . 1 1 19 19 PRO CA C 19 65.470 65.470 64.979 0.491 17919 117239 1 286 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.800 0.150 17919 117240 1 286 . 1 1 20 20 SER N N 20 103.400 103.400 109.761 -6.361 17919 117241 1 286 . 1 1 20 20 SER HA H 20 4.370 4.370 4.319 0.051 17919 117242 1 286 . 1 1 20 20 SER C C 20 174.660 174.660 174.501 0.159 17919 117243 1 286 . 1 1 20 20 SER CA C 20 57.400 57.400 59.288 -1.888 17919 117244 1 286 . 1 1 20 20 SER CB C 20 63.370 63.370 62.439 0.931 17919 117245 1 286 . 1 1 20 20 SER H H 20 7.040 7.040 8.041 -1.001 17919 117246 1 286 . 1 1 21 21 ASP N N 21 123.480 123.480 124.561 -1.081 17919 117247 1 286 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.648 0.047 17919 117248 1 286 . 1 1 21 21 ASP C C 21 176.360 176.360 176.213 0.147 17919 117249 1 286 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.231 0.469 17919 117250 1 286 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.536 -0.736 17919 117251 1 286 . 1 1 21 21 ASP H H 21 8.030 8.030 8.077 -0.047 17919 117252 1 286 . 1 1 22 22 THR N N 22 108.800 108.800 113.226 -4.426 17919 117253 1 286 . 1 1 22 22 THR HA H 22 4.920 4.920 5.124 -0.204 17919 117254 1 286 . 1 1 22 22 THR C C 22 176.750 176.750 176.492 0.258 17919 117255 1 286 . 1 1 22 22 THR CA C 22 59.690 59.690 60.438 -0.748 17919 117256 1 286 . 1 1 22 22 THR CB C 22 71.200 71.200 70.867 0.333 17919 117257 1 286 . 1 1 22 22 THR H H 22 7.900 7.900 8.462 -0.562 17919 117258 1 286 . 1 1 23 23 ILE N N 23 121.190 121.190 121.644 -0.454 17919 117259 1 286 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.824 -0.167 17919 117260 1 286 . 1 1 23 23 ILE C C 23 179.040 179.040 177.855 1.185 17919 117261 1 286 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.448 -0.188 17919 117262 1 286 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.195 -1.845 17919 117263 1 286 . 1 1 23 23 ILE H H 23 8.560 8.560 8.540 0.020 17919 117264 1 286 . 1 1 24 24 GLU N N 24 120.830 120.830 121.694 -0.864 17919 117265 1 286 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.906 0.011 17919 117266 1 286 . 1 1 24 24 GLU C C 24 178.640 178.640 178.463 0.177 17919 117267 1 286 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.233 -0.013 17919 117268 1 286 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.440 -1.160 17919 117269 1 286 . 1 1 24 24 GLU H H 24 9.760 9.760 8.288 1.472 17919 117270 1 286 . 1 1 25 25 ASN N N 25 120.570 120.570 118.456 2.114 17919 117271 1 286 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.470 0.055 17919 117272 1 286 . 1 1 25 25 ASN C C 25 178.380 178.380 178.154 0.226 17919 117273 1 286 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.303 -0.243 17919 117274 1 286 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.552 -0.102 17919 117275 1 286 . 1 1 25 25 ASN H H 25 7.920 7.920 7.877 0.043 17919 117276 1 286 . 1 1 26 26 VAL N N 26 121.710 121.710 121.229 0.481 17919 117277 1 286 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.633 -0.236 17919 117278 1 286 . 1 1 26 26 VAL C C 26 177.950 177.950 177.488 0.462 17919 117279 1 286 . 1 1 26 26 VAL CA C 26 67.660 67.660 67.056 0.604 17919 117280 1 286 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.327 -0.487 17919 117281 1 286 . 1 1 26 26 VAL H H 26 8.070 8.070 8.384 -0.314 17919 117282 1 286 . 1 1 27 27 LYS N N 27 118.860 118.860 120.501 -1.641 17919 117283 1 286 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.247 0.333 17919 117284 1 286 . 1 1 27 27 LYS C C 27 180.550 180.550 179.172 1.378 17919 117285 1 286 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.457 -0.207 17919 117286 1 286 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.269 1.461 17919 117287 1 286 . 1 1 27 27 LYS H H 27 8.560 8.560 8.093 0.467 17919 117288 1 286 . 1 1 28 28 ALA N N 28 123.440 123.440 122.796 0.644 17919 117289 1 286 . 1 1 28 28 ALA HA H 28 4.160 4.160 3.954 0.206 17919 117290 1 286 . 1 1 28 28 ALA C C 28 180.300 180.300 179.064 1.236 17919 117291 1 286 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.522 -0.152 17919 117292 1 286 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.290 -0.580 17919 117293 1 286 . 1 1 28 28 ALA H H 28 8.060 8.060 8.311 -0.251 17919 117294 1 286 . 1 1 29 29 LYS N N 29 119.940 119.940 118.687 1.253 17919 117295 1 286 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.051 0.156 17919 117296 1 286 . 1 1 29 29 LYS C C 29 180.320 180.320 179.068 1.252 17919 117297 1 286 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.156 0.494 17919 117298 1 286 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.424 0.866 17919 117299 1 286 . 1 1 29 29 LYS H H 29 7.850 7.850 7.693 0.157 17919 117300 1 286 . 1 1 30 30 ILE N N 30 121.080 121.080 120.770 0.310 17919 117301 1 286 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.597 -0.090 17919 117302 1 286 . 1 1 30 30 ILE C C 30 178.310 178.310 177.232 1.078 17919 117303 1 286 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.321 0.829 17919 117304 1 286 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.761 -0.961 17919 117305 1 286 . 1 1 30 30 ILE H H 30 8.280 8.280 8.308 -0.028 17919 117306 1 286 . 1 1 31 31 GLN N N 31 123.490 123.490 120.801 2.689 17919 117307 1 286 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.959 -0.130 17919 117308 1 286 . 1 1 31 31 GLN C C 31 178.890 178.890 178.202 0.688 17919 117309 1 286 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.459 0.541 17919 117310 1 286 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.453 -0.734 17919 117311 1 286 . 1 1 31 31 GLN H H 31 8.580 8.580 8.013 0.567 17919 117312 1 286 . 1 1 32 32 ASP N N 32 119.360 119.360 118.710 0.650 17919 117313 1 286 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.407 -0.053 17919 117314 1 286 . 1 1 32 32 ASP C C 32 177.250 177.250 178.101 -0.851 17919 117315 1 286 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.552 0.638 17919 117316 1 286 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.670 -0.090 17919 117317 1 286 . 1 1 32 32 ASP H H 32 8.010 8.010 8.041 -0.031 17919 117318 1 286 . 1 1 33 33 LYS N N 33 115.130 115.130 119.213 -4.083 17919 117319 1 286 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.204 0.133 17919 117320 1 286 . 1 1 33 33 LYS C C 33 177.870 177.870 178.551 -0.681 17919 117321 1 286 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.321 -0.271 17919 117322 1 286 . 1 1 33 33 LYS CB C 33 34.170 34.170 32.996 1.174 17919 117323 1 286 . 1 1 33 33 LYS H H 33 7.430 7.430 7.583 -0.153 17919 117324 1 286 . 1 1 34 34 GLU N N 34 113.870 113.870 114.710 -0.840 17919 117325 1 286 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.521 0.104 17919 117326 1 286 . 1 1 34 34 GLU C C 34 177.840 177.840 177.244 0.596 17919 117327 1 286 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.872 -0.702 17919 117328 1 286 . 1 1 34 34 GLU CB C 34 32.660 32.660 30.790 1.870 17919 117329 1 286 . 1 1 34 34 GLU H H 34 8.740 8.740 8.317 0.423 17919 117330 1 286 . 1 1 35 35 GLY N N 35 108.650 108.650 108.554 0.096 17919 117331 1 286 . 1 1 35 35 GLY C C 35 173.960 173.960 174.165 -0.205 17919 117332 1 286 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.511 0.569 17919 117333 1 286 . 1 1 35 35 GLY H H 35 8.530 8.530 8.312 0.218 17919 117334 1 286 . 1 1 36 36 ILE N N 36 119.880 119.880 121.860 -1.980 17919 117335 1 286 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.310 0.135 17919 117336 1 286 . 1 1 36 36 ILE C C 36 173.590 173.590 174.087 -0.497 17919 117337 1 286 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.698 0.052 17919 117338 1 286 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.815 1.765 17919 117339 1 286 . 1 1 36 36 ILE H H 36 6.150 6.150 7.542 -1.392 17919 117340 1 286 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.857 -0.223 17919 117341 1 286 . 1 1 37 37 PRO C C 37 176.940 176.940 176.411 0.529 17919 117342 1 286 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.819 -0.159 17919 117343 1 286 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.468 0.383 17919 117344 1 286 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.208 -0.091 17919 117345 1 286 . 1 1 38 38 PRO C C 38 178.320 178.320 178.474 -0.154 17919 117346 1 286 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.437 0.823 17919 117347 1 286 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.982 0.908 17919 117348 1 286 . 1 1 39 39 ASP N N 39 113.380 113.380 115.945 -2.565 17919 117349 1 286 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.358 0.072 17919 117350 1 286 . 1 1 39 39 ASP C C 39 177.090 177.090 177.326 -0.236 17919 117351 1 286 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.574 -0.934 17919 117352 1 286 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.227 -0.687 17919 117353 1 286 . 1 1 39 39 ASP H H 39 8.550 8.550 8.729 -0.179 17919 117354 1 286 . 1 1 40 40 GLN N N 40 116.780 116.780 115.317 1.463 17919 117355 1 286 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.339 0.125 17919 117356 1 286 . 1 1 40 40 GLN C C 40 175.380 175.380 175.757 -0.377 17919 117357 1 286 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.921 -0.281 17919 117358 1 286 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.189 0.951 17919 117359 1 286 . 1 1 40 40 GLN H H 40 7.820 7.820 7.639 0.181 17919 117360 1 286 . 1 1 41 41 GLN N N 41 117.720 117.720 119.231 -1.511 17919 117361 1 286 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.423 -0.179 17919 117362 1 286 . 1 1 41 41 GLN C C 41 176.300 176.300 174.654 1.646 17919 117363 1 286 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.920 0.550 17919 117364 1 286 . 1 1 41 41 GLN CB C 41 31.650 31.650 30.062 1.588 17919 117365 1 286 . 1 1 41 41 GLN H H 41 7.480 7.480 7.634 -0.154 17919 117366 1 286 . 1 1 42 42 ARG N N 42 122.680 122.680 124.330 -1.650 17919 117367 1 286 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.656 -0.156 17919 117368 1 286 . 1 1 42 42 ARG C C 42 174.050 174.050 174.198 -0.148 17919 117369 1 286 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.541 0.509 17919 117370 1 286 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.115 -1.365 17919 117371 1 286 . 1 1 42 42 ARG H H 42 8.530 8.530 8.456 0.074 17919 117372 1 286 . 1 1 43 43 LEU N N 43 124.040 124.040 127.086 -3.046 17919 117373 1 286 . 1 1 43 43 LEU C C 43 175.290 175.290 175.872 -0.582 17919 117374 1 286 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.009 -1.029 17919 117375 1 286 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.977 1.813 17919 117376 1 286 . 1 1 43 43 LEU H H 43 8.820 8.820 8.822 -0.002 17919 117377 1 286 . 1 1 44 44 ILE N N 44 121.920 121.920 121.768 0.152 17919 117378 1 286 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.062 -0.070 17919 117379 1 286 . 1 1 44 44 ILE C C 44 176.060 176.060 174.270 1.790 17919 117380 1 286 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.378 -1.398 17919 117381 1 286 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.954 -0.534 17919 117382 1 286 . 1 1 44 44 ILE H H 44 9.030 9.030 8.910 0.120 17919 117383 1 286 . 1 1 45 45 PHE N N 45 125.390 125.390 127.119 -1.729 17919 117384 1 286 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.029 0.016 17919 117385 1 286 . 1 1 45 45 PHE C C 45 174.470 174.470 174.565 -0.095 17919 117386 1 286 . 1 1 45 45 PHE CA C 45 57.020 57.020 55.911 1.109 17919 117387 1 286 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.172 0.588 17919 117388 1 286 . 1 1 45 45 PHE H H 45 8.830 8.830 8.956 -0.126 17919 117389 1 286 . 1 1 46 46 ALA N N 46 132.200 132.200 129.167 3.033 17919 117390 1 286 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.657 0.033 17919 117391 1 286 . 1 1 46 46 ALA C C 46 177.290 177.290 177.912 -0.622 17919 117392 1 286 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.763 -0.223 17919 117393 1 286 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.754 -0.184 17919 117394 1 286 . 1 1 46 46 ALA H H 46 8.810 8.810 8.818 -0.008 17919 117395 1 286 . 1 1 47 47 GLY N N 47 102.340 102.340 102.940 -0.600 17919 117396 1 286 . 1 1 47 47 GLY C C 47 173.810 173.810 174.244 -0.434 17919 117397 1 286 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.073 0.277 17919 117398 1 286 . 1 1 47 47 GLY H H 47 8.130 8.130 8.399 -0.269 17919 117399 1 286 . 1 1 48 48 LYS N N 48 121.570 121.570 121.435 0.135 17919 117400 1 286 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.717 -0.095 17919 117401 1 286 . 1 1 48 48 LYS C C 48 174.700 174.700 175.204 -0.504 17919 117402 1 286 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.289 0.261 17919 117403 1 286 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.437 0.093 17919 117404 1 286 . 1 1 48 48 LYS H H 48 7.980 7.980 7.990 -0.010 17919 117405 1 286 . 1 1 49 49 GLN N N 49 122.410 122.410 122.082 0.328 17919 117406 1 286 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.688 -0.128 17919 117407 1 286 . 1 1 49 49 GLN C C 49 175.670 175.670 175.492 0.178 17919 117408 1 286 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.844 -0.104 17919 117409 1 286 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.183 -0.183 17919 117410 1 286 . 1 1 49 49 GLN H H 49 8.600 8.600 8.499 0.101 17919 117411 1 286 . 1 1 50 50 LEU N N 50 125.520 125.520 125.977 -0.457 17919 117412 1 286 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.360 -0.270 17919 117413 1 286 . 1 1 50 50 LEU C C 50 176.660 176.660 176.463 0.197 17919 117414 1 286 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.095 0.145 17919 117415 1 286 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.513 -0.943 17919 117416 1 286 . 1 1 50 50 LEU H H 50 8.530 8.530 8.457 0.073 17919 117417 1 286 . 1 1 51 51 GLU N N 51 122.940 122.940 122.731 0.209 17919 117418 1 286 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.517 -0.029 17919 117419 1 286 . 1 1 51 51 GLU C C 51 175.870 175.870 177.036 -1.166 17919 117420 1 286 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.510 0.450 17919 117421 1 286 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.721 -0.151 17919 117422 1 286 . 1 1 51 51 GLU H H 51 8.400 8.400 8.524 -0.124 17919 117423 1 286 . 1 1 52 52 ASP N N 52 120.030 120.030 123.746 -3.716 17919 117424 1 286 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.422 -0.063 17919 117425 1 286 . 1 1 52 52 ASP C C 52 177.330 177.330 177.762 -0.432 17919 117426 1 286 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.745 -0.785 17919 117427 1 286 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.736 0.114 17919 117428 1 286 . 1 1 52 52 ASP H H 52 8.160 8.160 8.841 -0.681 17919 117429 1 286 . 1 1 53 53 GLY N N 53 106.660 106.660 105.335 1.325 17919 117430 1 286 . 1 1 53 53 GLY C C 53 174.870 174.870 173.971 0.899 17919 117431 1 286 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.618 0.552 17919 117432 1 286 . 1 1 53 53 GLY H H 53 9.390 9.390 8.396 0.994 17919 117433 1 286 . 1 1 54 54 ARG N N 54 119.050 119.050 120.884 -1.834 17919 117434 1 286 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.610 0.085 17919 117435 1 286 . 1 1 54 54 ARG C C 54 175.350 175.350 176.002 -0.652 17919 117436 1 286 . 1 1 54 54 ARG CA C 54 54.390 54.390 53.703 0.687 17919 117437 1 286 . 1 1 54 54 ARG CB C 54 32.650 32.650 31.872 0.778 17919 117438 1 286 . 1 1 54 54 ARG H H 54 7.460 7.460 7.495 -0.035 17919 117439 1 286 . 1 1 55 55 THR N N 55 108.400 108.400 113.590 -5.190 17919 117440 1 286 . 1 1 55 55 THR HA H 55 5.240 5.240 4.603 0.637 17919 117441 1 286 . 1 1 55 55 THR C C 55 176.560 176.560 176.322 0.238 17919 117442 1 286 . 1 1 55 55 THR CA C 55 59.690 59.690 61.298 -1.608 17919 117443 1 286 . 1 1 55 55 THR CB C 55 72.260 72.260 70.317 1.942 17919 117444 1 286 . 1 1 55 55 THR H H 55 8.730 8.730 8.757 -0.027 17919 117445 1 286 . 1 1 56 56 LEU N N 56 117.920 117.920 122.811 -4.891 17919 117446 1 286 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.072 -0.012 17919 117447 1 286 . 1 1 56 56 LEU C C 56 180.810 180.810 178.837 1.973 17919 117448 1 286 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.218 0.492 17919 117449 1 286 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.355 -0.985 17919 117450 1 286 . 1 1 56 56 LEU H H 56 8.140 8.140 8.445 -0.305 17919 117451 1 286 . 1 1 57 57 SER N N 57 113.330 113.330 115.108 -1.778 17919 117452 1 286 . 1 1 57 57 SER HA H 57 4.370 4.370 4.109 0.261 17919 117453 1 286 . 1 1 57 57 SER C C 57 178.310 178.310 176.690 1.620 17919 117454 1 286 . 1 1 57 57 SER CA C 57 61.080 61.080 62.047 -0.967 17919 117455 1 286 . 1 1 57 57 SER CB C 57 62.530 62.530 62.691 -0.161 17919 117456 1 286 . 1 1 57 57 SER H H 57 8.470 8.470 8.387 0.083 17919 117457 1 286 . 1 1 58 58 ASP N N 58 124.190 124.190 121.340 2.850 17919 117458 1 286 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.382 -0.086 17919 117459 1 286 . 1 1 58 58 ASP C C 58 177.400 177.400 176.908 0.492 17919 117460 1 286 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.487 0.693 17919 117461 1 286 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.493 -0.394 17919 117462 1 286 . 1 1 58 58 ASP H H 58 7.930 7.930 7.732 0.198 17919 117463 1 286 . 1 1 59 59 TYR N N 59 115.510 115.510 116.361 -0.851 17919 117464 1 286 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.754 -0.084 17919 117465 1 286 . 1 1 59 59 TYR C C 59 174.700 174.700 174.924 -0.224 17919 117466 1 286 . 1 1 59 59 TYR CA C 59 58.250 58.250 56.808 1.442 17919 117467 1 286 . 1 1 59 59 TYR CB C 59 40.070 40.070 37.843 2.228 17919 117468 1 286 . 1 1 59 59 TYR H H 59 7.250 7.250 7.286 -0.036 17919 117469 1 286 . 1 1 60 60 ASN N N 60 115.900 115.900 117.910 -2.010 17919 117470 1 286 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.319 0.036 17919 117471 1 286 . 1 1 60 60 ASN C C 60 174.340 174.340 174.354 -0.014 17919 117472 1 286 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.345 -0.225 17919 117473 1 286 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.608 -0.198 17919 117474 1 286 . 1 1 60 60 ASN H H 60 8.150 8.150 7.778 0.372 17919 117475 1 286 . 1 1 61 61 ILE N N 61 118.600 118.600 120.002 -1.402 17919 117476 1 286 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.809 -0.416 17919 117477 1 286 . 1 1 61 61 ILE C C 61 174.610 174.610 175.067 -0.457 17919 117478 1 286 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.793 0.627 17919 117479 1 286 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.723 -0.983 17919 117480 1 286 . 1 1 61 61 ILE H H 61 7.250 7.250 7.393 -0.143 17919 117481 1 286 . 1 1 62 62 GLN N N 62 124.740 124.740 126.526 -1.786 17919 117482 1 286 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.615 -0.109 17919 117483 1 286 . 1 1 62 62 GLN C C 62 175.970 175.970 175.659 0.311 17919 117484 1 286 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.715 -0.055 17919 117485 1 286 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.365 0.285 17919 117486 1 286 . 1 1 62 62 GLN H H 62 7.610 7.610 8.087 -0.477 17919 117487 1 286 . 1 1 63 63 LYS N N 63 120.300 120.300 119.361 0.939 17919 117488 1 286 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.271 -0.270 17919 117489 1 286 . 1 1 63 63 LYS C C 63 175.810 175.810 177.290 -1.480 17919 117490 1 286 . 1 1 63 63 LYS CA C 63 57.790 57.790 56.593 1.197 17919 117491 1 286 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.678 -0.028 17919 117492 1 286 . 1 1 63 63 LYS H H 63 8.490 8.490 8.497 -0.007 17919 117493 1 286 . 1 1 64 64 GLU N N 64 113.950 113.950 118.824 -4.874 17919 117494 1 286 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.128 0.337 17919 117495 1 286 . 1 1 64 64 GLU C C 64 175.250 175.250 175.844 -0.594 17919 117496 1 286 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.478 0.412 17919 117497 1 286 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.905 -3.006 17919 117498 1 286 . 1 1 64 64 GLU H H 64 9.280 9.280 8.839 0.441 17919 117499 1 286 . 1 1 65 65 SER N N 65 114.730 114.730 115.533 -0.803 17919 117500 1 286 . 1 1 65 65 SER HA H 65 4.640 4.640 4.415 0.225 17919 117501 1 286 . 1 1 65 65 SER C C 65 172.160 172.160 173.660 -1.500 17919 117502 1 286 . 1 1 65 65 SER CA C 65 60.890 60.890 60.339 0.551 17919 117503 1 286 . 1 1 65 65 SER CB C 65 64.910 64.910 64.195 0.715 17919 117504 1 286 . 1 1 65 65 SER H H 65 7.670 7.670 7.250 0.420 17919 117505 1 286 . 1 1 66 66 THR N N 66 117.110 117.110 118.457 -1.347 17919 117506 1 286 . 1 1 66 66 THR HA H 66 5.270 5.270 5.159 0.111 17919 117507 1 286 . 1 1 66 66 THR C C 66 173.950 173.950 174.227 -0.277 17919 117508 1 286 . 1 1 66 66 THR CA C 66 62.340 62.340 61.914 0.426 17919 117509 1 286 . 1 1 66 66 THR CB C 66 70.080 70.080 70.730 -0.650 17919 117510 1 286 . 1 1 66 66 THR H H 66 8.730 8.730 8.556 0.174 17919 117511 1 286 . 1 1 67 67 LEU N N 67 127.110 127.110 127.488 -0.378 17919 117512 1 286 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.935 0.125 17919 117513 1 286 . 1 1 67 67 LEU C C 67 175.770 175.770 175.504 0.266 17919 117514 1 286 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.261 -0.361 17919 117515 1 286 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.936 0.324 17919 117516 1 286 . 1 1 67 67 LEU H H 67 9.410 9.410 9.041 0.369 17919 117517 1 286 . 1 1 68 68 HIS N N 68 118.380 118.380 121.542 -3.162 17919 117518 1 286 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.383 -0.143 17919 117519 1 286 . 1 1 68 68 HIS C C 68 173.150 173.150 173.801 -0.651 17919 117520 1 286 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.873 0.127 17919 117521 1 286 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.102 -1.572 17919 117522 1 286 . 1 1 68 68 HIS H H 68 9.230 9.230 8.833 0.397 17919 117523 1 286 . 1 1 69 69 LEU N N 69 124.460 124.460 128.973 -4.513 17919 117524 1 286 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.221 -0.031 17919 117525 1 286 . 1 1 69 69 LEU C C 69 175.270 175.270 173.901 1.369 17919 117526 1 286 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.439 0.451 17919 117527 1 286 . 1 1 69 69 LEU CB C 69 44.380 44.380 45.344 -0.964 17919 117528 1 286 . 1 1 69 69 LEU H H 69 8.340 8.340 8.363 -0.023 17919 117529 1 286 . 1 1 70 70 VAL N N 70 126.940 126.940 126.235 0.705 17919 117530 1 286 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.289 0.061 17919 117531 1 286 . 1 1 70 70 VAL C C 70 174.000 174.000 174.648 -0.648 17919 117532 1 286 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.748 0.052 17919 117533 1 286 . 1 1 70 70 VAL CB C 70 34.910 34.910 34.451 0.459 17919 117534 1 286 . 1 1 70 70 VAL H H 70 9.200 9.200 8.974 0.226 17919 117535 1 286 . 1 1 71 71 LEU N N 71 123.130 123.130 125.563 -2.433 17919 117536 1 286 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.963 0.097 17919 117537 1 286 . 1 1 71 71 LEU C C 71 177.830 177.830 177.465 0.365 17919 117538 1 286 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.172 0.768 17919 117539 1 286 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.577 0.273 17919 117540 1 286 . 1 1 71 71 LEU H H 71 8.120 8.120 8.285 -0.165 17919 117541 1 286 . 1 1 72 72 ARG N N 72 123.490 123.490 122.578 0.912 17919 117542 1 286 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.283 0.018 17919 117543 1 286 . 1 1 72 72 ARG C C 72 175.350 175.350 176.083 -0.733 17919 117544 1 286 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.388 -0.778 17919 117545 1 286 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.832 0.518 17919 117546 1 286 . 1 1 72 72 ARG H H 72 8.580 8.580 8.447 0.133 17919 117547 1 287 . 1 1 2 2 GLN N N 2 123.220 123.220 120.696 2.524 17919 117548 1 287 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.358 -0.109 17919 117549 1 287 . 1 1 2 2 GLN C C 2 175.920 175.920 176.083 -0.163 17919 117550 1 287 . 1 1 2 2 GLN CA C 2 55.080 55.080 55.173 -0.093 17919 117551 1 287 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.366 0.394 17919 117552 1 287 . 1 1 2 2 GLN H H 2 8.900 8.900 8.428 0.472 17919 117553 1 287 . 1 1 3 3 ILE N N 3 115.340 115.340 114.784 0.556 17919 117554 1 287 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.688 -0.475 17919 117555 1 287 . 1 1 3 3 ILE C C 3 172.450 172.450 173.768 -1.318 17919 117556 1 287 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.308 0.262 17919 117557 1 287 . 1 1 3 3 ILE CB C 3 42.210 42.210 42.156 0.054 17919 117558 1 287 . 1 1 3 3 ILE H H 3 8.320 8.320 8.513 -0.193 17919 117559 1 287 . 1 1 4 4 PHE N N 4 118.110 118.110 119.023 -0.913 17919 117560 1 287 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.370 0.260 17919 117561 1 287 . 1 1 4 4 PHE C C 4 175.320 175.320 174.837 0.483 17919 117562 1 287 . 1 1 4 4 PHE CA C 4 55.210 55.210 56.408 -1.198 17919 117563 1 287 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.185 -0.705 17919 117564 1 287 . 1 1 4 4 PHE H H 4 8.610 8.610 8.245 0.365 17919 117565 1 287 . 1 1 5 5 VAL N N 5 121.000 121.000 124.578 -3.578 17919 117566 1 287 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.866 -0.141 17919 117567 1 287 . 1 1 5 5 VAL C C 5 174.870 174.870 174.708 0.162 17919 117568 1 287 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.448 -0.828 17919 117569 1 287 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.471 0.759 17919 117570 1 287 . 1 1 5 5 VAL H H 5 9.300 9.300 9.382 -0.082 17919 117571 1 287 . 1 1 6 6 LYS N N 6 127.520 127.520 129.784 -2.264 17919 117572 1 287 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.088 0.279 17919 117573 1 287 . 1 1 6 6 LYS C C 6 177.140 177.140 176.242 0.898 17919 117574 1 287 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.218 0.302 17919 117575 1 287 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.200 0.850 17919 117576 1 287 . 1 1 6 6 LYS H H 6 8.820 8.820 9.390 -0.570 17919 117577 1 287 . 1 1 7 7 THR N N 7 115.400 115.400 118.882 -3.482 17919 117578 1 287 . 1 1 7 7 THR HA H 7 4.970 4.970 4.861 0.109 17919 117579 1 287 . 1 1 7 7 THR C C 7 176.910 176.910 176.076 0.834 17919 117580 1 287 . 1 1 7 7 THR CA C 7 60.470 60.470 60.946 -0.476 17919 117581 1 287 . 1 1 7 7 THR CB C 7 70.630 70.630 70.327 0.303 17919 117582 1 287 . 1 1 7 7 THR H H 7 8.730 8.730 8.960 -0.230 17919 117583 1 287 . 1 1 8 8 LEU N N 8 121.330 121.330 122.976 -1.646 17919 117584 1 287 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.225 0.085 17919 117585 1 287 . 1 1 8 8 LEU C C 8 178.800 178.800 177.654 1.146 17919 117586 1 287 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.688 -0.108 17919 117587 1 287 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.061 -0.091 17919 117588 1 287 . 1 1 8 8 LEU H H 8 9.100 9.100 8.533 0.567 17919 117589 1 287 . 1 1 9 9 THR N N 9 105.590 105.590 110.000 -4.410 17919 117590 1 287 . 1 1 9 9 THR HA H 9 4.428 4.428 4.345 0.083 17919 117591 1 287 . 1 1 9 9 THR C C 9 175.520 175.520 175.158 0.362 17919 117592 1 287 . 1 1 9 9 THR CA C 9 61.400 61.400 62.072 -0.672 17919 117593 1 287 . 1 1 9 9 THR CB C 9 69.140 69.140 68.292 0.848 17919 117594 1 287 . 1 1 9 9 THR H H 9 7.630 7.630 7.671 -0.041 17919 117595 1 287 . 1 1 10 10 GLY N N 10 108.890 108.890 109.887 -0.997 17919 117596 1 287 . 1 1 10 10 GLY C C 10 174.070 174.070 173.883 0.187 17919 117597 1 287 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.333 0.127 17919 117598 1 287 . 1 1 10 10 GLY H H 10 7.810 7.810 7.737 0.073 17919 117599 1 287 . 1 1 11 11 LYS N N 11 121.600 121.600 120.993 0.607 17919 117600 1 287 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.541 -0.180 17919 117601 1 287 . 1 1 11 11 LYS C C 11 175.940 175.940 175.132 0.808 17919 117602 1 287 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.162 0.118 17919 117603 1 287 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.728 -0.528 17919 117604 1 287 . 1 1 11 11 LYS H H 11 7.280 7.280 7.677 -0.397 17919 117605 1 287 . 1 1 12 12 THR N N 12 120.440 120.440 118.507 1.933 17919 117606 1 287 . 1 1 12 12 THR HA H 12 5.046 5.046 5.471 -0.425 17919 117607 1 287 . 1 1 12 12 THR C C 12 174.320 174.320 174.364 -0.044 17919 117608 1 287 . 1 1 12 12 THR CA C 12 62.390 62.390 61.437 0.953 17919 117609 1 287 . 1 1 12 12 THR CB C 12 69.910 69.910 70.515 -0.605 17919 117610 1 287 . 1 1 12 12 THR H H 12 8.650 8.650 8.256 0.394 17919 117611 1 287 . 1 1 13 13 ILE N N 13 127.110 127.110 120.253 6.857 17919 117612 1 287 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.704 -0.160 17919 117613 1 287 . 1 1 13 13 ILE C C 13 175.220 175.220 174.442 0.778 17919 117614 1 287 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.228 0.752 17919 117615 1 287 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.232 -0.282 17919 117616 1 287 . 1 1 13 13 ILE H H 13 9.450 9.450 9.244 0.206 17919 117617 1 287 . 1 1 14 14 THR N N 14 121.520 121.520 119.879 1.641 17919 117618 1 287 . 1 1 14 14 THR HA H 14 4.964 4.964 4.989 -0.025 17919 117619 1 287 . 1 1 14 14 THR C C 14 173.790 173.790 173.705 0.085 17919 117620 1 287 . 1 1 14 14 THR CA C 14 61.940 61.940 61.074 0.866 17919 117621 1 287 . 1 1 14 14 THR CB C 14 69.650 69.650 70.004 -0.354 17919 117622 1 287 . 1 1 14 14 THR H H 14 8.710 8.710 8.502 0.208 17919 117623 1 287 . 1 1 15 15 LEU N N 15 124.800 124.800 124.189 0.611 17919 117624 1 287 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.657 0.123 17919 117625 1 287 . 1 1 15 15 LEU C C 15 174.670 174.670 174.415 0.255 17919 117626 1 287 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.529 -0.699 17919 117627 1 287 . 1 1 15 15 LEU CB C 15 47.070 47.070 46.108 0.962 17919 117628 1 287 . 1 1 15 15 LEU H H 15 8.710 8.710 8.518 0.192 17919 117629 1 287 . 1 1 16 16 GLU N N 16 122.160 122.160 122.582 -0.422 17919 117630 1 287 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.055 -0.138 17919 117631 1 287 . 1 1 16 16 GLU C C 16 175.860 175.860 175.953 -0.093 17919 117632 1 287 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.371 -0.551 17919 117633 1 287 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.396 -0.946 17919 117634 1 287 . 1 1 16 16 GLU H H 16 8.140 8.140 8.571 -0.431 17919 117635 1 287 . 1 1 17 17 VAL N N 17 117.210 117.210 121.756 -4.546 17919 117636 1 287 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.888 -0.174 17919 117637 1 287 . 1 1 17 17 VAL C C 17 174.160 174.160 174.610 -0.450 17919 117638 1 287 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.751 -1.321 17919 117639 1 287 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.982 0.418 17919 117640 1 287 . 1 1 17 17 VAL H H 17 8.900 8.900 8.851 0.049 17919 117641 1 287 . 1 1 18 18 GLU N N 18 118.990 118.990 119.349 -0.359 17919 117642 1 287 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.832 0.247 17919 117643 1 287 . 1 1 18 18 GLU C C 18 176.160 176.160 175.616 0.544 17919 117644 1 287 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.901 -0.181 17919 117645 1 287 . 1 1 18 18 GLU CB C 18 30.310 30.310 31.411 -1.101 17919 117646 1 287 . 1 1 18 18 GLU H H 18 8.640 8.640 8.640 -0.000 17919 117647 1 287 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.329 -0.188 17919 117648 1 287 . 1 1 19 19 PRO C C 19 175.310 175.310 177.362 -2.052 17919 117649 1 287 . 1 1 19 19 PRO CA C 19 65.470 65.470 64.821 0.649 17919 117650 1 287 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.813 0.137 17919 117651 1 287 . 1 1 20 20 SER N N 20 103.400 103.400 111.037 -7.637 17919 117652 1 287 . 1 1 20 20 SER HA H 20 4.370 4.370 4.393 -0.023 17919 117653 1 287 . 1 1 20 20 SER C C 20 174.660 174.660 174.444 0.216 17919 117654 1 287 . 1 1 20 20 SER CA C 20 57.400 57.400 57.788 -0.388 17919 117655 1 287 . 1 1 20 20 SER CB C 20 63.370 63.370 62.997 0.373 17919 117656 1 287 . 1 1 20 20 SER H H 20 7.040 7.040 8.038 -0.998 17919 117657 1 287 . 1 1 21 21 ASP N N 21 123.480 123.480 125.111 -1.631 17919 117658 1 287 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.736 -0.041 17919 117659 1 287 . 1 1 21 21 ASP C C 21 176.360 176.360 175.479 0.881 17919 117660 1 287 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.068 0.632 17919 117661 1 287 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.282 -0.482 17919 117662 1 287 . 1 1 21 21 ASP H H 21 8.030 8.030 8.168 -0.138 17919 117663 1 287 . 1 1 22 22 THR N N 22 108.800 108.800 110.546 -1.746 17919 117664 1 287 . 1 1 22 22 THR HA H 22 4.920 4.920 4.918 0.002 17919 117665 1 287 . 1 1 22 22 THR C C 22 176.750 176.750 176.112 0.638 17919 117666 1 287 . 1 1 22 22 THR CA C 22 59.690 59.690 60.892 -1.202 17919 117667 1 287 . 1 1 22 22 THR CB C 22 71.200 71.200 70.763 0.438 17919 117668 1 287 . 1 1 22 22 THR H H 22 7.900 7.900 8.226 -0.326 17919 117669 1 287 . 1 1 23 23 ILE N N 23 121.190 121.190 121.571 -0.381 17919 117670 1 287 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.936 -0.279 17919 117671 1 287 . 1 1 23 23 ILE C C 23 179.040 179.040 177.298 1.742 17919 117672 1 287 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.267 -0.007 17919 117673 1 287 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.538 -2.188 17919 117674 1 287 . 1 1 23 23 ILE H H 23 8.560 8.560 8.472 0.088 17919 117675 1 287 . 1 1 24 24 GLU N N 24 120.830 120.830 122.082 -1.252 17919 117676 1 287 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.877 0.040 17919 117677 1 287 . 1 1 24 24 GLU C C 24 178.640 178.640 178.466 0.174 17919 117678 1 287 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.226 -0.006 17919 117679 1 287 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.363 -1.083 17919 117680 1 287 . 1 1 24 24 GLU H H 24 9.760 9.760 8.125 1.635 17919 117681 1 287 . 1 1 25 25 ASN N N 25 120.570 120.570 117.850 2.720 17919 117682 1 287 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.495 0.030 17919 117683 1 287 . 1 1 25 25 ASN C C 25 178.380 178.380 177.935 0.445 17919 117684 1 287 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.966 0.094 17919 117685 1 287 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.767 -0.317 17919 117686 1 287 . 1 1 25 25 ASN H H 25 7.920 7.920 7.644 0.276 17919 117687 1 287 . 1 1 26 26 VAL N N 26 121.710 121.710 120.581 1.129 17919 117688 1 287 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.519 -0.122 17919 117689 1 287 . 1 1 26 26 VAL C C 26 177.950 177.950 177.711 0.239 17919 117690 1 287 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.686 0.974 17919 117691 1 287 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.599 -0.759 17919 117692 1 287 . 1 1 26 26 VAL H H 26 8.070 8.070 7.690 0.380 17919 117693 1 287 . 1 1 27 27 LYS N N 27 118.860 118.860 119.944 -1.084 17919 117694 1 287 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.156 0.424 17919 117695 1 287 . 1 1 27 27 LYS C C 27 180.550 180.550 178.988 1.562 17919 117696 1 287 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.751 -0.501 17919 117697 1 287 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.185 1.545 17919 117698 1 287 . 1 1 27 27 LYS H H 27 8.560 8.560 8.393 0.167 17919 117699 1 287 . 1 1 28 28 ALA N N 28 123.440 123.440 121.617 1.823 17919 117700 1 287 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.121 0.039 17919 117701 1 287 . 1 1 28 28 ALA C C 28 180.300 180.300 179.306 0.994 17919 117702 1 287 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.058 0.312 17919 117703 1 287 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.400 -0.690 17919 117704 1 287 . 1 1 28 28 ALA H H 28 8.060 8.060 7.753 0.307 17919 117705 1 287 . 1 1 29 29 LYS N N 29 119.940 119.940 119.026 0.914 17919 117706 1 287 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.085 0.122 17919 117707 1 287 . 1 1 29 29 LYS C C 29 180.320 180.320 179.122 1.198 17919 117708 1 287 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.178 0.472 17919 117709 1 287 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.410 0.880 17919 117710 1 287 . 1 1 29 29 LYS H H 29 7.850 7.850 7.504 0.346 17919 117711 1 287 . 1 1 30 30 ILE N N 30 121.080 121.080 121.580 -0.500 17919 117712 1 287 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.560 -0.053 17919 117713 1 287 . 1 1 30 30 ILE C C 30 178.310 178.310 177.557 0.753 17919 117714 1 287 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.539 0.611 17919 117715 1 287 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.740 -0.940 17919 117716 1 287 . 1 1 30 30 ILE H H 30 8.280 8.280 8.351 -0.071 17919 117717 1 287 . 1 1 31 31 GLN N N 31 123.490 123.490 120.136 3.354 17919 117718 1 287 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.856 -0.027 17919 117719 1 287 . 1 1 31 31 GLN C C 31 178.890 178.890 178.446 0.444 17919 117720 1 287 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.270 0.730 17919 117721 1 287 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.488 -0.768 17919 117722 1 287 . 1 1 31 31 GLN H H 31 8.580 8.580 8.525 0.055 17919 117723 1 287 . 1 1 32 32 ASP N N 32 119.360 119.360 119.716 -0.356 17919 117724 1 287 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.392 -0.038 17919 117725 1 287 . 1 1 32 32 ASP C C 32 177.250 177.250 178.022 -0.772 17919 117726 1 287 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.804 0.386 17919 117727 1 287 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.837 -0.257 17919 117728 1 287 . 1 1 32 32 ASP H H 32 8.010 8.010 8.425 -0.415 17919 117729 1 287 . 1 1 33 33 LYS N N 33 115.130 115.130 117.690 -2.560 17919 117730 1 287 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.255 0.082 17919 117731 1 287 . 1 1 33 33 LYS C C 33 177.870 177.870 177.861 0.009 17919 117732 1 287 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.321 -0.271 17919 117733 1 287 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.520 0.650 17919 117734 1 287 . 1 1 33 33 LYS H H 33 7.430 7.430 7.591 -0.161 17919 117735 1 287 . 1 1 34 34 GLU N N 34 113.870 113.870 114.455 -0.585 17919 117736 1 287 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.461 0.164 17919 117737 1 287 . 1 1 34 34 GLU C C 34 177.840 177.840 176.942 0.898 17919 117738 1 287 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.114 -0.944 17919 117739 1 287 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.888 0.772 17919 117740 1 287 . 1 1 34 34 GLU H H 34 8.740 8.740 8.029 0.711 17919 117741 1 287 . 1 1 35 35 GLY N N 35 108.650 108.650 108.371 0.279 17919 117742 1 287 . 1 1 35 35 GLY C C 35 173.960 173.960 174.293 -0.333 17919 117743 1 287 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.897 0.183 17919 117744 1 287 . 1 1 35 35 GLY H H 35 8.530 8.530 8.358 0.172 17919 117745 1 287 . 1 1 36 36 ILE N N 36 119.880 119.880 123.124 -3.244 17919 117746 1 287 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.383 0.062 17919 117747 1 287 . 1 1 36 36 ILE C C 36 173.590 173.590 174.618 -1.028 17919 117748 1 287 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.248 0.502 17919 117749 1 287 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.550 2.030 17919 117750 1 287 . 1 1 36 36 ILE H H 36 6.150 6.150 7.695 -1.545 17919 117751 1 287 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.757 -0.123 17919 117752 1 287 . 1 1 37 37 PRO C C 37 176.940 176.940 176.328 0.612 17919 117753 1 287 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.396 0.264 17919 117754 1 287 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.818 0.032 17919 117755 1 287 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.241 -0.124 17919 117756 1 287 . 1 1 38 38 PRO C C 38 178.320 178.320 178.781 -0.461 17919 117757 1 287 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.663 0.597 17919 117758 1 287 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.902 0.988 17919 117759 1 287 . 1 1 39 39 ASP N N 39 113.380 113.380 118.029 -4.649 17919 117760 1 287 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.364 0.066 17919 117761 1 287 . 1 1 39 39 ASP C C 39 177.090 177.090 177.730 -0.640 17919 117762 1 287 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.677 -1.037 17919 117763 1 287 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.426 -0.886 17919 117764 1 287 . 1 1 39 39 ASP H H 39 8.550 8.550 8.616 -0.066 17919 117765 1 287 . 1 1 40 40 GLN N N 40 116.780 116.780 116.194 0.586 17919 117766 1 287 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.342 0.122 17919 117767 1 287 . 1 1 40 40 GLN C C 40 175.380 175.380 175.902 -0.522 17919 117768 1 287 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.501 0.139 17919 117769 1 287 . 1 1 40 40 GLN CB C 40 30.140 30.140 28.933 1.207 17919 117770 1 287 . 1 1 40 40 GLN H H 40 7.820 7.820 8.206 -0.386 17919 117771 1 287 . 1 1 41 41 GLN N N 41 117.720 117.720 119.238 -1.518 17919 117772 1 287 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.471 -0.227 17919 117773 1 287 . 1 1 41 41 GLN C C 41 176.300 176.300 175.420 0.880 17919 117774 1 287 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.002 0.468 17919 117775 1 287 . 1 1 41 41 GLN CB C 41 31.650 31.650 30.136 1.514 17919 117776 1 287 . 1 1 41 41 GLN H H 41 7.480 7.480 7.278 0.202 17919 117777 1 287 . 1 1 42 42 ARG N N 42 122.680 122.680 122.324 0.356 17919 117778 1 287 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.634 -0.134 17919 117779 1 287 . 1 1 42 42 ARG C C 42 174.050 174.050 174.659 -0.609 17919 117780 1 287 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.045 0.005 17919 117781 1 287 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.126 -0.376 17919 117782 1 287 . 1 1 42 42 ARG H H 42 8.530 8.530 8.866 -0.336 17919 117783 1 287 . 1 1 43 43 LEU N N 43 124.040 124.040 126.389 -2.349 17919 117784 1 287 . 1 1 43 43 LEU C C 43 175.290 175.290 175.502 -0.212 17919 117785 1 287 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.376 -1.396 17919 117786 1 287 . 1 1 43 43 LEU CB C 43 45.790 45.790 42.997 2.793 17919 117787 1 287 . 1 1 43 43 LEU H H 43 8.820 8.820 8.852 -0.032 17919 117788 1 287 . 1 1 44 44 ILE N N 44 121.920 121.920 122.164 -0.244 17919 117789 1 287 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.792 0.200 17919 117790 1 287 . 1 1 44 44 ILE C C 44 176.060 176.060 174.082 1.978 17919 117791 1 287 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.448 -1.468 17919 117792 1 287 . 1 1 44 44 ILE CB C 44 41.420 41.420 42.073 -0.653 17919 117793 1 287 . 1 1 44 44 ILE H H 44 9.030 9.030 9.159 -0.129 17919 117794 1 287 . 1 1 45 45 PHE N N 45 125.390 125.390 125.600 -0.210 17919 117795 1 287 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.035 0.010 17919 117796 1 287 . 1 1 45 45 PHE C C 45 174.470 174.470 174.495 -0.025 17919 117797 1 287 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.560 0.460 17919 117798 1 287 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.721 1.039 17919 117799 1 287 . 1 1 45 45 PHE H H 45 8.830 8.830 9.177 -0.347 17919 117800 1 287 . 1 1 46 46 ALA N N 46 132.200 132.200 130.931 1.269 17919 117801 1 287 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.687 0.003 17919 117802 1 287 . 1 1 46 46 ALA C C 46 177.290 177.290 177.176 0.114 17919 117803 1 287 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.822 -0.281 17919 117804 1 287 . 1 1 46 46 ALA CB C 46 16.570 16.570 17.032 -0.462 17919 117805 1 287 . 1 1 46 46 ALA H H 46 8.810 8.810 9.092 -0.282 17919 117806 1 287 . 1 1 47 47 GLY N N 47 102.340 102.340 103.589 -1.249 17919 117807 1 287 . 1 1 47 47 GLY C C 47 173.810 173.810 174.406 -0.596 17919 117808 1 287 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.309 0.041 17919 117809 1 287 . 1 1 47 47 GLY H H 47 8.130 8.130 8.535 -0.405 17919 117810 1 287 . 1 1 48 48 LYS N N 48 121.570 121.570 121.293 0.277 17919 117811 1 287 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.620 0.002 17919 117812 1 287 . 1 1 48 48 LYS C C 48 174.700 174.700 175.667 -0.967 17919 117813 1 287 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.856 -0.306 17919 117814 1 287 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.526 0.004 17919 117815 1 287 . 1 1 48 48 LYS H H 48 7.980 7.980 7.892 0.088 17919 117816 1 287 . 1 1 49 49 GLN N N 49 122.410 122.410 122.878 -0.468 17919 117817 1 287 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.417 0.143 17919 117818 1 287 . 1 1 49 49 GLN C C 49 175.670 175.670 175.866 -0.196 17919 117819 1 287 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.451 -0.711 17919 117820 1 287 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.294 -0.294 17919 117821 1 287 . 1 1 49 49 GLN H H 49 8.600 8.600 8.639 -0.039 17919 117822 1 287 . 1 1 50 50 LEU N N 50 125.520 125.520 127.763 -2.243 17919 117823 1 287 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.220 -0.130 17919 117824 1 287 . 1 1 50 50 LEU C C 50 176.660 176.660 175.530 1.130 17919 117825 1 287 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.953 0.287 17919 117826 1 287 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.721 -0.151 17919 117827 1 287 . 1 1 50 50 LEU H H 50 8.530 8.530 8.797 -0.267 17919 117828 1 287 . 1 1 51 51 GLU N N 51 122.940 122.940 123.943 -1.003 17919 117829 1 287 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.572 -0.084 17919 117830 1 287 . 1 1 51 51 GLU C C 51 175.870 175.870 176.801 -0.931 17919 117831 1 287 . 1 1 51 51 GLU CA C 51 55.960 55.960 54.687 1.274 17919 117832 1 287 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.923 -1.353 17919 117833 1 287 . 1 1 51 51 GLU H H 51 8.400 8.400 8.467 -0.067 17919 117834 1 287 . 1 1 52 52 ASP N N 52 120.030 120.030 125.659 -5.629 17919 117835 1 287 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.453 -0.094 17919 117836 1 287 . 1 1 52 52 ASP C C 52 177.330 177.330 177.628 -0.298 17919 117837 1 287 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.868 -0.908 17919 117838 1 287 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.672 0.178 17919 117839 1 287 . 1 1 52 52 ASP H H 52 8.160 8.160 8.831 -0.671 17919 117840 1 287 . 1 1 53 53 GLY N N 53 106.660 106.660 104.745 1.915 17919 117841 1 287 . 1 1 53 53 GLY C C 53 174.870 174.870 174.239 0.631 17919 117842 1 287 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.658 0.512 17919 117843 1 287 . 1 1 53 53 GLY H H 53 9.390 9.390 8.341 1.049 17919 117844 1 287 . 1 1 54 54 ARG N N 54 119.050 119.050 121.243 -2.193 17919 117845 1 287 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.586 0.109 17919 117846 1 287 . 1 1 54 54 ARG C C 54 175.350 175.350 175.791 -0.441 17919 117847 1 287 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.888 -0.498 17919 117848 1 287 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.780 -0.130 17919 117849 1 287 . 1 1 54 54 ARG H H 54 7.460 7.460 7.540 -0.080 17919 117850 1 287 . 1 1 55 55 THR N N 55 108.400 108.400 112.145 -3.745 17919 117851 1 287 . 1 1 55 55 THR HA H 55 5.240 5.240 4.919 0.321 17919 117852 1 287 . 1 1 55 55 THR C C 55 176.560 176.560 175.971 0.589 17919 117853 1 287 . 1 1 55 55 THR CA C 55 59.690 59.690 60.979 -1.289 17919 117854 1 287 . 1 1 55 55 THR CB C 55 72.260 72.260 70.464 1.796 17919 117855 1 287 . 1 1 55 55 THR H H 55 8.730 8.730 9.104 -0.374 17919 117856 1 287 . 1 1 56 56 LEU N N 56 117.920 117.920 121.643 -3.723 17919 117857 1 287 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.082 -0.022 17919 117858 1 287 . 1 1 56 56 LEU C C 56 180.810 180.810 179.043 1.767 17919 117859 1 287 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.637 0.073 17919 117860 1 287 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.478 -1.108 17919 117861 1 287 . 1 1 56 56 LEU H H 56 8.140 8.140 8.576 -0.436 17919 117862 1 287 . 1 1 57 57 SER N N 57 113.330 113.330 114.472 -1.142 17919 117863 1 287 . 1 1 57 57 SER HA H 57 4.370 4.370 4.180 0.190 17919 117864 1 287 . 1 1 57 57 SER C C 57 178.310 178.310 176.154 2.156 17919 117865 1 287 . 1 1 57 57 SER CA C 57 61.080 61.080 62.223 -1.143 17919 117866 1 287 . 1 1 57 57 SER CB C 57 62.530 62.530 62.843 -0.312 17919 117867 1 287 . 1 1 57 57 SER H H 57 8.470 8.470 8.193 0.277 17919 117868 1 287 . 1 1 58 58 ASP N N 58 124.190 124.190 121.375 2.815 17919 117869 1 287 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.428 -0.132 17919 117870 1 287 . 1 1 58 58 ASP C C 58 177.400 177.400 177.206 0.194 17919 117871 1 287 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.310 0.870 17919 117872 1 287 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.655 -0.555 17919 117873 1 287 . 1 1 58 58 ASP H H 58 7.930 7.930 7.637 0.293 17919 117874 1 287 . 1 1 59 59 TYR N N 59 115.510 115.510 116.717 -1.207 17919 117875 1 287 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.622 0.048 17919 117876 1 287 . 1 1 59 59 TYR C C 59 174.700 174.700 175.304 -0.604 17919 117877 1 287 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.625 0.625 17919 117878 1 287 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.746 1.324 17919 117879 1 287 . 1 1 59 59 TYR H H 59 7.250 7.250 7.475 -0.225 17919 117880 1 287 . 1 1 60 60 ASN N N 60 115.900 115.900 117.227 -1.327 17919 117881 1 287 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.380 -0.025 17919 117882 1 287 . 1 1 60 60 ASN C C 60 174.340 174.340 174.459 -0.119 17919 117883 1 287 . 1 1 60 60 ASN CA C 60 54.120 54.120 53.999 0.121 17919 117884 1 287 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.572 -0.162 17919 117885 1 287 . 1 1 60 60 ASN H H 60 8.150 8.150 7.550 0.600 17919 117886 1 287 . 1 1 61 61 ILE N N 61 118.600 118.600 120.760 -2.160 17919 117887 1 287 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.740 -0.347 17919 117888 1 287 . 1 1 61 61 ILE C C 61 174.610 174.610 174.741 -0.131 17919 117889 1 287 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.286 0.134 17919 117890 1 287 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.176 -0.436 17919 117891 1 287 . 1 1 61 61 ILE H H 61 7.250 7.250 8.094 -0.844 17919 117892 1 287 . 1 1 62 62 GLN N N 62 124.740 124.740 124.895 -0.155 17919 117893 1 287 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.679 -0.173 17919 117894 1 287 . 1 1 62 62 GLN C C 62 175.970 175.970 175.489 0.481 17919 117895 1 287 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.746 -0.086 17919 117896 1 287 . 1 1 62 62 GLN CB C 62 31.650 31.650 32.286 -0.636 17919 117897 1 287 . 1 1 62 62 GLN H H 62 7.610 7.610 8.311 -0.701 17919 117898 1 287 . 1 1 63 63 LYS N N 63 120.300 120.300 120.991 -0.691 17919 117899 1 287 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.078 -0.077 17919 117900 1 287 . 1 1 63 63 LYS C C 63 175.810 175.810 177.044 -1.234 17919 117901 1 287 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.463 -0.673 17919 117902 1 287 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.627 0.023 17919 117903 1 287 . 1 1 63 63 LYS H H 63 8.490 8.490 8.610 -0.120 17919 117904 1 287 . 1 1 64 64 GLU N N 64 113.950 113.950 120.440 -6.490 17919 117905 1 287 . 1 1 64 64 GLU HA H 64 3.465 3.465 4.222 -0.757 17919 117906 1 287 . 1 1 64 64 GLU C C 64 175.250 175.250 176.464 -1.214 17919 117907 1 287 . 1 1 64 64 GLU CA C 64 57.890 57.890 58.140 -0.250 17919 117908 1 287 . 1 1 64 64 GLU CB C 64 25.900 25.900 29.242 -3.342 17919 117909 1 287 . 1 1 64 64 GLU H H 64 9.280 9.280 8.708 0.572 17919 117910 1 287 . 1 1 65 65 SER N N 65 114.730 114.730 114.103 0.627 17919 117911 1 287 . 1 1 65 65 SER HA H 65 4.640 4.640 4.527 0.113 17919 117912 1 287 . 1 1 65 65 SER C C 65 172.160 172.160 173.948 -1.788 17919 117913 1 287 . 1 1 65 65 SER CA C 65 60.890 60.890 59.672 1.218 17919 117914 1 287 . 1 1 65 65 SER CB C 65 64.910 64.910 64.448 0.462 17919 117915 1 287 . 1 1 65 65 SER H H 65 7.670 7.670 7.737 -0.067 17919 117916 1 287 . 1 1 66 66 THR N N 66 117.110 117.110 117.698 -0.588 17919 117917 1 287 . 1 1 66 66 THR HA H 66 5.270 5.270 5.463 -0.193 17919 117918 1 287 . 1 1 66 66 THR C C 66 173.950 173.950 173.974 -0.024 17919 117919 1 287 . 1 1 66 66 THR CA C 66 62.340 62.340 61.956 0.384 17919 117920 1 287 . 1 1 66 66 THR CB C 66 70.080 70.080 70.141 -0.062 17919 117921 1 287 . 1 1 66 66 THR H H 66 8.730 8.730 8.377 0.353 17919 117922 1 287 . 1 1 67 67 LEU N N 67 127.110 127.110 126.710 0.400 17919 117923 1 287 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.938 0.122 17919 117924 1 287 . 1 1 67 67 LEU C C 67 175.770 175.770 174.849 0.921 17919 117925 1 287 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.002 -0.102 17919 117926 1 287 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.610 -0.350 17919 117927 1 287 . 1 1 67 67 LEU H H 67 9.410 9.410 9.304 0.106 17919 117928 1 287 . 1 1 68 68 HIS N N 68 118.380 118.380 122.129 -3.749 17919 117929 1 287 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.359 -0.119 17919 117930 1 287 . 1 1 68 68 HIS C C 68 173.150 173.150 173.646 -0.496 17919 117931 1 287 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.136 0.864 17919 117932 1 287 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.433 -1.903 17919 117933 1 287 . 1 1 68 68 HIS H H 68 9.230 9.230 9.376 -0.146 17919 117934 1 287 . 1 1 69 69 LEU N N 69 124.460 124.460 130.450 -5.990 17919 117935 1 287 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.475 0.715 17919 117936 1 287 . 1 1 69 69 LEU C C 69 175.270 175.270 173.926 1.344 17919 117937 1 287 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.624 0.266 17919 117938 1 287 . 1 1 69 69 LEU CB C 69 44.380 44.380 43.596 0.784 17919 117939 1 287 . 1 1 69 69 LEU H H 69 8.340 8.340 8.926 -0.586 17919 117940 1 287 . 1 1 70 70 VAL N N 70 126.940 126.940 127.100 -0.160 17919 117941 1 287 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.224 0.126 17919 117942 1 287 . 1 1 70 70 VAL C C 70 174.000 174.000 174.531 -0.531 17919 117943 1 287 . 1 1 70 70 VAL CA C 70 60.800 60.800 61.155 -0.355 17919 117944 1 287 . 1 1 70 70 VAL CB C 70 34.910 34.910 34.032 0.878 17919 117945 1 287 . 1 1 70 70 VAL H H 70 9.200 9.200 8.746 0.454 17919 117946 1 287 . 1 1 71 71 LEU N N 71 123.130 123.130 124.716 -1.586 17919 117947 1 287 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.859 0.201 17919 117948 1 287 . 1 1 71 71 LEU C C 71 177.830 177.830 177.408 0.422 17919 117949 1 287 . 1 1 71 71 LEU CA C 71 53.940 53.940 52.560 1.379 17919 117950 1 287 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.765 0.085 17919 117951 1 287 . 1 1 71 71 LEU H H 71 8.120 8.120 8.482 -0.362 17919 117952 1 287 . 1 1 72 72 ARG N N 72 123.490 123.490 121.865 1.625 17919 117953 1 287 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.303 -0.002 17919 117954 1 287 . 1 1 72 72 ARG C C 72 175.350 175.350 175.981 -0.631 17919 117955 1 287 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.091 -0.481 17919 117956 1 287 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.748 0.602 17919 117957 1 287 . 1 1 72 72 ARG H H 72 8.580 8.580 7.960 0.620 17919 117958 1 288 . 1 1 2 2 GLN N N 2 123.220 123.220 118.756 4.464 17919 117959 1 288 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.289 -0.040 17919 117960 1 288 . 1 1 2 2 GLN C C 2 175.920 175.920 175.987 -0.067 17919 117961 1 288 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.677 0.403 17919 117962 1 288 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.398 0.363 17919 117963 1 288 . 1 1 2 2 GLN H H 2 8.900 8.900 8.182 0.718 17919 117964 1 288 . 1 1 3 3 ILE N N 3 115.340 115.340 115.669 -0.329 17919 117965 1 288 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.450 -0.237 17919 117966 1 288 . 1 1 3 3 ILE C C 3 172.450 172.450 174.100 -1.650 17919 117967 1 288 . 1 1 3 3 ILE CA C 3 59.570 59.570 58.562 1.008 17919 117968 1 288 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.355 0.855 17919 117969 1 288 . 1 1 3 3 ILE H H 3 8.320 8.320 8.668 -0.348 17919 117970 1 288 . 1 1 4 4 PHE N N 4 118.110 118.110 118.457 -0.347 17919 117971 1 288 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.180 0.450 17919 117972 1 288 . 1 1 4 4 PHE C C 4 175.320 175.320 174.707 0.613 17919 117973 1 288 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.181 0.029 17919 117974 1 288 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.182 0.298 17919 117975 1 288 . 1 1 4 4 PHE H H 4 8.610 8.610 8.171 0.439 17919 117976 1 288 . 1 1 5 5 VAL N N 5 121.000 121.000 123.015 -2.015 17919 117977 1 288 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.805 -0.080 17919 117978 1 288 . 1 1 5 5 VAL C C 5 174.870 174.870 174.730 0.140 17919 117979 1 288 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.053 -0.434 17919 117980 1 288 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.002 0.228 17919 117981 1 288 . 1 1 5 5 VAL H H 5 9.300 9.300 9.310 -0.010 17919 117982 1 288 . 1 1 6 6 LYS N N 6 127.520 127.520 128.288 -0.768 17919 117983 1 288 . 1 1 6 6 LYS HA H 6 5.367 5.367 4.987 0.380 17919 117984 1 288 . 1 1 6 6 LYS C C 6 177.140 177.140 176.227 0.913 17919 117985 1 288 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.499 0.021 17919 117986 1 288 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.386 -0.337 17919 117987 1 288 . 1 1 6 6 LYS H H 6 8.820 8.820 9.027 -0.207 17919 117988 1 288 . 1 1 7 7 THR N N 7 115.400 115.400 119.116 -3.716 17919 117989 1 288 . 1 1 7 7 THR HA H 7 4.970 4.970 4.614 0.356 17919 117990 1 288 . 1 1 7 7 THR C C 7 176.910 176.910 176.669 0.241 17919 117991 1 288 . 1 1 7 7 THR CA C 7 60.470 60.470 61.418 -0.948 17919 117992 1 288 . 1 1 7 7 THR CB C 7 70.630 70.630 70.590 0.040 17919 117993 1 288 . 1 1 7 7 THR H H 7 8.730 8.730 8.556 0.174 17919 117994 1 288 . 1 1 8 8 LEU N N 8 121.330 121.330 121.231 0.099 17919 117995 1 288 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.072 0.238 17919 117996 1 288 . 1 1 8 8 LEU C C 8 178.800 178.800 177.689 1.111 17919 117997 1 288 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.476 0.104 17919 117998 1 288 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.516 0.454 17919 117999 1 288 . 1 1 8 8 LEU H H 8 9.100 9.100 8.962 0.138 17919 118000 1 288 . 1 1 9 9 THR N N 9 105.590 105.590 106.485 -0.895 17919 118001 1 288 . 1 1 9 9 THR HA H 9 4.428 4.428 4.418 0.010 17919 118002 1 288 . 1 1 9 9 THR C C 9 175.520 175.520 175.784 -0.264 17919 118003 1 288 . 1 1 9 9 THR CA C 9 61.400 61.400 61.712 -0.312 17919 118004 1 288 . 1 1 9 9 THR CB C 9 69.140 69.140 69.373 -0.233 17919 118005 1 288 . 1 1 9 9 THR H H 9 7.630 7.630 7.481 0.149 17919 118006 1 288 . 1 1 10 10 GLY N N 10 108.890 108.890 110.878 -1.988 17919 118007 1 288 . 1 1 10 10 GLY C C 10 174.070 174.070 173.654 0.416 17919 118008 1 288 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.408 0.052 17919 118009 1 288 . 1 1 10 10 GLY H H 10 7.810 7.810 8.301 -0.491 17919 118010 1 288 . 1 1 11 11 LYS N N 11 121.600 121.600 121.769 -0.169 17919 118011 1 288 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.200 0.161 17919 118012 1 288 . 1 1 11 11 LYS C C 11 175.940 175.940 175.618 0.322 17919 118013 1 288 . 1 1 11 11 LYS CA C 11 56.280 56.280 57.222 -0.942 17919 118014 1 288 . 1 1 11 11 LYS CB C 11 33.200 33.200 32.978 0.222 17919 118015 1 288 . 1 1 11 11 LYS H H 11 7.280 7.280 7.560 -0.280 17919 118016 1 288 . 1 1 12 12 THR N N 12 120.440 120.440 116.779 3.661 17919 118017 1 288 . 1 1 12 12 THR HA H 12 5.046 5.046 5.397 -0.351 17919 118018 1 288 . 1 1 12 12 THR C C 12 174.320 174.320 174.273 0.047 17919 118019 1 288 . 1 1 12 12 THR CA C 12 62.390 62.390 61.224 1.166 17919 118020 1 288 . 1 1 12 12 THR CB C 12 69.910 69.910 70.454 -0.544 17919 118021 1 288 . 1 1 12 12 THR H H 12 8.650 8.650 8.171 0.479 17919 118022 1 288 . 1 1 13 13 ILE N N 13 127.110 127.110 123.525 3.585 17919 118023 1 288 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.708 -0.164 17919 118024 1 288 . 1 1 13 13 ILE C C 13 175.220 175.220 174.209 1.011 17919 118025 1 288 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.546 0.434 17919 118026 1 288 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.732 0.218 17919 118027 1 288 . 1 1 13 13 ILE H H 13 9.450 9.450 9.307 0.143 17919 118028 1 288 . 1 1 14 14 THR N N 14 121.520 121.520 122.767 -1.247 17919 118029 1 288 . 1 1 14 14 THR HA H 14 4.964 4.964 5.117 -0.153 17919 118030 1 288 . 1 1 14 14 THR C C 14 173.790 173.790 173.585 0.205 17919 118031 1 288 . 1 1 14 14 THR CA C 14 61.940 61.940 61.965 -0.025 17919 118032 1 288 . 1 1 14 14 THR CB C 14 69.650 69.650 70.026 -0.376 17919 118033 1 288 . 1 1 14 14 THR H H 14 8.710 8.710 8.494 0.216 17919 118034 1 288 . 1 1 15 15 LEU N N 15 124.800 124.800 123.026 1.774 17919 118035 1 288 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.792 -0.012 17919 118036 1 288 . 1 1 15 15 LEU C C 15 174.670 174.670 174.770 -0.100 17919 118037 1 288 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.510 -0.680 17919 118038 1 288 . 1 1 15 15 LEU CB C 15 47.070 47.070 46.125 0.945 17919 118039 1 288 . 1 1 15 15 LEU H H 15 8.710 8.710 8.145 0.565 17919 118040 1 288 . 1 1 16 16 GLU N N 16 122.160 122.160 122.202 -0.042 17919 118041 1 288 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.397 -0.480 17919 118042 1 288 . 1 1 16 16 GLU C C 16 175.860 175.860 175.922 -0.062 17919 118043 1 288 . 1 1 16 16 GLU CA C 16 54.820 54.820 54.038 0.782 17919 118044 1 288 . 1 1 16 16 GLU CB C 16 29.450 29.450 29.804 -0.354 17919 118045 1 288 . 1 1 16 16 GLU H H 16 8.140 8.140 8.589 -0.449 17919 118046 1 288 . 1 1 17 17 VAL N N 17 117.210 117.210 117.840 -0.630 17919 118047 1 288 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.950 -0.236 17919 118048 1 288 . 1 1 17 17 VAL C C 17 174.160 174.160 175.046 -0.886 17919 118049 1 288 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.487 -1.057 17919 118050 1 288 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.850 0.550 17919 118051 1 288 . 1 1 17 17 VAL H H 17 8.900 8.900 8.670 0.230 17919 118052 1 288 . 1 1 18 18 GLU N N 18 118.990 118.990 120.937 -1.947 17919 118053 1 288 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.899 0.180 17919 118054 1 288 . 1 1 18 18 GLU C C 18 176.160 176.160 175.872 0.288 17919 118055 1 288 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.189 0.531 17919 118056 1 288 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.550 -0.241 17919 118057 1 288 . 1 1 18 18 GLU H H 18 8.640 8.640 8.522 0.118 17919 118058 1 288 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.207 -0.066 17919 118059 1 288 . 1 1 19 19 PRO C C 19 175.310 175.310 177.382 -2.072 17919 118060 1 288 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.623 -0.153 17919 118061 1 288 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.829 0.121 17919 118062 1 288 . 1 1 20 20 SER N N 20 103.400 103.400 108.799 -5.399 17919 118063 1 288 . 1 1 20 20 SER HA H 20 4.370 4.370 4.287 0.083 17919 118064 1 288 . 1 1 20 20 SER C C 20 174.660 174.660 174.388 0.272 17919 118065 1 288 . 1 1 20 20 SER CA C 20 57.400 57.400 58.638 -1.238 17919 118066 1 288 . 1 1 20 20 SER CB C 20 63.370 63.370 62.693 0.677 17919 118067 1 288 . 1 1 20 20 SER H H 20 7.040 7.040 8.357 -1.317 17919 118068 1 288 . 1 1 21 21 ASP N N 21 123.480 123.480 123.906 -0.426 17919 118069 1 288 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.665 0.030 17919 118070 1 288 . 1 1 21 21 ASP C C 21 176.360 176.360 176.417 -0.057 17919 118071 1 288 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.931 0.770 17919 118072 1 288 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.706 -0.906 17919 118073 1 288 . 1 1 21 21 ASP H H 21 8.030 8.030 7.601 0.429 17919 118074 1 288 . 1 1 22 22 THR N N 22 108.800 108.800 113.380 -4.580 17919 118075 1 288 . 1 1 22 22 THR HA H 22 4.920 4.920 4.861 0.059 17919 118076 1 288 . 1 1 22 22 THR C C 22 176.750 176.750 175.867 0.883 17919 118077 1 288 . 1 1 22 22 THR CA C 22 59.690 59.690 61.286 -1.596 17919 118078 1 288 . 1 1 22 22 THR CB C 22 71.200 71.200 71.006 0.194 17919 118079 1 288 . 1 1 22 22 THR H H 22 7.900 7.900 8.211 -0.311 17919 118080 1 288 . 1 1 23 23 ILE N N 23 121.190 121.190 122.684 -1.494 17919 118081 1 288 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.961 -0.304 17919 118082 1 288 . 1 1 23 23 ILE C C 23 179.040 179.040 177.606 1.434 17919 118083 1 288 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.102 0.158 17919 118084 1 288 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.614 -2.264 17919 118085 1 288 . 1 1 23 23 ILE H H 23 8.560 8.560 8.448 0.112 17919 118086 1 288 . 1 1 24 24 GLU N N 24 120.830 120.830 121.630 -0.800 17919 118087 1 288 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.886 0.031 17919 118088 1 288 . 1 1 24 24 GLU C C 24 178.640 178.640 178.403 0.237 17919 118089 1 288 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.272 -0.052 17919 118090 1 288 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.459 -1.179 17919 118091 1 288 . 1 1 24 24 GLU H H 24 9.760 9.760 8.496 1.264 17919 118092 1 288 . 1 1 25 25 ASN N N 25 120.570 120.570 117.594 2.976 17919 118093 1 288 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.583 -0.058 17919 118094 1 288 . 1 1 25 25 ASN C C 25 178.380 178.380 177.856 0.524 17919 118095 1 288 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.873 0.187 17919 118096 1 288 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.744 -0.294 17919 118097 1 288 . 1 1 25 25 ASN H H 25 7.920 7.920 7.478 0.442 17919 118098 1 288 . 1 1 26 26 VAL N N 26 121.710 121.710 120.638 1.072 17919 118099 1 288 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.640 -0.243 17919 118100 1 288 . 1 1 26 26 VAL C C 26 177.950 177.950 177.960 -0.010 17919 118101 1 288 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.216 1.444 17919 118102 1 288 . 1 1 26 26 VAL CB C 26 30.840 30.840 30.765 0.075 17919 118103 1 288 . 1 1 26 26 VAL H H 26 8.070 8.070 8.572 -0.502 17919 118104 1 288 . 1 1 27 27 LYS N N 27 118.860 118.860 119.857 -0.997 17919 118105 1 288 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.210 0.370 17919 118106 1 288 . 1 1 27 27 LYS C C 27 180.550 180.550 179.262 1.288 17919 118107 1 288 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.477 -0.227 17919 118108 1 288 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.161 1.569 17919 118109 1 288 . 1 1 27 27 LYS H H 27 8.560 8.560 8.454 0.106 17919 118110 1 288 . 1 1 28 28 ALA N N 28 123.440 123.440 122.993 0.447 17919 118111 1 288 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.042 0.118 17919 118112 1 288 . 1 1 28 28 ALA C C 28 180.300 180.300 179.306 0.994 17919 118113 1 288 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.147 0.223 17919 118114 1 288 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.302 -0.592 17919 118115 1 288 . 1 1 28 28 ALA H H 28 8.060 8.060 8.061 -0.001 17919 118116 1 288 . 1 1 29 29 LYS N N 29 119.940 119.940 118.516 1.424 17919 118117 1 288 . 1 1 29 29 LYS HA H 29 4.207 4.207 3.998 0.209 17919 118118 1 288 . 1 1 29 29 LYS C C 29 180.320 180.320 179.181 1.139 17919 118119 1 288 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.386 0.264 17919 118120 1 288 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.350 0.940 17919 118121 1 288 . 1 1 29 29 LYS H H 29 7.850 7.850 8.007 -0.157 17919 118122 1 288 . 1 1 30 30 ILE N N 30 121.080 121.080 119.180 1.900 17919 118123 1 288 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.667 -0.160 17919 118124 1 288 . 1 1 30 30 ILE C C 30 178.310 178.310 177.505 0.805 17919 118125 1 288 . 1 1 30 30 ILE CA C 30 66.150 66.150 64.759 1.391 17919 118126 1 288 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.781 -0.981 17919 118127 1 288 . 1 1 30 30 ILE H H 30 8.280 8.280 7.881 0.399 17919 118128 1 288 . 1 1 31 31 GLN N N 31 123.490 123.490 120.839 2.651 17919 118129 1 288 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.948 -0.119 17919 118130 1 288 . 1 1 31 31 GLN C C 31 178.890 178.890 178.568 0.322 17919 118131 1 288 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.252 0.748 17919 118132 1 288 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.539 -0.819 17919 118133 1 288 . 1 1 31 31 GLN H H 31 8.580 8.580 7.960 0.620 17919 118134 1 288 . 1 1 32 32 ASP N N 32 119.360 119.360 118.753 0.607 17919 118135 1 288 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.479 -0.125 17919 118136 1 288 . 1 1 32 32 ASP C C 32 177.250 177.250 177.257 -0.007 17919 118137 1 288 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.383 0.806 17919 118138 1 288 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.505 0.075 17919 118139 1 288 . 1 1 32 32 ASP H H 32 8.010 8.010 8.258 -0.248 17919 118140 1 288 . 1 1 33 33 LYS N N 33 115.130 115.130 118.817 -3.687 17919 118141 1 288 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.364 -0.027 17919 118142 1 288 . 1 1 33 33 LYS C C 33 177.870 177.870 177.754 0.116 17919 118143 1 288 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.768 0.282 17919 118144 1 288 . 1 1 33 33 LYS CB C 33 34.170 34.170 34.152 0.018 17919 118145 1 288 . 1 1 33 33 LYS H H 33 7.430 7.430 7.399 0.031 17919 118146 1 288 . 1 1 34 34 GLU N N 34 113.870 113.870 115.142 -1.272 17919 118147 1 288 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.560 0.065 17919 118148 1 288 . 1 1 34 34 GLU C C 34 177.840 177.840 176.602 1.238 17919 118149 1 288 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.833 -0.663 17919 118150 1 288 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.183 1.477 17919 118151 1 288 . 1 1 34 34 GLU H H 34 8.740 8.740 8.183 0.557 17919 118152 1 288 . 1 1 35 35 GLY N N 35 108.650 108.650 109.317 -0.667 17919 118153 1 288 . 1 1 35 35 GLY C C 35 173.960 173.960 174.473 -0.513 17919 118154 1 288 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.979 0.101 17919 118155 1 288 . 1 1 35 35 GLY H H 35 8.530 8.530 7.976 0.554 17919 118156 1 288 . 1 1 36 36 ILE N N 36 119.880 119.880 121.331 -1.451 17919 118157 1 288 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.238 0.207 17919 118158 1 288 . 1 1 36 36 ILE C C 36 173.590 173.590 173.920 -0.330 17919 118159 1 288 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.126 -0.376 17919 118160 1 288 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.765 1.815 17919 118161 1 288 . 1 1 36 36 ILE H H 36 6.150 6.150 7.583 -1.433 17919 118162 1 288 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.575 0.059 17919 118163 1 288 . 1 1 37 37 PRO C C 37 176.940 176.940 175.985 0.955 17919 118164 1 288 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.774 -0.114 17919 118165 1 288 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.430 0.420 17919 118166 1 288 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.143 -0.026 17919 118167 1 288 . 1 1 38 38 PRO C C 38 178.320 178.320 178.794 -0.474 17919 118168 1 288 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.589 0.671 17919 118169 1 288 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.884 1.006 17919 118170 1 288 . 1 1 39 39 ASP N N 39 113.380 113.380 115.837 -2.457 17919 118171 1 288 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.379 0.051 17919 118172 1 288 . 1 1 39 39 ASP C C 39 177.090 177.090 176.949 0.141 17919 118173 1 288 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.425 -0.785 17919 118174 1 288 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.548 -1.008 17919 118175 1 288 . 1 1 39 39 ASP H H 39 8.550 8.550 8.571 -0.021 17919 118176 1 288 . 1 1 40 40 GLN N N 40 116.780 116.780 115.106 1.674 17919 118177 1 288 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.612 -0.148 17919 118178 1 288 . 1 1 40 40 GLN C C 40 175.380 175.380 175.681 -0.301 17919 118179 1 288 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.806 -0.166 17919 118180 1 288 . 1 1 40 40 GLN CB C 40 30.140 30.140 30.217 -0.077 17919 118181 1 288 . 1 1 40 40 GLN H H 40 7.820 7.820 7.881 -0.061 17919 118182 1 288 . 1 1 41 41 GLN N N 41 117.720 117.720 118.825 -1.105 17919 118183 1 288 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.742 -0.498 17919 118184 1 288 . 1 1 41 41 GLN C C 41 176.300 176.300 175.216 1.084 17919 118185 1 288 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.272 1.198 17919 118186 1 288 . 1 1 41 41 GLN CB C 41 31.650 31.650 30.354 1.296 17919 118187 1 288 . 1 1 41 41 GLN H H 41 7.480 7.480 7.385 0.095 17919 118188 1 288 . 1 1 42 42 ARG N N 42 122.680 122.680 125.540 -2.860 17919 118189 1 288 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.658 -0.158 17919 118190 1 288 . 1 1 42 42 ARG C C 42 174.050 174.050 173.915 0.135 17919 118191 1 288 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.564 0.486 17919 118192 1 288 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.896 -1.146 17919 118193 1 288 . 1 1 42 42 ARG H H 42 8.530 8.530 9.135 -0.605 17919 118194 1 288 . 1 1 43 43 LEU N N 43 124.040 124.040 127.302 -3.262 17919 118195 1 288 . 1 1 43 43 LEU C C 43 175.290 175.290 175.587 -0.297 17919 118196 1 288 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.657 -1.677 17919 118197 1 288 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.490 2.300 17919 118198 1 288 . 1 1 43 43 LEU H H 43 8.820 8.820 8.871 -0.051 17919 118199 1 288 . 1 1 44 44 ILE N N 44 121.920 121.920 123.217 -1.297 17919 118200 1 288 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.857 0.135 17919 118201 1 288 . 1 1 44 44 ILE C C 44 176.060 176.060 174.241 1.819 17919 118202 1 288 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.325 -1.345 17919 118203 1 288 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.075 0.345 17919 118204 1 288 . 1 1 44 44 ILE H H 44 9.030 9.030 8.846 0.184 17919 118205 1 288 . 1 1 45 45 PHE N N 45 125.390 125.390 127.125 -1.735 17919 118206 1 288 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.154 -0.109 17919 118207 1 288 . 1 1 45 45 PHE C C 45 174.470 174.470 174.805 -0.335 17919 118208 1 288 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.023 0.997 17919 118209 1 288 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.299 0.461 17919 118210 1 288 . 1 1 45 45 PHE H H 45 8.830 8.830 9.117 -0.287 17919 118211 1 288 . 1 1 46 46 ALA N N 46 132.200 132.200 129.448 2.752 17919 118212 1 288 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.632 0.058 17919 118213 1 288 . 1 1 46 46 ALA C C 46 177.290 177.290 177.262 0.028 17919 118214 1 288 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.909 -0.369 17919 118215 1 288 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.450 0.121 17919 118216 1 288 . 1 1 46 46 ALA H H 46 8.810 8.810 8.868 -0.058 17919 118217 1 288 . 1 1 47 47 GLY N N 47 102.340 102.340 103.202 -0.862 17919 118218 1 288 . 1 1 47 47 GLY C C 47 173.810 173.810 174.182 -0.372 17919 118219 1 288 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.015 0.335 17919 118220 1 288 . 1 1 47 47 GLY H H 47 8.130 8.130 8.412 -0.282 17919 118221 1 288 . 1 1 48 48 LYS N N 48 121.570 121.570 120.833 0.737 17919 118222 1 288 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.621 0.001 17919 118223 1 288 . 1 1 48 48 LYS C C 48 174.700 174.700 175.646 -0.946 17919 118224 1 288 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.833 -0.283 17919 118225 1 288 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.601 -0.071 17919 118226 1 288 . 1 1 48 48 LYS H H 48 7.980 7.980 8.083 -0.103 17919 118227 1 288 . 1 1 49 49 GLN N N 49 122.410 122.410 122.856 -0.446 17919 118228 1 288 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.191 0.369 17919 118229 1 288 . 1 1 49 49 GLN C C 49 175.670 175.670 175.677 -0.007 17919 118230 1 288 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.329 -0.589 17919 118231 1 288 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.232 -0.232 17919 118232 1 288 . 1 1 49 49 GLN H H 49 8.600 8.600 8.573 0.027 17919 118233 1 288 . 1 1 50 50 LEU N N 50 125.520 125.520 128.096 -2.576 17919 118234 1 288 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.179 -0.089 17919 118235 1 288 . 1 1 50 50 LEU C C 50 176.660 176.660 175.962 0.698 17919 118236 1 288 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.043 0.197 17919 118237 1 288 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.795 -0.225 17919 118238 1 288 . 1 1 50 50 LEU H H 50 8.530 8.530 8.540 -0.010 17919 118239 1 288 . 1 1 51 51 GLU N N 51 122.940 122.940 122.532 0.408 17919 118240 1 288 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.566 -0.078 17919 118241 1 288 . 1 1 51 51 GLU C C 51 175.870 175.870 177.085 -1.215 17919 118242 1 288 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.316 0.644 17919 118243 1 288 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.519 0.051 17919 118244 1 288 . 1 1 51 51 GLU H H 51 8.400 8.400 8.329 0.071 17919 118245 1 288 . 1 1 52 52 ASP N N 52 120.030 120.030 123.677 -3.647 17919 118246 1 288 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.406 -0.047 17919 118247 1 288 . 1 1 52 52 ASP C C 52 177.330 177.330 177.918 -0.588 17919 118248 1 288 . 1 1 52 52 ASP CA C 52 56.960 56.960 58.201 -1.241 17919 118249 1 288 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.667 0.183 17919 118250 1 288 . 1 1 52 52 ASP H H 52 8.160 8.160 8.847 -0.687 17919 118251 1 288 . 1 1 53 53 GLY N N 53 106.660 106.660 104.958 1.702 17919 118252 1 288 . 1 1 53 53 GLY C C 53 174.870 174.870 174.138 0.732 17919 118253 1 288 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.699 0.471 17919 118254 1 288 . 1 1 53 53 GLY H H 53 9.390 9.390 8.435 0.955 17919 118255 1 288 . 1 1 54 54 ARG N N 54 119.050 119.050 121.078 -2.028 17919 118256 1 288 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.633 0.062 17919 118257 1 288 . 1 1 54 54 ARG C C 54 175.350 175.350 175.119 0.231 17919 118258 1 288 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.981 -0.591 17919 118259 1 288 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.774 -0.124 17919 118260 1 288 . 1 1 54 54 ARG H H 54 7.460 7.460 7.431 0.029 17919 118261 1 288 . 1 1 55 55 THR N N 55 108.400 108.400 110.516 -2.116 17919 118262 1 288 . 1 1 55 55 THR HA H 55 5.240 5.240 5.077 0.163 17919 118263 1 288 . 1 1 55 55 THR C C 55 176.560 176.560 176.052 0.508 17919 118264 1 288 . 1 1 55 55 THR CA C 55 59.690 59.690 59.489 0.201 17919 118265 1 288 . 1 1 55 55 THR CB C 55 72.260 72.260 71.854 0.406 17919 118266 1 288 . 1 1 55 55 THR H H 55 8.730 8.730 8.905 -0.175 17919 118267 1 288 . 1 1 56 56 LEU N N 56 117.920 117.920 120.594 -2.674 17919 118268 1 288 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.205 -0.145 17919 118269 1 288 . 1 1 56 56 LEU C C 56 180.810 180.810 178.648 2.162 17919 118270 1 288 . 1 1 56 56 LEU CA C 56 58.710 58.710 57.476 1.234 17919 118271 1 288 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.464 -1.094 17919 118272 1 288 . 1 1 56 56 LEU H H 56 8.140 8.140 8.904 -0.764 17919 118273 1 288 . 1 1 57 57 SER N N 57 113.330 113.330 115.303 -1.973 17919 118274 1 288 . 1 1 57 57 SER HA H 57 4.370 4.370 4.291 0.079 17919 118275 1 288 . 1 1 57 57 SER C C 57 178.310 178.310 176.950 1.360 17919 118276 1 288 . 1 1 57 57 SER CA C 57 61.080 61.080 61.116 -0.036 17919 118277 1 288 . 1 1 57 57 SER CB C 57 62.530 62.530 62.879 -0.349 17919 118278 1 288 . 1 1 57 57 SER H H 57 8.470 8.470 8.258 0.212 17919 118279 1 288 . 1 1 58 58 ASP N N 58 124.190 124.190 123.045 1.145 17919 118280 1 288 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.290 0.006 17919 118281 1 288 . 1 1 58 58 ASP C C 58 177.400 177.400 177.660 -0.260 17919 118282 1 288 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.839 0.341 17919 118283 1 288 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.371 -0.271 17919 118284 1 288 . 1 1 58 58 ASP H H 58 7.930 7.930 7.613 0.317 17919 118285 1 288 . 1 1 59 59 TYR N N 59 115.510 115.510 115.431 0.079 17919 118286 1 288 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.617 0.053 17919 118287 1 288 . 1 1 59 59 TYR C C 59 174.700 174.700 175.079 -0.379 17919 118288 1 288 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.131 1.119 17919 118289 1 288 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.214 1.856 17919 118290 1 288 . 1 1 59 59 TYR H H 59 7.250 7.250 7.397 -0.147 17919 118291 1 288 . 1 1 60 60 ASN N N 60 115.900 115.900 117.571 -1.671 17919 118292 1 288 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.414 -0.059 17919 118293 1 288 . 1 1 60 60 ASN C C 60 174.340 174.340 175.234 -0.894 17919 118294 1 288 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.122 -0.002 17919 118295 1 288 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.480 -0.070 17919 118296 1 288 . 1 1 60 60 ASN H H 60 8.150 8.150 7.672 0.478 17919 118297 1 288 . 1 1 61 61 ILE N N 61 118.600 118.600 118.750 -0.150 17919 118298 1 288 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.712 -0.319 17919 118299 1 288 . 1 1 61 61 ILE C C 61 174.610 174.610 175.692 -1.082 17919 118300 1 288 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.114 1.306 17919 118301 1 288 . 1 1 61 61 ILE CB C 61 36.740 36.740 36.517 0.223 17919 118302 1 288 . 1 1 61 61 ILE H H 61 7.250 7.250 7.673 -0.423 17919 118303 1 288 . 1 1 62 62 GLN N N 62 124.740 124.740 124.280 0.460 17919 118304 1 288 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.700 -0.194 17919 118305 1 288 . 1 1 62 62 GLN C C 62 175.970 175.970 175.338 0.632 17919 118306 1 288 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.523 0.137 17919 118307 1 288 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.083 0.567 17919 118308 1 288 . 1 1 62 62 GLN H H 62 7.610 7.610 8.312 -0.702 17919 118309 1 288 . 1 1 63 63 LYS N N 63 120.300 120.300 123.843 -3.543 17919 118310 1 288 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.753 0.248 17919 118311 1 288 . 1 1 63 63 LYS C C 63 175.810 175.810 176.996 -1.186 17919 118312 1 288 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.531 -0.741 17919 118313 1 288 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.228 0.422 17919 118314 1 288 . 1 1 63 63 LYS H H 63 8.490 8.490 8.570 -0.080 17919 118315 1 288 . 1 1 64 64 GLU N N 64 113.950 113.950 118.883 -4.933 17919 118316 1 288 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.471 -0.006 17919 118317 1 288 . 1 1 64 64 GLU C C 64 175.250 175.250 175.513 -0.263 17919 118318 1 288 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.702 0.188 17919 118319 1 288 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.894 -2.994 17919 118320 1 288 . 1 1 64 64 GLU H H 64 9.280 9.280 8.690 0.590 17919 118321 1 288 . 1 1 65 65 SER N N 65 114.730 114.730 116.237 -1.507 17919 118322 1 288 . 1 1 65 65 SER HA H 65 4.640 4.640 4.342 0.298 17919 118323 1 288 . 1 1 65 65 SER C C 65 172.160 172.160 173.784 -1.624 17919 118324 1 288 . 1 1 65 65 SER CA C 65 60.890 60.890 61.072 -0.182 17919 118325 1 288 . 1 1 65 65 SER CB C 65 64.910 64.910 63.549 1.361 17919 118326 1 288 . 1 1 65 65 SER H H 65 7.670 7.670 7.669 0.001 17919 118327 1 288 . 1 1 66 66 THR N N 66 117.110 117.110 120.084 -2.974 17919 118328 1 288 . 1 1 66 66 THR HA H 66 5.270 5.270 5.140 0.130 17919 118329 1 288 . 1 1 66 66 THR C C 66 173.950 173.950 173.481 0.469 17919 118330 1 288 . 1 1 66 66 THR CA C 66 62.340 62.340 61.698 0.642 17919 118331 1 288 . 1 1 66 66 THR CB C 66 70.080 70.080 70.094 -0.014 17919 118332 1 288 . 1 1 66 66 THR H H 66 8.730 8.730 8.231 0.499 17919 118333 1 288 . 1 1 67 67 LEU N N 67 127.110 127.110 127.015 0.095 17919 118334 1 288 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.742 0.318 17919 118335 1 288 . 1 1 67 67 LEU C C 67 175.770 175.770 175.367 0.403 17919 118336 1 288 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.803 0.097 17919 118337 1 288 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.297 -0.038 17919 118338 1 288 . 1 1 67 67 LEU H H 67 9.410 9.410 9.198 0.212 17919 118339 1 288 . 1 1 68 68 HIS N N 68 118.380 118.380 119.660 -1.280 17919 118340 1 288 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.182 0.058 17919 118341 1 288 . 1 1 68 68 HIS C C 68 173.150 173.150 174.011 -0.861 17919 118342 1 288 . 1 1 68 68 HIS CA C 68 55.000 55.000 55.086 -0.085 17919 118343 1 288 . 1 1 68 68 HIS CB C 68 30.530 30.530 31.355 -0.825 17919 118344 1 288 . 1 1 68 68 HIS H H 68 9.230 9.230 8.652 0.578 17919 118345 1 288 . 1 1 69 69 LEU N N 69 124.460 124.460 127.717 -3.257 17919 118346 1 288 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.123 0.067 17919 118347 1 288 . 1 1 69 69 LEU C C 69 175.270 175.270 174.615 0.655 17919 118348 1 288 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.706 0.184 17919 118349 1 288 . 1 1 69 69 LEU CB C 69 44.380 44.380 43.922 0.458 17919 118350 1 288 . 1 1 69 69 LEU H H 69 8.340 8.340 8.423 -0.083 17919 118351 1 288 . 1 1 70 70 VAL N N 70 126.940 126.940 126.406 0.534 17919 118352 1 288 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.423 -0.073 17919 118353 1 288 . 1 1 70 70 VAL C C 70 174.000 174.000 174.562 -0.562 17919 118354 1 288 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.877 -0.077 17919 118355 1 288 . 1 1 70 70 VAL CB C 70 34.910 34.910 34.877 0.033 17919 118356 1 288 . 1 1 70 70 VAL H H 70 9.200 9.200 9.155 0.045 17919 118357 1 288 . 1 1 71 71 LEU N N 71 123.130 123.130 125.406 -2.276 17919 118358 1 288 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.354 -0.294 17919 118359 1 288 . 1 1 71 71 LEU C C 71 177.830 177.830 176.980 0.850 17919 118360 1 288 . 1 1 71 71 LEU CA C 71 53.940 53.940 54.292 -0.352 17919 118361 1 288 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.520 -0.670 17919 118362 1 288 . 1 1 71 71 LEU H H 71 8.120 8.120 8.523 -0.403 17919 118363 1 288 . 1 1 72 72 ARG N N 72 123.490 123.490 120.985 2.505 17919 118364 1 288 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.659 -0.358 17919 118365 1 288 . 1 1 72 72 ARG C C 72 175.350 175.350 175.886 -0.536 17919 118366 1 288 . 1 1 72 72 ARG CA C 72 55.610 55.610 54.874 0.736 17919 118367 1 288 . 1 1 72 72 ARG CB C 72 31.350 31.350 32.532 -1.182 17919 118368 1 288 . 1 1 72 72 ARG H H 72 8.580 8.580 8.345 0.235 17919 118369 1 289 . 1 1 2 2 GLN N N 2 123.220 123.220 120.549 2.671 17919 118370 1 289 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.292 -0.043 17919 118371 1 289 . 1 1 2 2 GLN C C 2 175.920 175.920 174.752 1.168 17919 118372 1 289 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.331 0.750 17919 118373 1 289 . 1 1 2 2 GLN CB C 2 30.760 30.760 31.245 -0.485 17919 118374 1 289 . 1 1 2 2 GLN H H 2 8.900 8.900 8.155 0.745 17919 118375 1 289 . 1 1 3 3 ILE N N 3 115.340 115.340 113.409 1.931 17919 118376 1 289 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.241 -0.028 17919 118377 1 289 . 1 1 3 3 ILE C C 3 172.450 172.450 173.064 -0.614 17919 118378 1 289 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.125 0.445 17919 118379 1 289 . 1 1 3 3 ILE CB C 3 42.210 42.210 42.215 -0.005 17919 118380 1 289 . 1 1 3 3 ILE H H 3 8.320 8.320 8.379 -0.059 17919 118381 1 289 . 1 1 4 4 PHE N N 4 118.110 118.110 118.749 -0.639 17919 118382 1 289 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.387 0.243 17919 118383 1 289 . 1 1 4 4 PHE C C 4 175.320 175.320 174.981 0.339 17919 118384 1 289 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.411 -0.202 17919 118385 1 289 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.581 -0.101 17919 118386 1 289 . 1 1 4 4 PHE H H 4 8.610 8.610 8.574 0.036 17919 118387 1 289 . 1 1 5 5 VAL N N 5 121.000 121.000 121.963 -0.963 17919 118388 1 289 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.956 -0.231 17919 118389 1 289 . 1 1 5 5 VAL C C 5 174.870 174.870 175.002 -0.132 17919 118390 1 289 . 1 1 5 5 VAL CA C 5 60.620 60.620 60.892 -0.272 17919 118391 1 289 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.514 0.716 17919 118392 1 289 . 1 1 5 5 VAL H H 5 9.300 9.300 9.190 0.110 17919 118393 1 289 . 1 1 6 6 LYS N N 6 127.520 127.520 127.736 -0.216 17919 118394 1 289 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.453 -0.086 17919 118395 1 289 . 1 1 6 6 LYS C C 6 177.140 177.140 176.523 0.617 17919 118396 1 289 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.377 0.143 17919 118397 1 289 . 1 1 6 6 LYS CB C 6 35.050 35.050 36.087 -1.037 17919 118398 1 289 . 1 1 6 6 LYS H H 6 8.820 8.820 9.339 -0.519 17919 118399 1 289 . 1 1 7 7 THR N N 7 115.400 115.400 117.561 -2.161 17919 118400 1 289 . 1 1 7 7 THR HA H 7 4.970 4.970 4.723 0.247 17919 118401 1 289 . 1 1 7 7 THR C C 7 176.910 176.910 176.292 0.618 17919 118402 1 289 . 1 1 7 7 THR CA C 7 60.470 60.470 61.302 -0.832 17919 118403 1 289 . 1 1 7 7 THR CB C 7 70.630 70.630 70.594 0.036 17919 118404 1 289 . 1 1 7 7 THR H H 7 8.730 8.730 9.022 -0.292 17919 118405 1 289 . 1 1 8 8 LEU N N 8 121.330 121.330 123.824 -2.494 17919 118406 1 289 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.302 0.008 17919 118407 1 289 . 1 1 8 8 LEU C C 8 178.800 178.800 177.596 1.204 17919 118408 1 289 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.691 -0.111 17919 118409 1 289 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.139 -0.168 17919 118410 1 289 . 1 1 8 8 LEU H H 8 9.100 9.100 8.882 0.218 17919 118411 1 289 . 1 1 9 9 THR N N 9 105.590 105.590 109.379 -3.789 17919 118412 1 289 . 1 1 9 9 THR HA H 9 4.428 4.428 4.429 -0.001 17919 118413 1 289 . 1 1 9 9 THR C C 9 175.520 175.520 175.320 0.200 17919 118414 1 289 . 1 1 9 9 THR CA C 9 61.400 61.400 61.170 0.230 17919 118415 1 289 . 1 1 9 9 THR CB C 9 69.140 69.140 68.885 0.255 17919 118416 1 289 . 1 1 9 9 THR H H 9 7.630 7.630 7.655 -0.025 17919 118417 1 289 . 1 1 10 10 GLY N N 10 108.890 108.890 110.283 -1.393 17919 118418 1 289 . 1 1 10 10 GLY C C 10 174.070 174.070 174.070 0.000 17919 118419 1 289 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.314 0.146 17919 118420 1 289 . 1 1 10 10 GLY H H 10 7.810 7.810 8.181 -0.371 17919 118421 1 289 . 1 1 11 11 LYS N N 11 121.600 121.600 120.971 0.629 17919 118422 1 289 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.414 -0.053 17919 118423 1 289 . 1 1 11 11 LYS C C 11 175.940 175.940 175.762 0.178 17919 118424 1 289 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.517 -0.237 17919 118425 1 289 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.740 -0.540 17919 118426 1 289 . 1 1 11 11 LYS H H 11 7.280 7.280 7.884 -0.604 17919 118427 1 289 . 1 1 12 12 THR N N 12 120.440 120.440 118.329 2.111 17919 118428 1 289 . 1 1 12 12 THR HA H 12 5.046 5.046 5.332 -0.286 17919 118429 1 289 . 1 1 12 12 THR C C 12 174.320 174.320 174.503 -0.183 17919 118430 1 289 . 1 1 12 12 THR CA C 12 62.390 62.390 61.430 0.960 17919 118431 1 289 . 1 1 12 12 THR CB C 12 69.910 69.910 70.110 -0.200 17919 118432 1 289 . 1 1 12 12 THR H H 12 8.650 8.650 8.252 0.398 17919 118433 1 289 . 1 1 13 13 ILE N N 13 127.110 127.110 121.937 5.173 17919 118434 1 289 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.755 -0.211 17919 118435 1 289 . 1 1 13 13 ILE C C 13 175.220 175.220 174.814 0.406 17919 118436 1 289 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.465 0.515 17919 118437 1 289 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.000 -0.050 17919 118438 1 289 . 1 1 13 13 ILE H H 13 9.450 9.450 9.194 0.256 17919 118439 1 289 . 1 1 14 14 THR N N 14 121.520 121.520 120.435 1.085 17919 118440 1 289 . 1 1 14 14 THR HA H 14 4.964 4.964 5.066 -0.102 17919 118441 1 289 . 1 1 14 14 THR C C 14 173.790 173.790 174.043 -0.253 17919 118442 1 289 . 1 1 14 14 THR CA C 14 61.940 61.940 62.064 -0.124 17919 118443 1 289 . 1 1 14 14 THR CB C 14 69.650 69.650 70.066 -0.416 17919 118444 1 289 . 1 1 14 14 THR H H 14 8.710 8.710 8.348 0.362 17919 118445 1 289 . 1 1 15 15 LEU N N 15 124.800 124.800 125.627 -0.827 17919 118446 1 289 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.730 0.050 17919 118447 1 289 . 1 1 15 15 LEU C C 15 174.670 174.670 175.105 -0.435 17919 118448 1 289 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.600 -0.770 17919 118449 1 289 . 1 1 15 15 LEU CB C 15 47.070 47.070 46.058 1.012 17919 118450 1 289 . 1 1 15 15 LEU H H 15 8.710 8.710 8.950 -0.240 17919 118451 1 289 . 1 1 16 16 GLU N N 16 122.160 122.160 122.202 -0.042 17919 118452 1 289 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.061 -0.144 17919 118453 1 289 . 1 1 16 16 GLU C C 16 175.860 175.860 175.916 -0.056 17919 118454 1 289 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.770 -0.950 17919 118455 1 289 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.879 -1.429 17919 118456 1 289 . 1 1 16 16 GLU H H 16 8.140 8.140 8.693 -0.553 17919 118457 1 289 . 1 1 17 17 VAL N N 17 117.210 117.210 119.153 -1.943 17919 118458 1 289 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.750 -0.036 17919 118459 1 289 . 1 1 17 17 VAL C C 17 174.160 174.160 174.552 -0.392 17919 118460 1 289 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.069 -0.639 17919 118461 1 289 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.667 0.733 17919 118462 1 289 . 1 1 17 17 VAL H H 17 8.900 8.900 8.863 0.037 17919 118463 1 289 . 1 1 18 18 GLU N N 18 118.990 118.990 121.197 -2.207 17919 118464 1 289 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.807 0.272 17919 118465 1 289 . 1 1 18 18 GLU C C 18 176.160 176.160 175.239 0.921 17919 118466 1 289 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.442 0.278 17919 118467 1 289 . 1 1 18 18 GLU CB C 18 30.310 30.310 31.390 -1.080 17919 118468 1 289 . 1 1 18 18 GLU H H 18 8.640 8.640 8.045 0.595 17919 118469 1 289 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.233 -0.092 17919 118470 1 289 . 1 1 19 19 PRO C C 19 175.310 175.310 177.868 -2.558 17919 118471 1 289 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.558 -0.088 17919 118472 1 289 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.884 0.067 17919 118473 1 289 . 1 1 20 20 SER N N 20 103.400 103.400 111.337 -7.937 17919 118474 1 289 . 1 1 20 20 SER HA H 20 4.370 4.370 4.364 0.006 17919 118475 1 289 . 1 1 20 20 SER C C 20 174.660 174.660 174.632 0.028 17919 118476 1 289 . 1 1 20 20 SER CA C 20 57.400 57.400 59.819 -2.418 17919 118477 1 289 . 1 1 20 20 SER CB C 20 63.370 63.370 62.838 0.532 17919 118478 1 289 . 1 1 20 20 SER H H 20 7.040 7.040 8.121 -1.081 17919 118479 1 289 . 1 1 21 21 ASP N N 21 123.480 123.480 123.495 -0.015 17919 118480 1 289 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.588 0.107 17919 118481 1 289 . 1 1 21 21 ASP C C 21 176.360 176.360 176.219 0.141 17919 118482 1 289 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.171 0.529 17919 118483 1 289 . 1 1 21 21 ASP CB C 21 40.800 40.800 40.886 -0.086 17919 118484 1 289 . 1 1 21 21 ASP H H 21 8.030 8.030 7.666 0.364 17919 118485 1 289 . 1 1 22 22 THR N N 22 108.800 108.800 113.733 -4.933 17919 118486 1 289 . 1 1 22 22 THR HA H 22 4.920 4.920 4.676 0.244 17919 118487 1 289 . 1 1 22 22 THR C C 22 176.750 176.750 176.478 0.272 17919 118488 1 289 . 1 1 22 22 THR CA C 22 59.690 59.690 61.957 -2.267 17919 118489 1 289 . 1 1 22 22 THR CB C 22 71.200 71.200 70.339 0.861 17919 118490 1 289 . 1 1 22 22 THR H H 22 7.900 7.900 8.402 -0.502 17919 118491 1 289 . 1 1 23 23 ILE N N 23 121.190 121.190 121.737 -0.547 17919 118492 1 289 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.816 -0.159 17919 118493 1 289 . 1 1 23 23 ILE C C 23 179.040 179.040 177.844 1.196 17919 118494 1 289 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.688 -0.428 17919 118495 1 289 . 1 1 23 23 ILE CB C 23 34.350 34.350 35.995 -1.645 17919 118496 1 289 . 1 1 23 23 ILE H H 23 8.560 8.560 8.981 -0.421 17919 118497 1 289 . 1 1 24 24 GLU N N 24 120.830 120.830 121.419 -0.589 17919 118498 1 289 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.893 0.024 17919 118499 1 289 . 1 1 24 24 GLU C C 24 178.640 178.640 178.636 0.004 17919 118500 1 289 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.405 -0.185 17919 118501 1 289 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.285 -1.005 17919 118502 1 289 . 1 1 24 24 GLU H H 24 9.760 9.760 8.764 0.996 17919 118503 1 289 . 1 1 25 25 ASN N N 25 120.570 120.570 118.488 2.082 17919 118504 1 289 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.444 0.082 17919 118505 1 289 . 1 1 25 25 ASN C C 25 178.380 178.380 177.918 0.462 17919 118506 1 289 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.383 -0.323 17919 118507 1 289 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.563 -0.113 17919 118508 1 289 . 1 1 25 25 ASN H H 25 7.920 7.920 7.814 0.106 17919 118509 1 289 . 1 1 26 26 VAL N N 26 121.710 121.710 121.264 0.446 17919 118510 1 289 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.452 -0.055 17919 118511 1 289 . 1 1 26 26 VAL C C 26 177.950 177.950 177.599 0.351 17919 118512 1 289 . 1 1 26 26 VAL CA C 26 67.660 67.660 67.048 0.612 17919 118513 1 289 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.418 -0.578 17919 118514 1 289 . 1 1 26 26 VAL H H 26 8.070 8.070 7.968 0.102 17919 118515 1 289 . 1 1 27 27 LYS N N 27 118.860 118.860 119.659 -0.799 17919 118516 1 289 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.127 0.454 17919 118517 1 289 . 1 1 27 27 LYS C C 27 180.550 180.550 179.082 1.468 17919 118518 1 289 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.674 -0.424 17919 118519 1 289 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.202 1.528 17919 118520 1 289 . 1 1 27 27 LYS H H 27 8.560 8.560 8.449 0.111 17919 118521 1 289 . 1 1 28 28 ALA N N 28 123.440 123.440 120.865 2.575 17919 118522 1 289 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.222 -0.062 17919 118523 1 289 . 1 1 28 28 ALA C C 28 180.300 180.300 179.084 1.216 17919 118524 1 289 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.498 0.872 17919 118525 1 289 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.508 -0.798 17919 118526 1 289 . 1 1 28 28 ALA H H 28 8.060 8.060 8.185 -0.125 17919 118527 1 289 . 1 1 29 29 LYS N N 29 119.940 119.940 119.948 -0.008 17919 118528 1 289 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.026 0.181 17919 118529 1 289 . 1 1 29 29 LYS C C 29 180.320 180.320 179.195 1.125 17919 118530 1 289 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.392 0.258 17919 118531 1 289 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.370 0.920 17919 118532 1 289 . 1 1 29 29 LYS H H 29 7.850 7.850 7.684 0.166 17919 118533 1 289 . 1 1 30 30 ILE N N 30 121.080 121.080 120.393 0.687 17919 118534 1 289 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.608 -0.101 17919 118535 1 289 . 1 1 30 30 ILE C C 30 178.310 178.310 177.485 0.825 17919 118536 1 289 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.056 1.094 17919 118537 1 289 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.647 -0.847 17919 118538 1 289 . 1 1 30 30 ILE H H 30 8.280 8.280 8.361 -0.081 17919 118539 1 289 . 1 1 31 31 GLN N N 31 123.490 123.490 120.098 3.392 17919 118540 1 289 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.878 -0.050 17919 118541 1 289 . 1 1 31 31 GLN C C 31 178.890 178.890 178.245 0.645 17919 118542 1 289 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.574 0.426 17919 118543 1 289 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.383 -0.663 17919 118544 1 289 . 1 1 31 31 GLN H H 31 8.580 8.580 8.153 0.427 17919 118545 1 289 . 1 1 32 32 ASP N N 32 119.360 119.360 119.344 0.016 17919 118546 1 289 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.374 -0.020 17919 118547 1 289 . 1 1 32 32 ASP C C 32 177.250 177.250 177.898 -0.648 17919 118548 1 289 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.859 0.331 17919 118549 1 289 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.772 -0.191 17919 118550 1 289 . 1 1 32 32 ASP H H 32 8.010 8.010 7.929 0.081 17919 118551 1 289 . 1 1 33 33 LYS N N 33 115.130 115.130 117.870 -2.740 17919 118552 1 289 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.216 0.121 17919 118553 1 289 . 1 1 33 33 LYS C C 33 177.870 177.870 178.102 -0.232 17919 118554 1 289 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.569 -0.520 17919 118555 1 289 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.342 0.828 17919 118556 1 289 . 1 1 33 33 LYS H H 33 7.430 7.430 7.570 -0.140 17919 118557 1 289 . 1 1 34 34 GLU N N 34 113.870 113.870 114.416 -0.546 17919 118558 1 289 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.484 0.141 17919 118559 1 289 . 1 1 34 34 GLU C C 34 177.840 177.840 176.950 0.890 17919 118560 1 289 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.066 -0.896 17919 118561 1 289 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.769 0.891 17919 118562 1 289 . 1 1 34 34 GLU H H 34 8.740 8.740 8.028 0.712 17919 118563 1 289 . 1 1 35 35 GLY N N 35 108.650 108.650 108.826 -0.176 17919 118564 1 289 . 1 1 35 35 GLY C C 35 173.960 173.960 174.116 -0.156 17919 118565 1 289 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.376 0.704 17919 118566 1 289 . 1 1 35 35 GLY H H 35 8.530 8.530 8.381 0.149 17919 118567 1 289 . 1 1 36 36 ILE N N 36 119.880 119.880 123.323 -3.443 17919 118568 1 289 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.291 0.154 17919 118569 1 289 . 1 1 36 36 ILE C C 36 173.590 173.590 174.448 -0.858 17919 118570 1 289 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.879 -0.129 17919 118571 1 289 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.652 1.928 17919 118572 1 289 . 1 1 36 36 ILE H H 36 6.150 6.150 7.629 -1.479 17919 118573 1 289 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.523 0.111 17919 118574 1 289 . 1 1 37 37 PRO C C 37 176.940 176.940 176.382 0.558 17919 118575 1 289 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.651 0.008 17919 118576 1 289 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.250 0.600 17919 118577 1 289 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.304 -0.187 17919 118578 1 289 . 1 1 38 38 PRO C C 38 178.320 178.320 178.829 -0.509 17919 118579 1 289 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.406 0.854 17919 118580 1 289 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.939 0.951 17919 118581 1 289 . 1 1 39 39 ASP N N 39 113.380 113.380 117.941 -4.561 17919 118582 1 289 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.359 0.071 17919 118583 1 289 . 1 1 39 39 ASP C C 39 177.090 177.090 177.041 0.049 17919 118584 1 289 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.505 -0.865 17919 118585 1 289 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.510 -0.970 17919 118586 1 289 . 1 1 39 39 ASP H H 39 8.550 8.550 8.492 0.058 17919 118587 1 289 . 1 1 40 40 GLN N N 40 116.780 116.780 114.767 2.013 17919 118588 1 289 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.498 -0.034 17919 118589 1 289 . 1 1 40 40 GLN C C 40 175.380 175.380 175.658 -0.278 17919 118590 1 289 . 1 1 40 40 GLN CA C 40 55.640 55.640 54.705 0.935 17919 118591 1 289 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.021 1.119 17919 118592 1 289 . 1 1 40 40 GLN H H 40 7.820 7.820 7.806 0.014 17919 118593 1 289 . 1 1 41 41 GLN N N 41 117.720 117.720 120.159 -2.439 17919 118594 1 289 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.545 -0.301 17919 118595 1 289 . 1 1 41 41 GLN C C 41 176.300 176.300 174.921 1.379 17919 118596 1 289 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.754 0.716 17919 118597 1 289 . 1 1 41 41 GLN CB C 41 31.650 31.650 30.319 1.331 17919 118598 1 289 . 1 1 41 41 GLN H H 41 7.480 7.480 7.954 -0.474 17919 118599 1 289 . 1 1 42 42 ARG N N 42 122.680 122.680 124.197 -1.517 17919 118600 1 289 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.661 -0.161 17919 118601 1 289 . 1 1 42 42 ARG C C 42 174.050 174.050 174.469 -0.419 17919 118602 1 289 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.815 0.235 17919 118603 1 289 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.780 -1.030 17919 118604 1 289 . 1 1 42 42 ARG H H 42 8.530 8.530 8.541 -0.011 17919 118605 1 289 . 1 1 43 43 LEU N N 43 124.040 124.040 125.712 -1.672 17919 118606 1 289 . 1 1 43 43 LEU C C 43 175.290 175.290 175.618 -0.328 17919 118607 1 289 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.866 -0.886 17919 118608 1 289 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.354 2.436 17919 118609 1 289 . 1 1 43 43 LEU H H 43 8.820 8.820 8.840 -0.020 17919 118610 1 289 . 1 1 44 44 ILE N N 44 121.920 121.920 122.981 -1.061 17919 118611 1 289 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.001 -0.009 17919 118612 1 289 . 1 1 44 44 ILE C C 44 176.060 176.060 174.453 1.607 17919 118613 1 289 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.183 -1.203 17919 118614 1 289 . 1 1 44 44 ILE CB C 44 41.420 41.420 40.663 0.756 17919 118615 1 289 . 1 1 44 44 ILE H H 44 9.030 9.030 8.721 0.309 17919 118616 1 289 . 1 1 45 45 PHE N N 45 125.390 125.390 128.513 -3.123 17919 118617 1 289 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.966 0.079 17919 118618 1 289 . 1 1 45 45 PHE C C 45 174.470 174.470 174.880 -0.410 17919 118619 1 289 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.338 0.682 17919 118620 1 289 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.551 1.208 17919 118621 1 289 . 1 1 45 45 PHE H H 45 8.830 8.830 8.214 0.616 17919 118622 1 289 . 1 1 46 46 ALA N N 46 132.200 132.200 131.158 1.042 17919 118623 1 289 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.777 -0.087 17919 118624 1 289 . 1 1 46 46 ALA C C 46 177.290 177.290 177.305 -0.015 17919 118625 1 289 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.390 0.150 17919 118626 1 289 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.365 0.205 17919 118627 1 289 . 1 1 46 46 ALA H H 46 8.810 8.810 8.944 -0.134 17919 118628 1 289 . 1 1 47 47 GLY N N 47 102.340 102.340 105.294 -2.954 17919 118629 1 289 . 1 1 47 47 GLY C C 47 173.810 173.810 174.474 -0.664 17919 118630 1 289 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.327 0.023 17919 118631 1 289 . 1 1 47 47 GLY H H 47 8.130 8.130 8.558 -0.428 17919 118632 1 289 . 1 1 48 48 LYS N N 48 121.570 121.570 122.145 -0.575 17919 118633 1 289 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.574 0.048 17919 118634 1 289 . 1 1 48 48 LYS C C 48 174.700 174.700 175.718 -1.018 17919 118635 1 289 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.989 -0.439 17919 118636 1 289 . 1 1 48 48 LYS CB C 48 34.530 34.530 33.934 0.597 17919 118637 1 289 . 1 1 48 48 LYS H H 48 7.980 7.980 7.565 0.415 17919 118638 1 289 . 1 1 49 49 GLN N N 49 122.410 122.410 123.142 -0.732 17919 118639 1 289 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.157 0.403 17919 118640 1 289 . 1 1 49 49 GLN C C 49 175.670 175.670 175.932 -0.262 17919 118641 1 289 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.389 -0.649 17919 118642 1 289 . 1 1 49 49 GLN CB C 49 29.000 29.000 28.445 0.555 17919 118643 1 289 . 1 1 49 49 GLN H H 49 8.600 8.600 8.544 0.056 17919 118644 1 289 . 1 1 50 50 LEU N N 50 125.520 125.520 125.835 -0.315 17919 118645 1 289 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.130 -0.040 17919 118646 1 289 . 1 1 50 50 LEU C C 50 176.660 176.660 176.363 0.297 17919 118647 1 289 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.582 -0.342 17919 118648 1 289 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.908 -0.338 17919 118649 1 289 . 1 1 50 50 LEU H H 50 8.530 8.530 8.422 0.108 17919 118650 1 289 . 1 1 51 51 GLU N N 51 122.940 122.940 123.041 -0.101 17919 118651 1 289 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.627 -0.139 17919 118652 1 289 . 1 1 51 51 GLU C C 51 175.870 175.870 176.750 -0.880 17919 118653 1 289 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.053 0.907 17919 118654 1 289 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.645 -0.075 17919 118655 1 289 . 1 1 51 51 GLU H H 51 8.400 8.400 8.812 -0.412 17919 118656 1 289 . 1 1 52 52 ASP N N 52 120.030 120.030 127.631 -7.601 17919 118657 1 289 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.417 -0.058 17919 118658 1 289 . 1 1 52 52 ASP C C 52 177.330 177.330 177.253 0.077 17919 118659 1 289 . 1 1 52 52 ASP CA C 52 56.960 56.960 55.845 1.115 17919 118660 1 289 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.362 0.488 17919 118661 1 289 . 1 1 52 52 ASP H H 52 8.160 8.160 8.936 -0.776 17919 118662 1 289 . 1 1 53 53 GLY N N 53 106.660 106.660 107.173 -0.513 17919 118663 1 289 . 1 1 53 53 GLY C C 53 174.870 174.870 174.626 0.244 17919 118664 1 289 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.739 0.431 17919 118665 1 289 . 1 1 53 53 GLY H H 53 9.390 9.390 8.655 0.735 17919 118666 1 289 . 1 1 54 54 ARG N N 54 119.050 119.050 120.528 -1.478 17919 118667 1 289 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.647 0.048 17919 118668 1 289 . 1 1 54 54 ARG C C 54 175.350 175.350 176.015 -0.665 17919 118669 1 289 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.268 0.122 17919 118670 1 289 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.268 0.382 17919 118671 1 289 . 1 1 54 54 ARG H H 54 7.460 7.460 7.314 0.146 17919 118672 1 289 . 1 1 55 55 THR N N 55 108.400 108.400 113.300 -4.900 17919 118673 1 289 . 1 1 55 55 THR HA H 55 5.240 5.240 4.720 0.520 17919 118674 1 289 . 1 1 55 55 THR C C 55 176.560 176.560 176.167 0.393 17919 118675 1 289 . 1 1 55 55 THR CA C 55 59.690 59.690 61.471 -1.781 17919 118676 1 289 . 1 1 55 55 THR CB C 55 72.260 72.260 70.140 2.120 17919 118677 1 289 . 1 1 55 55 THR H H 55 8.730 8.730 8.879 -0.149 17919 118678 1 289 . 1 1 56 56 LEU N N 56 117.920 117.920 120.850 -2.930 17919 118679 1 289 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.120 -0.060 17919 118680 1 289 . 1 1 56 56 LEU C C 56 180.810 180.810 178.927 1.883 17919 118681 1 289 . 1 1 56 56 LEU CA C 56 58.710 58.710 57.900 0.810 17919 118682 1 289 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.410 -1.040 17919 118683 1 289 . 1 1 56 56 LEU H H 56 8.140 8.140 8.971 -0.831 17919 118684 1 289 . 1 1 57 57 SER N N 57 113.330 113.330 115.601 -2.271 17919 118685 1 289 . 1 1 57 57 SER HA H 57 4.370 4.370 4.287 0.083 17919 118686 1 289 . 1 1 57 57 SER C C 57 178.310 178.310 177.094 1.216 17919 118687 1 289 . 1 1 57 57 SER CA C 57 61.080 61.080 61.450 -0.370 17919 118688 1 289 . 1 1 57 57 SER CB C 57 62.530 62.530 62.520 0.010 17919 118689 1 289 . 1 1 57 57 SER H H 57 8.470 8.470 8.277 0.193 17919 118690 1 289 . 1 1 58 58 ASP N N 58 124.190 124.190 124.196 -0.006 17919 118691 1 289 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.312 -0.016 17919 118692 1 289 . 1 1 58 58 ASP C C 58 177.400 177.400 177.544 -0.144 17919 118693 1 289 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.892 0.288 17919 118694 1 289 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.377 -0.277 17919 118695 1 289 . 1 1 58 58 ASP H H 58 7.930 7.930 8.095 -0.165 17919 118696 1 289 . 1 1 59 59 TYR N N 59 115.510 115.510 115.332 0.178 17919 118697 1 289 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.547 0.123 17919 118698 1 289 . 1 1 59 59 TYR C C 59 174.700 174.700 175.150 -0.450 17919 118699 1 289 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.899 0.351 17919 118700 1 289 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.091 1.979 17919 118701 1 289 . 1 1 59 59 TYR H H 59 7.250 7.250 7.431 -0.181 17919 118702 1 289 . 1 1 60 60 ASN N N 60 115.900 115.900 117.715 -1.815 17919 118703 1 289 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.420 -0.065 17919 118704 1 289 . 1 1 60 60 ASN C C 60 174.340 174.340 174.967 -0.627 17919 118705 1 289 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.181 -0.061 17919 118706 1 289 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.129 0.281 17919 118707 1 289 . 1 1 60 60 ASN H H 60 8.150 8.150 7.762 0.388 17919 118708 1 289 . 1 1 61 61 ILE N N 61 118.600 118.600 119.652 -1.052 17919 118709 1 289 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.949 -0.556 17919 118710 1 289 . 1 1 61 61 ILE C C 61 174.610 174.610 175.269 -0.659 17919 118711 1 289 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.231 0.189 17919 118712 1 289 . 1 1 61 61 ILE CB C 61 36.740 36.740 38.071 -1.331 17919 118713 1 289 . 1 1 61 61 ILE H H 61 7.250 7.250 7.906 -0.656 17919 118714 1 289 . 1 1 62 62 GLN N N 62 124.740 124.740 124.840 -0.100 17919 118715 1 289 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.773 -0.267 17919 118716 1 289 . 1 1 62 62 GLN C C 62 175.970 175.970 175.382 0.588 17919 118717 1 289 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.646 0.014 17919 118718 1 289 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.756 -0.106 17919 118719 1 289 . 1 1 62 62 GLN H H 62 7.610 7.610 8.350 -0.740 17919 118720 1 289 . 1 1 63 63 LYS N N 63 120.300 120.300 120.066 0.234 17919 118721 1 289 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.134 -0.133 17919 118722 1 289 . 1 1 63 63 LYS C C 63 175.810 175.810 177.173 -1.363 17919 118723 1 289 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.359 0.431 17919 118724 1 289 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.320 0.330 17919 118725 1 289 . 1 1 63 63 LYS H H 63 8.490 8.490 8.551 -0.061 17919 118726 1 289 . 1 1 64 64 GLU N N 64 113.950 113.950 117.597 -3.647 17919 118727 1 289 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.641 -0.176 17919 118728 1 289 . 1 1 64 64 GLU C C 64 175.250 175.250 175.930 -0.680 17919 118729 1 289 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.626 0.265 17919 118730 1 289 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.337 -2.437 17919 118731 1 289 . 1 1 64 64 GLU H H 64 9.280 9.280 8.837 0.443 17919 118732 1 289 . 1 1 65 65 SER N N 65 114.730 114.730 115.121 -0.391 17919 118733 1 289 . 1 1 65 65 SER HA H 65 4.640 4.640 4.500 0.140 17919 118734 1 289 . 1 1 65 65 SER C C 65 172.160 172.160 174.176 -2.016 17919 118735 1 289 . 1 1 65 65 SER CA C 65 60.890 60.890 60.347 0.543 17919 118736 1 289 . 1 1 65 65 SER CB C 65 64.910 64.910 64.303 0.607 17919 118737 1 289 . 1 1 65 65 SER H H 65 7.670 7.670 7.287 0.383 17919 118738 1 289 . 1 1 66 66 THR N N 66 117.110 117.110 118.934 -1.824 17919 118739 1 289 . 1 1 66 66 THR HA H 66 5.270 5.270 5.300 -0.030 17919 118740 1 289 . 1 1 66 66 THR C C 66 173.950 173.950 173.981 -0.031 17919 118741 1 289 . 1 1 66 66 THR CA C 66 62.340 62.340 61.418 0.922 17919 118742 1 289 . 1 1 66 66 THR CB C 66 70.080 70.080 70.897 -0.817 17919 118743 1 289 . 1 1 66 66 THR H H 66 8.730 8.730 8.571 0.159 17919 118744 1 289 . 1 1 67 67 LEU N N 67 127.110 127.110 126.981 0.129 17919 118745 1 289 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.983 0.077 17919 118746 1 289 . 1 1 67 67 LEU C C 67 175.770 175.770 175.210 0.560 17919 118747 1 289 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.841 0.059 17919 118748 1 289 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.171 0.089 17919 118749 1 289 . 1 1 67 67 LEU H H 67 9.410 9.410 9.120 0.290 17919 118750 1 289 . 1 1 68 68 HIS N N 68 118.380 118.380 121.388 -3.008 17919 118751 1 289 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.342 -0.102 17919 118752 1 289 . 1 1 68 68 HIS C C 68 173.150 173.150 173.468 -0.318 17919 118753 1 289 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.320 0.680 17919 118754 1 289 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.347 -1.817 17919 118755 1 289 . 1 1 68 68 HIS H H 68 9.230 9.230 8.860 0.370 17919 118756 1 289 . 1 1 69 69 LEU N N 69 124.460 124.460 129.622 -5.162 17919 118757 1 289 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.242 -0.052 17919 118758 1 289 . 1 1 69 69 LEU C C 69 175.270 175.270 174.087 1.183 17919 118759 1 289 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.115 0.775 17919 118760 1 289 . 1 1 69 69 LEU CB C 69 44.380 44.380 45.404 -1.024 17919 118761 1 289 . 1 1 69 69 LEU H H 69 8.340 8.340 8.677 -0.337 17919 118762 1 289 . 1 1 70 70 VAL N N 70 126.940 126.940 119.859 7.081 17919 118763 1 289 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.469 -0.119 17919 118764 1 289 . 1 1 70 70 VAL C C 70 174.000 174.000 173.699 0.301 17919 118765 1 289 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.026 0.774 17919 118766 1 289 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.550 -0.640 17919 118767 1 289 . 1 1 70 70 VAL H H 70 9.200 9.200 8.951 0.249 17919 118768 1 289 . 1 1 71 71 LEU N N 71 123.130 123.130 121.993 1.137 17919 118769 1 289 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.094 -0.034 17919 118770 1 289 . 1 1 71 71 LEU C C 71 177.830 177.830 176.891 0.939 17919 118771 1 289 . 1 1 71 71 LEU CA C 71 53.940 53.940 52.848 1.092 17919 118772 1 289 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.803 -0.954 17919 118773 1 289 . 1 1 71 71 LEU H H 71 8.120 8.120 8.224 -0.104 17919 118774 1 289 . 1 1 72 72 ARG N N 72 123.490 123.490 121.841 1.649 17919 118775 1 289 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.292 0.009 17919 118776 1 289 . 1 1 72 72 ARG C C 72 175.350 175.350 175.758 -0.408 17919 118777 1 289 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.343 -0.733 17919 118778 1 289 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.567 0.783 17919 118779 1 289 . 1 1 72 72 ARG H H 72 8.580 8.580 8.152 0.428 17919 118780 1 290 . 1 1 2 2 GLN N N 2 123.220 123.220 120.331 2.889 17919 118781 1 290 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.314 -0.065 17919 118782 1 290 . 1 1 2 2 GLN C C 2 175.920 175.920 176.167 -0.247 17919 118783 1 290 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.279 0.801 17919 118784 1 290 . 1 1 2 2 GLN CB C 2 30.760 30.760 29.529 1.231 17919 118785 1 290 . 1 1 2 2 GLN H H 2 8.900 8.900 8.363 0.537 17919 118786 1 290 . 1 1 3 3 ILE N N 3 115.340 115.340 115.753 -0.413 17919 118787 1 290 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.529 -0.316 17919 118788 1 290 . 1 1 3 3 ILE C C 3 172.450 172.450 173.858 -1.408 17919 118789 1 290 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.088 0.482 17919 118790 1 290 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.976 0.234 17919 118791 1 290 . 1 1 3 3 ILE H H 3 8.320 8.320 7.913 0.407 17919 118792 1 290 . 1 1 4 4 PHE N N 4 118.110 118.110 119.095 -0.985 17919 118793 1 290 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.249 0.381 17919 118794 1 290 . 1 1 4 4 PHE C C 4 175.320 175.320 174.928 0.392 17919 118795 1 290 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.973 -0.763 17919 118796 1 290 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.816 -0.336 17919 118797 1 290 . 1 1 4 4 PHE H H 4 8.610 8.610 8.852 -0.242 17919 118798 1 290 . 1 1 5 5 VAL N N 5 121.000 121.000 123.256 -2.256 17919 118799 1 290 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.912 -0.187 17919 118800 1 290 . 1 1 5 5 VAL C C 5 174.870 174.870 174.787 0.083 17919 118801 1 290 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.229 -0.609 17919 118802 1 290 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.745 0.485 17919 118803 1 290 . 1 1 5 5 VAL H H 5 9.300 9.300 9.476 -0.176 17919 118804 1 290 . 1 1 6 6 LYS N N 6 127.520 127.520 129.264 -1.744 17919 118805 1 290 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.251 0.116 17919 118806 1 290 . 1 1 6 6 LYS C C 6 177.140 177.140 176.704 0.436 17919 118807 1 290 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.684 -0.164 17919 118808 1 290 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.574 -0.524 17919 118809 1 290 . 1 1 6 6 LYS H H 6 8.820 8.820 9.336 -0.516 17919 118810 1 290 . 1 1 7 7 THR N N 7 115.400 115.400 117.700 -2.300 17919 118811 1 290 . 1 1 7 7 THR HA H 7 4.970 4.970 4.847 0.123 17919 118812 1 290 . 1 1 7 7 THR C C 7 176.910 176.910 177.015 -0.105 17919 118813 1 290 . 1 1 7 7 THR CA C 7 60.470 60.470 61.145 -0.675 17919 118814 1 290 . 1 1 7 7 THR CB C 7 70.630 70.630 70.572 0.058 17919 118815 1 290 . 1 1 7 7 THR H H 7 8.730 8.730 8.959 -0.229 17919 118816 1 290 . 1 1 8 8 LEU N N 8 121.330 121.330 122.304 -0.974 17919 118817 1 290 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.205 0.105 17919 118818 1 290 . 1 1 8 8 LEU C C 8 178.800 178.800 178.411 0.389 17919 118819 1 290 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.685 -0.105 17919 118820 1 290 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.339 0.631 17919 118821 1 290 . 1 1 8 8 LEU H H 8 9.100 9.100 8.875 0.225 17919 118822 1 290 . 1 1 9 9 THR N N 9 105.590 105.590 107.433 -1.843 17919 118823 1 290 . 1 1 9 9 THR HA H 9 4.428 4.428 4.349 0.079 17919 118824 1 290 . 1 1 9 9 THR C C 9 175.520 175.520 175.840 -0.320 17919 118825 1 290 . 1 1 9 9 THR CA C 9 61.400 61.400 61.714 -0.314 17919 118826 1 290 . 1 1 9 9 THR CB C 9 69.140 69.140 69.751 -0.611 17919 118827 1 290 . 1 1 9 9 THR H H 9 7.630 7.630 7.648 -0.018 17919 118828 1 290 . 1 1 10 10 GLY N N 10 108.890 108.890 110.884 -1.994 17919 118829 1 290 . 1 1 10 10 GLY C C 10 174.070 174.070 174.018 0.052 17919 118830 1 290 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.977 0.483 17919 118831 1 290 . 1 1 10 10 GLY H H 10 7.810 7.810 8.032 -0.222 17919 118832 1 290 . 1 1 11 11 LYS N N 11 121.600 121.600 121.767 -0.167 17919 118833 1 290 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.421 -0.060 17919 118834 1 290 . 1 1 11 11 LYS C C 11 175.940 175.940 175.275 0.665 17919 118835 1 290 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.542 -0.262 17919 118836 1 290 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.716 -0.516 17919 118837 1 290 . 1 1 11 11 LYS H H 11 7.280 7.280 7.731 -0.451 17919 118838 1 290 . 1 1 12 12 THR N N 12 120.440 120.440 121.126 -0.686 17919 118839 1 290 . 1 1 12 12 THR HA H 12 5.046 5.046 5.356 -0.310 17919 118840 1 290 . 1 1 12 12 THR C C 12 174.320 174.320 174.465 -0.145 17919 118841 1 290 . 1 1 12 12 THR CA C 12 62.390 62.390 61.397 0.993 17919 118842 1 290 . 1 1 12 12 THR CB C 12 69.910 69.910 70.031 -0.121 17919 118843 1 290 . 1 1 12 12 THR H H 12 8.650 8.650 8.266 0.384 17919 118844 1 290 . 1 1 13 13 ILE N N 13 127.110 127.110 122.650 4.460 17919 118845 1 290 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.775 -0.231 17919 118846 1 290 . 1 1 13 13 ILE C C 13 175.220 175.220 173.975 1.245 17919 118847 1 290 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.285 0.695 17919 118848 1 290 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.287 0.663 17919 118849 1 290 . 1 1 13 13 ILE H H 13 9.450 9.450 9.247 0.203 17919 118850 1 290 . 1 1 14 14 THR N N 14 121.520 121.520 121.587 -0.067 17919 118851 1 290 . 1 1 14 14 THR HA H 14 4.964 4.964 5.024 -0.060 17919 118852 1 290 . 1 1 14 14 THR C C 14 173.790 173.790 173.606 0.184 17919 118853 1 290 . 1 1 14 14 THR CA C 14 61.940 61.940 61.901 0.039 17919 118854 1 290 . 1 1 14 14 THR CB C 14 69.650 69.650 69.995 -0.345 17919 118855 1 290 . 1 1 14 14 THR H H 14 8.710 8.710 8.365 0.345 17919 118856 1 290 . 1 1 15 15 LEU N N 15 124.800 124.800 125.761 -0.961 17919 118857 1 290 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.743 0.037 17919 118858 1 290 . 1 1 15 15 LEU C C 15 174.670 174.670 175.658 -0.988 17919 118859 1 290 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.407 -0.577 17919 118860 1 290 . 1 1 15 15 LEU CB C 15 47.070 47.070 44.832 2.238 17919 118861 1 290 . 1 1 15 15 LEU H H 15 8.710 8.710 8.158 0.552 17919 118862 1 290 . 1 1 16 16 GLU N N 16 122.160 122.160 123.282 -1.122 17919 118863 1 290 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.104 -0.187 17919 118864 1 290 . 1 1 16 16 GLU C C 16 175.860 175.860 176.131 -0.271 17919 118865 1 290 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.853 -1.033 17919 118866 1 290 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.349 -0.899 17919 118867 1 290 . 1 1 16 16 GLU H H 16 8.140 8.140 8.672 -0.532 17919 118868 1 290 . 1 1 17 17 VAL N N 17 117.210 117.210 117.807 -0.597 17919 118869 1 290 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.803 -0.089 17919 118870 1 290 . 1 1 17 17 VAL C C 17 174.160 174.160 174.670 -0.510 17919 118871 1 290 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.231 -0.801 17919 118872 1 290 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.623 0.777 17919 118873 1 290 . 1 1 17 17 VAL H H 17 8.900 8.900 8.497 0.403 17919 118874 1 290 . 1 1 18 18 GLU N N 18 118.990 118.990 121.902 -2.912 17919 118875 1 290 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.810 0.269 17919 118876 1 290 . 1 1 18 18 GLU C C 18 176.160 176.160 175.620 0.540 17919 118877 1 290 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.304 0.416 17919 118878 1 290 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.252 0.058 17919 118879 1 290 . 1 1 18 18 GLU H H 18 8.640 8.640 8.569 0.071 17919 118880 1 290 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.455 -0.314 17919 118881 1 290 . 1 1 19 19 PRO C C 19 175.310 175.310 177.021 -1.711 17919 118882 1 290 . 1 1 19 19 PRO CA C 19 65.470 65.470 64.580 0.890 17919 118883 1 290 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.304 -0.354 17919 118884 1 290 . 1 1 20 20 SER N N 20 103.400 103.400 111.879 -8.479 17919 118885 1 290 . 1 1 20 20 SER HA H 20 4.370 4.370 4.302 0.068 17919 118886 1 290 . 1 1 20 20 SER C C 20 174.660 174.660 174.656 0.004 17919 118887 1 290 . 1 1 20 20 SER CA C 20 57.400 57.400 58.719 -1.319 17919 118888 1 290 . 1 1 20 20 SER CB C 20 63.370 63.370 62.841 0.529 17919 118889 1 290 . 1 1 20 20 SER H H 20 7.040 7.040 7.998 -0.958 17919 118890 1 290 . 1 1 21 21 ASP N N 21 123.480 123.480 125.410 -1.930 17919 118891 1 290 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.771 -0.076 17919 118892 1 290 . 1 1 21 21 ASP C C 21 176.360 176.360 176.089 0.271 17919 118893 1 290 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.066 0.634 17919 118894 1 290 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.626 -0.826 17919 118895 1 290 . 1 1 21 21 ASP H H 21 8.030 8.030 7.861 0.169 17919 118896 1 290 . 1 1 22 22 THR N N 22 108.800 108.800 113.230 -4.430 17919 118897 1 290 . 1 1 22 22 THR HA H 22 4.920 4.920 4.722 0.198 17919 118898 1 290 . 1 1 22 22 THR C C 22 176.750 176.750 176.267 0.483 17919 118899 1 290 . 1 1 22 22 THR CA C 22 59.690 59.690 60.878 -1.188 17919 118900 1 290 . 1 1 22 22 THR CB C 22 71.200 71.200 70.664 0.536 17919 118901 1 290 . 1 1 22 22 THR H H 22 7.900 7.900 8.137 -0.237 17919 118902 1 290 . 1 1 23 23 ILE N N 23 121.190 121.190 122.601 -1.411 17919 118903 1 290 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.689 -0.032 17919 118904 1 290 . 1 1 23 23 ILE C C 23 179.040 179.040 177.844 1.196 17919 118905 1 290 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.255 -0.995 17919 118906 1 290 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.157 -1.807 17919 118907 1 290 . 1 1 23 23 ILE H H 23 8.560 8.560 8.798 -0.238 17919 118908 1 290 . 1 1 24 24 GLU N N 24 120.830 120.830 119.472 1.358 17919 118909 1 290 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.947 -0.030 17919 118910 1 290 . 1 1 24 24 GLU C C 24 178.640 178.640 178.639 0.001 17919 118911 1 290 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.269 0.951 17919 118912 1 290 . 1 1 24 24 GLU CB C 24 28.280 28.280 28.749 -0.469 17919 118913 1 290 . 1 1 24 24 GLU H H 24 9.760 9.760 8.158 1.602 17919 118914 1 290 . 1 1 25 25 ASN N N 25 120.570 120.570 118.786 1.784 17919 118915 1 290 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.475 0.050 17919 118916 1 290 . 1 1 25 25 ASN C C 25 178.380 178.380 177.739 0.641 17919 118917 1 290 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.027 0.033 17919 118918 1 290 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.938 -0.487 17919 118919 1 290 . 1 1 25 25 ASN H H 25 7.920 7.920 7.694 0.226 17919 118920 1 290 . 1 1 26 26 VAL N N 26 121.710 121.710 120.711 0.999 17919 118921 1 290 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.599 -0.202 17919 118922 1 290 . 1 1 26 26 VAL C C 26 177.950 177.950 177.623 0.327 17919 118923 1 290 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.597 1.064 17919 118924 1 290 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.667 -0.827 17919 118925 1 290 . 1 1 26 26 VAL H H 26 8.070 8.070 8.090 -0.020 17919 118926 1 290 . 1 1 27 27 LYS N N 27 118.860 118.860 120.066 -1.206 17919 118927 1 290 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.294 0.286 17919 118928 1 290 . 1 1 27 27 LYS C C 27 180.550 180.550 179.074 1.476 17919 118929 1 290 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.508 -0.258 17919 118930 1 290 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.219 1.511 17919 118931 1 290 . 1 1 27 27 LYS H H 27 8.560 8.560 8.251 0.309 17919 118932 1 290 . 1 1 28 28 ALA N N 28 123.440 123.440 122.360 1.080 17919 118933 1 290 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.069 0.091 17919 118934 1 290 . 1 1 28 28 ALA C C 28 180.300 180.300 178.999 1.301 17919 118935 1 290 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.092 0.278 17919 118936 1 290 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.242 -0.532 17919 118937 1 290 . 1 1 28 28 ALA H H 28 8.060 8.060 8.260 -0.200 17919 118938 1 290 . 1 1 29 29 LYS N N 29 119.940 119.940 119.797 0.143 17919 118939 1 290 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.025 0.182 17919 118940 1 290 . 1 1 29 29 LYS C C 29 180.320 180.320 179.008 1.312 17919 118941 1 290 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.477 0.173 17919 118942 1 290 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.328 0.962 17919 118943 1 290 . 1 1 29 29 LYS H H 29 7.850 7.850 7.639 0.211 17919 118944 1 290 . 1 1 30 30 ILE N N 30 121.080 121.080 119.824 1.256 17919 118945 1 290 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.653 -0.146 17919 118946 1 290 . 1 1 30 30 ILE C C 30 178.310 178.310 177.401 0.909 17919 118947 1 290 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.204 0.946 17919 118948 1 290 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.796 -0.996 17919 118949 1 290 . 1 1 30 30 ILE H H 30 8.280 8.280 8.391 -0.111 17919 118950 1 290 . 1 1 31 31 GLN N N 31 123.490 123.490 121.220 2.270 17919 118951 1 290 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.934 -0.105 17919 118952 1 290 . 1 1 31 31 GLN C C 31 178.890 178.890 178.358 0.532 17919 118953 1 290 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.133 0.868 17919 118954 1 290 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.534 -0.814 17919 118955 1 290 . 1 1 31 31 GLN H H 31 8.580 8.580 8.083 0.497 17919 118956 1 290 . 1 1 32 32 ASP N N 32 119.360 119.360 118.359 1.001 17919 118957 1 290 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.493 -0.139 17919 118958 1 290 . 1 1 32 32 ASP C C 32 177.250 177.250 177.363 -0.113 17919 118959 1 290 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.282 0.908 17919 118960 1 290 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.397 0.183 17919 118961 1 290 . 1 1 32 32 ASP H H 32 8.010 8.010 8.156 -0.146 17919 118962 1 290 . 1 1 33 33 LYS N N 33 115.130 115.130 118.454 -3.324 17919 118963 1 290 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.469 -0.132 17919 118964 1 290 . 1 1 33 33 LYS C C 33 177.870 177.870 177.663 0.207 17919 118965 1 290 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.220 0.830 17919 118966 1 290 . 1 1 33 33 LYS CB C 33 34.170 34.170 34.296 -0.126 17919 118967 1 290 . 1 1 33 33 LYS H H 33 7.430 7.430 7.660 -0.230 17919 118968 1 290 . 1 1 34 34 GLU N N 34 113.870 113.870 114.767 -0.897 17919 118969 1 290 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.520 0.105 17919 118970 1 290 . 1 1 34 34 GLU C C 34 177.840 177.840 177.320 0.520 17919 118971 1 290 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.807 -0.637 17919 118972 1 290 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.704 0.956 17919 118973 1 290 . 1 1 34 34 GLU H H 34 8.740 8.740 8.116 0.624 17919 118974 1 290 . 1 1 35 35 GLY N N 35 108.650 108.650 109.480 -0.830 17919 118975 1 290 . 1 1 35 35 GLY C C 35 173.960 173.960 174.220 -0.260 17919 118976 1 290 . 1 1 35 35 GLY CA C 35 46.080 46.080 46.108 -0.027 17919 118977 1 290 . 1 1 35 35 GLY H H 35 8.530 8.530 8.056 0.474 17919 118978 1 290 . 1 1 36 36 ILE N N 36 119.880 119.880 122.168 -2.288 17919 118979 1 290 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.343 0.102 17919 118980 1 290 . 1 1 36 36 ILE C C 36 173.590 173.590 174.302 -0.712 17919 118981 1 290 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.956 -0.206 17919 118982 1 290 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.328 2.252 17919 118983 1 290 . 1 1 36 36 ILE H H 36 6.150 6.150 7.672 -1.522 17919 118984 1 290 . 1 1 37 37 PRO HA H 37 4.634 4.634 5.006 -0.372 17919 118985 1 290 . 1 1 37 37 PRO C C 37 176.940 176.940 176.138 0.802 17919 118986 1 290 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.180 0.480 17919 118987 1 290 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.191 0.659 17919 118988 1 290 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.225 -0.108 17919 118989 1 290 . 1 1 38 38 PRO C C 38 178.320 178.320 178.280 0.040 17919 118990 1 290 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.602 0.658 17919 118991 1 290 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.802 1.088 17919 118992 1 290 . 1 1 39 39 ASP N N 39 113.380 113.380 117.164 -3.784 17919 118993 1 290 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.374 0.056 17919 118994 1 290 . 1 1 39 39 ASP C C 39 177.090 177.090 177.509 -0.419 17919 118995 1 290 . 1 1 39 39 ASP CA C 39 55.640 55.640 57.030 -1.390 17919 118996 1 290 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.429 -0.889 17919 118997 1 290 . 1 1 39 39 ASP H H 39 8.550 8.550 8.758 -0.208 17919 118998 1 290 . 1 1 40 40 GLN N N 40 116.780 116.780 116.889 -0.109 17919 118999 1 290 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.247 0.217 17919 119000 1 290 . 1 1 40 40 GLN C C 40 175.380 175.380 175.651 -0.271 17919 119001 1 290 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.325 -0.685 17919 119002 1 290 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.324 0.816 17919 119003 1 290 . 1 1 40 40 GLN H H 40 7.820 7.820 7.828 -0.008 17919 119004 1 290 . 1 1 41 41 GLN N N 41 117.720 117.720 119.149 -1.429 17919 119005 1 290 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.420 -0.176 17919 119006 1 290 . 1 1 41 41 GLN C C 41 176.300 176.300 175.584 0.716 17919 119007 1 290 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.991 0.479 17919 119008 1 290 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.490 2.160 17919 119009 1 290 . 1 1 41 41 GLN H H 41 7.480 7.480 7.162 0.318 17919 119010 1 290 . 1 1 42 42 ARG N N 42 122.680 122.680 127.231 -4.551 17919 119011 1 290 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.599 -0.099 17919 119012 1 290 . 1 1 42 42 ARG C C 42 174.050 174.050 173.934 0.116 17919 119013 1 290 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.739 0.311 17919 119014 1 290 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.260 -0.510 17919 119015 1 290 . 1 1 42 42 ARG H H 42 8.530 8.530 9.082 -0.552 17919 119016 1 290 . 1 1 43 43 LEU N N 43 124.040 124.040 127.888 -3.848 17919 119017 1 290 . 1 1 43 43 LEU C C 43 175.290 175.290 175.304 -0.014 17919 119018 1 290 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.692 -0.712 17919 119019 1 290 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.297 2.493 17919 119020 1 290 . 1 1 43 43 LEU H H 43 8.820 8.820 8.785 0.035 17919 119021 1 290 . 1 1 44 44 ILE N N 44 121.920 121.920 123.464 -1.544 17919 119022 1 290 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.162 -0.170 17919 119023 1 290 . 1 1 44 44 ILE C C 44 176.060 176.060 174.450 1.610 17919 119024 1 290 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.080 -1.100 17919 119025 1 290 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.031 0.389 17919 119026 1 290 . 1 1 44 44 ILE H H 44 9.030 9.030 9.197 -0.167 17919 119027 1 290 . 1 1 45 45 PHE N N 45 125.390 125.390 127.950 -2.560 17919 119028 1 290 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.083 -0.038 17919 119029 1 290 . 1 1 45 45 PHE C C 45 174.470 174.470 174.460 0.010 17919 119030 1 290 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.063 0.957 17919 119031 1 290 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.314 0.446 17919 119032 1 290 . 1 1 45 45 PHE H H 45 8.830 8.830 8.879 -0.049 17919 119033 1 290 . 1 1 46 46 ALA N N 46 132.200 132.200 129.309 2.891 17919 119034 1 290 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.659 0.031 17919 119035 1 290 . 1 1 46 46 ALA C C 46 177.290 177.290 177.876 -0.586 17919 119036 1 290 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.416 0.124 17919 119037 1 290 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.328 0.242 17919 119038 1 290 . 1 1 46 46 ALA H H 46 8.810 8.810 8.758 0.052 17919 119039 1 290 . 1 1 47 47 GLY N N 47 102.340 102.340 104.414 -2.074 17919 119040 1 290 . 1 1 47 47 GLY C C 47 173.810 173.810 174.251 -0.441 17919 119041 1 290 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.924 0.426 17919 119042 1 290 . 1 1 47 47 GLY H H 47 8.130 8.130 8.472 -0.342 17919 119043 1 290 . 1 1 48 48 LYS N N 48 121.570 121.570 121.532 0.038 17919 119044 1 290 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.618 0.004 17919 119045 1 290 . 1 1 48 48 LYS C C 48 174.700 174.700 175.424 -0.724 17919 119046 1 290 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.005 -0.455 17919 119047 1 290 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.440 0.090 17919 119048 1 290 . 1 1 48 48 LYS H H 48 7.980 7.980 8.067 -0.087 17919 119049 1 290 . 1 1 49 49 GLN N N 49 122.410 122.410 123.134 -0.724 17919 119050 1 290 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.420 0.140 17919 119051 1 290 . 1 1 49 49 GLN C C 49 175.670 175.670 175.668 0.002 17919 119052 1 290 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.042 -0.302 17919 119053 1 290 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.261 -0.261 17919 119054 1 290 . 1 1 49 49 GLN H H 49 8.600 8.600 8.548 0.052 17919 119055 1 290 . 1 1 50 50 LEU N N 50 125.520 125.520 126.817 -1.297 17919 119056 1 290 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.031 0.059 17919 119057 1 290 . 1 1 50 50 LEU C C 50 176.660 176.660 176.219 0.441 17919 119058 1 290 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.313 -0.073 17919 119059 1 290 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.744 -0.174 17919 119060 1 290 . 1 1 50 50 LEU H H 50 8.530 8.530 8.680 -0.150 17919 119061 1 290 . 1 1 51 51 GLU N N 51 122.940 122.940 123.458 -0.518 17919 119062 1 290 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.573 -0.085 17919 119063 1 290 . 1 1 51 51 GLU C C 51 175.870 175.870 176.688 -0.818 17919 119064 1 290 . 1 1 51 51 GLU CA C 51 55.960 55.960 54.938 1.022 17919 119065 1 290 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.983 -0.413 17919 119066 1 290 . 1 1 51 51 GLU H H 51 8.400 8.400 7.926 0.474 17919 119067 1 290 . 1 1 52 52 ASP N N 52 120.030 120.030 123.390 -3.360 17919 119068 1 290 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.441 -0.082 17919 119069 1 290 . 1 1 52 52 ASP C C 52 177.330 177.330 177.680 -0.350 17919 119070 1 290 . 1 1 52 52 ASP CA C 52 56.960 56.960 58.105 -1.145 17919 119071 1 290 . 1 1 52 52 ASP CB C 52 40.850 40.850 41.065 -0.214 17919 119072 1 290 . 1 1 52 52 ASP H H 52 8.160 8.160 8.871 -0.711 17919 119073 1 290 . 1 1 53 53 GLY N N 53 106.660 106.660 105.786 0.874 17919 119074 1 290 . 1 1 53 53 GLY C C 53 174.870 174.870 174.001 0.869 17919 119075 1 290 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.642 0.528 17919 119076 1 290 . 1 1 53 53 GLY H H 53 9.390 9.390 8.400 0.990 17919 119077 1 290 . 1 1 54 54 ARG N N 54 119.050 119.050 120.269 -1.219 17919 119078 1 290 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.665 0.030 17919 119079 1 290 . 1 1 54 54 ARG C C 54 175.350 175.350 175.213 0.137 17919 119080 1 290 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.074 0.316 17919 119081 1 290 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.734 -0.084 17919 119082 1 290 . 1 1 54 54 ARG H H 54 7.460 7.460 7.499 -0.039 17919 119083 1 290 . 1 1 55 55 THR N N 55 108.400 108.400 111.551 -3.151 17919 119084 1 290 . 1 1 55 55 THR HA H 55 5.240 5.240 5.158 0.082 17919 119085 1 290 . 1 1 55 55 THR C C 55 176.560 176.560 176.340 0.220 17919 119086 1 290 . 1 1 55 55 THR CA C 55 59.690 59.690 59.605 0.085 17919 119087 1 290 . 1 1 55 55 THR CB C 55 72.260 72.260 71.115 1.145 17919 119088 1 290 . 1 1 55 55 THR H H 55 8.730 8.730 8.838 -0.108 17919 119089 1 290 . 1 1 56 56 LEU N N 56 117.920 117.920 120.388 -2.468 17919 119090 1 290 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.984 0.076 17919 119091 1 290 . 1 1 56 56 LEU C C 56 180.810 180.810 178.929 1.881 17919 119092 1 290 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.133 0.577 17919 119093 1 290 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.292 -0.923 17919 119094 1 290 . 1 1 56 56 LEU H H 56 8.140 8.140 8.420 -0.280 17919 119095 1 290 . 1 1 57 57 SER N N 57 113.330 113.330 114.511 -1.181 17919 119096 1 290 . 1 1 57 57 SER HA H 57 4.370 4.370 4.115 0.255 17919 119097 1 290 . 1 1 57 57 SER C C 57 178.310 178.310 176.881 1.429 17919 119098 1 290 . 1 1 57 57 SER CA C 57 61.080 61.080 61.673 -0.593 17919 119099 1 290 . 1 1 57 57 SER CB C 57 62.530 62.530 62.667 -0.137 17919 119100 1 290 . 1 1 57 57 SER H H 57 8.470 8.470 8.523 -0.053 17919 119101 1 290 . 1 1 58 58 ASP N N 58 124.190 124.190 121.239 2.951 17919 119102 1 290 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.395 -0.099 17919 119103 1 290 . 1 1 58 58 ASP C C 58 177.400 177.400 176.970 0.430 17919 119104 1 290 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.343 0.837 17919 119105 1 290 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.571 -0.471 17919 119106 1 290 . 1 1 58 58 ASP H H 58 7.930 7.930 7.779 0.151 17919 119107 1 290 . 1 1 59 59 TYR N N 59 115.510 115.510 115.807 -0.297 17919 119108 1 290 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.635 0.035 17919 119109 1 290 . 1 1 59 59 TYR C C 59 174.700 174.700 175.035 -0.335 17919 119110 1 290 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.106 1.144 17919 119111 1 290 . 1 1 59 59 TYR CB C 59 40.070 40.070 37.815 2.255 17919 119112 1 290 . 1 1 59 59 TYR H H 59 7.250 7.250 7.187 0.063 17919 119113 1 290 . 1 1 60 60 ASN N N 60 115.900 115.900 115.227 0.673 17919 119114 1 290 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.398 -0.043 17919 119115 1 290 . 1 1 60 60 ASN C C 60 174.340 174.340 174.533 -0.193 17919 119116 1 290 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.727 -0.607 17919 119117 1 290 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.070 0.340 17919 119118 1 290 . 1 1 60 60 ASN H H 60 8.150 8.150 7.674 0.476 17919 119119 1 290 . 1 1 61 61 ILE N N 61 118.600 118.600 119.853 -1.253 17919 119120 1 290 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.626 -0.233 17919 119121 1 290 . 1 1 61 61 ILE C C 61 174.610 174.610 175.380 -0.770 17919 119122 1 290 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.190 0.230 17919 119123 1 290 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.287 -0.547 17919 119124 1 290 . 1 1 61 61 ILE H H 61 7.250 7.250 8.061 -0.811 17919 119125 1 290 . 1 1 62 62 GLN N N 62 124.740 124.740 125.919 -1.179 17919 119126 1 290 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.792 -0.286 17919 119127 1 290 . 1 1 62 62 GLN C C 62 175.970 175.970 175.699 0.271 17919 119128 1 290 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.411 0.249 17919 119129 1 290 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.867 -0.217 17919 119130 1 290 . 1 1 62 62 GLN H H 62 7.610 7.610 8.165 -0.555 17919 119131 1 290 . 1 1 63 63 LYS N N 63 120.300 120.300 121.561 -1.261 17919 119132 1 290 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.118 -0.117 17919 119133 1 290 . 1 1 63 63 LYS C C 63 175.810 175.810 176.889 -1.079 17919 119134 1 290 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.673 0.117 17919 119135 1 290 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.947 0.703 17919 119136 1 290 . 1 1 63 63 LYS H H 63 8.490 8.490 8.565 -0.075 17919 119137 1 290 . 1 1 64 64 GLU N N 64 113.950 113.950 120.342 -6.392 17919 119138 1 290 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.759 -0.294 17919 119139 1 290 . 1 1 64 64 GLU C C 64 175.250 175.250 176.156 -0.906 17919 119140 1 290 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.709 0.180 17919 119141 1 290 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.514 -2.614 17919 119142 1 290 . 1 1 64 64 GLU H H 64 9.280 9.280 9.060 0.220 17919 119143 1 290 . 1 1 65 65 SER N N 65 114.730 114.730 115.658 -0.928 17919 119144 1 290 . 1 1 65 65 SER HA H 65 4.640 4.640 4.513 0.127 17919 119145 1 290 . 1 1 65 65 SER C C 65 172.160 172.160 173.827 -1.667 17919 119146 1 290 . 1 1 65 65 SER CA C 65 60.890 60.890 60.674 0.216 17919 119147 1 290 . 1 1 65 65 SER CB C 65 64.910 64.910 64.279 0.631 17919 119148 1 290 . 1 1 65 65 SER H H 65 7.670 7.670 7.641 0.029 17919 119149 1 290 . 1 1 66 66 THR N N 66 117.110 117.110 119.144 -2.034 17919 119150 1 290 . 1 1 66 66 THR HA H 66 5.270 5.270 5.331 -0.061 17919 119151 1 290 . 1 1 66 66 THR C C 66 173.950 173.950 173.897 0.053 17919 119152 1 290 . 1 1 66 66 THR CA C 66 62.340 62.340 61.986 0.353 17919 119153 1 290 . 1 1 66 66 THR CB C 66 70.080 70.080 70.817 -0.737 17919 119154 1 290 . 1 1 66 66 THR H H 66 8.730 8.730 8.547 0.183 17919 119155 1 290 . 1 1 67 67 LEU N N 67 127.110 127.110 126.287 0.823 17919 119156 1 290 . 1 1 67 67 LEU HA H 67 5.060 5.060 5.057 0.003 17919 119157 1 290 . 1 1 67 67 LEU C C 67 175.770 175.770 174.962 0.808 17919 119158 1 290 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.115 -0.215 17919 119159 1 290 . 1 1 67 67 LEU CB C 67 44.260 44.260 45.132 -0.872 17919 119160 1 290 . 1 1 67 67 LEU H H 67 9.410 9.410 9.364 0.046 17919 119161 1 290 . 1 1 68 68 HIS N N 68 118.380 118.380 122.414 -4.034 17919 119162 1 290 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.361 -0.121 17919 119163 1 290 . 1 1 68 68 HIS C C 68 173.150 173.150 173.572 -0.422 17919 119164 1 290 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.167 0.833 17919 119165 1 290 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.314 -1.784 17919 119166 1 290 . 1 1 68 68 HIS H H 68 9.230 9.230 9.299 -0.069 17919 119167 1 290 . 1 1 69 69 LEU N N 69 124.460 124.460 129.644 -5.184 17919 119168 1 290 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.010 0.180 17919 119169 1 290 . 1 1 69 69 LEU C C 69 175.270 175.270 173.947 1.323 17919 119170 1 290 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.909 -0.019 17919 119171 1 290 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.285 0.095 17919 119172 1 290 . 1 1 69 69 LEU H H 69 8.340 8.340 8.938 -0.598 17919 119173 1 290 . 1 1 70 70 VAL N N 70 126.940 126.940 125.995 0.945 17919 119174 1 290 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.276 0.074 17919 119175 1 290 . 1 1 70 70 VAL C C 70 174.000 174.000 174.059 -0.059 17919 119176 1 290 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.952 0.848 17919 119177 1 290 . 1 1 70 70 VAL CB C 70 34.910 34.910 36.100 -1.190 17919 119178 1 290 . 1 1 70 70 VAL H H 70 9.200 9.200 8.981 0.219 17919 119179 1 290 . 1 1 71 71 LEU N N 71 123.130 123.130 124.701 -1.571 17919 119180 1 290 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.013 0.047 17919 119181 1 290 . 1 1 71 71 LEU C C 71 177.830 177.830 178.069 -0.239 17919 119182 1 290 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.605 0.335 17919 119183 1 290 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.382 0.468 17919 119184 1 290 . 1 1 71 71 LEU H H 71 8.120 8.120 8.576 -0.456 17919 119185 1 290 . 1 1 72 72 ARG N N 72 123.490 123.490 125.545 -2.055 17919 119186 1 290 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.353 -0.052 17919 119187 1 290 . 1 1 72 72 ARG C C 72 175.350 175.350 176.460 -1.110 17919 119188 1 290 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.738 -0.128 17919 119189 1 290 . 1 1 72 72 ARG CB C 72 31.350 31.350 28.030 3.320 17919 119190 1 290 . 1 1 72 72 ARG H H 72 8.580 8.580 8.975 -0.395 17919 119191 1 291 . 1 1 2 2 GLN N N 2 123.220 123.220 120.363 2.857 17919 119192 1 291 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.250 -0.001 17919 119193 1 291 . 1 1 2 2 GLN C C 2 175.920 175.920 176.053 -0.133 17919 119194 1 291 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.658 0.422 17919 119195 1 291 . 1 1 2 2 GLN CB C 2 30.760 30.760 28.995 1.765 17919 119196 1 291 . 1 1 2 2 GLN H H 2 8.900 8.900 8.405 0.495 17919 119197 1 291 . 1 1 3 3 ILE N N 3 115.340 115.340 116.842 -1.502 17919 119198 1 291 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.230 -0.017 17919 119199 1 291 . 1 1 3 3 ILE C C 3 172.450 172.450 173.303 -0.853 17919 119200 1 291 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.731 -0.161 17919 119201 1 291 . 1 1 3 3 ILE CB C 3 42.210 42.210 42.150 0.060 17919 119202 1 291 . 1 1 3 3 ILE H H 3 8.320 8.320 8.315 0.005 17919 119203 1 291 . 1 1 4 4 PHE N N 4 118.110 118.110 120.731 -2.621 17919 119204 1 291 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.406 0.224 17919 119205 1 291 . 1 1 4 4 PHE C C 4 175.320 175.320 174.979 0.341 17919 119206 1 291 . 1 1 4 4 PHE CA C 4 55.210 55.210 56.126 -0.916 17919 119207 1 291 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.638 -0.158 17919 119208 1 291 . 1 1 4 4 PHE H H 4 8.610 8.610 8.845 -0.235 17919 119209 1 291 . 1 1 5 5 VAL N N 5 121.000 121.000 122.263 -1.263 17919 119210 1 291 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.871 -0.146 17919 119211 1 291 . 1 1 5 5 VAL C C 5 174.870 174.870 174.283 0.587 17919 119212 1 291 . 1 1 5 5 VAL CA C 5 60.620 60.620 60.573 0.047 17919 119213 1 291 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.836 -0.606 17919 119214 1 291 . 1 1 5 5 VAL H H 5 9.300 9.300 9.133 0.167 17919 119215 1 291 . 1 1 6 6 LYS N N 6 127.520 127.520 129.574 -2.054 17919 119216 1 291 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.218 0.149 17919 119217 1 291 . 1 1 6 6 LYS C C 6 177.140 177.140 176.791 0.349 17919 119218 1 291 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.660 -0.140 17919 119219 1 291 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.888 -0.838 17919 119220 1 291 . 1 1 6 6 LYS H H 6 8.820 8.820 9.320 -0.500 17919 119221 1 291 . 1 1 7 7 THR N N 7 115.400 115.400 117.923 -2.523 17919 119222 1 291 . 1 1 7 7 THR HA H 7 4.970 4.970 4.859 0.111 17919 119223 1 291 . 1 1 7 7 THR C C 7 176.910 176.910 175.886 1.024 17919 119224 1 291 . 1 1 7 7 THR CA C 7 60.470 60.470 61.718 -1.248 17919 119225 1 291 . 1 1 7 7 THR CB C 7 70.630 70.630 70.023 0.606 17919 119226 1 291 . 1 1 7 7 THR H H 7 8.730 8.730 8.978 -0.248 17919 119227 1 291 . 1 1 8 8 LEU N N 8 121.330 121.330 119.986 1.344 17919 119228 1 291 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.845 -0.535 17919 119229 1 291 . 1 1 8 8 LEU C C 8 178.800 178.800 177.086 1.714 17919 119230 1 291 . 1 1 8 8 LEU CA C 8 57.580 57.580 55.198 2.382 17919 119231 1 291 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.833 -0.863 17919 119232 1 291 . 1 1 8 8 LEU H H 8 9.100 9.100 8.727 0.373 17919 119233 1 291 . 1 1 9 9 THR N N 9 105.590 105.590 111.431 -5.841 17919 119234 1 291 . 1 1 9 9 THR HA H 9 4.428 4.428 4.402 0.026 17919 119235 1 291 . 1 1 9 9 THR C C 9 175.520 175.520 175.684 -0.164 17919 119236 1 291 . 1 1 9 9 THR CA C 9 61.400 61.400 61.582 -0.182 17919 119237 1 291 . 1 1 9 9 THR CB C 9 69.140 69.140 69.555 -0.415 17919 119238 1 291 . 1 1 9 9 THR H H 9 7.630 7.630 7.825 -0.195 17919 119239 1 291 . 1 1 10 10 GLY N N 10 108.890 108.890 110.449 -1.559 17919 119240 1 291 . 1 1 10 10 GLY C C 10 174.070 174.070 173.581 0.489 17919 119241 1 291 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.782 0.678 17919 119242 1 291 . 1 1 10 10 GLY H H 10 7.810 7.810 8.399 -0.589 17919 119243 1 291 . 1 1 11 11 LYS N N 11 121.600 121.600 121.772 -0.172 17919 119244 1 291 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.669 -0.308 17919 119245 1 291 . 1 1 11 11 LYS C C 11 175.940 175.940 174.955 0.985 17919 119246 1 291 . 1 1 11 11 LYS CA C 11 56.280 56.280 55.318 0.962 17919 119247 1 291 . 1 1 11 11 LYS CB C 11 33.200 33.200 34.387 -1.187 17919 119248 1 291 . 1 1 11 11 LYS H H 11 7.280 7.280 7.720 -0.440 17919 119249 1 291 . 1 1 12 12 THR N N 12 120.440 120.440 120.275 0.165 17919 119250 1 291 . 1 1 12 12 THR HA H 12 5.046 5.046 5.225 -0.179 17919 119251 1 291 . 1 1 12 12 THR C C 12 174.320 174.320 174.167 0.153 17919 119252 1 291 . 1 1 12 12 THR CA C 12 62.390 62.390 61.813 0.577 17919 119253 1 291 . 1 1 12 12 THR CB C 12 69.910 69.910 70.278 -0.368 17919 119254 1 291 . 1 1 12 12 THR H H 12 8.650 8.650 8.405 0.245 17919 119255 1 291 . 1 1 13 13 ILE N N 13 127.110 127.110 126.962 0.148 17919 119256 1 291 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.527 0.017 17919 119257 1 291 . 1 1 13 13 ILE C C 13 175.220 175.220 175.080 0.140 17919 119258 1 291 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.153 -0.173 17919 119259 1 291 . 1 1 13 13 ILE CB C 13 40.950 40.950 42.464 -1.514 17919 119260 1 291 . 1 1 13 13 ILE H H 13 9.450 9.450 9.338 0.112 17919 119261 1 291 . 1 1 14 14 THR N N 14 121.520 121.520 121.673 -0.153 17919 119262 1 291 . 1 1 14 14 THR HA H 14 4.964 4.964 4.999 -0.035 17919 119263 1 291 . 1 1 14 14 THR C C 14 173.790 173.790 173.818 -0.028 17919 119264 1 291 . 1 1 14 14 THR CA C 14 61.940 61.940 61.703 0.237 17919 119265 1 291 . 1 1 14 14 THR CB C 14 69.650 69.650 69.952 -0.302 17919 119266 1 291 . 1 1 14 14 THR H H 14 8.710 8.710 8.589 0.121 17919 119267 1 291 . 1 1 15 15 LEU N N 15 124.800 124.800 126.501 -1.701 17919 119268 1 291 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.747 0.033 17919 119269 1 291 . 1 1 15 15 LEU C C 15 174.670 174.670 175.167 -0.497 17919 119270 1 291 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.638 -0.808 17919 119271 1 291 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.420 1.650 17919 119272 1 291 . 1 1 15 15 LEU H H 15 8.710 8.710 8.888 -0.178 17919 119273 1 291 . 1 1 16 16 GLU N N 16 122.160 122.160 122.427 -0.267 17919 119274 1 291 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.379 -0.462 17919 119275 1 291 . 1 1 16 16 GLU C C 16 175.860 175.860 176.027 -0.167 17919 119276 1 291 . 1 1 16 16 GLU CA C 16 54.820 54.820 54.932 -0.112 17919 119277 1 291 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.050 -0.600 17919 119278 1 291 . 1 1 16 16 GLU H H 16 8.140 8.140 8.666 -0.526 17919 119279 1 291 . 1 1 17 17 VAL N N 17 117.210 117.210 119.532 -2.322 17919 119280 1 291 . 1 1 17 17 VAL HA H 17 4.714 4.714 5.118 -0.404 17919 119281 1 291 . 1 1 17 17 VAL C C 17 174.160 174.160 174.276 -0.116 17919 119282 1 291 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.804 -0.374 17919 119283 1 291 . 1 1 17 17 VAL CB C 17 36.400 36.400 36.543 -0.143 17919 119284 1 291 . 1 1 17 17 VAL H H 17 8.900 8.900 8.737 0.163 17919 119285 1 291 . 1 1 18 18 GLU N N 18 118.990 118.990 118.226 0.764 17919 119286 1 291 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.865 0.214 17919 119287 1 291 . 1 1 18 18 GLU C C 18 176.160 176.160 174.480 1.680 17919 119288 1 291 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.184 -0.464 17919 119289 1 291 . 1 1 18 18 GLU CB C 18 30.310 30.310 31.045 -0.735 17919 119290 1 291 . 1 1 18 18 GLU H H 18 8.640 8.640 8.515 0.125 17919 119291 1 291 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.295 -0.154 17919 119292 1 291 . 1 1 19 19 PRO C C 19 175.310 175.310 177.890 -2.580 17919 119293 1 291 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.516 -0.046 17919 119294 1 291 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.764 0.186 17919 119295 1 291 . 1 1 20 20 SER N N 20 103.400 103.400 109.818 -6.418 17919 119296 1 291 . 1 1 20 20 SER HA H 20 4.370 4.370 4.244 0.126 17919 119297 1 291 . 1 1 20 20 SER C C 20 174.660 174.660 174.626 0.034 17919 119298 1 291 . 1 1 20 20 SER CA C 20 57.400 57.400 59.035 -1.635 17919 119299 1 291 . 1 1 20 20 SER CB C 20 63.370 63.370 62.639 0.731 17919 119300 1 291 . 1 1 20 20 SER H H 20 7.040 7.040 8.341 -1.301 17919 119301 1 291 . 1 1 21 21 ASP N N 21 123.480 123.480 124.089 -0.609 17919 119302 1 291 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.827 -0.132 17919 119303 1 291 . 1 1 21 21 ASP C C 21 176.360 176.360 175.978 0.382 17919 119304 1 291 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.799 0.901 17919 119305 1 291 . 1 1 21 21 ASP CB C 21 40.800 40.800 42.136 -1.336 17919 119306 1 291 . 1 1 21 21 ASP H H 21 8.030 8.030 8.153 -0.123 17919 119307 1 291 . 1 1 22 22 THR N N 22 108.800 108.800 112.208 -3.408 17919 119308 1 291 . 1 1 22 22 THR HA H 22 4.920 4.920 4.798 0.122 17919 119309 1 291 . 1 1 22 22 THR C C 22 176.750 176.750 175.984 0.766 17919 119310 1 291 . 1 1 22 22 THR CA C 22 59.690 59.690 61.021 -1.331 17919 119311 1 291 . 1 1 22 22 THR CB C 22 71.200 71.200 70.561 0.639 17919 119312 1 291 . 1 1 22 22 THR H H 22 7.900 7.900 8.233 -0.333 17919 119313 1 291 . 1 1 23 23 ILE N N 23 121.190 121.190 120.892 0.298 17919 119314 1 291 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.871 -0.214 17919 119315 1 291 . 1 1 23 23 ILE C C 23 179.040 179.040 177.576 1.464 17919 119316 1 291 . 1 1 23 23 ILE CA C 23 62.260 62.260 61.026 1.234 17919 119317 1 291 . 1 1 23 23 ILE CB C 23 34.350 34.350 35.953 -1.603 17919 119318 1 291 . 1 1 23 23 ILE H H 23 8.560 8.560 8.436 0.124 17919 119319 1 291 . 1 1 24 24 GLU N N 24 120.830 120.830 121.559 -0.729 17919 119320 1 291 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.857 0.060 17919 119321 1 291 . 1 1 24 24 GLU C C 24 178.640 178.640 178.299 0.341 17919 119322 1 291 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.198 0.022 17919 119323 1 291 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.504 -1.224 17919 119324 1 291 . 1 1 24 24 GLU H H 24 9.760 9.760 8.541 1.219 17919 119325 1 291 . 1 1 25 25 ASN N N 25 120.570 120.570 118.064 2.506 17919 119326 1 291 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.485 0.040 17919 119327 1 291 . 1 1 25 25 ASN C C 25 178.380 178.380 177.757 0.623 17919 119328 1 291 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.184 -0.124 17919 119329 1 291 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.764 -0.314 17919 119330 1 291 . 1 1 25 25 ASN H H 25 7.920 7.920 7.778 0.142 17919 119331 1 291 . 1 1 26 26 VAL N N 26 121.710 121.710 121.022 0.688 17919 119332 1 291 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.506 -0.109 17919 119333 1 291 . 1 1 26 26 VAL C C 26 177.950 177.950 177.764 0.186 17919 119334 1 291 . 1 1 26 26 VAL CA C 26 67.660 67.660 67.032 0.628 17919 119335 1 291 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.666 -0.826 17919 119336 1 291 . 1 1 26 26 VAL H H 26 8.070 8.070 8.249 -0.179 17919 119337 1 291 . 1 1 27 27 LYS N N 27 118.860 118.860 119.685 -0.825 17919 119338 1 291 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.157 0.423 17919 119339 1 291 . 1 1 27 27 LYS C C 27 180.550 180.550 179.205 1.345 17919 119340 1 291 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.533 -0.283 17919 119341 1 291 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.341 1.389 17919 119342 1 291 . 1 1 27 27 LYS H H 27 8.560 8.560 8.123 0.437 17919 119343 1 291 . 1 1 28 28 ALA N N 28 123.440 123.440 122.146 1.294 17919 119344 1 291 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.010 0.150 17919 119345 1 291 . 1 1 28 28 ALA C C 28 180.300 180.300 179.349 0.951 17919 119346 1 291 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.266 0.104 17919 119347 1 291 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.358 -0.648 17919 119348 1 291 . 1 1 28 28 ALA H H 28 8.060 8.060 8.344 -0.284 17919 119349 1 291 . 1 1 29 29 LYS N N 29 119.940 119.940 118.632 1.308 17919 119350 1 291 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.045 0.162 17919 119351 1 291 . 1 1 29 29 LYS C C 29 180.320 180.320 179.040 1.280 17919 119352 1 291 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.382 0.269 17919 119353 1 291 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.421 0.869 17919 119354 1 291 . 1 1 29 29 LYS H H 29 7.850 7.850 7.935 -0.085 17919 119355 1 291 . 1 1 30 30 ILE N N 30 121.080 121.080 120.503 0.577 17919 119356 1 291 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.635 -0.128 17919 119357 1 291 . 1 1 30 30 ILE C C 30 178.310 178.310 177.298 1.012 17919 119358 1 291 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.535 0.615 17919 119359 1 291 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.782 -0.982 17919 119360 1 291 . 1 1 30 30 ILE H H 30 8.280 8.280 8.142 0.138 17919 119361 1 291 . 1 1 31 31 GLN N N 31 123.490 123.490 120.643 2.847 17919 119362 1 291 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.875 -0.046 17919 119363 1 291 . 1 1 31 31 GLN C C 31 178.890 178.890 178.085 0.805 17919 119364 1 291 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.571 0.429 17919 119365 1 291 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.415 -0.695 17919 119366 1 291 . 1 1 31 31 GLN H H 31 8.580 8.580 7.915 0.665 17919 119367 1 291 . 1 1 32 32 ASP N N 32 119.360 119.360 119.546 -0.186 17919 119368 1 291 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.360 -0.006 17919 119369 1 291 . 1 1 32 32 ASP C C 32 177.250 177.250 178.213 -0.963 17919 119370 1 291 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.851 0.339 17919 119371 1 291 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.863 -0.283 17919 119372 1 291 . 1 1 32 32 ASP H H 32 8.010 8.010 7.983 0.027 17919 119373 1 291 . 1 1 33 33 LYS N N 33 115.130 115.130 117.413 -2.283 17919 119374 1 291 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.244 0.093 17919 119375 1 291 . 1 1 33 33 LYS C C 33 177.870 177.870 178.027 -0.157 17919 119376 1 291 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.469 -0.419 17919 119377 1 291 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.336 0.834 17919 119378 1 291 . 1 1 33 33 LYS H H 33 7.430 7.430 7.705 -0.275 17919 119379 1 291 . 1 1 34 34 GLU N N 34 113.870 113.870 114.777 -0.907 17919 119380 1 291 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.552 0.073 17919 119381 1 291 . 1 1 34 34 GLU C C 34 177.840 177.840 177.168 0.672 17919 119382 1 291 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.201 -0.031 17919 119383 1 291 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.727 0.932 17919 119384 1 291 . 1 1 34 34 GLU H H 34 8.740 8.740 8.247 0.493 17919 119385 1 291 . 1 1 35 35 GLY N N 35 108.650 108.650 109.543 -0.893 17919 119386 1 291 . 1 1 35 35 GLY C C 35 173.960 173.960 174.314 -0.354 17919 119387 1 291 . 1 1 35 35 GLY CA C 35 46.080 46.080 46.104 -0.024 17919 119388 1 291 . 1 1 35 35 GLY H H 35 8.530 8.530 8.373 0.157 17919 119389 1 291 . 1 1 36 36 ILE N N 36 119.880 119.880 121.373 -1.493 17919 119390 1 291 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.284 0.161 17919 119391 1 291 . 1 1 36 36 ILE C C 36 173.590 173.590 174.370 -0.780 17919 119392 1 291 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.824 -0.074 17919 119393 1 291 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.672 1.908 17919 119394 1 291 . 1 1 36 36 ILE H H 36 6.150 6.150 7.597 -1.447 17919 119395 1 291 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.800 -0.166 17919 119396 1 291 . 1 1 37 37 PRO C C 37 176.940 176.940 176.088 0.852 17919 119397 1 291 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.260 0.400 17919 119398 1 291 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.400 0.450 17919 119399 1 291 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.149 -0.032 17919 119400 1 291 . 1 1 38 38 PRO C C 38 178.320 178.320 177.824 0.496 17919 119401 1 291 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.729 0.531 17919 119402 1 291 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.935 0.955 17919 119403 1 291 . 1 1 39 39 ASP N N 39 113.380 113.380 114.638 -1.258 17919 119404 1 291 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.457 -0.027 17919 119405 1 291 . 1 1 39 39 ASP C C 39 177.090 177.090 177.884 -0.794 17919 119406 1 291 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.392 -0.752 17919 119407 1 291 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.641 -1.101 17919 119408 1 291 . 1 1 39 39 ASP H H 39 8.550 8.550 8.336 0.214 17919 119409 1 291 . 1 1 40 40 GLN N N 40 116.780 116.780 117.404 -0.624 17919 119410 1 291 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.306 0.158 17919 119411 1 291 . 1 1 40 40 GLN C C 40 175.380 175.380 176.232 -0.852 17919 119412 1 291 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.209 -0.570 17919 119413 1 291 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.214 0.926 17919 119414 1 291 . 1 1 40 40 GLN H H 40 7.820 7.820 8.193 -0.373 17919 119415 1 291 . 1 1 41 41 GLN N N 41 117.720 117.720 118.937 -1.217 17919 119416 1 291 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.461 -0.217 17919 119417 1 291 . 1 1 41 41 GLN C C 41 176.300 176.300 175.505 0.795 17919 119418 1 291 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.953 0.517 17919 119419 1 291 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.478 2.172 17919 119420 1 291 . 1 1 41 41 GLN H H 41 7.480 7.480 7.238 0.242 17919 119421 1 291 . 1 1 42 42 ARG N N 42 122.680 122.680 126.860 -4.180 17919 119422 1 291 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.616 -0.116 17919 119423 1 291 . 1 1 42 42 ARG C C 42 174.050 174.050 173.840 0.210 17919 119424 1 291 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.922 0.128 17919 119425 1 291 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.545 -0.795 17919 119426 1 291 . 1 1 42 42 ARG H H 42 8.530 8.530 8.566 -0.036 17919 119427 1 291 . 1 1 43 43 LEU N N 43 124.040 124.040 127.493 -3.453 17919 119428 1 291 . 1 1 43 43 LEU C C 43 175.290 175.290 175.861 -0.571 17919 119429 1 291 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.637 -0.657 17919 119430 1 291 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.179 1.611 17919 119431 1 291 . 1 1 43 43 LEU H H 43 8.820 8.820 8.679 0.141 17919 119432 1 291 . 1 1 44 44 ILE N N 44 121.920 121.920 121.259 0.661 17919 119433 1 291 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.743 0.249 17919 119434 1 291 . 1 1 44 44 ILE C C 44 176.060 176.060 174.042 2.018 17919 119435 1 291 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.237 -1.258 17919 119436 1 291 . 1 1 44 44 ILE CB C 44 41.420 41.420 42.444 -1.024 17919 119437 1 291 . 1 1 44 44 ILE H H 44 9.030 9.030 8.879 0.151 17919 119438 1 291 . 1 1 45 45 PHE N N 45 125.390 125.390 125.355 0.035 17919 119439 1 291 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.027 0.018 17919 119440 1 291 . 1 1 45 45 PHE C C 45 174.470 174.470 174.676 -0.206 17919 119441 1 291 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.425 0.596 17919 119442 1 291 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.175 1.585 17919 119443 1 291 . 1 1 45 45 PHE H H 45 8.830 8.830 8.870 -0.040 17919 119444 1 291 . 1 1 46 46 ALA N N 46 132.200 132.200 130.591 1.609 17919 119445 1 291 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.717 -0.027 17919 119446 1 291 . 1 1 46 46 ALA C C 46 177.290 177.290 177.324 -0.034 17919 119447 1 291 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.839 -0.299 17919 119448 1 291 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.605 -0.035 17919 119449 1 291 . 1 1 46 46 ALA H H 46 8.810 8.810 9.278 -0.468 17919 119450 1 291 . 1 1 47 47 GLY N N 47 102.340 102.340 103.757 -1.417 17919 119451 1 291 . 1 1 47 47 GLY C C 47 173.810 173.810 174.248 -0.438 17919 119452 1 291 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.258 0.092 17919 119453 1 291 . 1 1 47 47 GLY H H 47 8.130 8.130 8.536 -0.406 17919 119454 1 291 . 1 1 48 48 LYS N N 48 121.570 121.570 121.226 0.344 17919 119455 1 291 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.624 -0.002 17919 119456 1 291 . 1 1 48 48 LYS C C 48 174.700 174.700 175.301 -0.601 17919 119457 1 291 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.140 -0.590 17919 119458 1 291 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.475 0.055 17919 119459 1 291 . 1 1 48 48 LYS H H 48 7.980 7.980 7.828 0.152 17919 119460 1 291 . 1 1 49 49 GLN N N 49 122.410 122.410 124.880 -2.470 17919 119461 1 291 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.390 0.170 17919 119462 1 291 . 1 1 49 49 GLN C C 49 175.670 175.670 175.364 0.306 17919 119463 1 291 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.305 0.435 17919 119464 1 291 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.661 -0.661 17919 119465 1 291 . 1 1 49 49 GLN H H 49 8.600 8.600 8.465 0.135 17919 119466 1 291 . 1 1 50 50 LEU N N 50 125.520 125.520 123.931 1.589 17919 119467 1 291 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.491 -0.401 17919 119468 1 291 . 1 1 50 50 LEU C C 50 176.660 176.660 177.107 -0.447 17919 119469 1 291 . 1 1 50 50 LEU CA C 50 54.240 54.240 52.867 1.373 17919 119470 1 291 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.008 -0.438 17919 119471 1 291 . 1 1 50 50 LEU H H 50 8.530 8.530 8.393 0.137 17919 119472 1 291 . 1 1 51 51 GLU N N 51 122.940 122.940 123.446 -0.506 17919 119473 1 291 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.376 0.112 17919 119474 1 291 . 1 1 51 51 GLU C C 51 175.870 175.870 177.023 -1.153 17919 119475 1 291 . 1 1 51 51 GLU CA C 51 55.960 55.960 56.181 -0.222 17919 119476 1 291 . 1 1 51 51 GLU CB C 51 31.570 31.570 30.942 0.628 17919 119477 1 291 . 1 1 51 51 GLU H H 51 8.400 8.400 8.483 -0.083 17919 119478 1 291 . 1 1 52 52 ASP N N 52 120.030 120.030 127.662 -7.632 17919 119479 1 291 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.488 -0.129 17919 119480 1 291 . 1 1 52 52 ASP C C 52 177.330 177.330 177.339 -0.009 17919 119481 1 291 . 1 1 52 52 ASP CA C 52 56.960 56.960 56.680 0.280 17919 119482 1 291 . 1 1 52 52 ASP CB C 52 40.850 40.850 41.063 -0.213 17919 119483 1 291 . 1 1 52 52 ASP H H 52 8.160 8.160 8.801 -0.641 17919 119484 1 291 . 1 1 53 53 GLY N N 53 106.660 106.660 105.942 0.718 17919 119485 1 291 . 1 1 53 53 GLY C C 53 174.870 174.870 173.814 1.056 17919 119486 1 291 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.964 0.206 17919 119487 1 291 . 1 1 53 53 GLY H H 53 9.390 9.390 8.593 0.797 17919 119488 1 291 . 1 1 54 54 ARG N N 54 119.050 119.050 120.336 -1.286 17919 119489 1 291 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.631 0.064 17919 119490 1 291 . 1 1 54 54 ARG C C 54 175.350 175.350 175.340 0.010 17919 119491 1 291 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.374 0.016 17919 119492 1 291 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.479 -0.829 17919 119493 1 291 . 1 1 54 54 ARG H H 54 7.460 7.460 7.344 0.116 17919 119494 1 291 . 1 1 55 55 THR N N 55 108.400 108.400 113.148 -4.748 17919 119495 1 291 . 1 1 55 55 THR HA H 55 5.240 5.240 4.787 0.453 17919 119496 1 291 . 1 1 55 55 THR C C 55 176.560 176.560 176.195 0.365 17919 119497 1 291 . 1 1 55 55 THR CA C 55 59.690 59.690 61.075 -1.385 17919 119498 1 291 . 1 1 55 55 THR CB C 55 72.260 72.260 70.257 2.003 17919 119499 1 291 . 1 1 55 55 THR H H 55 8.730 8.730 8.922 -0.192 17919 119500 1 291 . 1 1 56 56 LEU N N 56 117.920 117.920 122.942 -5.022 17919 119501 1 291 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.058 0.002 17919 119502 1 291 . 1 1 56 56 LEU C C 56 180.810 180.810 178.772 2.038 17919 119503 1 291 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.782 -0.073 17919 119504 1 291 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.210 -0.840 17919 119505 1 291 . 1 1 56 56 LEU H H 56 8.140 8.140 8.552 -0.412 17919 119506 1 291 . 1 1 57 57 SER N N 57 113.330 113.330 115.810 -2.480 17919 119507 1 291 . 1 1 57 57 SER HA H 57 4.370 4.370 4.085 0.285 17919 119508 1 291 . 1 1 57 57 SER C C 57 178.310 178.310 176.861 1.449 17919 119509 1 291 . 1 1 57 57 SER CA C 57 61.080 61.080 62.415 -1.335 17919 119510 1 291 . 1 1 57 57 SER CB C 57 62.530 62.530 62.570 -0.040 17919 119511 1 291 . 1 1 57 57 SER H H 57 8.470 8.470 8.110 0.360 17919 119512 1 291 . 1 1 58 58 ASP N N 58 124.190 124.190 121.524 2.666 17919 119513 1 291 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.307 -0.011 17919 119514 1 291 . 1 1 58 58 ASP C C 58 177.400 177.400 177.268 0.132 17919 119515 1 291 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.808 0.372 17919 119516 1 291 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.416 -0.316 17919 119517 1 291 . 1 1 58 58 ASP H H 58 7.930 7.930 7.870 0.060 17919 119518 1 291 . 1 1 59 59 TYR N N 59 115.510 115.510 115.462 0.048 17919 119519 1 291 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.647 0.023 17919 119520 1 291 . 1 1 59 59 TYR C C 59 174.700 174.700 175.135 -0.435 17919 119521 1 291 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.270 0.980 17919 119522 1 291 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.351 1.719 17919 119523 1 291 . 1 1 59 59 TYR H H 59 7.250 7.250 7.229 0.021 17919 119524 1 291 . 1 1 60 60 ASN N N 60 115.900 115.900 117.676 -1.776 17919 119525 1 291 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.419 -0.064 17919 119526 1 291 . 1 1 60 60 ASN C C 60 174.340 174.340 174.718 -0.378 17919 119527 1 291 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.067 0.053 17919 119528 1 291 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.227 0.183 17919 119529 1 291 . 1 1 60 60 ASN H H 60 8.150 8.150 8.105 0.045 17919 119530 1 291 . 1 1 61 61 ILE N N 61 118.600 118.600 120.373 -1.773 17919 119531 1 291 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.966 -0.573 17919 119532 1 291 . 1 1 61 61 ILE C C 61 174.610 174.610 175.377 -0.767 17919 119533 1 291 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.220 0.200 17919 119534 1 291 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.503 -0.763 17919 119535 1 291 . 1 1 61 61 ILE H H 61 7.250 7.250 8.160 -0.910 17919 119536 1 291 . 1 1 62 62 GLN N N 62 124.740 124.740 125.578 -0.838 17919 119537 1 291 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.789 -0.283 17919 119538 1 291 . 1 1 62 62 GLN C C 62 175.970 175.970 176.055 -0.085 17919 119539 1 291 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.673 -0.013 17919 119540 1 291 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.858 -0.208 17919 119541 1 291 . 1 1 62 62 GLN H H 62 7.610 7.610 7.920 -0.310 17919 119542 1 291 . 1 1 63 63 LYS N N 63 120.300 120.300 121.410 -1.110 17919 119543 1 291 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.035 -0.034 17919 119544 1 291 . 1 1 63 63 LYS C C 63 175.810 175.810 177.368 -1.558 17919 119545 1 291 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.337 -0.547 17919 119546 1 291 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.650 0.000 17919 119547 1 291 . 1 1 63 63 LYS H H 63 8.490 8.490 8.704 -0.214 17919 119548 1 291 . 1 1 64 64 GLU N N 64 113.950 113.950 120.818 -6.868 17919 119549 1 291 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.725 -0.260 17919 119550 1 291 . 1 1 64 64 GLU C C 64 175.250 175.250 175.981 -0.731 17919 119551 1 291 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.578 0.312 17919 119552 1 291 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.310 -2.410 17919 119553 1 291 . 1 1 64 64 GLU H H 64 9.280 9.280 8.755 0.525 17919 119554 1 291 . 1 1 65 65 SER N N 65 114.730 114.730 115.212 -0.482 17919 119555 1 291 . 1 1 65 65 SER HA H 65 4.640 4.640 4.416 0.224 17919 119556 1 291 . 1 1 65 65 SER C C 65 172.160 172.160 174.103 -1.943 17919 119557 1 291 . 1 1 65 65 SER CA C 65 60.890 60.890 60.903 -0.013 17919 119558 1 291 . 1 1 65 65 SER CB C 65 64.910 64.910 64.133 0.777 17919 119559 1 291 . 1 1 65 65 SER H H 65 7.670 7.670 7.504 0.166 17919 119560 1 291 . 1 1 66 66 THR N N 66 117.110 117.110 120.246 -3.136 17919 119561 1 291 . 1 1 66 66 THR HA H 66 5.270 5.270 5.271 -0.001 17919 119562 1 291 . 1 1 66 66 THR C C 66 173.950 173.950 174.240 -0.290 17919 119563 1 291 . 1 1 66 66 THR CA C 66 62.340 62.340 61.925 0.415 17919 119564 1 291 . 1 1 66 66 THR CB C 66 70.080 70.080 70.809 -0.729 17919 119565 1 291 . 1 1 66 66 THR H H 66 8.730 8.730 8.558 0.172 17919 119566 1 291 . 1 1 67 67 LEU N N 67 127.110 127.110 127.306 -0.196 17919 119567 1 291 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.783 0.277 17919 119568 1 291 . 1 1 67 67 LEU C C 67 175.770 175.770 175.407 0.363 17919 119569 1 291 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.059 -0.159 17919 119570 1 291 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.856 0.404 17919 119571 1 291 . 1 1 67 67 LEU H H 67 9.410 9.410 8.892 0.518 17919 119572 1 291 . 1 1 68 68 HIS N N 68 118.380 118.380 122.685 -4.305 17919 119573 1 291 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.339 -0.099 17919 119574 1 291 . 1 1 68 68 HIS C C 68 173.150 173.150 173.840 -0.690 17919 119575 1 291 . 1 1 68 68 HIS CA C 68 55.000 55.000 53.906 1.094 17919 119576 1 291 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.120 -1.590 17919 119577 1 291 . 1 1 68 68 HIS H H 68 9.230 9.230 9.229 0.001 17919 119578 1 291 . 1 1 69 69 LEU N N 69 124.460 124.460 128.162 -3.702 17919 119579 1 291 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.372 -0.182 17919 119580 1 291 . 1 1 69 69 LEU C C 69 175.270 175.270 174.337 0.933 17919 119581 1 291 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.034 0.856 17919 119582 1 291 . 1 1 69 69 LEU CB C 69 44.380 44.380 45.866 -1.486 17919 119583 1 291 . 1 1 69 69 LEU H H 69 8.340 8.340 9.019 -0.679 17919 119584 1 291 . 1 1 70 70 VAL N N 70 126.940 126.940 121.318 5.622 17919 119585 1 291 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.457 -0.107 17919 119586 1 291 . 1 1 70 70 VAL C C 70 174.000 174.000 173.096 0.904 17919 119587 1 291 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.152 0.648 17919 119588 1 291 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.639 -0.729 17919 119589 1 291 . 1 1 70 70 VAL H H 70 9.200 9.200 9.016 0.184 17919 119590 1 291 . 1 1 71 71 LEU N N 71 123.130 123.130 124.192 -1.062 17919 119591 1 291 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.105 -0.045 17919 119592 1 291 . 1 1 71 71 LEU C C 71 177.830 177.830 177.298 0.532 17919 119593 1 291 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.702 0.238 17919 119594 1 291 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.635 -0.785 17919 119595 1 291 . 1 1 71 71 LEU H H 71 8.120 8.120 8.513 -0.393 17919 119596 1 291 . 1 1 72 72 ARG N N 72 123.490 123.490 125.863 -2.373 17919 119597 1 291 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.566 -0.265 17919 119598 1 291 . 1 1 72 72 ARG C C 72 175.350 175.350 175.462 -0.112 17919 119599 1 291 . 1 1 72 72 ARG CA C 72 55.610 55.610 54.653 0.957 17919 119600 1 291 . 1 1 72 72 ARG CB C 72 31.350 31.350 28.963 2.387 17919 119601 1 291 . 1 1 72 72 ARG H H 72 8.580 8.580 8.750 -0.170 17919 119602 1 292 . 1 1 2 2 GLN N N 2 123.220 123.220 124.057 -0.837 17919 119603 1 292 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.258 -0.009 17919 119604 1 292 . 1 1 2 2 GLN C C 2 175.920 175.920 175.464 0.456 17919 119605 1 292 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.482 0.598 17919 119606 1 292 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.593 0.167 17919 119607 1 292 . 1 1 2 2 GLN H H 2 8.900 8.900 8.460 0.440 17919 119608 1 292 . 1 1 3 3 ILE N N 3 115.340 115.340 116.977 -1.637 17919 119609 1 292 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.818 -0.605 17919 119610 1 292 . 1 1 3 3 ILE C C 3 172.450 172.450 174.008 -1.558 17919 119611 1 292 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.008 0.562 17919 119612 1 292 . 1 1 3 3 ILE CB C 3 42.210 42.210 42.042 0.168 17919 119613 1 292 . 1 1 3 3 ILE H H 3 8.320 8.320 7.749 0.571 17919 119614 1 292 . 1 1 4 4 PHE N N 4 118.110 118.110 119.940 -1.830 17919 119615 1 292 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.468 0.162 17919 119616 1 292 . 1 1 4 4 PHE C C 4 175.320 175.320 174.979 0.341 17919 119617 1 292 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.577 -0.367 17919 119618 1 292 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.648 -0.168 17919 119619 1 292 . 1 1 4 4 PHE H H 4 8.610 8.610 8.987 -0.377 17919 119620 1 292 . 1 1 5 5 VAL N N 5 121.000 121.000 123.823 -2.823 17919 119621 1 292 . 1 1 5 5 VAL HA H 5 4.725 4.725 5.027 -0.302 17919 119622 1 292 . 1 1 5 5 VAL C C 5 174.870 174.870 174.666 0.204 17919 119623 1 292 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.309 -0.689 17919 119624 1 292 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.944 0.286 17919 119625 1 292 . 1 1 5 5 VAL H H 5 9.300 9.300 9.495 -0.195 17919 119626 1 292 . 1 1 6 6 LYS N N 6 127.520 127.520 128.725 -1.205 17919 119627 1 292 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.367 0.000 17919 119628 1 292 . 1 1 6 6 LYS C C 6 177.140 177.140 175.968 1.172 17919 119629 1 292 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.139 0.381 17919 119630 1 292 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.995 -0.945 17919 119631 1 292 . 1 1 6 6 LYS H H 6 8.820 8.820 9.378 -0.558 17919 119632 1 292 . 1 1 7 7 THR N N 7 115.400 115.400 116.983 -1.583 17919 119633 1 292 . 1 1 7 7 THR HA H 7 4.970 4.970 4.610 0.360 17919 119634 1 292 . 1 1 7 7 THR C C 7 176.910 176.910 176.199 0.711 17919 119635 1 292 . 1 1 7 7 THR CA C 7 60.470 60.470 60.660 -0.189 17919 119636 1 292 . 1 1 7 7 THR CB C 7 70.630 70.630 70.818 -0.188 17919 119637 1 292 . 1 1 7 7 THR H H 7 8.730 8.730 8.990 -0.260 17919 119638 1 292 . 1 1 8 8 LEU N N 8 121.330 121.330 123.652 -2.322 17919 119639 1 292 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.127 0.183 17919 119640 1 292 . 1 1 8 8 LEU C C 8 178.800 178.800 177.257 1.543 17919 119641 1 292 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.537 0.043 17919 119642 1 292 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.959 0.011 17919 119643 1 292 . 1 1 8 8 LEU H H 8 9.100 9.100 8.525 0.575 17919 119644 1 292 . 1 1 9 9 THR N N 9 105.590 105.590 106.324 -0.734 17919 119645 1 292 . 1 1 9 9 THR HA H 9 4.428 4.428 4.291 0.137 17919 119646 1 292 . 1 1 9 9 THR C C 9 175.520 175.520 175.592 -0.072 17919 119647 1 292 . 1 1 9 9 THR CA C 9 61.400 61.400 62.066 -0.666 17919 119648 1 292 . 1 1 9 9 THR CB C 9 69.140 69.140 68.626 0.514 17919 119649 1 292 . 1 1 9 9 THR H H 9 7.630 7.630 7.641 -0.011 17919 119650 1 292 . 1 1 10 10 GLY N N 10 108.890 108.890 111.166 -2.276 17919 119651 1 292 . 1 1 10 10 GLY C C 10 174.070 174.070 174.321 -0.251 17919 119652 1 292 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.236 0.224 17919 119653 1 292 . 1 1 10 10 GLY H H 10 7.810 7.810 8.366 -0.556 17919 119654 1 292 . 1 1 11 11 LYS N N 11 121.600 121.600 120.996 0.604 17919 119655 1 292 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.564 -0.203 17919 119656 1 292 . 1 1 11 11 LYS C C 11 175.940 175.940 175.383 0.557 17919 119657 1 292 . 1 1 11 11 LYS CA C 11 56.280 56.280 55.862 0.418 17919 119658 1 292 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.496 -0.296 17919 119659 1 292 . 1 1 11 11 LYS H H 11 7.280 7.280 7.994 -0.714 17919 119660 1 292 . 1 1 12 12 THR N N 12 120.440 120.440 117.326 3.114 17919 119661 1 292 . 1 1 12 12 THR HA H 12 5.046 5.046 5.313 -0.267 17919 119662 1 292 . 1 1 12 12 THR C C 12 174.320 174.320 174.322 -0.002 17919 119663 1 292 . 1 1 12 12 THR CA C 12 62.390 62.390 61.178 1.212 17919 119664 1 292 . 1 1 12 12 THR CB C 12 69.910 69.910 70.215 -0.305 17919 119665 1 292 . 1 1 12 12 THR H H 12 8.650 8.650 8.301 0.349 17919 119666 1 292 . 1 1 13 13 ILE N N 13 127.110 127.110 122.042 5.068 17919 119667 1 292 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.854 -0.310 17919 119668 1 292 . 1 1 13 13 ILE C C 13 175.220 175.220 174.761 0.459 17919 119669 1 292 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.179 0.801 17919 119670 1 292 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.123 -0.173 17919 119671 1 292 . 1 1 13 13 ILE H H 13 9.450 9.450 9.099 0.351 17919 119672 1 292 . 1 1 14 14 THR N N 14 121.520 121.520 122.319 -0.799 17919 119673 1 292 . 1 1 14 14 THR HA H 14 4.964 4.964 5.409 -0.445 17919 119674 1 292 . 1 1 14 14 THR C C 14 173.790 173.790 174.031 -0.241 17919 119675 1 292 . 1 1 14 14 THR CA C 14 61.940 61.940 61.902 0.038 17919 119676 1 292 . 1 1 14 14 THR CB C 14 69.650 69.650 69.848 -0.198 17919 119677 1 292 . 1 1 14 14 THR H H 14 8.710 8.710 8.514 0.196 17919 119678 1 292 . 1 1 15 15 LEU N N 15 124.800 124.800 125.484 -0.684 17919 119679 1 292 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.833 -0.053 17919 119680 1 292 . 1 1 15 15 LEU C C 15 174.670 174.670 175.405 -0.735 17919 119681 1 292 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.422 -0.592 17919 119682 1 292 . 1 1 15 15 LEU CB C 15 47.070 47.070 44.775 2.295 17919 119683 1 292 . 1 1 15 15 LEU H H 15 8.710 8.710 8.528 0.182 17919 119684 1 292 . 1 1 16 16 GLU N N 16 122.160 122.160 121.441 0.719 17919 119685 1 292 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.210 -0.293 17919 119686 1 292 . 1 1 16 16 GLU C C 16 175.860 175.860 175.797 0.063 17919 119687 1 292 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.132 -0.312 17919 119688 1 292 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.930 -1.480 17919 119689 1 292 . 1 1 16 16 GLU H H 16 8.140 8.140 8.579 -0.439 17919 119690 1 292 . 1 1 17 17 VAL N N 17 117.210 117.210 120.195 -2.985 17919 119691 1 292 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.747 -0.033 17919 119692 1 292 . 1 1 17 17 VAL C C 17 174.160 174.160 174.166 -0.006 17919 119693 1 292 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.356 -0.926 17919 119694 1 292 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.495 0.905 17919 119695 1 292 . 1 1 17 17 VAL H H 17 8.900 8.900 8.723 0.177 17919 119696 1 292 . 1 1 18 18 GLU N N 18 118.990 118.990 121.860 -2.870 17919 119697 1 292 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.779 0.300 17919 119698 1 292 . 1 1 18 18 GLU C C 18 176.160 176.160 175.811 0.349 17919 119699 1 292 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.836 -0.116 17919 119700 1 292 . 1 1 18 18 GLU CB C 18 30.310 30.310 29.791 0.519 17919 119701 1 292 . 1 1 18 18 GLU H H 18 8.640 8.640 8.516 0.124 17919 119702 1 292 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.198 -0.057 17919 119703 1 292 . 1 1 19 19 PRO C C 19 175.310 175.310 177.249 -1.939 17919 119704 1 292 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.675 -0.205 17919 119705 1 292 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.858 0.092 17919 119706 1 292 . 1 1 20 20 SER N N 20 103.400 103.400 110.643 -7.243 17919 119707 1 292 . 1 1 20 20 SER HA H 20 4.370 4.370 4.398 -0.028 17919 119708 1 292 . 1 1 20 20 SER C C 20 174.660 174.660 174.127 0.533 17919 119709 1 292 . 1 1 20 20 SER CA C 20 57.400 57.400 58.240 -0.840 17919 119710 1 292 . 1 1 20 20 SER CB C 20 63.370 63.370 62.891 0.479 17919 119711 1 292 . 1 1 20 20 SER H H 20 7.040 7.040 8.223 -1.183 17919 119712 1 292 . 1 1 21 21 ASP N N 21 123.480 123.480 123.877 -0.397 17919 119713 1 292 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.648 0.047 17919 119714 1 292 . 1 1 21 21 ASP C C 21 176.360 176.360 176.175 0.185 17919 119715 1 292 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.367 0.333 17919 119716 1 292 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.221 -0.421 17919 119717 1 292 . 1 1 21 21 ASP H H 21 8.030 8.030 7.676 0.354 17919 119718 1 292 . 1 1 22 22 THR N N 22 108.800 108.800 113.497 -4.697 17919 119719 1 292 . 1 1 22 22 THR HA H 22 4.920 4.920 4.522 0.398 17919 119720 1 292 . 1 1 22 22 THR C C 22 176.750 176.750 175.828 0.922 17919 119721 1 292 . 1 1 22 22 THR CA C 22 59.690 59.690 62.352 -2.662 17919 119722 1 292 . 1 1 22 22 THR CB C 22 71.200 71.200 70.255 0.945 17919 119723 1 292 . 1 1 22 22 THR H H 22 7.900 7.900 8.315 -0.415 17919 119724 1 292 . 1 1 23 23 ILE N N 23 121.190 121.190 122.936 -1.746 17919 119725 1 292 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.954 -0.297 17919 119726 1 292 . 1 1 23 23 ILE C C 23 179.040 179.040 177.822 1.218 17919 119727 1 292 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.129 0.131 17919 119728 1 292 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.396 -2.046 17919 119729 1 292 . 1 1 23 23 ILE H H 23 8.560 8.560 8.630 -0.070 17919 119730 1 292 . 1 1 24 24 GLU N N 24 120.830 120.830 122.019 -1.189 17919 119731 1 292 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.808 0.109 17919 119732 1 292 . 1 1 24 24 GLU C C 24 178.640 178.640 178.153 0.487 17919 119733 1 292 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.459 -0.239 17919 119734 1 292 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.441 -1.161 17919 119735 1 292 . 1 1 24 24 GLU H H 24 9.760 9.760 8.853 0.907 17919 119736 1 292 . 1 1 25 25 ASN N N 25 120.570 120.570 117.522 3.048 17919 119737 1 292 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.479 0.046 17919 119738 1 292 . 1 1 25 25 ASN C C 25 178.380 178.380 178.088 0.292 17919 119739 1 292 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.155 -0.095 17919 119740 1 292 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.740 -0.291 17919 119741 1 292 . 1 1 25 25 ASN H H 25 7.920 7.920 7.647 0.273 17919 119742 1 292 . 1 1 26 26 VAL N N 26 121.710 121.710 120.717 0.993 17919 119743 1 292 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.604 -0.207 17919 119744 1 292 . 1 1 26 26 VAL C C 26 177.950 177.950 177.919 0.031 17919 119745 1 292 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.786 0.874 17919 119746 1 292 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.467 -0.627 17919 119747 1 292 . 1 1 26 26 VAL H H 26 8.070 8.070 8.444 -0.374 17919 119748 1 292 . 1 1 27 27 LYS N N 27 118.860 118.860 120.135 -1.275 17919 119749 1 292 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.294 0.286 17919 119750 1 292 . 1 1 27 27 LYS C C 27 180.550 180.550 178.954 1.596 17919 119751 1 292 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.490 -0.240 17919 119752 1 292 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.279 1.451 17919 119753 1 292 . 1 1 27 27 LYS H H 27 8.560 8.560 8.481 0.079 17919 119754 1 292 . 1 1 28 28 ALA N N 28 123.440 123.440 122.296 1.144 17919 119755 1 292 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.231 -0.071 17919 119756 1 292 . 1 1 28 28 ALA C C 28 180.300 180.300 179.136 1.164 17919 119757 1 292 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.699 0.671 17919 119758 1 292 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.432 -0.722 17919 119759 1 292 . 1 1 28 28 ALA H H 28 8.060 8.060 8.398 -0.338 17919 119760 1 292 . 1 1 29 29 LYS N N 29 119.940 119.940 119.730 0.210 17919 119761 1 292 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.027 0.180 17919 119762 1 292 . 1 1 29 29 LYS C C 29 180.320 180.320 179.034 1.286 17919 119763 1 292 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.228 0.422 17919 119764 1 292 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.381 0.909 17919 119765 1 292 . 1 1 29 29 LYS H H 29 7.850 7.850 7.773 0.077 17919 119766 1 292 . 1 1 30 30 ILE N N 30 121.080 121.080 120.438 0.642 17919 119767 1 292 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.606 -0.099 17919 119768 1 292 . 1 1 30 30 ILE C C 30 178.310 178.310 177.242 1.068 17919 119769 1 292 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.432 0.718 17919 119770 1 292 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.746 -0.946 17919 119771 1 292 . 1 1 30 30 ILE H H 30 8.280 8.280 8.437 -0.157 17919 119772 1 292 . 1 1 31 31 GLN N N 31 123.490 123.490 121.274 2.216 17919 119773 1 292 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.034 -0.205 17919 119774 1 292 . 1 1 31 31 GLN C C 31 178.890 178.890 177.976 0.914 17919 119775 1 292 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.084 0.916 17919 119776 1 292 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.554 -0.834 17919 119777 1 292 . 1 1 31 31 GLN H H 31 8.580 8.580 8.463 0.117 17919 119778 1 292 . 1 1 32 32 ASP N N 32 119.360 119.360 117.922 1.438 17919 119779 1 292 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.383 -0.029 17919 119780 1 292 . 1 1 32 32 ASP C C 32 177.250 177.250 178.027 -0.777 17919 119781 1 292 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.788 0.402 17919 119782 1 292 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.917 -0.337 17919 119783 1 292 . 1 1 32 32 ASP H H 32 8.010 8.010 8.047 -0.037 17919 119784 1 292 . 1 1 33 33 LYS N N 33 115.130 115.130 117.993 -2.863 17919 119785 1 292 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.354 -0.017 17919 119786 1 292 . 1 1 33 33 LYS C C 33 177.870 177.870 177.903 -0.033 17919 119787 1 292 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.770 0.280 17919 119788 1 292 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.622 0.548 17919 119789 1 292 . 1 1 33 33 LYS H H 33 7.430 7.430 7.399 0.030 17919 119790 1 292 . 1 1 34 34 GLU N N 34 113.870 113.870 115.560 -1.690 17919 119791 1 292 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.516 0.109 17919 119792 1 292 . 1 1 34 34 GLU C C 34 177.840 177.840 176.901 0.939 17919 119793 1 292 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.597 -1.427 17919 119794 1 292 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.795 0.865 17919 119795 1 292 . 1 1 34 34 GLU H H 34 8.740 8.740 8.295 0.445 17919 119796 1 292 . 1 1 35 35 GLY N N 35 108.650 108.650 109.238 -0.588 17919 119797 1 292 . 1 1 35 35 GLY C C 35 173.960 173.960 174.119 -0.159 17919 119798 1 292 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.213 0.867 17919 119799 1 292 . 1 1 35 35 GLY H H 35 8.530 8.530 7.931 0.599 17919 119800 1 292 . 1 1 36 36 ILE N N 36 119.880 119.880 117.068 2.812 17919 119801 1 292 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.742 -0.297 17919 119802 1 292 . 1 1 36 36 ILE C C 36 173.590 173.590 173.618 -0.028 17919 119803 1 292 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.493 0.257 17919 119804 1 292 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.918 1.662 17919 119805 1 292 . 1 1 36 36 ILE H H 36 6.150 6.150 7.650 -1.500 17919 119806 1 292 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.827 -0.193 17919 119807 1 292 . 1 1 37 37 PRO C C 37 176.940 176.940 176.304 0.636 17919 119808 1 292 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.497 0.163 17919 119809 1 292 . 1 1 37 37 PRO CB C 37 31.850 31.850 30.915 0.935 17919 119810 1 292 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.142 -0.025 17919 119811 1 292 . 1 1 38 38 PRO C C 38 178.320 178.320 178.425 -0.105 17919 119812 1 292 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.743 0.517 17919 119813 1 292 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.629 1.261 17919 119814 1 292 . 1 1 39 39 ASP N N 39 113.380 113.380 116.948 -3.568 17919 119815 1 292 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.395 0.035 17919 119816 1 292 . 1 1 39 39 ASP C C 39 177.090 177.090 177.670 -0.580 17919 119817 1 292 . 1 1 39 39 ASP CA C 39 55.640 55.640 57.237 -1.597 17919 119818 1 292 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.057 -0.517 17919 119819 1 292 . 1 1 39 39 ASP H H 39 8.550 8.550 8.679 -0.129 17919 119820 1 292 . 1 1 40 40 GLN N N 40 116.780 116.780 115.392 1.388 17919 119821 1 292 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.443 0.021 17919 119822 1 292 . 1 1 40 40 GLN C C 40 175.380 175.380 175.351 0.029 17919 119823 1 292 . 1 1 40 40 GLN CA C 40 55.640 55.640 54.971 0.669 17919 119824 1 292 . 1 1 40 40 GLN CB C 40 30.140 30.140 28.790 1.350 17919 119825 1 292 . 1 1 40 40 GLN H H 40 7.820 7.820 7.883 -0.063 17919 119826 1 292 . 1 1 41 41 GLN N N 41 117.720 117.720 119.733 -2.013 17919 119827 1 292 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.745 -0.501 17919 119828 1 292 . 1 1 41 41 GLN C C 41 176.300 176.300 175.488 0.812 17919 119829 1 292 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.865 0.605 17919 119830 1 292 . 1 1 41 41 GLN CB C 41 31.650 31.650 30.309 1.341 17919 119831 1 292 . 1 1 41 41 GLN H H 41 7.480 7.480 7.407 0.073 17919 119832 1 292 . 1 1 42 42 ARG N N 42 122.680 122.680 122.601 0.079 17919 119833 1 292 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.630 -0.130 17919 119834 1 292 . 1 1 42 42 ARG C C 42 174.050 174.050 174.519 -0.469 17919 119835 1 292 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.996 0.054 17919 119836 1 292 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.951 -1.201 17919 119837 1 292 . 1 1 42 42 ARG H H 42 8.530 8.530 8.578 -0.048 17919 119838 1 292 . 1 1 43 43 LEU N N 43 124.040 124.040 125.535 -1.495 17919 119839 1 292 . 1 1 43 43 LEU C C 43 175.290 175.290 175.538 -0.248 17919 119840 1 292 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.868 -0.888 17919 119841 1 292 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.740 2.050 17919 119842 1 292 . 1 1 43 43 LEU H H 43 8.820 8.820 8.850 -0.030 17919 119843 1 292 . 1 1 44 44 ILE N N 44 121.920 121.920 123.138 -1.218 17919 119844 1 292 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.071 -0.079 17919 119845 1 292 . 1 1 44 44 ILE C C 44 176.060 176.060 174.473 1.587 17919 119846 1 292 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.050 -1.071 17919 119847 1 292 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.715 -0.295 17919 119848 1 292 . 1 1 44 44 ILE H H 44 9.030 9.030 8.605 0.425 17919 119849 1 292 . 1 1 45 45 PHE N N 45 125.390 125.390 127.200 -1.810 17919 119850 1 292 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.045 -0.000 17919 119851 1 292 . 1 1 45 45 PHE C C 45 174.470 174.470 174.769 -0.299 17919 119852 1 292 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.058 0.962 17919 119853 1 292 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.038 0.722 17919 119854 1 292 . 1 1 45 45 PHE H H 45 8.830 8.830 8.804 0.026 17919 119855 1 292 . 1 1 46 46 ALA N N 46 132.200 132.200 129.987 2.213 17919 119856 1 292 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.641 0.049 17919 119857 1 292 . 1 1 46 46 ALA C C 46 177.290 177.290 177.643 -0.353 17919 119858 1 292 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.481 0.059 17919 119859 1 292 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.512 0.058 17919 119860 1 292 . 1 1 46 46 ALA H H 46 8.810 8.810 8.549 0.261 17919 119861 1 292 . 1 1 47 47 GLY N N 47 102.340 102.340 102.236 0.104 17919 119862 1 292 . 1 1 47 47 GLY C C 47 173.810 173.810 174.701 -0.891 17919 119863 1 292 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.633 -0.283 17919 119864 1 292 . 1 1 47 47 GLY H H 47 8.130 8.130 8.524 -0.394 17919 119865 1 292 . 1 1 48 48 LYS N N 48 121.570 121.570 119.830 1.740 17919 119866 1 292 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.655 -0.033 17919 119867 1 292 . 1 1 48 48 LYS C C 48 174.700 174.700 175.135 -0.435 17919 119868 1 292 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.211 0.339 17919 119869 1 292 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.514 0.016 17919 119870 1 292 . 1 1 48 48 LYS H H 48 7.980 7.980 7.992 -0.012 17919 119871 1 292 . 1 1 49 49 GLN N N 49 122.410 122.410 121.903 0.507 17919 119872 1 292 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.405 0.155 17919 119873 1 292 . 1 1 49 49 GLN C C 49 175.670 175.670 176.385 -0.715 17919 119874 1 292 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.502 0.238 17919 119875 1 292 . 1 1 49 49 GLN CB C 49 29.000 29.000 28.559 0.441 17919 119876 1 292 . 1 1 49 49 GLN H H 49 8.600 8.600 8.490 0.110 17919 119877 1 292 . 1 1 50 50 LEU N N 50 125.520 125.520 127.920 -2.400 17919 119878 1 292 . 1 1 50 50 LEU HA H 50 4.090 4.090 3.910 0.180 17919 119879 1 292 . 1 1 50 50 LEU C C 50 176.660 176.660 176.391 0.269 17919 119880 1 292 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.405 -0.165 17919 119881 1 292 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.568 0.002 17919 119882 1 292 . 1 1 50 50 LEU H H 50 8.530 8.530 8.660 -0.130 17919 119883 1 292 . 1 1 51 51 GLU N N 51 122.940 122.940 124.498 -1.558 17919 119884 1 292 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.501 -0.013 17919 119885 1 292 . 1 1 51 51 GLU C C 51 175.870 175.870 176.945 -1.075 17919 119886 1 292 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.211 0.750 17919 119887 1 292 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.822 -0.252 17919 119888 1 292 . 1 1 51 51 GLU H H 51 8.400 8.400 8.334 0.066 17919 119889 1 292 . 1 1 52 52 ASP N N 52 120.030 120.030 127.904 -7.874 17919 119890 1 292 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.445 -0.086 17919 119891 1 292 . 1 1 52 52 ASP C C 52 177.330 177.330 177.709 -0.379 17919 119892 1 292 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.519 -0.559 17919 119893 1 292 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.791 0.059 17919 119894 1 292 . 1 1 52 52 ASP H H 52 8.160 8.160 8.854 -0.694 17919 119895 1 292 . 1 1 53 53 GLY N N 53 106.660 106.660 105.308 1.352 17919 119896 1 292 . 1 1 53 53 GLY C C 53 174.870 174.870 174.759 0.111 17919 119897 1 292 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.097 0.073 17919 119898 1 292 . 1 1 53 53 GLY H H 53 9.390 9.390 8.591 0.799 17919 119899 1 292 . 1 1 54 54 ARG N N 54 119.050 119.050 121.002 -1.952 17919 119900 1 292 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.603 0.092 17919 119901 1 292 . 1 1 54 54 ARG C C 54 175.350 175.350 175.587 -0.237 17919 119902 1 292 . 1 1 54 54 ARG CA C 54 54.390 54.390 55.451 -1.061 17919 119903 1 292 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.493 0.157 17919 119904 1 292 . 1 1 54 54 ARG H H 54 7.460 7.460 7.481 -0.021 17919 119905 1 292 . 1 1 55 55 THR N N 55 108.400 108.400 110.145 -1.745 17919 119906 1 292 . 1 1 55 55 THR HA H 55 5.240 5.240 4.981 0.259 17919 119907 1 292 . 1 1 55 55 THR C C 55 176.560 176.560 175.319 1.241 17919 119908 1 292 . 1 1 55 55 THR CA C 55 59.690 59.690 59.979 -0.289 17919 119909 1 292 . 1 1 55 55 THR CB C 55 72.260 72.260 72.021 0.239 17919 119910 1 292 . 1 1 55 55 THR H H 55 8.730 8.730 8.825 -0.095 17919 119911 1 292 . 1 1 56 56 LEU N N 56 117.920 117.920 121.723 -3.803 17919 119912 1 292 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.131 -0.071 17919 119913 1 292 . 1 1 56 56 LEU C C 56 180.810 180.810 178.219 2.591 17919 119914 1 292 . 1 1 56 56 LEU CA C 56 58.710 58.710 57.616 1.094 17919 119915 1 292 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.841 -1.471 17919 119916 1 292 . 1 1 56 56 LEU H H 56 8.140 8.140 8.659 -0.519 17919 119917 1 292 . 1 1 57 57 SER N N 57 113.330 113.330 114.354 -1.024 17919 119918 1 292 . 1 1 57 57 SER HA H 57 4.370 4.370 4.169 0.201 17919 119919 1 292 . 1 1 57 57 SER C C 57 178.310 178.310 176.779 1.531 17919 119920 1 292 . 1 1 57 57 SER CA C 57 61.080 61.080 61.779 -0.699 17919 119921 1 292 . 1 1 57 57 SER CB C 57 62.530 62.530 62.633 -0.103 17919 119922 1 292 . 1 1 57 57 SER H H 57 8.470 8.470 8.030 0.440 17919 119923 1 292 . 1 1 58 58 ASP N N 58 124.190 124.190 122.723 1.467 17919 119924 1 292 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.310 -0.014 17919 119925 1 292 . 1 1 58 58 ASP C C 58 177.400 177.400 177.602 -0.202 17919 119926 1 292 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.653 0.527 17919 119927 1 292 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.362 -0.262 17919 119928 1 292 . 1 1 58 58 ASP H H 58 7.930 7.930 7.608 0.322 17919 119929 1 292 . 1 1 59 59 TYR N N 59 115.510 115.510 116.456 -0.946 17919 119930 1 292 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.498 0.172 17919 119931 1 292 . 1 1 59 59 TYR C C 59 174.700 174.700 174.600 0.100 17919 119932 1 292 . 1 1 59 59 TYR CA C 59 58.250 58.250 58.045 0.205 17919 119933 1 292 . 1 1 59 59 TYR CB C 59 40.070 40.070 37.335 2.735 17919 119934 1 292 . 1 1 59 59 TYR H H 59 7.250 7.250 7.344 -0.094 17919 119935 1 292 . 1 1 60 60 ASN N N 60 115.900 115.900 113.639 2.261 17919 119936 1 292 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.362 -0.007 17919 119937 1 292 . 1 1 60 60 ASN C C 60 174.340 174.340 174.480 -0.140 17919 119938 1 292 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.040 0.080 17919 119939 1 292 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.049 0.361 17919 119940 1 292 . 1 1 60 60 ASN H H 60 8.150 8.150 7.868 0.282 17919 119941 1 292 . 1 1 61 61 ILE N N 61 118.600 118.600 119.652 -1.052 17919 119942 1 292 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.941 -0.548 17919 119943 1 292 . 1 1 61 61 ILE C C 61 174.610 174.610 175.647 -1.037 17919 119944 1 292 . 1 1 61 61 ILE CA C 61 62.420 62.420 60.375 2.045 17919 119945 1 292 . 1 1 61 61 ILE CB C 61 36.740 36.740 36.885 -0.144 17919 119946 1 292 . 1 1 61 61 ILE H H 61 7.250 7.250 7.266 -0.016 17919 119947 1 292 . 1 1 62 62 GLN N N 62 124.740 124.740 125.481 -0.741 17919 119948 1 292 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.661 -0.155 17919 119949 1 292 . 1 1 62 62 GLN C C 62 175.970 175.970 175.308 0.662 17919 119950 1 292 . 1 1 62 62 GLN CA C 62 53.660 53.660 54.406 -0.746 17919 119951 1 292 . 1 1 62 62 GLN CB C 62 31.650 31.650 30.986 0.664 17919 119952 1 292 . 1 1 62 62 GLN H H 62 7.610 7.610 8.226 -0.616 17919 119953 1 292 . 1 1 63 63 LYS N N 63 120.300 120.300 118.906 1.394 17919 119954 1 292 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.963 0.038 17919 119955 1 292 . 1 1 63 63 LYS C C 63 175.810 175.810 177.472 -1.662 17919 119956 1 292 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.831 -0.041 17919 119957 1 292 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.575 0.075 17919 119958 1 292 . 1 1 63 63 LYS H H 63 8.490 8.490 8.336 0.154 17919 119959 1 292 . 1 1 64 64 GLU N N 64 113.950 113.950 119.252 -5.302 17919 119960 1 292 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.603 -0.138 17919 119961 1 292 . 1 1 64 64 GLU C C 64 175.250 175.250 175.865 -0.615 17919 119962 1 292 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.522 0.368 17919 119963 1 292 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.706 -2.806 17919 119964 1 292 . 1 1 64 64 GLU H H 64 9.280 9.280 9.090 0.190 17919 119965 1 292 . 1 1 65 65 SER N N 65 114.730 114.730 114.820 -0.090 17919 119966 1 292 . 1 1 65 65 SER HA H 65 4.640 4.640 4.507 0.133 17919 119967 1 292 . 1 1 65 65 SER C C 65 172.160 172.160 173.995 -1.835 17919 119968 1 292 . 1 1 65 65 SER CA C 65 60.890 60.890 60.447 0.444 17919 119969 1 292 . 1 1 65 65 SER CB C 65 64.910 64.910 64.356 0.554 17919 119970 1 292 . 1 1 65 65 SER H H 65 7.670 7.670 7.500 0.170 17919 119971 1 292 . 1 1 66 66 THR N N 66 117.110 117.110 119.093 -1.983 17919 119972 1 292 . 1 1 66 66 THR HA H 66 5.270 5.270 5.390 -0.120 17919 119973 1 292 . 1 1 66 66 THR C C 66 173.950 173.950 174.031 -0.081 17919 119974 1 292 . 1 1 66 66 THR CA C 66 62.340 62.340 61.859 0.481 17919 119975 1 292 . 1 1 66 66 THR CB C 66 70.080 70.080 70.287 -0.207 17919 119976 1 292 . 1 1 66 66 THR H H 66 8.730 8.730 8.570 0.160 17919 119977 1 292 . 1 1 67 67 LEU N N 67 127.110 127.110 126.317 0.793 17919 119978 1 292 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.835 0.225 17919 119979 1 292 . 1 1 67 67 LEU C C 67 175.770 175.770 175.009 0.761 17919 119980 1 292 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.799 0.101 17919 119981 1 292 . 1 1 67 67 LEU CB C 67 44.260 44.260 45.061 -0.801 17919 119982 1 292 . 1 1 67 67 LEU H H 67 9.410 9.410 9.266 0.144 17919 119983 1 292 . 1 1 68 68 HIS N N 68 118.380 118.380 122.109 -3.729 17919 119984 1 292 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.392 -0.152 17919 119985 1 292 . 1 1 68 68 HIS C C 68 173.150 173.150 173.749 -0.599 17919 119986 1 292 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.345 0.655 17919 119987 1 292 . 1 1 68 68 HIS CB C 68 30.530 30.530 31.918 -1.388 17919 119988 1 292 . 1 1 68 68 HIS H H 68 9.230 9.230 9.050 0.180 17919 119989 1 292 . 1 1 69 69 LEU N N 69 124.460 124.460 129.438 -4.978 17919 119990 1 292 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.021 0.169 17919 119991 1 292 . 1 1 69 69 LEU C C 69 175.270 175.270 174.095 1.175 17919 119992 1 292 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.374 0.516 17919 119993 1 292 . 1 1 69 69 LEU CB C 69 44.380 44.380 45.290 -0.910 17919 119994 1 292 . 1 1 69 69 LEU H H 69 8.340 8.340 8.670 -0.330 17919 119995 1 292 . 1 1 70 70 VAL N N 70 126.940 126.940 124.162 2.778 17919 119996 1 292 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.370 -0.020 17919 119997 1 292 . 1 1 70 70 VAL C C 70 174.000 174.000 174.240 -0.240 17919 119998 1 292 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.684 0.116 17919 119999 1 292 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.612 -0.702 17919 120000 1 292 . 1 1 70 70 VAL H H 70 9.200 9.200 8.860 0.340 17919 120001 1 292 . 1 1 71 71 LEU N N 71 123.130 123.130 124.311 -1.181 17919 120002 1 292 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.241 -0.181 17919 120003 1 292 . 1 1 71 71 LEU C C 71 177.830 177.830 176.993 0.837 17919 120004 1 292 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.253 0.687 17919 120005 1 292 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.361 -0.512 17919 120006 1 292 . 1 1 71 71 LEU H H 71 8.120 8.120 8.316 -0.196 17919 120007 1 292 . 1 1 72 72 ARG N N 72 123.490 123.490 122.074 1.416 17919 120008 1 292 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.574 -0.273 17919 120009 1 292 . 1 1 72 72 ARG C C 72 175.350 175.350 174.495 0.855 17919 120010 1 292 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.274 0.336 17919 120011 1 292 . 1 1 72 72 ARG CB C 72 31.350 31.350 31.646 -0.296 17919 120012 1 292 . 1 1 72 72 ARG H H 72 8.580 8.580 8.412 0.168 17919 120013 1 293 . 1 1 2 2 GLN N N 2 123.220 123.220 125.382 -2.162 17919 120014 1 293 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.501 -0.252 17919 120015 1 293 . 1 1 2 2 GLN C C 2 175.920 175.920 174.832 1.088 17919 120016 1 293 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.656 0.424 17919 120017 1 293 . 1 1 2 2 GLN CB C 2 30.760 30.760 31.267 -0.507 17919 120018 1 293 . 1 1 2 2 GLN H H 2 8.900 8.900 8.420 0.480 17919 120019 1 293 . 1 1 3 3 ILE N N 3 115.340 115.340 117.170 -1.830 17919 120020 1 293 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.570 -0.357 17919 120021 1 293 . 1 1 3 3 ILE C C 3 172.450 172.450 173.431 -0.981 17919 120022 1 293 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.390 0.180 17919 120023 1 293 . 1 1 3 3 ILE CB C 3 42.210 42.210 42.066 0.144 17919 120024 1 293 . 1 1 3 3 ILE H H 3 8.320 8.320 8.910 -0.590 17919 120025 1 293 . 1 1 4 4 PHE N N 4 118.110 118.110 119.618 -1.508 17919 120026 1 293 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.559 0.071 17919 120027 1 293 . 1 1 4 4 PHE C C 4 175.320 175.320 175.164 0.156 17919 120028 1 293 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.099 0.111 17919 120029 1 293 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.504 -0.024 17919 120030 1 293 . 1 1 4 4 PHE H H 4 8.610 8.610 8.838 -0.228 17919 120031 1 293 . 1 1 5 5 VAL N N 5 121.000 121.000 121.998 -0.998 17919 120032 1 293 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.618 0.107 17919 120033 1 293 . 1 1 5 5 VAL C C 5 174.870 174.870 174.909 -0.039 17919 120034 1 293 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.319 -0.699 17919 120035 1 293 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.457 -0.227 17919 120036 1 293 . 1 1 5 5 VAL H H 5 9.300 9.300 9.229 0.071 17919 120037 1 293 . 1 1 6 6 LYS N N 6 127.520 127.520 129.651 -2.131 17919 120038 1 293 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.016 0.351 17919 120039 1 293 . 1 1 6 6 LYS C C 6 177.140 177.140 176.242 0.898 17919 120040 1 293 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.161 0.359 17919 120041 1 293 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.181 0.869 17919 120042 1 293 . 1 1 6 6 LYS H H 6 8.820 8.820 8.793 0.027 17919 120043 1 293 . 1 1 7 7 THR N N 7 115.400 115.400 118.169 -2.769 17919 120044 1 293 . 1 1 7 7 THR HA H 7 4.970 4.970 4.515 0.455 17919 120045 1 293 . 1 1 7 7 THR C C 7 176.910 176.910 175.235 1.675 17919 120046 1 293 . 1 1 7 7 THR CA C 7 60.470 60.470 60.912 -0.442 17919 120047 1 293 . 1 1 7 7 THR CB C 7 70.630 70.630 70.160 0.470 17919 120048 1 293 . 1 1 7 7 THR H H 7 8.730 8.730 8.642 0.088 17919 120049 1 293 . 1 1 8 8 LEU N N 8 121.330 121.330 122.029 -0.699 17919 120050 1 293 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.078 0.232 17919 120051 1 293 . 1 1 8 8 LEU C C 8 178.800 178.800 177.890 0.910 17919 120052 1 293 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.932 -0.352 17919 120053 1 293 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.121 -0.151 17919 120054 1 293 . 1 1 8 8 LEU H H 8 9.100 9.100 8.724 0.376 17919 120055 1 293 . 1 1 9 9 THR N N 9 105.590 105.590 107.173 -1.583 17919 120056 1 293 . 1 1 9 9 THR HA H 9 4.428 4.428 4.283 0.145 17919 120057 1 293 . 1 1 9 9 THR C C 9 175.520 175.520 174.924 0.596 17919 120058 1 293 . 1 1 9 9 THR CA C 9 61.400 61.400 62.242 -0.842 17919 120059 1 293 . 1 1 9 9 THR CB C 9 69.140 69.140 69.082 0.058 17919 120060 1 293 . 1 1 9 9 THR H H 9 7.630 7.630 7.939 -0.309 17919 120061 1 293 . 1 1 10 10 GLY N N 10 108.890 108.890 110.699 -1.809 17919 120062 1 293 . 1 1 10 10 GLY C C 10 174.070 174.070 174.566 -0.496 17919 120063 1 293 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.831 0.629 17919 120064 1 293 . 1 1 10 10 GLY H H 10 7.810 7.810 7.702 0.108 17919 120065 1 293 . 1 1 11 11 LYS N N 11 121.600 121.600 121.556 0.044 17919 120066 1 293 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.253 0.108 17919 120067 1 293 . 1 1 11 11 LYS C C 11 175.940 175.940 175.892 0.048 17919 120068 1 293 . 1 1 11 11 LYS CA C 11 56.280 56.280 57.130 -0.850 17919 120069 1 293 . 1 1 11 11 LYS CB C 11 33.200 33.200 32.981 0.219 17919 120070 1 293 . 1 1 11 11 LYS H H 11 7.280 7.280 7.942 -0.662 17919 120071 1 293 . 1 1 12 12 THR N N 12 120.440 120.440 112.282 8.158 17919 120072 1 293 . 1 1 12 12 THR HA H 12 5.046 5.046 5.173 -0.127 17919 120073 1 293 . 1 1 12 12 THR C C 12 174.320 174.320 174.246 0.074 17919 120074 1 293 . 1 1 12 12 THR CA C 12 62.390 62.390 60.528 1.862 17919 120075 1 293 . 1 1 12 12 THR CB C 12 69.910 69.910 70.721 -0.811 17919 120076 1 293 . 1 1 12 12 THR H H 12 8.650 8.650 8.140 0.510 17919 120077 1 293 . 1 1 13 13 ILE N N 13 127.110 127.110 123.155 3.955 17919 120078 1 293 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.454 0.090 17919 120079 1 293 . 1 1 13 13 ILE C C 13 175.220 175.220 175.416 -0.196 17919 120080 1 293 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.461 -0.481 17919 120081 1 293 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.107 -0.157 17919 120082 1 293 . 1 1 13 13 ILE H H 13 9.450 9.450 8.661 0.789 17919 120083 1 293 . 1 1 14 14 THR N N 14 121.520 121.520 123.559 -2.039 17919 120084 1 293 . 1 1 14 14 THR HA H 14 4.964 4.964 4.851 0.113 17919 120085 1 293 . 1 1 14 14 THR C C 14 173.790 173.790 173.622 0.168 17919 120086 1 293 . 1 1 14 14 THR CA C 14 61.940 61.940 62.566 -0.626 17919 120087 1 293 . 1 1 14 14 THR CB C 14 69.650 69.650 69.628 0.022 17919 120088 1 293 . 1 1 14 14 THR H H 14 8.710 8.710 8.733 -0.023 17919 120089 1 293 . 1 1 15 15 LEU N N 15 124.800 124.800 127.541 -2.741 17919 120090 1 293 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.782 -0.002 17919 120091 1 293 . 1 1 15 15 LEU C C 15 174.670 174.670 175.049 -0.379 17919 120092 1 293 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.704 -0.874 17919 120093 1 293 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.477 1.593 17919 120094 1 293 . 1 1 15 15 LEU H H 15 8.710 8.710 9.126 -0.416 17919 120095 1 293 . 1 1 16 16 GLU N N 16 122.160 122.160 123.427 -1.267 17919 120096 1 293 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.165 -0.248 17919 120097 1 293 . 1 1 16 16 GLU C C 16 175.860 175.860 176.023 -0.163 17919 120098 1 293 . 1 1 16 16 GLU CA C 16 54.820 54.820 54.803 0.017 17919 120099 1 293 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.184 -0.734 17919 120100 1 293 . 1 1 16 16 GLU H H 16 8.140 8.140 8.793 -0.653 17919 120101 1 293 . 1 1 17 17 VAL N N 17 117.210 117.210 118.438 -1.228 17919 120102 1 293 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.990 -0.276 17919 120103 1 293 . 1 1 17 17 VAL C C 17 174.160 174.160 174.757 -0.597 17919 120104 1 293 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.749 -0.319 17919 120105 1 293 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.871 0.529 17919 120106 1 293 . 1 1 17 17 VAL H H 17 8.900 8.900 8.993 -0.093 17919 120107 1 293 . 1 1 18 18 GLU N N 18 118.990 118.990 121.894 -2.904 17919 120108 1 293 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.805 0.274 17919 120109 1 293 . 1 1 18 18 GLU C C 18 176.160 176.160 175.328 0.832 17919 120110 1 293 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.110 0.610 17919 120111 1 293 . 1 1 18 18 GLU CB C 18 30.310 30.310 31.686 -1.375 17919 120112 1 293 . 1 1 18 18 GLU H H 18 8.640 8.640 8.896 -0.256 17919 120113 1 293 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.233 -0.092 17919 120114 1 293 . 1 1 19 19 PRO C C 19 175.310 175.310 177.884 -2.574 17919 120115 1 293 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.355 0.115 17919 120116 1 293 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.873 0.077 17919 120117 1 293 . 1 1 20 20 SER N N 20 103.400 103.400 111.087 -7.687 17919 120118 1 293 . 1 1 20 20 SER HA H 20 4.370 4.370 4.198 0.172 17919 120119 1 293 . 1 1 20 20 SER C C 20 174.660 174.660 174.731 -0.071 17919 120120 1 293 . 1 1 20 20 SER CA C 20 57.400 57.400 59.683 -2.283 17919 120121 1 293 . 1 1 20 20 SER CB C 20 63.370 63.370 62.644 0.726 17919 120122 1 293 . 1 1 20 20 SER H H 20 7.040 7.040 8.160 -1.120 17919 120123 1 293 . 1 1 21 21 ASP N N 21 123.480 123.480 123.556 -0.076 17919 120124 1 293 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.795 -0.100 17919 120125 1 293 . 1 1 21 21 ASP C C 21 176.360 176.360 175.837 0.523 17919 120126 1 293 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.840 0.860 17919 120127 1 293 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.816 -1.016 17919 120128 1 293 . 1 1 21 21 ASP H H 21 8.030 8.030 7.759 0.271 17919 120129 1 293 . 1 1 22 22 THR N N 22 108.800 108.800 114.177 -5.377 17919 120130 1 293 . 1 1 22 22 THR HA H 22 4.920 4.920 4.812 0.108 17919 120131 1 293 . 1 1 22 22 THR C C 22 176.750 176.750 176.516 0.234 17919 120132 1 293 . 1 1 22 22 THR CA C 22 59.690 59.690 61.037 -1.347 17919 120133 1 293 . 1 1 22 22 THR CB C 22 71.200 71.200 70.567 0.633 17919 120134 1 293 . 1 1 22 22 THR H H 22 7.900 7.900 8.118 -0.218 17919 120135 1 293 . 1 1 23 23 ILE N N 23 121.190 121.190 121.934 -0.744 17919 120136 1 293 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.680 -0.023 17919 120137 1 293 . 1 1 23 23 ILE C C 23 179.040 179.040 177.808 1.232 17919 120138 1 293 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.818 -1.558 17919 120139 1 293 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.344 -1.994 17919 120140 1 293 . 1 1 23 23 ILE H H 23 8.560 8.560 8.495 0.065 17919 120141 1 293 . 1 1 24 24 GLU N N 24 120.830 120.830 118.650 2.180 17919 120142 1 293 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.854 0.062 17919 120143 1 293 . 1 1 24 24 GLU C C 24 178.640 178.640 178.433 0.207 17919 120144 1 293 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.618 0.602 17919 120145 1 293 . 1 1 24 24 GLU CB C 24 28.280 28.280 28.579 -0.299 17919 120146 1 293 . 1 1 24 24 GLU H H 24 9.760 9.760 7.901 1.859 17919 120147 1 293 . 1 1 25 25 ASN N N 25 120.570 120.570 117.986 2.584 17919 120148 1 293 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.544 -0.019 17919 120149 1 293 . 1 1 25 25 ASN C C 25 178.380 178.380 177.365 1.015 17919 120150 1 293 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.600 0.460 17919 120151 1 293 . 1 1 25 25 ASN CB C 25 38.450 38.450 37.880 0.570 17919 120152 1 293 . 1 1 25 25 ASN H H 25 7.920 7.920 8.198 -0.278 17919 120153 1 293 . 1 1 26 26 VAL N N 26 121.710 121.710 119.451 2.259 17919 120154 1 293 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.619 -0.222 17919 120155 1 293 . 1 1 26 26 VAL C C 26 177.950 177.950 177.928 0.022 17919 120156 1 293 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.307 1.353 17919 120157 1 293 . 1 1 26 26 VAL CB C 26 30.840 30.840 30.948 -0.108 17919 120158 1 293 . 1 1 26 26 VAL H H 26 8.070 8.070 7.438 0.632 17919 120159 1 293 . 1 1 27 27 LYS N N 27 118.860 118.860 120.196 -1.336 17919 120160 1 293 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.171 0.409 17919 120161 1 293 . 1 1 27 27 LYS C C 27 180.550 180.550 179.185 1.365 17919 120162 1 293 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.602 -0.352 17919 120163 1 293 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.045 1.685 17919 120164 1 293 . 1 1 27 27 LYS H H 27 8.560 8.560 8.081 0.479 17919 120165 1 293 . 1 1 28 28 ALA N N 28 123.440 123.440 122.489 0.951 17919 120166 1 293 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.082 0.078 17919 120167 1 293 . 1 1 28 28 ALA C C 28 180.300 180.300 179.267 1.033 17919 120168 1 293 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.066 0.304 17919 120169 1 293 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.320 -0.610 17919 120170 1 293 . 1 1 28 28 ALA H H 28 8.060 8.060 8.409 -0.349 17919 120171 1 293 . 1 1 29 29 LYS N N 29 119.940 119.940 118.347 1.593 17919 120172 1 293 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.116 0.091 17919 120173 1 293 . 1 1 29 29 LYS C C 29 180.320 180.320 178.978 1.342 17919 120174 1 293 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.430 0.220 17919 120175 1 293 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.584 0.706 17919 120176 1 293 . 1 1 29 29 LYS H H 29 7.850 7.850 8.035 -0.185 17919 120177 1 293 . 1 1 30 30 ILE N N 30 121.080 121.080 120.689 0.391 17919 120178 1 293 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.651 -0.144 17919 120179 1 293 . 1 1 30 30 ILE C C 30 178.310 178.310 177.290 1.020 17919 120180 1 293 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.352 0.798 17919 120181 1 293 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.625 -0.825 17919 120182 1 293 . 1 1 30 30 ILE H H 30 8.280 8.280 7.994 0.286 17919 120183 1 293 . 1 1 31 31 GLN N N 31 123.490 123.490 121.088 2.402 17919 120184 1 293 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.116 -0.287 17919 120185 1 293 . 1 1 31 31 GLN C C 31 178.890 178.890 177.923 0.967 17919 120186 1 293 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.166 0.834 17919 120187 1 293 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.730 -1.010 17919 120188 1 293 . 1 1 31 31 GLN H H 31 8.580 8.580 8.193 0.387 17919 120189 1 293 . 1 1 32 32 ASP N N 32 119.360 119.360 118.978 0.382 17919 120190 1 293 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.422 -0.068 17919 120191 1 293 . 1 1 32 32 ASP C C 32 177.250 177.250 178.447 -1.197 17919 120192 1 293 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.688 0.502 17919 120193 1 293 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.895 -0.315 17919 120194 1 293 . 1 1 32 32 ASP H H 32 8.010 8.010 8.104 -0.094 17919 120195 1 293 . 1 1 33 33 LYS N N 33 115.130 115.130 118.271 -3.141 17919 120196 1 293 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.235 0.102 17919 120197 1 293 . 1 1 33 33 LYS C C 33 177.870 177.870 178.335 -0.465 17919 120198 1 293 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.443 -0.393 17919 120199 1 293 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.553 0.617 17919 120200 1 293 . 1 1 33 33 LYS H H 33 7.430 7.430 7.739 -0.309 17919 120201 1 293 . 1 1 34 34 GLU N N 34 113.870 113.870 114.243 -0.373 17919 120202 1 293 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.516 0.109 17919 120203 1 293 . 1 1 34 34 GLU C C 34 177.840 177.840 176.698 1.142 17919 120204 1 293 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.678 -0.508 17919 120205 1 293 . 1 1 34 34 GLU CB C 34 32.660 32.660 30.663 1.997 17919 120206 1 293 . 1 1 34 34 GLU H H 34 8.740 8.740 8.211 0.529 17919 120207 1 293 . 1 1 35 35 GLY N N 35 108.650 108.650 108.726 -0.076 17919 120208 1 293 . 1 1 35 35 GLY C C 35 173.960 173.960 174.508 -0.548 17919 120209 1 293 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.676 0.404 17919 120210 1 293 . 1 1 35 35 GLY H H 35 8.530 8.530 7.846 0.684 17919 120211 1 293 . 1 1 36 36 ILE N N 36 119.880 119.880 122.190 -2.310 17919 120212 1 293 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.390 0.055 17919 120213 1 293 . 1 1 36 36 ILE C C 36 173.590 173.590 174.073 -0.483 17919 120214 1 293 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.994 -0.244 17919 120215 1 293 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.555 2.025 17919 120216 1 293 . 1 1 36 36 ILE H H 36 6.150 6.150 7.592 -1.442 17919 120217 1 293 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.928 -0.294 17919 120218 1 293 . 1 1 37 37 PRO C C 37 176.940 176.940 176.224 0.716 17919 120219 1 293 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.444 0.216 17919 120220 1 293 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.679 0.171 17919 120221 1 293 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.274 -0.157 17919 120222 1 293 . 1 1 38 38 PRO C C 38 178.320 178.320 177.759 0.561 17919 120223 1 293 . 1 1 38 38 PRO CA C 38 66.260 66.260 64.877 1.383 17919 120224 1 293 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.905 0.985 17919 120225 1 293 . 1 1 39 39 ASP N N 39 113.380 113.380 117.873 -4.493 17919 120226 1 293 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.404 0.026 17919 120227 1 293 . 1 1 39 39 ASP C C 39 177.090 177.090 178.001 -0.911 17919 120228 1 293 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.737 -1.097 17919 120229 1 293 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.838 -1.298 17919 120230 1 293 . 1 1 39 39 ASP H H 39 8.550 8.550 8.411 0.139 17919 120231 1 293 . 1 1 40 40 GLN N N 40 116.780 116.780 117.287 -0.507 17919 120232 1 293 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.338 0.126 17919 120233 1 293 . 1 1 40 40 GLN C C 40 175.380 175.380 176.286 -0.906 17919 120234 1 293 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.843 -0.203 17919 120235 1 293 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.168 0.972 17919 120236 1 293 . 1 1 40 40 GLN H H 40 7.820 7.820 7.882 -0.062 17919 120237 1 293 . 1 1 41 41 GLN N N 41 117.720 117.720 119.090 -1.370 17919 120238 1 293 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.484 -0.240 17919 120239 1 293 . 1 1 41 41 GLN C C 41 176.300 176.300 175.086 1.214 17919 120240 1 293 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.054 0.416 17919 120241 1 293 . 1 1 41 41 GLN CB C 41 31.650 31.650 30.229 1.421 17919 120242 1 293 . 1 1 41 41 GLN H H 41 7.480 7.480 7.406 0.074 17919 120243 1 293 . 1 1 42 42 ARG N N 42 122.680 122.680 122.738 -0.058 17919 120244 1 293 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.697 -0.197 17919 120245 1 293 . 1 1 42 42 ARG C C 42 174.050 174.050 174.663 -0.613 17919 120246 1 293 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.536 0.513 17919 120247 1 293 . 1 1 42 42 ARG CB C 42 31.750 31.750 33.331 -1.581 17919 120248 1 293 . 1 1 42 42 ARG H H 42 8.530 8.530 8.472 0.058 17919 120249 1 293 . 1 1 43 43 LEU N N 43 124.040 124.040 123.469 0.571 17919 120250 1 293 . 1 1 43 43 LEU C C 43 175.290 175.290 176.202 -0.912 17919 120251 1 293 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.787 -0.807 17919 120252 1 293 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.482 1.308 17919 120253 1 293 . 1 1 43 43 LEU H H 43 8.820 8.820 8.668 0.152 17919 120254 1 293 . 1 1 44 44 ILE N N 44 121.920 121.920 121.804 0.116 17919 120255 1 293 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.962 0.030 17919 120256 1 293 . 1 1 44 44 ILE C C 44 176.060 176.060 174.231 1.829 17919 120257 1 293 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.477 -1.497 17919 120258 1 293 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.581 -0.161 17919 120259 1 293 . 1 1 44 44 ILE H H 44 9.030 9.030 8.816 0.214 17919 120260 1 293 . 1 1 45 45 PHE N N 45 125.390 125.390 128.326 -2.936 17919 120261 1 293 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.034 0.011 17919 120262 1 293 . 1 1 45 45 PHE C C 45 174.470 174.470 174.878 -0.408 17919 120263 1 293 . 1 1 45 45 PHE CA C 45 57.020 57.020 55.980 1.040 17919 120264 1 293 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.689 1.071 17919 120265 1 293 . 1 1 45 45 PHE H H 45 8.830 8.830 8.893 -0.063 17919 120266 1 293 . 1 1 46 46 ALA N N 46 132.200 132.200 130.483 1.717 17919 120267 1 293 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.700 -0.010 17919 120268 1 293 . 1 1 46 46 ALA C C 46 177.290 177.290 177.383 -0.093 17919 120269 1 293 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.887 -0.347 17919 120270 1 293 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.359 0.211 17919 120271 1 293 . 1 1 46 46 ALA H H 46 8.810 8.810 8.862 -0.052 17919 120272 1 293 . 1 1 47 47 GLY N N 47 102.340 102.340 103.979 -1.639 17919 120273 1 293 . 1 1 47 47 GLY C C 47 173.810 173.810 174.700 -0.890 17919 120274 1 293 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.226 0.124 17919 120275 1 293 . 1 1 47 47 GLY H H 47 8.130 8.130 8.444 -0.314 17919 120276 1 293 . 1 1 48 48 LYS N N 48 121.570 121.570 121.584 -0.014 17919 120277 1 293 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.659 -0.037 17919 120278 1 293 . 1 1 48 48 LYS C C 48 174.700 174.700 175.286 -0.586 17919 120279 1 293 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.627 -0.077 17919 120280 1 293 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.739 -0.209 17919 120281 1 293 . 1 1 48 48 LYS H H 48 7.980 7.980 7.970 0.010 17919 120282 1 293 . 1 1 49 49 GLN N N 49 122.410 122.410 122.539 -0.129 17919 120283 1 293 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.460 0.100 17919 120284 1 293 . 1 1 49 49 GLN C C 49 175.670 175.670 176.163 -0.493 17919 120285 1 293 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.072 -0.332 17919 120286 1 293 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.183 -0.183 17919 120287 1 293 . 1 1 49 49 GLN H H 49 8.600 8.600 8.552 0.048 17919 120288 1 293 . 1 1 50 50 LEU N N 50 125.520 125.520 128.371 -2.851 17919 120289 1 293 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.064 0.026 17919 120290 1 293 . 1 1 50 50 LEU C C 50 176.660 176.660 176.659 0.001 17919 120291 1 293 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.902 -0.662 17919 120292 1 293 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.979 -0.409 17919 120293 1 293 . 1 1 50 50 LEU H H 50 8.530 8.530 8.406 0.124 17919 120294 1 293 . 1 1 51 51 GLU N N 51 122.940 122.940 122.887 0.053 17919 120295 1 293 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.520 -0.032 17919 120296 1 293 . 1 1 51 51 GLU C C 51 175.870 175.870 176.669 -0.799 17919 120297 1 293 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.812 0.148 17919 120298 1 293 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.183 0.387 17919 120299 1 293 . 1 1 51 51 GLU H H 51 8.400 8.400 8.418 -0.018 17919 120300 1 293 . 1 1 52 52 ASP N N 52 120.030 120.030 124.801 -4.771 17919 120301 1 293 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.517 -0.158 17919 120302 1 293 . 1 1 52 52 ASP C C 52 177.330 177.330 177.565 -0.235 17919 120303 1 293 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.274 -0.314 17919 120304 1 293 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.893 -0.043 17919 120305 1 293 . 1 1 52 52 ASP H H 52 8.160 8.160 8.943 -0.783 17919 120306 1 293 . 1 1 53 53 GLY N N 53 106.660 106.660 105.426 1.234 17919 120307 1 293 . 1 1 53 53 GLY C C 53 174.870 174.870 174.087 0.783 17919 120308 1 293 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.709 0.461 17919 120309 1 293 . 1 1 53 53 GLY H H 53 9.390 9.390 8.390 1.000 17919 120310 1 293 . 1 1 54 54 ARG N N 54 119.050 119.050 120.046 -0.996 17919 120311 1 293 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.705 -0.010 17919 120312 1 293 . 1 1 54 54 ARG C C 54 175.350 175.350 175.913 -0.563 17919 120313 1 293 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.099 0.291 17919 120314 1 293 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.054 -0.404 17919 120315 1 293 . 1 1 54 54 ARG H H 54 7.460 7.460 7.462 -0.002 17919 120316 1 293 . 1 1 55 55 THR N N 55 108.400 108.400 111.996 -3.596 17919 120317 1 293 . 1 1 55 55 THR HA H 55 5.240 5.240 4.943 0.297 17919 120318 1 293 . 1 1 55 55 THR C C 55 176.560 176.560 175.869 0.691 17919 120319 1 293 . 1 1 55 55 THR CA C 55 59.690 59.690 60.074 -0.384 17919 120320 1 293 . 1 1 55 55 THR CB C 55 72.260 72.260 70.869 1.391 17919 120321 1 293 . 1 1 55 55 THR H H 55 8.730 8.730 8.940 -0.210 17919 120322 1 293 . 1 1 56 56 LEU N N 56 117.920 117.920 120.567 -2.647 17919 120323 1 293 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.110 -0.050 17919 120324 1 293 . 1 1 56 56 LEU C C 56 180.810 180.810 178.829 1.981 17919 120325 1 293 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.134 0.576 17919 120326 1 293 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.376 -1.006 17919 120327 1 293 . 1 1 56 56 LEU H H 56 8.140 8.140 8.448 -0.308 17919 120328 1 293 . 1 1 57 57 SER N N 57 113.330 113.330 114.883 -1.553 17919 120329 1 293 . 1 1 57 57 SER HA H 57 4.370 4.370 4.094 0.276 17919 120330 1 293 . 1 1 57 57 SER C C 57 178.310 178.310 176.973 1.337 17919 120331 1 293 . 1 1 57 57 SER CA C 57 61.080 61.080 61.863 -0.783 17919 120332 1 293 . 1 1 57 57 SER CB C 57 62.530 62.530 62.801 -0.271 17919 120333 1 293 . 1 1 57 57 SER H H 57 8.470 8.470 7.953 0.517 17919 120334 1 293 . 1 1 58 58 ASP N N 58 124.190 124.190 121.113 3.077 17919 120335 1 293 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.347 -0.051 17919 120336 1 293 . 1 1 58 58 ASP C C 58 177.400 177.400 177.854 -0.454 17919 120337 1 293 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.710 0.470 17919 120338 1 293 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.385 -0.285 17919 120339 1 293 . 1 1 58 58 ASP H H 58 7.930 7.930 7.921 0.009 17919 120340 1 293 . 1 1 59 59 TYR N N 59 115.510 115.510 116.662 -1.152 17919 120341 1 293 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.420 0.250 17919 120342 1 293 . 1 1 59 59 TYR C C 59 174.700 174.700 175.124 -0.424 17919 120343 1 293 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.355 0.895 17919 120344 1 293 . 1 1 59 59 TYR CB C 59 40.070 40.070 37.931 2.139 17919 120345 1 293 . 1 1 59 59 TYR H H 59 7.250 7.250 7.323 -0.073 17919 120346 1 293 . 1 1 60 60 ASN N N 60 115.900 115.900 117.073 -1.173 17919 120347 1 293 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.377 -0.022 17919 120348 1 293 . 1 1 60 60 ASN C C 60 174.340 174.340 174.829 -0.489 17919 120349 1 293 . 1 1 60 60 ASN CA C 60 54.120 54.120 53.986 0.134 17919 120350 1 293 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.407 0.003 17919 120351 1 293 . 1 1 60 60 ASN H H 60 8.150 8.150 7.630 0.520 17919 120352 1 293 . 1 1 61 61 ILE N N 61 118.600 118.600 118.720 -0.120 17919 120353 1 293 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.892 -0.499 17919 120354 1 293 . 1 1 61 61 ILE C C 61 174.610 174.610 176.012 -1.402 17919 120355 1 293 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.244 1.176 17919 120356 1 293 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.242 -0.502 17919 120357 1 293 . 1 1 61 61 ILE H H 61 7.250 7.250 7.745 -0.495 17919 120358 1 293 . 1 1 62 62 GLN N N 62 124.740 124.740 125.469 -0.729 17919 120359 1 293 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.759 -0.253 17919 120360 1 293 . 1 1 62 62 GLN C C 62 175.970 175.970 175.692 0.278 17919 120361 1 293 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.439 0.221 17919 120362 1 293 . 1 1 62 62 GLN CB C 62 31.650 31.650 30.705 0.945 17919 120363 1 293 . 1 1 62 62 GLN H H 62 7.610 7.610 8.034 -0.424 17919 120364 1 293 . 1 1 63 63 LYS N N 63 120.300 120.300 120.964 -0.664 17919 120365 1 293 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.033 -0.032 17919 120366 1 293 . 1 1 63 63 LYS C C 63 175.810 175.810 176.716 -0.906 17919 120367 1 293 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.873 -0.083 17919 120368 1 293 . 1 1 63 63 LYS CB C 63 32.650 32.650 31.785 0.865 17919 120369 1 293 . 1 1 63 63 LYS H H 63 8.490 8.490 8.539 -0.049 17919 120370 1 293 . 1 1 64 64 GLU N N 64 113.950 113.950 119.837 -5.887 17919 120371 1 293 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.276 0.189 17919 120372 1 293 . 1 1 64 64 GLU C C 64 175.250 175.250 176.357 -1.107 17919 120373 1 293 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.706 0.183 17919 120374 1 293 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.610 -2.710 17919 120375 1 293 . 1 1 64 64 GLU H H 64 9.280 9.280 8.488 0.792 17919 120376 1 293 . 1 1 65 65 SER N N 65 114.730 114.730 115.639 -0.909 17919 120377 1 293 . 1 1 65 65 SER HA H 65 4.640 4.640 4.406 0.234 17919 120378 1 293 . 1 1 65 65 SER C C 65 172.160 172.160 173.941 -1.781 17919 120379 1 293 . 1 1 65 65 SER CA C 65 60.890 60.890 60.747 0.143 17919 120380 1 293 . 1 1 65 65 SER CB C 65 64.910 64.910 64.149 0.761 17919 120381 1 293 . 1 1 65 65 SER H H 65 7.670 7.670 7.248 0.422 17919 120382 1 293 . 1 1 66 66 THR N N 66 117.110 117.110 118.299 -1.189 17919 120383 1 293 . 1 1 66 66 THR HA H 66 5.270 5.270 5.067 0.203 17919 120384 1 293 . 1 1 66 66 THR C C 66 173.950 173.950 174.145 -0.195 17919 120385 1 293 . 1 1 66 66 THR CA C 66 62.340 62.340 61.982 0.358 17919 120386 1 293 . 1 1 66 66 THR CB C 66 70.080 70.080 71.129 -1.049 17919 120387 1 293 . 1 1 66 66 THR H H 66 8.730 8.730 8.468 0.262 17919 120388 1 293 . 1 1 67 67 LEU N N 67 127.110 127.110 126.797 0.313 17919 120389 1 293 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.796 0.264 17919 120390 1 293 . 1 1 67 67 LEU C C 67 175.770 175.770 175.621 0.149 17919 120391 1 293 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.216 -0.316 17919 120392 1 293 . 1 1 67 67 LEU CB C 67 44.260 44.260 43.648 0.612 17919 120393 1 293 . 1 1 67 67 LEU H H 67 9.410 9.410 9.021 0.389 17919 120394 1 293 . 1 1 68 68 HIS N N 68 118.380 118.380 120.798 -2.418 17919 120395 1 293 . 1 1 68 68 HIS HA H 68 5.240 5.240 4.957 0.283 17919 120396 1 293 . 1 1 68 68 HIS C C 68 173.150 173.150 173.712 -0.562 17919 120397 1 293 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.242 0.758 17919 120398 1 293 . 1 1 68 68 HIS CB C 68 30.530 30.530 31.904 -1.374 17919 120399 1 293 . 1 1 68 68 HIS H H 68 9.230 9.230 9.248 -0.018 17919 120400 1 293 . 1 1 69 69 LEU N N 69 124.460 124.460 129.598 -5.138 17919 120401 1 293 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.147 0.043 17919 120402 1 293 . 1 1 69 69 LEU C C 69 175.270 175.270 174.083 1.187 17919 120403 1 293 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.620 0.270 17919 120404 1 293 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.247 0.133 17919 120405 1 293 . 1 1 69 69 LEU H H 69 8.340 8.340 8.572 -0.232 17919 120406 1 293 . 1 1 70 70 VAL N N 70 126.940 126.940 125.600 1.340 17919 120407 1 293 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.446 -0.096 17919 120408 1 293 . 1 1 70 70 VAL C C 70 174.000 174.000 173.460 0.540 17919 120409 1 293 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.518 1.282 17919 120410 1 293 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.357 -0.447 17919 120411 1 293 . 1 1 70 70 VAL H H 70 9.200 9.200 8.549 0.651 17919 120412 1 293 . 1 1 71 71 LEU N N 71 123.130 123.130 126.651 -3.521 17919 120413 1 293 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.045 0.015 17919 120414 1 293 . 1 1 71 71 LEU C C 71 177.830 177.830 176.981 0.849 17919 120415 1 293 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.189 0.751 17919 120416 1 293 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.379 -0.529 17919 120417 1 293 . 1 1 71 71 LEU H H 71 8.120 8.120 8.387 -0.267 17919 120418 1 293 . 1 1 72 72 ARG N N 72 123.490 123.490 123.633 -0.143 17919 120419 1 293 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.150 0.151 17919 120420 1 293 . 1 1 72 72 ARG C C 72 175.350 175.350 176.116 -0.766 17919 120421 1 293 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.369 -0.759 17919 120422 1 293 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.265 1.085 17919 120423 1 293 . 1 1 72 72 ARG H H 72 8.580 8.580 8.105 0.475 17919 120424 1 294 . 1 1 2 2 GLN N N 2 123.220 123.220 120.523 2.697 17919 120425 1 294 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.267 -0.018 17919 120426 1 294 . 1 1 2 2 GLN C C 2 175.920 175.920 174.706 1.214 17919 120427 1 294 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.445 0.635 17919 120428 1 294 . 1 1 2 2 GLN CB C 2 30.760 30.760 31.388 -0.628 17919 120429 1 294 . 1 1 2 2 GLN H H 2 8.900 8.900 8.326 0.574 17919 120430 1 294 . 1 1 3 3 ILE N N 3 115.340 115.340 117.691 -2.351 17919 120431 1 294 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.671 -0.458 17919 120432 1 294 . 1 1 3 3 ILE C C 3 172.450 172.450 173.133 -0.683 17919 120433 1 294 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.221 0.349 17919 120434 1 294 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.984 0.226 17919 120435 1 294 . 1 1 3 3 ILE H H 3 8.320 8.320 8.586 -0.266 17919 120436 1 294 . 1 1 4 4 PHE N N 4 118.110 118.110 119.437 -1.327 17919 120437 1 294 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.408 0.222 17919 120438 1 294 . 1 1 4 4 PHE C C 4 175.320 175.320 174.964 0.356 17919 120439 1 294 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.716 -0.506 17919 120440 1 294 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.133 -0.653 17919 120441 1 294 . 1 1 4 4 PHE H H 4 8.610 8.610 8.657 -0.047 17919 120442 1 294 . 1 1 5 5 VAL N N 5 121.000 121.000 121.113 -0.113 17919 120443 1 294 . 1 1 5 5 VAL HA H 5 4.725 4.725 5.042 -0.317 17919 120444 1 294 . 1 1 5 5 VAL C C 5 174.870 174.870 175.209 -0.339 17919 120445 1 294 . 1 1 5 5 VAL CA C 5 60.620 60.620 60.872 -0.252 17919 120446 1 294 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.971 0.259 17919 120447 1 294 . 1 1 5 5 VAL H H 5 9.300 9.300 9.257 0.043 17919 120448 1 294 . 1 1 6 6 LYS N N 6 127.520 127.520 127.445 0.075 17919 120449 1 294 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.557 -0.190 17919 120450 1 294 . 1 1 6 6 LYS C C 6 177.140 177.140 176.519 0.621 17919 120451 1 294 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.558 -0.038 17919 120452 1 294 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.657 -0.607 17919 120453 1 294 . 1 1 6 6 LYS H H 6 8.820 8.820 9.184 -0.364 17919 120454 1 294 . 1 1 7 7 THR N N 7 115.400 115.400 114.431 0.969 17919 120455 1 294 . 1 1 7 7 THR HA H 7 4.970 4.970 4.530 0.440 17919 120456 1 294 . 1 1 7 7 THR C C 7 176.910 176.910 176.081 0.829 17919 120457 1 294 . 1 1 7 7 THR CA C 7 60.470 60.470 60.238 0.232 17919 120458 1 294 . 1 1 7 7 THR CB C 7 70.630 70.630 70.809 -0.179 17919 120459 1 294 . 1 1 7 7 THR H H 7 8.730 8.730 8.637 0.093 17919 120460 1 294 . 1 1 8 8 LEU N N 8 121.330 121.330 122.037 -0.707 17919 120461 1 294 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.442 -0.132 17919 120462 1 294 . 1 1 8 8 LEU C C 8 178.800 178.800 177.238 1.562 17919 120463 1 294 . 1 1 8 8 LEU CA C 8 57.580 57.580 56.753 0.827 17919 120464 1 294 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.009 -0.039 17919 120465 1 294 . 1 1 8 8 LEU H H 8 9.100 9.100 8.638 0.462 17919 120466 1 294 . 1 1 9 9 THR N N 9 105.590 105.590 109.678 -4.088 17919 120467 1 294 . 1 1 9 9 THR HA H 9 4.428 4.428 4.376 0.052 17919 120468 1 294 . 1 1 9 9 THR C C 9 175.520 175.520 175.611 -0.091 17919 120469 1 294 . 1 1 9 9 THR CA C 9 61.400 61.400 61.701 -0.301 17919 120470 1 294 . 1 1 9 9 THR CB C 9 69.140 69.140 69.710 -0.570 17919 120471 1 294 . 1 1 9 9 THR H H 9 7.630 7.630 7.670 -0.040 17919 120472 1 294 . 1 1 10 10 GLY N N 10 108.890 108.890 111.331 -2.441 17919 120473 1 294 . 1 1 10 10 GLY C C 10 174.070 174.070 173.354 0.716 17919 120474 1 294 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.028 0.432 17919 120475 1 294 . 1 1 10 10 GLY H H 10 7.810 7.810 7.828 -0.018 17919 120476 1 294 . 1 1 11 11 LYS N N 11 121.600 121.600 121.293 0.307 17919 120477 1 294 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.554 -0.193 17919 120478 1 294 . 1 1 11 11 LYS C C 11 175.940 175.940 175.491 0.449 17919 120479 1 294 . 1 1 11 11 LYS CA C 11 56.280 56.280 55.692 0.588 17919 120480 1 294 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.850 -0.650 17919 120481 1 294 . 1 1 11 11 LYS H H 11 7.280 7.280 8.219 -0.939 17919 120482 1 294 . 1 1 12 12 THR N N 12 120.440 120.440 120.909 -0.469 17919 120483 1 294 . 1 1 12 12 THR HA H 12 5.046 5.046 5.240 -0.194 17919 120484 1 294 . 1 1 12 12 THR C C 12 174.320 174.320 174.533 -0.213 17919 120485 1 294 . 1 1 12 12 THR CA C 12 62.390 62.390 61.695 0.695 17919 120486 1 294 . 1 1 12 12 THR CB C 12 69.910 69.910 69.955 -0.045 17919 120487 1 294 . 1 1 12 12 THR H H 12 8.650 8.650 8.371 0.279 17919 120488 1 294 . 1 1 13 13 ILE N N 13 127.110 127.110 121.383 5.727 17919 120489 1 294 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.757 -0.213 17919 120490 1 294 . 1 1 13 13 ILE C C 13 175.220 175.220 174.662 0.558 17919 120491 1 294 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.440 0.540 17919 120492 1 294 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.646 -0.696 17919 120493 1 294 . 1 1 13 13 ILE H H 13 9.450 9.450 9.103 0.347 17919 120494 1 294 . 1 1 14 14 THR N N 14 121.520 121.520 122.655 -1.135 17919 120495 1 294 . 1 1 14 14 THR HA H 14 4.964 4.964 4.759 0.205 17919 120496 1 294 . 1 1 14 14 THR C C 14 173.790 173.790 173.936 -0.146 17919 120497 1 294 . 1 1 14 14 THR CA C 14 61.940 61.940 62.383 -0.443 17919 120498 1 294 . 1 1 14 14 THR CB C 14 69.650 69.650 69.734 -0.084 17919 120499 1 294 . 1 1 14 14 THR H H 14 8.710 8.710 8.390 0.320 17919 120500 1 294 . 1 1 15 15 LEU N N 15 124.800 124.800 127.898 -3.098 17919 120501 1 294 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.699 0.081 17919 120502 1 294 . 1 1 15 15 LEU C C 15 174.670 174.670 174.964 -0.294 17919 120503 1 294 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.858 -1.028 17919 120504 1 294 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.480 1.590 17919 120505 1 294 . 1 1 15 15 LEU H H 15 8.710 8.710 8.969 -0.259 17919 120506 1 294 . 1 1 16 16 GLU N N 16 122.160 122.160 123.001 -0.841 17919 120507 1 294 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.341 -0.424 17919 120508 1 294 . 1 1 16 16 GLU C C 16 175.860 175.860 175.773 0.087 17919 120509 1 294 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.898 -1.078 17919 120510 1 294 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.936 -1.486 17919 120511 1 294 . 1 1 16 16 GLU H H 16 8.140 8.140 8.627 -0.487 17919 120512 1 294 . 1 1 17 17 VAL N N 17 117.210 117.210 119.300 -2.090 17919 120513 1 294 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.692 0.022 17919 120514 1 294 . 1 1 17 17 VAL C C 17 174.160 174.160 174.119 0.041 17919 120515 1 294 . 1 1 17 17 VAL CA C 17 58.430 58.430 60.047 -1.617 17919 120516 1 294 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.460 0.940 17919 120517 1 294 . 1 1 17 17 VAL H H 17 8.900 8.900 8.460 0.440 17919 120518 1 294 . 1 1 18 18 GLU N N 18 118.990 118.990 119.365 -0.375 17919 120519 1 294 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.889 0.190 17919 120520 1 294 . 1 1 18 18 GLU C C 18 176.160 176.160 175.428 0.732 17919 120521 1 294 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.270 -0.550 17919 120522 1 294 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.326 -0.016 17919 120523 1 294 . 1 1 18 18 GLU H H 18 8.640 8.640 9.232 -0.592 17919 120524 1 294 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.482 -0.341 17919 120525 1 294 . 1 1 19 19 PRO C C 19 175.310 175.310 177.430 -2.120 17919 120526 1 294 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.359 0.111 17919 120527 1 294 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.076 -0.126 17919 120528 1 294 . 1 1 20 20 SER N N 20 103.400 103.400 110.216 -6.816 17919 120529 1 294 . 1 1 20 20 SER HA H 20 4.370 4.370 4.457 -0.087 17919 120530 1 294 . 1 1 20 20 SER C C 20 174.660 174.660 174.488 0.172 17919 120531 1 294 . 1 1 20 20 SER CA C 20 57.400 57.400 58.222 -0.822 17919 120532 1 294 . 1 1 20 20 SER CB C 20 63.370 63.370 63.094 0.276 17919 120533 1 294 . 1 1 20 20 SER H H 20 7.040 7.040 8.032 -0.992 17919 120534 1 294 . 1 1 21 21 ASP N N 21 123.480 123.480 122.539 0.941 17919 120535 1 294 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.723 -0.028 17919 120536 1 294 . 1 1 21 21 ASP C C 21 176.360 176.360 175.778 0.582 17919 120537 1 294 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.854 0.846 17919 120538 1 294 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.656 -0.856 17919 120539 1 294 . 1 1 21 21 ASP H H 21 8.030 8.030 7.670 0.360 17919 120540 1 294 . 1 1 22 22 THR N N 22 108.800 108.800 111.405 -2.605 17919 120541 1 294 . 1 1 22 22 THR HA H 22 4.920 4.920 5.260 -0.340 17919 120542 1 294 . 1 1 22 22 THR C C 22 176.750 176.750 176.485 0.265 17919 120543 1 294 . 1 1 22 22 THR CA C 22 59.690 59.690 59.801 -0.112 17919 120544 1 294 . 1 1 22 22 THR CB C 22 71.200 71.200 71.345 -0.145 17919 120545 1 294 . 1 1 22 22 THR H H 22 7.900 7.900 8.541 -0.641 17919 120546 1 294 . 1 1 23 23 ILE N N 23 121.190 121.190 121.262 -0.072 17919 120547 1 294 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.777 -0.120 17919 120548 1 294 . 1 1 23 23 ILE C C 23 179.040 179.040 177.610 1.430 17919 120549 1 294 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.049 -0.789 17919 120550 1 294 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.322 -1.972 17919 120551 1 294 . 1 1 23 23 ILE H H 23 8.560 8.560 8.604 -0.044 17919 120552 1 294 . 1 1 24 24 GLU N N 24 120.830 120.830 121.599 -0.769 17919 120553 1 294 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.895 0.022 17919 120554 1 294 . 1 1 24 24 GLU C C 24 178.640 178.640 178.360 0.280 17919 120555 1 294 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.369 -0.149 17919 120556 1 294 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.404 -1.124 17919 120557 1 294 . 1 1 24 24 GLU H H 24 9.760 9.760 8.437 1.323 17919 120558 1 294 . 1 1 25 25 ASN N N 25 120.570 120.570 118.043 2.527 17919 120559 1 294 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.442 0.083 17919 120560 1 294 . 1 1 25 25 ASN C C 25 178.380 178.380 177.983 0.397 17919 120561 1 294 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.086 -0.026 17919 120562 1 294 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.381 0.069 17919 120563 1 294 . 1 1 25 25 ASN H H 25 7.920 7.920 7.674 0.246 17919 120564 1 294 . 1 1 26 26 VAL N N 26 121.710 121.710 121.798 -0.088 17919 120565 1 294 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.501 -0.104 17919 120566 1 294 . 1 1 26 26 VAL C C 26 177.950 177.950 177.535 0.415 17919 120567 1 294 . 1 1 26 26 VAL CA C 26 67.660 67.660 67.197 0.463 17919 120568 1 294 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.528 -0.688 17919 120569 1 294 . 1 1 26 26 VAL H H 26 8.070 8.070 7.655 0.415 17919 120570 1 294 . 1 1 27 27 LYS N N 27 118.860 118.860 120.039 -1.179 17919 120571 1 294 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.180 0.400 17919 120572 1 294 . 1 1 27 27 LYS C C 27 180.550 180.550 179.245 1.305 17919 120573 1 294 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.684 -0.434 17919 120574 1 294 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.398 1.332 17919 120575 1 294 . 1 1 27 27 LYS H H 27 8.560 8.560 8.160 0.400 17919 120576 1 294 . 1 1 28 28 ALA N N 28 123.440 123.440 122.154 1.286 17919 120577 1 294 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.266 -0.106 17919 120578 1 294 . 1 1 28 28 ALA C C 28 180.300 180.300 179.378 0.922 17919 120579 1 294 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.118 0.252 17919 120580 1 294 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.401 -0.691 17919 120581 1 294 . 1 1 28 28 ALA H H 28 8.060 8.060 8.604 -0.544 17919 120582 1 294 . 1 1 29 29 LYS N N 29 119.940 119.940 118.738 1.202 17919 120583 1 294 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.079 0.128 17919 120584 1 294 . 1 1 29 29 LYS C C 29 180.320 180.320 179.319 1.001 17919 120585 1 294 . 1 1 29 29 LYS CA C 29 59.650 59.650 58.979 0.671 17919 120586 1 294 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.350 0.940 17919 120587 1 294 . 1 1 29 29 LYS H H 29 7.850 7.850 7.717 0.133 17919 120588 1 294 . 1 1 30 30 ILE N N 30 121.080 121.080 121.602 -0.522 17919 120589 1 294 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.570 -0.063 17919 120590 1 294 . 1 1 30 30 ILE C C 30 178.310 178.310 177.200 1.110 17919 120591 1 294 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.191 0.959 17919 120592 1 294 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.657 -0.858 17919 120593 1 294 . 1 1 30 30 ILE H H 30 8.280 8.280 8.448 -0.168 17919 120594 1 294 . 1 1 31 31 GLN N N 31 123.490 123.490 120.522 2.968 17919 120595 1 294 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.846 -0.017 17919 120596 1 294 . 1 1 31 31 GLN C C 31 178.890 178.890 178.238 0.652 17919 120597 1 294 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.287 0.713 17919 120598 1 294 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.452 -0.732 17919 120599 1 294 . 1 1 31 31 GLN H H 31 8.580 8.580 8.256 0.324 17919 120600 1 294 . 1 1 32 32 ASP N N 32 119.360 119.360 119.757 -0.397 17919 120601 1 294 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.355 -0.001 17919 120602 1 294 . 1 1 32 32 ASP C C 32 177.250 177.250 178.172 -0.922 17919 120603 1 294 . 1 1 32 32 ASP CA C 32 57.190 57.190 57.047 0.143 17919 120604 1 294 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.729 -0.149 17919 120605 1 294 . 1 1 32 32 ASP H H 32 8.010 8.010 8.149 -0.139 17919 120606 1 294 . 1 1 33 33 LYS N N 33 115.130 115.130 117.494 -2.364 17919 120607 1 294 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.180 0.157 17919 120608 1 294 . 1 1 33 33 LYS C C 33 177.870 177.870 178.048 -0.178 17919 120609 1 294 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.858 -0.808 17919 120610 1 294 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.113 1.057 17919 120611 1 294 . 1 1 33 33 LYS H H 33 7.430 7.430 7.558 -0.128 17919 120612 1 294 . 1 1 34 34 GLU N N 34 113.870 113.870 113.749 0.121 17919 120613 1 294 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.485 0.140 17919 120614 1 294 . 1 1 34 34 GLU C C 34 177.840 177.840 177.293 0.547 17919 120615 1 294 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.818 -0.648 17919 120616 1 294 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.410 1.250 17919 120617 1 294 . 1 1 34 34 GLU H H 34 8.740 8.740 8.171 0.569 17919 120618 1 294 . 1 1 35 35 GLY N N 35 108.650 108.650 110.054 -1.404 17919 120619 1 294 . 1 1 35 35 GLY C C 35 173.960 173.960 173.949 0.011 17919 120620 1 294 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.800 0.280 17919 120621 1 294 . 1 1 35 35 GLY H H 35 8.530 8.530 8.269 0.261 17919 120622 1 294 . 1 1 36 36 ILE N N 36 119.880 119.880 120.333 -0.453 17919 120623 1 294 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.308 0.137 17919 120624 1 294 . 1 1 36 36 ILE C C 36 173.590 173.590 173.741 -0.151 17919 120625 1 294 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.542 0.208 17919 120626 1 294 . 1 1 36 36 ILE CB C 36 40.580 40.580 39.241 1.339 17919 120627 1 294 . 1 1 36 36 ILE H H 36 6.150 6.150 7.404 -1.254 17919 120628 1 294 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.449 0.185 17919 120629 1 294 . 1 1 37 37 PRO C C 37 176.940 176.940 176.429 0.511 17919 120630 1 294 . 1 1 37 37 PRO CA C 37 61.660 61.660 62.165 -0.505 17919 120631 1 294 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.274 0.576 17919 120632 1 294 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.216 -0.099 17919 120633 1 294 . 1 1 38 38 PRO C C 38 178.320 178.320 178.600 -0.280 17919 120634 1 294 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.665 0.595 17919 120635 1 294 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.950 0.940 17919 120636 1 294 . 1 1 39 39 ASP N N 39 113.380 113.380 117.203 -3.823 17919 120637 1 294 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.409 0.021 17919 120638 1 294 . 1 1 39 39 ASP C C 39 177.090 177.090 177.535 -0.445 17919 120639 1 294 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.420 -0.780 17919 120640 1 294 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.165 -0.625 17919 120641 1 294 . 1 1 39 39 ASP H H 39 8.550 8.550 8.638 -0.088 17919 120642 1 294 . 1 1 40 40 GLN N N 40 116.780 116.780 116.615 0.165 17919 120643 1 294 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.365 0.099 17919 120644 1 294 . 1 1 40 40 GLN C C 40 175.380 175.380 176.137 -0.757 17919 120645 1 294 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.474 0.166 17919 120646 1 294 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.054 1.086 17919 120647 1 294 . 1 1 40 40 GLN H H 40 7.820 7.820 7.889 -0.069 17919 120648 1 294 . 1 1 41 41 GLN N N 41 117.720 117.720 120.161 -2.441 17919 120649 1 294 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.462 -0.218 17919 120650 1 294 . 1 1 41 41 GLN C C 41 176.300 176.300 175.212 1.088 17919 120651 1 294 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.211 0.259 17919 120652 1 294 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.434 2.216 17919 120653 1 294 . 1 1 41 41 GLN H H 41 7.480 7.480 7.699 -0.219 17919 120654 1 294 . 1 1 42 42 ARG N N 42 122.680 122.680 124.425 -1.745 17919 120655 1 294 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.615 -0.115 17919 120656 1 294 . 1 1 42 42 ARG C C 42 174.050 174.050 174.551 -0.501 17919 120657 1 294 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.888 0.162 17919 120658 1 294 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.074 -0.324 17919 120659 1 294 . 1 1 42 42 ARG H H 42 8.530 8.530 8.728 -0.198 17919 120660 1 294 . 1 1 43 43 LEU N N 43 124.040 124.040 126.064 -2.024 17919 120661 1 294 . 1 1 43 43 LEU C C 43 175.290 175.290 176.032 -0.742 17919 120662 1 294 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.776 -0.796 17919 120663 1 294 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.439 2.351 17919 120664 1 294 . 1 1 43 43 LEU H H 43 8.820 8.820 8.811 0.009 17919 120665 1 294 . 1 1 44 44 ILE N N 44 121.920 121.920 123.280 -1.360 17919 120666 1 294 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.210 -0.218 17919 120667 1 294 . 1 1 44 44 ILE C C 44 176.060 176.060 174.325 1.735 17919 120668 1 294 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.444 -1.464 17919 120669 1 294 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.138 0.282 17919 120670 1 294 . 1 1 44 44 ILE H H 44 9.030 9.030 8.980 0.050 17919 120671 1 294 . 1 1 45 45 PHE N N 45 125.390 125.390 127.661 -2.271 17919 120672 1 294 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.040 0.005 17919 120673 1 294 . 1 1 45 45 PHE C C 45 174.470 174.470 174.439 0.031 17919 120674 1 294 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.202 0.818 17919 120675 1 294 . 1 1 45 45 PHE CB C 45 43.760 43.760 43.108 0.652 17919 120676 1 294 . 1 1 45 45 PHE H H 45 8.830 8.830 8.968 -0.138 17919 120677 1 294 . 1 1 46 46 ALA N N 46 132.200 132.200 129.210 2.990 17919 120678 1 294 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.699 -0.009 17919 120679 1 294 . 1 1 46 46 ALA C C 46 177.290 177.290 177.893 -0.603 17919 120680 1 294 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.614 -0.074 17919 120681 1 294 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.507 0.063 17919 120682 1 294 . 1 1 46 46 ALA H H 46 8.810 8.810 8.941 -0.131 17919 120683 1 294 . 1 1 47 47 GLY N N 47 102.340 102.340 104.332 -1.992 17919 120684 1 294 . 1 1 47 47 GLY C C 47 173.810 173.810 174.228 -0.418 17919 120685 1 294 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.970 0.380 17919 120686 1 294 . 1 1 47 47 GLY H H 47 8.130 8.130 8.496 -0.366 17919 120687 1 294 . 1 1 48 48 LYS N N 48 121.570 121.570 121.205 0.365 17919 120688 1 294 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.633 -0.011 17919 120689 1 294 . 1 1 48 48 LYS C C 48 174.700 174.700 175.187 -0.487 17919 120690 1 294 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.871 -0.321 17919 120691 1 294 . 1 1 48 48 LYS CB C 48 34.530 34.530 35.044 -0.514 17919 120692 1 294 . 1 1 48 48 LYS H H 48 7.980 7.980 7.902 0.078 17919 120693 1 294 . 1 1 49 49 GLN N N 49 122.410 122.410 124.704 -2.294 17919 120694 1 294 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.723 -0.163 17919 120695 1 294 . 1 1 49 49 GLN C C 49 175.670 175.670 175.884 -0.214 17919 120696 1 294 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.214 -0.474 17919 120697 1 294 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.331 -0.331 17919 120698 1 294 . 1 1 49 49 GLN H H 49 8.600 8.600 8.603 -0.003 17919 120699 1 294 . 1 1 50 50 LEU N N 50 125.520 125.520 128.845 -3.325 17919 120700 1 294 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.481 -0.391 17919 120701 1 294 . 1 1 50 50 LEU C C 50 176.660 176.660 176.403 0.257 17919 120702 1 294 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.337 -0.097 17919 120703 1 294 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.191 -0.621 17919 120704 1 294 . 1 1 50 50 LEU H H 50 8.530 8.530 8.157 0.373 17919 120705 1 294 . 1 1 51 51 GLU N N 51 122.940 122.940 124.570 -1.630 17919 120706 1 294 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.342 0.146 17919 120707 1 294 . 1 1 51 51 GLU C C 51 175.870 175.870 176.884 -1.014 17919 120708 1 294 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.573 0.387 17919 120709 1 294 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.925 -0.355 17919 120710 1 294 . 1 1 51 51 GLU H H 51 8.400 8.400 8.525 -0.125 17919 120711 1 294 . 1 1 52 52 ASP N N 52 120.030 120.030 125.017 -4.987 17919 120712 1 294 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.510 -0.151 17919 120713 1 294 . 1 1 52 52 ASP C C 52 177.330 177.330 177.832 -0.502 17919 120714 1 294 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.108 -0.148 17919 120715 1 294 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.768 0.082 17919 120716 1 294 . 1 1 52 52 ASP H H 52 8.160 8.160 8.803 -0.642 17919 120717 1 294 . 1 1 53 53 GLY N N 53 106.660 106.660 104.169 2.491 17919 120718 1 294 . 1 1 53 53 GLY C C 53 174.870 174.870 173.787 1.083 17919 120719 1 294 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.642 0.528 17919 120720 1 294 . 1 1 53 53 GLY H H 53 9.390 9.390 8.271 1.119 17919 120721 1 294 . 1 1 54 54 ARG N N 54 119.050 119.050 120.749 -1.699 17919 120722 1 294 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.563 0.132 17919 120723 1 294 . 1 1 54 54 ARG C C 54 175.350 175.350 175.605 -0.255 17919 120724 1 294 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.483 -0.093 17919 120725 1 294 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.166 0.484 17919 120726 1 294 . 1 1 54 54 ARG H H 54 7.460 7.460 7.207 0.253 17919 120727 1 294 . 1 1 55 55 THR N N 55 108.400 108.400 116.845 -8.445 17919 120728 1 294 . 1 1 55 55 THR HA H 55 5.240 5.240 4.634 0.606 17919 120729 1 294 . 1 1 55 55 THR C C 55 176.560 176.560 175.610 0.950 17919 120730 1 294 . 1 1 55 55 THR CA C 55 59.690 59.690 61.852 -2.162 17919 120731 1 294 . 1 1 55 55 THR CB C 55 72.260 72.260 69.612 2.647 17919 120732 1 294 . 1 1 55 55 THR H H 55 8.730 8.730 8.453 0.277 17919 120733 1 294 . 1 1 56 56 LEU N N 56 117.920 117.920 123.226 -5.306 17919 120734 1 294 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.294 -0.234 17919 120735 1 294 . 1 1 56 56 LEU C C 56 180.810 180.810 178.648 2.162 17919 120736 1 294 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.175 0.535 17919 120737 1 294 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.337 -0.967 17919 120738 1 294 . 1 1 56 56 LEU H H 56 8.140 8.140 8.660 -0.520 17919 120739 1 294 . 1 1 57 57 SER N N 57 113.330 113.330 115.163 -1.833 17919 120740 1 294 . 1 1 57 57 SER HA H 57 4.370 4.370 4.098 0.272 17919 120741 1 294 . 1 1 57 57 SER C C 57 178.310 178.310 176.671 1.639 17919 120742 1 294 . 1 1 57 57 SER CA C 57 61.080 61.080 61.451 -0.371 17919 120743 1 294 . 1 1 57 57 SER CB C 57 62.530 62.530 62.616 -0.086 17919 120744 1 294 . 1 1 57 57 SER H H 57 8.470 8.470 8.693 -0.223 17919 120745 1 294 . 1 1 58 58 ASP N N 58 124.190 124.190 122.729 1.461 17919 120746 1 294 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.342 -0.046 17919 120747 1 294 . 1 1 58 58 ASP C C 58 177.400 177.400 177.488 -0.088 17919 120748 1 294 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.718 0.462 17919 120749 1 294 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.674 -0.574 17919 120750 1 294 . 1 1 58 58 ASP H H 58 7.930 7.930 7.967 -0.037 17919 120751 1 294 . 1 1 59 59 TYR N N 59 115.510 115.510 115.402 0.108 17919 120752 1 294 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.495 0.175 17919 120753 1 294 . 1 1 59 59 TYR C C 59 174.700 174.700 175.531 -0.831 17919 120754 1 294 . 1 1 59 59 TYR CA C 59 58.250 58.250 58.401 -0.151 17919 120755 1 294 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.479 1.591 17919 120756 1 294 . 1 1 59 59 TYR H H 59 7.250 7.250 7.413 -0.163 17919 120757 1 294 . 1 1 60 60 ASN N N 60 115.900 115.900 117.799 -1.899 17919 120758 1 294 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.422 -0.067 17919 120759 1 294 . 1 1 60 60 ASN C C 60 174.340 174.340 174.590 -0.250 17919 120760 1 294 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.156 -0.036 17919 120761 1 294 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.445 -0.035 17919 120762 1 294 . 1 1 60 60 ASN H H 60 8.150 8.150 8.190 -0.040 17919 120763 1 294 . 1 1 61 61 ILE N N 61 118.600 118.600 120.004 -1.404 17919 120764 1 294 . 1 1 61 61 ILE HA H 61 3.393 3.393 4.012 -0.619 17919 120765 1 294 . 1 1 61 61 ILE C C 61 174.610 174.610 175.123 -0.513 17919 120766 1 294 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.065 0.355 17919 120767 1 294 . 1 1 61 61 ILE CB C 61 36.740 36.740 38.319 -1.579 17919 120768 1 294 . 1 1 61 61 ILE H H 61 7.250 7.250 7.981 -0.731 17919 120769 1 294 . 1 1 62 62 GLN N N 62 124.740 124.740 125.442 -0.702 17919 120770 1 294 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.782 -0.276 17919 120771 1 294 . 1 1 62 62 GLN C C 62 175.970 175.970 175.717 0.253 17919 120772 1 294 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.687 -0.027 17919 120773 1 294 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.690 -0.040 17919 120774 1 294 . 1 1 62 62 GLN H H 62 7.610 7.610 7.935 -0.325 17919 120775 1 294 . 1 1 63 63 LYS N N 63 120.300 120.300 120.848 -0.548 17919 120776 1 294 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.139 -0.138 17919 120777 1 294 . 1 1 63 63 LYS C C 63 175.810 175.810 177.260 -1.450 17919 120778 1 294 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.781 0.010 17919 120779 1 294 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.218 0.432 17919 120780 1 294 . 1 1 63 63 LYS H H 63 8.490 8.490 8.670 -0.180 17919 120781 1 294 . 1 1 64 64 GLU N N 64 113.950 113.950 117.890 -3.940 17919 120782 1 294 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.965 -0.500 17919 120783 1 294 . 1 1 64 64 GLU C C 64 175.250 175.250 176.075 -0.825 17919 120784 1 294 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.800 0.090 17919 120785 1 294 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.877 -2.977 17919 120786 1 294 . 1 1 64 64 GLU H H 64 9.280 9.280 8.937 0.343 17919 120787 1 294 . 1 1 65 65 SER N N 65 114.730 114.730 115.663 -0.933 17919 120788 1 294 . 1 1 65 65 SER HA H 65 4.640 4.640 4.426 0.214 17919 120789 1 294 . 1 1 65 65 SER C C 65 172.160 172.160 173.727 -1.567 17919 120790 1 294 . 1 1 65 65 SER CA C 65 60.890 60.890 60.713 0.177 17919 120791 1 294 . 1 1 65 65 SER CB C 65 64.910 64.910 64.321 0.589 17919 120792 1 294 . 1 1 65 65 SER H H 65 7.670 7.670 7.512 0.158 17919 120793 1 294 . 1 1 66 66 THR N N 66 117.110 117.110 119.048 -1.938 17919 120794 1 294 . 1 1 66 66 THR HA H 66 5.270 5.270 5.189 0.081 17919 120795 1 294 . 1 1 66 66 THR C C 66 173.950 173.950 173.643 0.307 17919 120796 1 294 . 1 1 66 66 THR CA C 66 62.340 62.340 61.607 0.733 17919 120797 1 294 . 1 1 66 66 THR CB C 66 70.080 70.080 71.492 -1.412 17919 120798 1 294 . 1 1 66 66 THR H H 66 8.730 8.730 8.442 0.288 17919 120799 1 294 . 1 1 67 67 LEU N N 67 127.110 127.110 125.639 1.471 17919 120800 1 294 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.775 0.285 17919 120801 1 294 . 1 1 67 67 LEU C C 67 175.770 175.770 174.531 1.239 17919 120802 1 294 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.833 0.067 17919 120803 1 294 . 1 1 67 67 LEU CB C 67 44.260 44.260 45.406 -1.146 17919 120804 1 294 . 1 1 67 67 LEU H H 67 9.410 9.410 8.644 0.766 17919 120805 1 294 . 1 1 68 68 HIS N N 68 118.380 118.380 122.304 -3.924 17919 120806 1 294 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.458 -0.218 17919 120807 1 294 . 1 1 68 68 HIS C C 68 173.150 173.150 173.486 -0.336 17919 120808 1 294 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.540 0.460 17919 120809 1 294 . 1 1 68 68 HIS CB C 68 30.530 30.530 33.399 -2.869 17919 120810 1 294 . 1 1 68 68 HIS H H 68 9.230 9.230 9.087 0.143 17919 120811 1 294 . 1 1 69 69 LEU N N 69 124.460 124.460 127.826 -3.366 17919 120812 1 294 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.979 0.211 17919 120813 1 294 . 1 1 69 69 LEU C C 69 175.270 175.270 174.153 1.117 17919 120814 1 294 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.564 0.326 17919 120815 1 294 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.458 -0.078 17919 120816 1 294 . 1 1 69 69 LEU H H 69 8.340 8.340 8.377 -0.037 17919 120817 1 294 . 1 1 70 70 VAL N N 70 126.940 126.940 125.736 1.204 17919 120818 1 294 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.488 -0.138 17919 120819 1 294 . 1 1 70 70 VAL C C 70 174.000 174.000 174.435 -0.435 17919 120820 1 294 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.388 0.412 17919 120821 1 294 . 1 1 70 70 VAL CB C 70 34.910 34.910 36.168 -1.258 17919 120822 1 294 . 1 1 70 70 VAL H H 70 9.200 9.200 9.120 0.080 17919 120823 1 294 . 1 1 71 71 LEU N N 71 123.130 123.130 123.799 -0.669 17919 120824 1 294 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.172 -0.112 17919 120825 1 294 . 1 1 71 71 LEU C C 71 177.830 177.830 177.286 0.544 17919 120826 1 294 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.503 0.437 17919 120827 1 294 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.438 -0.588 17919 120828 1 294 . 1 1 71 71 LEU H H 71 8.120 8.120 8.453 -0.333 17919 120829 1 294 . 1 1 72 72 ARG N N 72 123.490 123.490 123.004 0.486 17919 120830 1 294 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.183 0.118 17919 120831 1 294 . 1 1 72 72 ARG C C 72 175.350 175.350 175.689 -0.339 17919 120832 1 294 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.867 -1.257 17919 120833 1 294 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.305 1.044 17919 120834 1 294 . 1 1 72 72 ARG H H 72 8.580 8.580 8.440 0.140 17919 120835 1 295 . 1 1 2 2 GLN N N 2 123.220 123.220 124.379 -1.159 17919 120836 1 295 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.284 -0.035 17919 120837 1 295 . 1 1 2 2 GLN C C 2 175.920 175.920 174.399 1.521 17919 120838 1 295 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.457 0.623 17919 120839 1 295 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.968 -0.208 17919 120840 1 295 . 1 1 2 2 GLN H H 2 8.900 8.900 8.450 0.450 17919 120841 1 295 . 1 1 3 3 ILE N N 3 115.340 115.340 119.428 -4.088 17919 120842 1 295 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.383 -0.170 17919 120843 1 295 . 1 1 3 3 ILE C C 3 172.450 172.450 173.136 -0.686 17919 120844 1 295 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.075 0.495 17919 120845 1 295 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.456 0.754 17919 120846 1 295 . 1 1 3 3 ILE H H 3 8.320 8.320 8.089 0.231 17919 120847 1 295 . 1 1 4 4 PHE N N 4 118.110 118.110 120.428 -2.318 17919 120848 1 295 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.326 0.304 17919 120849 1 295 . 1 1 4 4 PHE C C 4 175.320 175.320 175.493 -0.173 17919 120850 1 295 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.319 -0.109 17919 120851 1 295 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.538 -0.058 17919 120852 1 295 . 1 1 4 4 PHE H H 4 8.610 8.610 8.595 0.015 17919 120853 1 295 . 1 1 5 5 VAL N N 5 121.000 121.000 121.914 -0.914 17919 120854 1 295 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.733 -0.008 17919 120855 1 295 . 1 1 5 5 VAL C C 5 174.870 174.870 174.576 0.294 17919 120856 1 295 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.285 -0.665 17919 120857 1 295 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.857 0.373 17919 120858 1 295 . 1 1 5 5 VAL H H 5 9.300 9.300 9.308 -0.008 17919 120859 1 295 . 1 1 6 6 LYS N N 6 127.520 127.520 128.831 -1.311 17919 120860 1 295 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.324 0.043 17919 120861 1 295 . 1 1 6 6 LYS C C 6 177.140 177.140 176.343 0.797 17919 120862 1 295 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.219 0.300 17919 120863 1 295 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.774 -0.724 17919 120864 1 295 . 1 1 6 6 LYS H H 6 8.820 8.820 9.262 -0.442 17919 120865 1 295 . 1 1 7 7 THR N N 7 115.400 115.400 117.637 -2.237 17919 120866 1 295 . 1 1 7 7 THR HA H 7 4.970 4.970 4.578 0.392 17919 120867 1 295 . 1 1 7 7 THR C C 7 176.910 176.910 176.319 0.591 17919 120868 1 295 . 1 1 7 7 THR CA C 7 60.470 60.470 61.525 -1.055 17919 120869 1 295 . 1 1 7 7 THR CB C 7 70.630 70.630 70.327 0.303 17919 120870 1 295 . 1 1 7 7 THR H H 7 8.730 8.730 8.835 -0.105 17919 120871 1 295 . 1 1 8 8 LEU N N 8 121.330 121.330 122.961 -1.631 17919 120872 1 295 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.323 -0.013 17919 120873 1 295 . 1 1 8 8 LEU C C 8 178.800 178.800 177.643 1.157 17919 120874 1 295 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.379 0.201 17919 120875 1 295 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.814 0.156 17919 120876 1 295 . 1 1 8 8 LEU H H 8 9.100 9.100 8.852 0.248 17919 120877 1 295 . 1 1 9 9 THR N N 9 105.590 105.590 109.370 -3.780 17919 120878 1 295 . 1 1 9 9 THR HA H 9 4.428 4.428 4.355 0.073 17919 120879 1 295 . 1 1 9 9 THR C C 9 175.520 175.520 175.362 0.158 17919 120880 1 295 . 1 1 9 9 THR CA C 9 61.400 61.400 61.543 -0.143 17919 120881 1 295 . 1 1 9 9 THR CB C 9 69.140 69.140 69.055 0.085 17919 120882 1 295 . 1 1 9 9 THR H H 9 7.630 7.630 7.482 0.148 17919 120883 1 295 . 1 1 10 10 GLY N N 10 108.890 108.890 110.723 -1.833 17919 120884 1 295 . 1 1 10 10 GLY C C 10 174.070 174.070 174.106 -0.036 17919 120885 1 295 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.491 -0.031 17919 120886 1 295 . 1 1 10 10 GLY H H 10 7.810 7.810 8.009 -0.199 17919 120887 1 295 . 1 1 11 11 LYS N N 11 121.600 121.600 120.343 1.257 17919 120888 1 295 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.448 -0.087 17919 120889 1 295 . 1 1 11 11 LYS C C 11 175.940 175.940 175.248 0.692 17919 120890 1 295 . 1 1 11 11 LYS CA C 11 56.280 56.280 55.484 0.796 17919 120891 1 295 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.619 -0.419 17919 120892 1 295 . 1 1 11 11 LYS H H 11 7.280 7.280 7.918 -0.638 17919 120893 1 295 . 1 1 12 12 THR N N 12 120.440 120.440 118.904 1.536 17919 120894 1 295 . 1 1 12 12 THR HA H 12 5.046 5.046 5.062 -0.016 17919 120895 1 295 . 1 1 12 12 THR C C 12 174.320 174.320 174.334 -0.014 17919 120896 1 295 . 1 1 12 12 THR CA C 12 62.390 62.390 61.342 1.048 17919 120897 1 295 . 1 1 12 12 THR CB C 12 69.910 69.910 69.790 0.120 17919 120898 1 295 . 1 1 12 12 THR H H 12 8.650 8.650 8.272 0.378 17919 120899 1 295 . 1 1 13 13 ILE N N 13 127.110 127.110 124.860 2.250 17919 120900 1 295 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.653 -0.109 17919 120901 1 295 . 1 1 13 13 ILE C C 13 175.220 175.220 175.047 0.173 17919 120902 1 295 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.198 0.782 17919 120903 1 295 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.419 0.531 17919 120904 1 295 . 1 1 13 13 ILE H H 13 9.450 9.450 9.181 0.269 17919 120905 1 295 . 1 1 14 14 THR N N 14 121.520 121.520 121.003 0.517 17919 120906 1 295 . 1 1 14 14 THR HA H 14 4.964 4.964 5.005 -0.041 17919 120907 1 295 . 1 1 14 14 THR C C 14 173.790 173.790 173.645 0.145 17919 120908 1 295 . 1 1 14 14 THR CA C 14 61.940 61.940 61.951 -0.011 17919 120909 1 295 . 1 1 14 14 THR CB C 14 69.650 69.650 69.908 -0.258 17919 120910 1 295 . 1 1 14 14 THR H H 14 8.710 8.710 8.531 0.179 17919 120911 1 295 . 1 1 15 15 LEU N N 15 124.800 124.800 127.932 -3.132 17919 120912 1 295 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.698 0.082 17919 120913 1 295 . 1 1 15 15 LEU C C 15 174.670 174.670 175.106 -0.436 17919 120914 1 295 . 1 1 15 15 LEU CA C 15 52.830 52.830 54.391 -1.561 17919 120915 1 295 . 1 1 15 15 LEU CB C 15 47.070 47.070 46.493 0.577 17919 120916 1 295 . 1 1 15 15 LEU H H 15 8.710 8.710 8.578 0.132 17919 120917 1 295 . 1 1 16 16 GLU N N 16 122.160 122.160 124.357 -2.197 17919 120918 1 295 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.382 -0.465 17919 120919 1 295 . 1 1 16 16 GLU C C 16 175.860 175.860 176.228 -0.368 17919 120920 1 295 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.176 -0.356 17919 120921 1 295 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.091 -0.641 17919 120922 1 295 . 1 1 16 16 GLU H H 16 8.140 8.140 8.514 -0.374 17919 120923 1 295 . 1 1 17 17 VAL N N 17 117.210 117.210 118.573 -1.363 17919 120924 1 295 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.748 -0.034 17919 120925 1 295 . 1 1 17 17 VAL C C 17 174.160 174.160 174.504 -0.344 17919 120926 1 295 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.922 -0.492 17919 120927 1 295 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.189 1.211 17919 120928 1 295 . 1 1 17 17 VAL H H 17 8.900 8.900 8.535 0.365 17919 120929 1 295 . 1 1 18 18 GLU N N 18 118.990 118.990 120.713 -1.723 17919 120930 1 295 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.837 0.242 17919 120931 1 295 . 1 1 18 18 GLU C C 18 176.160 176.160 175.218 0.942 17919 120932 1 295 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.841 -0.121 17919 120933 1 295 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.628 -0.318 17919 120934 1 295 . 1 1 18 18 GLU H H 18 8.640 8.640 9.068 -0.428 17919 120935 1 295 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.290 -0.149 17919 120936 1 295 . 1 1 19 19 PRO C C 19 175.310 175.310 177.399 -2.089 17919 120937 1 295 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.347 0.123 17919 120938 1 295 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.841 0.109 17919 120939 1 295 . 1 1 20 20 SER N N 20 103.400 103.400 109.891 -6.491 17919 120940 1 295 . 1 1 20 20 SER HA H 20 4.370 4.370 4.341 0.029 17919 120941 1 295 . 1 1 20 20 SER C C 20 174.660 174.660 174.585 0.075 17919 120942 1 295 . 1 1 20 20 SER CA C 20 57.400 57.400 58.975 -1.575 17919 120943 1 295 . 1 1 20 20 SER CB C 20 63.370 63.370 62.607 0.763 17919 120944 1 295 . 1 1 20 20 SER H H 20 7.040 7.040 8.097 -1.057 17919 120945 1 295 . 1 1 21 21 ASP N N 21 123.480 123.480 124.710 -1.230 17919 120946 1 295 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.735 -0.040 17919 120947 1 295 . 1 1 21 21 ASP C C 21 176.360 176.360 175.657 0.703 17919 120948 1 295 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.666 1.034 17919 120949 1 295 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.355 -0.555 17919 120950 1 295 . 1 1 21 21 ASP H H 21 8.030 8.030 8.038 -0.008 17919 120951 1 295 . 1 1 22 22 THR N N 22 108.800 108.800 113.395 -4.595 17919 120952 1 295 . 1 1 22 22 THR HA H 22 4.920 4.920 4.755 0.165 17919 120953 1 295 . 1 1 22 22 THR C C 22 176.750 176.750 176.572 0.178 17919 120954 1 295 . 1 1 22 22 THR CA C 22 59.690 59.690 62.394 -2.704 17919 120955 1 295 . 1 1 22 22 THR CB C 22 71.200 71.200 70.668 0.532 17919 120956 1 295 . 1 1 22 22 THR H H 22 7.900 7.900 8.268 -0.368 17919 120957 1 295 . 1 1 23 23 ILE N N 23 121.190 121.190 123.370 -2.180 17919 120958 1 295 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.773 -0.116 17919 120959 1 295 . 1 1 23 23 ILE C C 23 179.040 179.040 177.751 1.289 17919 120960 1 295 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.218 -0.958 17919 120961 1 295 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.268 -1.918 17919 120962 1 295 . 1 1 23 23 ILE H H 23 8.560 8.560 8.396 0.164 17919 120963 1 295 . 1 1 24 24 GLU N N 24 120.830 120.830 120.638 0.192 17919 120964 1 295 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.868 0.049 17919 120965 1 295 . 1 1 24 24 GLU C C 24 178.640 178.640 178.285 0.355 17919 120966 1 295 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.219 0.001 17919 120967 1 295 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.452 -1.172 17919 120968 1 295 . 1 1 24 24 GLU H H 24 9.760 9.760 7.941 1.819 17919 120969 1 295 . 1 1 25 25 ASN N N 25 120.570 120.570 118.196 2.374 17919 120970 1 295 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.418 0.107 17919 120971 1 295 . 1 1 25 25 ASN C C 25 178.380 178.380 177.893 0.487 17919 120972 1 295 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.442 -0.382 17919 120973 1 295 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.665 -0.215 17919 120974 1 295 . 1 1 25 25 ASN H H 25 7.920 7.920 7.653 0.267 17919 120975 1 295 . 1 1 26 26 VAL N N 26 121.710 121.710 120.072 1.638 17919 120976 1 295 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.575 -0.178 17919 120977 1 295 . 1 1 26 26 VAL C C 26 177.950 177.950 177.884 0.066 17919 120978 1 295 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.568 1.092 17919 120979 1 295 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.327 -0.487 17919 120980 1 295 . 1 1 26 26 VAL H H 26 8.070 8.070 8.070 -0.000 17919 120981 1 295 . 1 1 27 27 LYS N N 27 118.860 118.860 120.243 -1.383 17919 120982 1 295 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.087 0.493 17919 120983 1 295 . 1 1 27 27 LYS C C 27 180.550 180.550 179.311 1.239 17919 120984 1 295 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.633 -0.383 17919 120985 1 295 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.214 1.516 17919 120986 1 295 . 1 1 27 27 LYS H H 27 8.560 8.560 8.230 0.330 17919 120987 1 295 . 1 1 28 28 ALA N N 28 123.440 123.440 121.695 1.745 17919 120988 1 295 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.050 0.110 17919 120989 1 295 . 1 1 28 28 ALA C C 28 180.300 180.300 179.546 0.754 17919 120990 1 295 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.135 0.235 17919 120991 1 295 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.309 -0.599 17919 120992 1 295 . 1 1 28 28 ALA H H 28 8.060 8.060 8.425 -0.365 17919 120993 1 295 . 1 1 29 29 LYS N N 29 119.940 119.940 118.924 1.016 17919 120994 1 295 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.031 0.176 17919 120995 1 295 . 1 1 29 29 LYS C C 29 180.320 180.320 179.369 0.951 17919 120996 1 295 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.291 0.359 17919 120997 1 295 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.364 0.926 17919 120998 1 295 . 1 1 29 29 LYS H H 29 7.850 7.850 7.604 0.246 17919 120999 1 295 . 1 1 30 30 ILE N N 30 121.080 121.080 120.464 0.616 17919 121000 1 295 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.652 -0.145 17919 121001 1 295 . 1 1 30 30 ILE C C 30 178.310 178.310 177.334 0.976 17919 121002 1 295 . 1 1 30 30 ILE CA C 30 66.150 66.150 64.913 1.237 17919 121003 1 295 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.746 -0.946 17919 121004 1 295 . 1 1 30 30 ILE H H 30 8.280 8.280 7.749 0.531 17919 121005 1 295 . 1 1 31 31 GLN N N 31 123.490 123.490 121.194 2.296 17919 121006 1 295 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.079 -0.250 17919 121007 1 295 . 1 1 31 31 GLN C C 31 178.890 178.890 178.132 0.758 17919 121008 1 295 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.202 0.798 17919 121009 1 295 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.693 -0.973 17919 121010 1 295 . 1 1 31 31 GLN H H 31 8.580 8.580 8.160 0.420 17919 121011 1 295 . 1 1 32 32 ASP N N 32 119.360 119.360 117.801 1.559 17919 121012 1 295 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.455 -0.101 17919 121013 1 295 . 1 1 32 32 ASP C C 32 177.250 177.250 177.704 -0.454 17919 121014 1 295 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.376 0.814 17919 121015 1 295 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.880 -0.299 17919 121016 1 295 . 1 1 32 32 ASP H H 32 8.010 8.010 8.026 -0.016 17919 121017 1 295 . 1 1 33 33 LYS N N 33 115.130 115.130 118.522 -3.392 17919 121018 1 295 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.283 0.054 17919 121019 1 295 . 1 1 33 33 LYS C C 33 177.870 177.870 178.022 -0.152 17919 121020 1 295 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.271 -0.221 17919 121021 1 295 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.782 0.388 17919 121022 1 295 . 1 1 33 33 LYS H H 33 7.430 7.430 7.409 0.021 17919 121023 1 295 . 1 1 34 34 GLU N N 34 113.870 113.870 114.807 -0.937 17919 121024 1 295 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.491 0.134 17919 121025 1 295 . 1 1 34 34 GLU C C 34 177.840 177.840 176.695 1.145 17919 121026 1 295 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.766 -0.596 17919 121027 1 295 . 1 1 34 34 GLU CB C 34 32.660 32.660 30.920 1.740 17919 121028 1 295 . 1 1 34 34 GLU H H 34 8.740 8.740 8.096 0.644 17919 121029 1 295 . 1 1 35 35 GLY N N 35 108.650 108.650 109.649 -0.999 17919 121030 1 295 . 1 1 35 35 GLY C C 35 173.960 173.960 174.140 -0.180 17919 121031 1 295 . 1 1 35 35 GLY CA C 35 46.080 46.080 46.195 -0.115 17919 121032 1 295 . 1 1 35 35 GLY H H 35 8.530 8.530 8.317 0.213 17919 121033 1 295 . 1 1 36 36 ILE N N 36 119.880 119.880 121.113 -1.233 17919 121034 1 295 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.268 0.177 17919 121035 1 295 . 1 1 36 36 ILE C C 36 173.590 173.590 174.330 -0.740 17919 121036 1 295 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.927 -0.177 17919 121037 1 295 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.544 2.037 17919 121038 1 295 . 1 1 36 36 ILE H H 36 6.150 6.150 7.525 -1.375 17919 121039 1 295 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.713 -0.079 17919 121040 1 295 . 1 1 37 37 PRO C C 37 176.940 176.940 175.934 1.006 17919 121041 1 295 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.171 0.489 17919 121042 1 295 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.074 0.776 17919 121043 1 295 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.178 -0.061 17919 121044 1 295 . 1 1 38 38 PRO C C 38 178.320 178.320 178.519 -0.199 17919 121045 1 295 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.722 0.538 17919 121046 1 295 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.954 0.936 17919 121047 1 295 . 1 1 39 39 ASP N N 39 113.380 113.380 116.163 -2.783 17919 121048 1 295 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.332 0.098 17919 121049 1 295 . 1 1 39 39 ASP C C 39 177.090 177.090 178.296 -1.206 17919 121050 1 295 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.974 -1.333 17919 121051 1 295 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.697 -1.157 17919 121052 1 295 . 1 1 39 39 ASP H H 39 8.550 8.550 8.686 -0.136 17919 121053 1 295 . 1 1 40 40 GLN N N 40 116.780 116.780 117.793 -1.013 17919 121054 1 295 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.242 0.222 17919 121055 1 295 . 1 1 40 40 GLN C C 40 175.380 175.380 176.938 -1.558 17919 121056 1 295 . 1 1 40 40 GLN CA C 40 55.640 55.640 57.159 -1.519 17919 121057 1 295 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.817 0.323 17919 121058 1 295 . 1 1 40 40 GLN H H 40 7.820 7.820 8.054 -0.234 17919 121059 1 295 . 1 1 41 41 GLN N N 41 117.720 117.720 119.697 -1.977 17919 121060 1 295 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.079 0.165 17919 121061 1 295 . 1 1 41 41 GLN C C 41 176.300 176.300 175.347 0.953 17919 121062 1 295 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.986 -0.516 17919 121063 1 295 . 1 1 41 41 GLN CB C 41 31.650 31.650 28.389 3.261 17919 121064 1 295 . 1 1 41 41 GLN H H 41 7.480 7.480 7.448 0.032 17919 121065 1 295 . 1 1 42 42 ARG N N 42 122.680 122.680 126.602 -3.922 17919 121066 1 295 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.627 -0.127 17919 121067 1 295 . 1 1 42 42 ARG C C 42 174.050 174.050 174.054 -0.004 17919 121068 1 295 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.111 -0.061 17919 121069 1 295 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.031 -0.281 17919 121070 1 295 . 1 1 42 42 ARG H H 42 8.530 8.530 8.362 0.168 17919 121071 1 295 . 1 1 43 43 LEU N N 43 124.040 124.040 128.444 -4.404 17919 121072 1 295 . 1 1 43 43 LEU C C 43 175.290 175.290 175.776 -0.486 17919 121073 1 295 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.590 -0.610 17919 121074 1 295 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.846 1.944 17919 121075 1 295 . 1 1 43 43 LEU H H 43 8.820 8.820 8.873 -0.053 17919 121076 1 295 . 1 1 44 44 ILE N N 44 121.920 121.920 118.950 2.970 17919 121077 1 295 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.236 -0.244 17919 121078 1 295 . 1 1 44 44 ILE C C 44 176.060 176.060 173.631 2.429 17919 121079 1 295 . 1 1 44 44 ILE CA C 44 58.980 58.980 58.651 0.329 17919 121080 1 295 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.519 -0.099 17919 121081 1 295 . 1 1 44 44 ILE H H 44 9.030 9.030 9.092 -0.062 17919 121082 1 295 . 1 1 45 45 PHE N N 45 125.390 125.390 126.530 -1.140 17919 121083 1 295 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.034 0.011 17919 121084 1 295 . 1 1 45 45 PHE C C 45 174.470 174.470 174.593 -0.123 17919 121085 1 295 . 1 1 45 45 PHE CA C 45 57.020 57.020 57.456 -0.436 17919 121086 1 295 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.925 0.835 17919 121087 1 295 . 1 1 45 45 PHE H H 45 8.830 8.830 8.658 0.172 17919 121088 1 295 . 1 1 46 46 ALA N N 46 132.200 132.200 127.730 4.470 17919 121089 1 295 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.476 0.214 17919 121090 1 295 . 1 1 46 46 ALA C C 46 177.290 177.290 177.760 -0.470 17919 121091 1 295 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.786 -0.246 17919 121092 1 295 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.785 -0.215 17919 121093 1 295 . 1 1 46 46 ALA H H 46 8.810 8.810 8.324 0.486 17919 121094 1 295 . 1 1 47 47 GLY N N 47 102.340 102.340 103.770 -1.430 17919 121095 1 295 . 1 1 47 47 GLY C C 47 173.810 173.810 173.884 -0.074 17919 121096 1 295 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.613 0.737 17919 121097 1 295 . 1 1 47 47 GLY H H 47 8.130 8.130 8.230 -0.100 17919 121098 1 295 . 1 1 48 48 LYS N N 48 121.570 121.570 121.222 0.348 17919 121099 1 295 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.629 -0.007 17919 121100 1 295 . 1 1 48 48 LYS C C 48 174.700 174.700 175.082 -0.382 17919 121101 1 295 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.001 -0.451 17919 121102 1 295 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.861 -0.331 17919 121103 1 295 . 1 1 48 48 LYS H H 48 7.980 7.980 7.899 0.081 17919 121104 1 295 . 1 1 49 49 GLN N N 49 122.410 122.410 126.185 -3.775 17919 121105 1 295 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.745 -0.185 17919 121106 1 295 . 1 1 49 49 GLN C C 49 175.670 175.670 175.662 0.008 17919 121107 1 295 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.968 -0.228 17919 121108 1 295 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.537 -0.537 17919 121109 1 295 . 1 1 49 49 GLN H H 49 8.600 8.600 8.622 -0.022 17919 121110 1 295 . 1 1 50 50 LEU N N 50 125.520 125.520 129.439 -3.919 17919 121111 1 295 . 1 1 50 50 LEU HA H 50 4.090 4.090 3.974 0.116 17919 121112 1 295 . 1 1 50 50 LEU C C 50 176.660 176.660 175.990 0.670 17919 121113 1 295 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.349 -0.109 17919 121114 1 295 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.669 -0.099 17919 121115 1 295 . 1 1 50 50 LEU H H 50 8.530 8.530 8.311 0.219 17919 121116 1 295 . 1 1 51 51 GLU N N 51 122.940 122.940 122.439 0.501 17919 121117 1 295 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.596 -0.108 17919 121118 1 295 . 1 1 51 51 GLU C C 51 175.870 175.870 176.775 -0.905 17919 121119 1 295 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.070 0.890 17919 121120 1 295 . 1 1 51 51 GLU CB C 51 31.570 31.570 33.210 -1.640 17919 121121 1 295 . 1 1 51 51 GLU H H 51 8.400 8.400 8.028 0.372 17919 121122 1 295 . 1 1 52 52 ASP N N 52 120.030 120.030 121.784 -1.754 17919 121123 1 295 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.560 -0.201 17919 121124 1 295 . 1 1 52 52 ASP C C 52 177.330 177.330 177.765 -0.435 17919 121125 1 295 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.058 -0.098 17919 121126 1 295 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.792 0.058 17919 121127 1 295 . 1 1 52 52 ASP H H 52 8.160 8.160 8.818 -0.658 17919 121128 1 295 . 1 1 53 53 GLY N N 53 106.660 106.660 105.106 1.554 17919 121129 1 295 . 1 1 53 53 GLY C C 53 174.870 174.870 174.736 0.134 17919 121130 1 295 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.441 0.729 17919 121131 1 295 . 1 1 53 53 GLY H H 53 9.390 9.390 8.224 1.166 17919 121132 1 295 . 1 1 54 54 ARG N N 54 119.050 119.050 119.596 -0.546 17919 121133 1 295 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.661 0.034 17919 121134 1 295 . 1 1 54 54 ARG C C 54 175.350 175.350 175.573 -0.223 17919 121135 1 295 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.905 -0.515 17919 121136 1 295 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.412 0.238 17919 121137 1 295 . 1 1 54 54 ARG H H 54 7.460 7.460 7.342 0.118 17919 121138 1 295 . 1 1 55 55 THR N N 55 108.400 108.400 110.204 -1.804 17919 121139 1 295 . 1 1 55 55 THR HA H 55 5.240 5.240 5.159 0.081 17919 121140 1 295 . 1 1 55 55 THR C C 55 176.560 176.560 175.903 0.657 17919 121141 1 295 . 1 1 55 55 THR CA C 55 59.690 59.690 59.420 0.270 17919 121142 1 295 . 1 1 55 55 THR CB C 55 72.260 72.260 72.106 0.154 17919 121143 1 295 . 1 1 55 55 THR H H 55 8.730 8.730 9.209 -0.479 17919 121144 1 295 . 1 1 56 56 LEU N N 56 117.920 117.920 120.809 -2.889 17919 121145 1 295 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.161 -0.101 17919 121146 1 295 . 1 1 56 56 LEU C C 56 180.810 180.810 178.692 2.118 17919 121147 1 295 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.054 0.656 17919 121148 1 295 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.874 -1.504 17919 121149 1 295 . 1 1 56 56 LEU H H 56 8.140 8.140 8.916 -0.776 17919 121150 1 295 . 1 1 57 57 SER N N 57 113.330 113.330 114.491 -1.161 17919 121151 1 295 . 1 1 57 57 SER HA H 57 4.370 4.370 4.313 0.057 17919 121152 1 295 . 1 1 57 57 SER C C 57 178.310 178.310 176.976 1.334 17919 121153 1 295 . 1 1 57 57 SER CA C 57 61.080 61.080 60.862 0.218 17919 121154 1 295 . 1 1 57 57 SER CB C 57 62.530 62.530 62.347 0.183 17919 121155 1 295 . 1 1 57 57 SER H H 57 8.470 8.470 8.366 0.104 17919 121156 1 295 . 1 1 58 58 ASP N N 58 124.190 124.190 124.302 -0.112 17919 121157 1 295 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.330 -0.034 17919 121158 1 295 . 1 1 58 58 ASP C C 58 177.400 177.400 177.338 0.062 17919 121159 1 295 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.601 0.579 17919 121160 1 295 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.171 -0.071 17919 121161 1 295 . 1 1 58 58 ASP H H 58 7.930 7.930 7.646 0.284 17919 121162 1 295 . 1 1 59 59 TYR N N 59 115.510 115.510 116.238 -0.728 17919 121163 1 295 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.493 0.177 17919 121164 1 295 . 1 1 59 59 TYR C C 59 174.700 174.700 174.705 -0.005 17919 121165 1 295 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.937 0.313 17919 121166 1 295 . 1 1 59 59 TYR CB C 59 40.070 40.070 37.731 2.339 17919 121167 1 295 . 1 1 59 59 TYR H H 59 7.250 7.250 7.344 -0.094 17919 121168 1 295 . 1 1 60 60 ASN N N 60 115.900 115.900 115.287 0.613 17919 121169 1 295 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.369 -0.014 17919 121170 1 295 . 1 1 60 60 ASN C C 60 174.340 174.340 174.723 -0.383 17919 121171 1 295 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.202 -0.082 17919 121172 1 295 . 1 1 60 60 ASN CB C 60 37.410 37.410 36.620 0.790 17919 121173 1 295 . 1 1 60 60 ASN H H 60 8.150 8.150 7.654 0.495 17919 121174 1 295 . 1 1 61 61 ILE N N 61 118.600 118.600 119.084 -0.484 17919 121175 1 295 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.982 -0.589 17919 121176 1 295 . 1 1 61 61 ILE C C 61 174.610 174.610 175.310 -0.700 17919 121177 1 295 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.670 0.750 17919 121178 1 295 . 1 1 61 61 ILE CB C 61 36.740 36.740 38.562 -1.822 17919 121179 1 295 . 1 1 61 61 ILE H H 61 7.250 7.250 7.683 -0.433 17919 121180 1 295 . 1 1 62 62 GLN N N 62 124.740 124.740 125.446 -0.706 17919 121181 1 295 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.775 -0.269 17919 121182 1 295 . 1 1 62 62 GLN C C 62 175.970 175.970 175.196 0.774 17919 121183 1 295 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.621 0.039 17919 121184 1 295 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.925 -0.275 17919 121185 1 295 . 1 1 62 62 GLN H H 62 7.610 7.610 7.986 -0.376 17919 121186 1 295 . 1 1 63 63 LYS N N 63 120.300 120.300 121.135 -0.835 17919 121187 1 295 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.110 -0.109 17919 121188 1 295 . 1 1 63 63 LYS C C 63 175.810 175.810 177.088 -1.278 17919 121189 1 295 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.582 0.208 17919 121190 1 295 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.261 0.389 17919 121191 1 295 . 1 1 63 63 LYS H H 63 8.490 8.490 8.633 -0.143 17919 121192 1 295 . 1 1 64 64 GLU N N 64 113.950 113.950 118.505 -4.555 17919 121193 1 295 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.371 0.094 17919 121194 1 295 . 1 1 64 64 GLU C C 64 175.250 175.250 175.742 -0.492 17919 121195 1 295 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.834 0.056 17919 121196 1 295 . 1 1 64 64 GLU CB C 64 25.900 25.900 29.116 -3.216 17919 121197 1 295 . 1 1 64 64 GLU H H 64 9.280 9.280 8.827 0.453 17919 121198 1 295 . 1 1 65 65 SER N N 65 114.730 114.730 116.075 -1.345 17919 121199 1 295 . 1 1 65 65 SER HA H 65 4.640 4.640 4.179 0.461 17919 121200 1 295 . 1 1 65 65 SER C C 65 172.160 172.160 173.908 -1.748 17919 121201 1 295 . 1 1 65 65 SER CA C 65 60.890 60.890 60.999 -0.109 17919 121202 1 295 . 1 1 65 65 SER CB C 65 64.910 64.910 63.320 1.590 17919 121203 1 295 . 1 1 65 65 SER H H 65 7.670 7.670 7.508 0.162 17919 121204 1 295 . 1 1 66 66 THR N N 66 117.110 117.110 120.684 -3.574 17919 121205 1 295 . 1 1 66 66 THR HA H 66 5.270 5.270 4.895 0.375 17919 121206 1 295 . 1 1 66 66 THR C C 66 173.950 173.950 174.132 -0.182 17919 121207 1 295 . 1 1 66 66 THR CA C 66 62.340 62.340 61.995 0.346 17919 121208 1 295 . 1 1 66 66 THR CB C 66 70.080 70.080 69.872 0.208 17919 121209 1 295 . 1 1 66 66 THR H H 66 8.730 8.730 8.252 0.478 17919 121210 1 295 . 1 1 67 67 LEU N N 67 127.110 127.110 127.124 -0.014 17919 121211 1 295 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.853 0.207 17919 121212 1 295 . 1 1 67 67 LEU C C 67 175.770 175.770 175.587 0.183 17919 121213 1 295 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.482 0.418 17919 121214 1 295 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.234 0.026 17919 121215 1 295 . 1 1 67 67 LEU H H 67 9.410 9.410 9.047 0.363 17919 121216 1 295 . 1 1 68 68 HIS N N 68 118.380 118.380 119.832 -1.452 17919 121217 1 295 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.551 -0.311 17919 121218 1 295 . 1 1 68 68 HIS C C 68 173.150 173.150 174.163 -1.013 17919 121219 1 295 . 1 1 68 68 HIS CA C 68 55.000 55.000 55.144 -0.144 17919 121220 1 295 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.282 -1.752 17919 121221 1 295 . 1 1 68 68 HIS H H 68 9.230 9.230 9.084 0.146 17919 121222 1 295 . 1 1 69 69 LEU N N 69 124.460 124.460 127.964 -3.504 17919 121223 1 295 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.072 0.118 17919 121224 1 295 . 1 1 69 69 LEU C C 69 175.270 175.270 174.272 0.998 17919 121225 1 295 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.689 0.201 17919 121226 1 295 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.632 -0.252 17919 121227 1 295 . 1 1 69 69 LEU H H 69 8.340 8.340 8.648 -0.308 17919 121228 1 295 . 1 1 70 70 VAL N N 70 126.940 126.940 122.264 4.676 17919 121229 1 295 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.687 -0.337 17919 121230 1 295 . 1 1 70 70 VAL C C 70 174.000 174.000 173.558 0.442 17919 121231 1 295 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.722 1.078 17919 121232 1 295 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.787 -0.877 17919 121233 1 295 . 1 1 70 70 VAL H H 70 9.200 9.200 8.963 0.237 17919 121234 1 295 . 1 1 71 71 LEU N N 71 123.130 123.130 122.555 0.575 17919 121235 1 295 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.969 0.091 17919 121236 1 295 . 1 1 71 71 LEU C C 71 177.830 177.830 177.609 0.221 17919 121237 1 295 . 1 1 71 71 LEU CA C 71 53.940 53.940 52.955 0.985 17919 121238 1 295 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.055 -0.205 17919 121239 1 295 . 1 1 71 71 LEU H H 71 8.120 8.120 8.370 -0.250 17919 121240 1 295 . 1 1 72 72 ARG N N 72 123.490 123.490 121.491 1.999 17919 121241 1 295 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.333 -0.032 17919 121242 1 295 . 1 1 72 72 ARG C C 72 175.350 175.350 176.334 -0.984 17919 121243 1 295 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.316 -0.706 17919 121244 1 295 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.902 0.448 17919 121245 1 295 . 1 1 72 72 ARG H H 72 8.580 8.580 8.416 0.164 17919 121246 1 296 . 1 1 2 2 GLN N N 2 123.220 123.220 120.856 2.364 17919 121247 1 296 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.373 -0.124 17919 121248 1 296 . 1 1 2 2 GLN C C 2 175.920 175.920 176.030 -0.110 17919 121249 1 296 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.789 0.291 17919 121250 1 296 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.019 0.741 17919 121251 1 296 . 1 1 2 2 GLN H H 2 8.900 8.900 8.395 0.505 17919 121252 1 296 . 1 1 3 3 ILE N N 3 115.340 115.340 116.770 -1.430 17919 121253 1 296 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.396 -0.183 17919 121254 1 296 . 1 1 3 3 ILE C C 3 172.450 172.450 173.428 -0.978 17919 121255 1 296 . 1 1 3 3 ILE CA C 3 59.570 59.570 58.918 0.652 17919 121256 1 296 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.656 0.554 17919 121257 1 296 . 1 1 3 3 ILE H H 3 8.320 8.320 8.273 0.047 17919 121258 1 296 . 1 1 4 4 PHE N N 4 118.110 118.110 118.118 -0.008 17919 121259 1 296 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.488 0.142 17919 121260 1 296 . 1 1 4 4 PHE C C 4 175.320 175.320 174.754 0.566 17919 121261 1 296 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.540 -0.330 17919 121262 1 296 . 1 1 4 4 PHE CB C 4 41.480 41.480 42.669 -1.189 17919 121263 1 296 . 1 1 4 4 PHE H H 4 8.610 8.610 8.389 0.221 17919 121264 1 296 . 1 1 5 5 VAL N N 5 121.000 121.000 122.007 -1.007 17919 121265 1 296 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.916 -0.191 17919 121266 1 296 . 1 1 5 5 VAL C C 5 174.870 174.870 174.426 0.444 17919 121267 1 296 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.142 -0.522 17919 121268 1 296 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.816 -0.586 17919 121269 1 296 . 1 1 5 5 VAL H H 5 9.300 9.300 9.238 0.062 17919 121270 1 296 . 1 1 6 6 LYS N N 6 127.520 127.520 129.610 -2.090 17919 121271 1 296 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.210 0.157 17919 121272 1 296 . 1 1 6 6 LYS C C 6 177.140 177.140 175.377 1.763 17919 121273 1 296 . 1 1 6 6 LYS CA C 6 54.520 54.520 53.311 1.209 17919 121274 1 296 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.773 0.277 17919 121275 1 296 . 1 1 6 6 LYS H H 6 8.820 8.820 8.965 -0.145 17919 121276 1 296 . 1 1 7 7 THR N N 7 115.400 115.400 118.397 -2.997 17919 121277 1 296 . 1 1 7 7 THR HA H 7 4.970 4.970 4.888 0.082 17919 121278 1 296 . 1 1 7 7 THR C C 7 176.910 176.910 176.080 0.830 17919 121279 1 296 . 1 1 7 7 THR CA C 7 60.470 60.470 60.413 0.057 17919 121280 1 296 . 1 1 7 7 THR CB C 7 70.630 70.630 70.554 0.076 17919 121281 1 296 . 1 1 7 7 THR H H 7 8.730 8.730 8.882 -0.152 17919 121282 1 296 . 1 1 8 8 LEU N N 8 121.330 121.330 124.774 -3.444 17919 121283 1 296 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.358 -0.048 17919 121284 1 296 . 1 1 8 8 LEU C C 8 178.800 178.800 177.790 1.010 17919 121285 1 296 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.398 0.182 17919 121286 1 296 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.328 -0.358 17919 121287 1 296 . 1 1 8 8 LEU H H 8 9.100 9.100 8.727 0.373 17919 121288 1 296 . 1 1 9 9 THR N N 9 105.590 105.590 108.349 -2.759 17919 121289 1 296 . 1 1 9 9 THR HA H 9 4.428 4.428 4.388 0.040 17919 121290 1 296 . 1 1 9 9 THR C C 9 175.520 175.520 175.593 -0.073 17919 121291 1 296 . 1 1 9 9 THR CA C 9 61.400 61.400 61.565 -0.165 17919 121292 1 296 . 1 1 9 9 THR CB C 9 69.140 69.140 69.672 -0.532 17919 121293 1 296 . 1 1 9 9 THR H H 9 7.630 7.630 7.527 0.103 17919 121294 1 296 . 1 1 10 10 GLY N N 10 108.890 108.890 111.137 -2.247 17919 121295 1 296 . 1 1 10 10 GLY C C 10 174.070 174.070 174.030 0.040 17919 121296 1 296 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.885 0.575 17919 121297 1 296 . 1 1 10 10 GLY H H 10 7.810 7.810 8.147 -0.337 17919 121298 1 296 . 1 1 11 11 LYS N N 11 121.600 121.600 122.387 -0.787 17919 121299 1 296 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.335 0.026 17919 121300 1 296 . 1 1 11 11 LYS C C 11 175.940 175.940 175.401 0.539 17919 121301 1 296 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.658 -0.378 17919 121302 1 296 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.395 -0.195 17919 121303 1 296 . 1 1 11 11 LYS H H 11 7.280 7.280 7.859 -0.579 17919 121304 1 296 . 1 1 12 12 THR N N 12 120.440 120.440 120.841 -0.401 17919 121305 1 296 . 1 1 12 12 THR HA H 12 5.046 5.046 4.807 0.239 17919 121306 1 296 . 1 1 12 12 THR C C 12 174.320 174.320 174.142 0.178 17919 121307 1 296 . 1 1 12 12 THR CA C 12 62.390 62.390 61.974 0.416 17919 121308 1 296 . 1 1 12 12 THR CB C 12 69.910 69.910 69.433 0.477 17919 121309 1 296 . 1 1 12 12 THR H H 12 8.650 8.650 8.338 0.312 17919 121310 1 296 . 1 1 13 13 ILE N N 13 127.110 127.110 128.242 -1.132 17919 121311 1 296 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.376 0.168 17919 121312 1 296 . 1 1 13 13 ILE C C 13 175.220 175.220 175.244 -0.024 17919 121313 1 296 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.504 -0.524 17919 121314 1 296 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.211 0.739 17919 121315 1 296 . 1 1 13 13 ILE H H 13 9.450 9.450 8.951 0.499 17919 121316 1 296 . 1 1 14 14 THR N N 14 121.520 121.520 122.640 -1.120 17919 121317 1 296 . 1 1 14 14 THR HA H 14 4.964 4.964 4.961 0.003 17919 121318 1 296 . 1 1 14 14 THR C C 14 173.790 173.790 173.313 0.477 17919 121319 1 296 . 1 1 14 14 THR CA C 14 61.940 61.940 61.932 0.008 17919 121320 1 296 . 1 1 14 14 THR CB C 14 69.650 69.650 69.948 -0.298 17919 121321 1 296 . 1 1 14 14 THR H H 14 8.710 8.710 8.572 0.138 17919 121322 1 296 . 1 1 15 15 LEU N N 15 124.800 124.800 124.254 0.546 17919 121323 1 296 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.793 -0.013 17919 121324 1 296 . 1 1 15 15 LEU C C 15 174.670 174.670 175.355 -0.685 17919 121325 1 296 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.532 -0.702 17919 121326 1 296 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.828 1.242 17919 121327 1 296 . 1 1 15 15 LEU H H 15 8.710 8.710 8.177 0.533 17919 121328 1 296 . 1 1 16 16 GLU N N 16 122.160 122.160 124.843 -2.683 17919 121329 1 296 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.038 -0.121 17919 121330 1 296 . 1 1 16 16 GLU C C 16 175.860 175.860 175.861 -0.001 17919 121331 1 296 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.484 -0.664 17919 121332 1 296 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.893 -1.443 17919 121333 1 296 . 1 1 16 16 GLU H H 16 8.140 8.140 8.694 -0.554 17919 121334 1 296 . 1 1 17 17 VAL N N 17 117.210 117.210 121.034 -3.824 17919 121335 1 296 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.934 -0.220 17919 121336 1 296 . 1 1 17 17 VAL C C 17 174.160 174.160 174.885 -0.725 17919 121337 1 296 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.651 -0.221 17919 121338 1 296 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.344 1.056 17919 121339 1 296 . 1 1 17 17 VAL H H 17 8.900 8.900 8.852 0.048 17919 121340 1 296 . 1 1 18 18 GLU N N 18 118.990 118.990 120.572 -1.582 17919 121341 1 296 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.794 0.285 17919 121342 1 296 . 1 1 18 18 GLU C C 18 176.160 176.160 175.568 0.592 17919 121343 1 296 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.685 0.035 17919 121344 1 296 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.308 0.002 17919 121345 1 296 . 1 1 18 18 GLU H H 18 8.640 8.640 8.699 -0.059 17919 121346 1 296 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.345 -0.204 17919 121347 1 296 . 1 1 19 19 PRO C C 19 175.310 175.310 176.922 -1.612 17919 121348 1 296 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.189 0.281 17919 121349 1 296 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.040 -0.090 17919 121350 1 296 . 1 1 20 20 SER N N 20 103.400 103.400 109.788 -6.388 17919 121351 1 296 . 1 1 20 20 SER HA H 20 4.370 4.370 4.395 -0.025 17919 121352 1 296 . 1 1 20 20 SER C C 20 174.660 174.660 174.385 0.275 17919 121353 1 296 . 1 1 20 20 SER CA C 20 57.400 57.400 57.621 -0.221 17919 121354 1 296 . 1 1 20 20 SER CB C 20 63.370 63.370 62.720 0.650 17919 121355 1 296 . 1 1 20 20 SER H H 20 7.040 7.040 8.165 -1.125 17919 121356 1 296 . 1 1 21 21 ASP N N 21 123.480 123.480 124.887 -1.407 17919 121357 1 296 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.707 -0.012 17919 121358 1 296 . 1 1 21 21 ASP C C 21 176.360 176.360 175.583 0.777 17919 121359 1 296 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.080 0.620 17919 121360 1 296 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.465 -0.665 17919 121361 1 296 . 1 1 21 21 ASP H H 21 8.030 8.030 7.754 0.276 17919 121362 1 296 . 1 1 22 22 THR N N 22 108.800 108.800 113.141 -4.341 17919 121363 1 296 . 1 1 22 22 THR HA H 22 4.920 4.920 4.917 0.003 17919 121364 1 296 . 1 1 22 22 THR C C 22 176.750 176.750 176.353 0.397 17919 121365 1 296 . 1 1 22 22 THR CA C 22 59.690 59.690 60.673 -0.983 17919 121366 1 296 . 1 1 22 22 THR CB C 22 71.200 71.200 71.141 0.059 17919 121367 1 296 . 1 1 22 22 THR H H 22 7.900 7.900 8.135 -0.235 17919 121368 1 296 . 1 1 23 23 ILE N N 23 121.190 121.190 122.461 -1.271 17919 121369 1 296 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.805 -0.148 17919 121370 1 296 . 1 1 23 23 ILE C C 23 179.040 179.040 177.732 1.308 17919 121371 1 296 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.386 -0.126 17919 121372 1 296 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.149 -1.799 17919 121373 1 296 . 1 1 23 23 ILE H H 23 8.560 8.560 8.711 -0.151 17919 121374 1 296 . 1 1 24 24 GLU N N 24 120.830 120.830 121.751 -0.921 17919 121375 1 296 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.816 0.101 17919 121376 1 296 . 1 1 24 24 GLU C C 24 178.640 178.640 178.262 0.378 17919 121377 1 296 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.327 -0.107 17919 121378 1 296 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.462 -1.182 17919 121379 1 296 . 1 1 24 24 GLU H H 24 9.760 9.760 8.491 1.269 17919 121380 1 296 . 1 1 25 25 ASN N N 25 120.570 120.570 117.842 2.728 17919 121381 1 296 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.457 0.068 17919 121382 1 296 . 1 1 25 25 ASN C C 25 178.380 178.380 177.918 0.462 17919 121383 1 296 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.260 -0.200 17919 121384 1 296 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.765 -0.315 17919 121385 1 296 . 1 1 25 25 ASN H H 25 7.920 7.920 7.839 0.081 17919 121386 1 296 . 1 1 26 26 VAL N N 26 121.710 121.710 120.272 1.438 17919 121387 1 296 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.611 -0.214 17919 121388 1 296 . 1 1 26 26 VAL C C 26 177.950 177.950 177.701 0.249 17919 121389 1 296 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.414 1.246 17919 121390 1 296 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.598 -0.757 17919 121391 1 296 . 1 1 26 26 VAL H H 26 8.070 8.070 8.286 -0.216 17919 121392 1 296 . 1 1 27 27 LYS N N 27 118.860 118.860 120.658 -1.798 17919 121393 1 296 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.135 0.445 17919 121394 1 296 . 1 1 27 27 LYS C C 27 180.550 180.550 179.266 1.284 17919 121395 1 296 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.731 -0.481 17919 121396 1 296 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.245 1.485 17919 121397 1 296 . 1 1 27 27 LYS H H 27 8.560 8.560 8.306 0.254 17919 121398 1 296 . 1 1 28 28 ALA N N 28 123.440 123.440 122.214 1.226 17919 121399 1 296 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.063 0.097 17919 121400 1 296 . 1 1 28 28 ALA C C 28 180.300 180.300 179.226 1.074 17919 121401 1 296 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.124 0.246 17919 121402 1 296 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.376 -0.666 17919 121403 1 296 . 1 1 28 28 ALA H H 28 8.060 8.060 8.243 -0.183 17919 121404 1 296 . 1 1 29 29 LYS N N 29 119.940 119.940 118.447 1.493 17919 121405 1 296 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.031 0.176 17919 121406 1 296 . 1 1 29 29 LYS C C 29 180.320 180.320 179.006 1.314 17919 121407 1 296 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.163 0.487 17919 121408 1 296 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.458 0.832 17919 121409 1 296 . 1 1 29 29 LYS H H 29 7.850 7.850 7.836 0.014 17919 121410 1 296 . 1 1 30 30 ILE N N 30 121.080 121.080 119.624 1.456 17919 121411 1 296 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.650 -0.143 17919 121412 1 296 . 1 1 30 30 ILE C C 30 178.310 178.310 177.241 1.069 17919 121413 1 296 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.022 1.129 17919 121414 1 296 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.982 -1.182 17919 121415 1 296 . 1 1 30 30 ILE H H 30 8.280 8.280 7.998 0.282 17919 121416 1 296 . 1 1 31 31 GLN N N 31 123.490 123.490 120.729 2.761 17919 121417 1 296 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.883 -0.054 17919 121418 1 296 . 1 1 31 31 GLN C C 31 178.890 178.890 178.246 0.644 17919 121419 1 296 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.557 0.443 17919 121420 1 296 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.440 -0.720 17919 121421 1 296 . 1 1 31 31 GLN H H 31 8.580 8.580 7.866 0.714 17919 121422 1 296 . 1 1 32 32 ASP N N 32 119.360 119.360 118.047 1.313 17919 121423 1 296 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.457 -0.103 17919 121424 1 296 . 1 1 32 32 ASP C C 32 177.250 177.250 177.309 -0.059 17919 121425 1 296 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.258 0.932 17919 121426 1 296 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.642 -0.062 17919 121427 1 296 . 1 1 32 32 ASP H H 32 8.010 8.010 8.030 -0.020 17919 121428 1 296 . 1 1 33 33 LYS N N 33 115.130 115.130 117.462 -2.332 17919 121429 1 296 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.447 -0.110 17919 121430 1 296 . 1 1 33 33 LYS C C 33 177.870 177.870 177.635 0.235 17919 121431 1 296 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.807 0.243 17919 121432 1 296 . 1 1 33 33 LYS CB C 33 34.170 34.170 34.465 -0.295 17919 121433 1 296 . 1 1 33 33 LYS H H 33 7.430 7.430 7.472 -0.042 17919 121434 1 296 . 1 1 34 34 GLU N N 34 113.870 113.870 114.948 -1.078 17919 121435 1 296 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.440 0.185 17919 121436 1 296 . 1 1 34 34 GLU C C 34 177.840 177.840 177.547 0.293 17919 121437 1 296 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.899 -0.729 17919 121438 1 296 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.156 1.504 17919 121439 1 296 . 1 1 34 34 GLU H H 34 8.740 8.740 8.269 0.471 17919 121440 1 296 . 1 1 35 35 GLY N N 35 108.650 108.650 109.989 -1.339 17919 121441 1 296 . 1 1 35 35 GLY C C 35 173.960 173.960 174.210 -0.250 17919 121442 1 296 . 1 1 35 35 GLY CA C 35 46.080 46.080 46.070 0.010 17919 121443 1 296 . 1 1 35 35 GLY H H 35 8.530 8.530 8.371 0.159 17919 121444 1 296 . 1 1 36 36 ILE N N 36 119.880 119.880 121.736 -1.856 17919 121445 1 296 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.236 0.209 17919 121446 1 296 . 1 1 36 36 ILE C C 36 173.590 173.590 174.700 -1.110 17919 121447 1 296 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.895 -0.145 17919 121448 1 296 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.582 1.998 17919 121449 1 296 . 1 1 36 36 ILE H H 36 6.150 6.150 7.557 -1.407 17919 121450 1 296 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.559 0.075 17919 121451 1 296 . 1 1 37 37 PRO C C 37 176.940 176.940 176.132 0.808 17919 121452 1 296 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.636 0.024 17919 121453 1 296 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.375 0.475 17919 121454 1 296 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.123 -0.006 17919 121455 1 296 . 1 1 38 38 PRO C C 38 178.320 178.320 178.635 -0.315 17919 121456 1 296 . 1 1 38 38 PRO CA C 38 66.260 66.260 66.074 0.186 17919 121457 1 296 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.831 1.059 17919 121458 1 296 . 1 1 39 39 ASP N N 39 113.380 113.380 114.096 -0.716 17919 121459 1 296 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.413 0.017 17919 121460 1 296 . 1 1 39 39 ASP C C 39 177.090 177.090 177.004 0.086 17919 121461 1 296 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.132 -0.492 17919 121462 1 296 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.196 -0.656 17919 121463 1 296 . 1 1 39 39 ASP H H 39 8.550 8.550 8.565 -0.015 17919 121464 1 296 . 1 1 40 40 GLN N N 40 116.780 116.780 116.164 0.616 17919 121465 1 296 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.313 0.151 17919 121466 1 296 . 1 1 40 40 GLN C C 40 175.380 175.380 175.949 -0.569 17919 121467 1 296 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.566 0.074 17919 121468 1 296 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.164 0.976 17919 121469 1 296 . 1 1 40 40 GLN H H 40 7.820 7.820 7.933 -0.113 17919 121470 1 296 . 1 1 41 41 GLN N N 41 117.720 117.720 119.665 -1.945 17919 121471 1 296 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.570 -0.326 17919 121472 1 296 . 1 1 41 41 GLN C C 41 176.300 176.300 175.279 1.021 17919 121473 1 296 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.965 0.505 17919 121474 1 296 . 1 1 41 41 GLN CB C 41 31.650 31.650 30.200 1.450 17919 121475 1 296 . 1 1 41 41 GLN H H 41 7.480 7.480 7.852 -0.372 17919 121476 1 296 . 1 1 42 42 ARG N N 42 122.680 122.680 122.543 0.137 17919 121477 1 296 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.618 -0.118 17919 121478 1 296 . 1 1 42 42 ARG C C 42 174.050 174.050 174.419 -0.369 17919 121479 1 296 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.141 -0.091 17919 121480 1 296 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.201 -0.451 17919 121481 1 296 . 1 1 42 42 ARG H H 42 8.530 8.530 8.377 0.153 17919 121482 1 296 . 1 1 43 43 LEU N N 43 124.040 124.040 125.946 -1.906 17919 121483 1 296 . 1 1 43 43 LEU C C 43 175.290 175.290 175.860 -0.570 17919 121484 1 296 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.524 -1.544 17919 121485 1 296 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.632 2.158 17919 121486 1 296 . 1 1 43 43 LEU H H 43 8.820 8.820 8.838 -0.018 17919 121487 1 296 . 1 1 44 44 ILE N N 44 121.920 121.920 123.310 -1.390 17919 121488 1 296 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.990 0.002 17919 121489 1 296 . 1 1 44 44 ILE C C 44 176.060 176.060 174.764 1.296 17919 121490 1 296 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.406 -1.426 17919 121491 1 296 . 1 1 44 44 ILE CB C 44 41.420 41.420 39.916 1.504 17919 121492 1 296 . 1 1 44 44 ILE H H 44 9.030 9.030 9.105 -0.075 17919 121493 1 296 . 1 1 45 45 PHE N N 45 125.390 125.390 128.896 -3.506 17919 121494 1 296 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.018 0.027 17919 121495 1 296 . 1 1 45 45 PHE C C 45 174.470 174.470 174.998 -0.528 17919 121496 1 296 . 1 1 45 45 PHE CA C 45 57.020 57.020 55.604 1.416 17919 121497 1 296 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.664 1.096 17919 121498 1 296 . 1 1 45 45 PHE H H 45 8.830 8.830 8.766 0.064 17919 121499 1 296 . 1 1 46 46 ALA N N 46 132.200 132.200 130.229 1.971 17919 121500 1 296 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.760 -0.070 17919 121501 1 296 . 1 1 46 46 ALA C C 46 177.290 177.290 177.484 -0.194 17919 121502 1 296 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.559 -0.019 17919 121503 1 296 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.259 0.311 17919 121504 1 296 . 1 1 46 46 ALA H H 46 8.810 8.810 8.991 -0.181 17919 121505 1 296 . 1 1 47 47 GLY N N 47 102.340 102.340 103.541 -1.201 17919 121506 1 296 . 1 1 47 47 GLY C C 47 173.810 173.810 174.603 -0.793 17919 121507 1 296 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.404 -0.054 17919 121508 1 296 . 1 1 47 47 GLY H H 47 8.130 8.130 8.540 -0.410 17919 121509 1 296 . 1 1 48 48 LYS N N 48 121.570 121.570 121.058 0.512 17919 121510 1 296 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.638 -0.016 17919 121511 1 296 . 1 1 48 48 LYS C C 48 174.700 174.700 175.279 -0.579 17919 121512 1 296 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.250 0.300 17919 121513 1 296 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.178 0.352 17919 121514 1 296 . 1 1 48 48 LYS H H 48 7.980 7.980 7.948 0.032 17919 121515 1 296 . 1 1 49 49 GLN N N 49 122.410 122.410 121.955 0.455 17919 121516 1 296 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.892 -0.332 17919 121517 1 296 . 1 1 49 49 GLN C C 49 175.670 175.670 175.904 -0.234 17919 121518 1 296 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.475 0.265 17919 121519 1 296 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.585 -0.585 17919 121520 1 296 . 1 1 49 49 GLN H H 49 8.600 8.600 8.492 0.108 17919 121521 1 296 . 1 1 50 50 LEU N N 50 125.520 125.520 128.058 -2.538 17919 121522 1 296 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.545 -0.455 17919 121523 1 296 . 1 1 50 50 LEU C C 50 176.660 176.660 176.579 0.081 17919 121524 1 296 . 1 1 50 50 LEU CA C 50 54.240 54.240 53.987 0.253 17919 121525 1 296 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.471 -0.901 17919 121526 1 296 . 1 1 50 50 LEU H H 50 8.530 8.530 8.540 -0.010 17919 121527 1 296 . 1 1 51 51 GLU N N 51 122.940 122.940 122.360 0.580 17919 121528 1 296 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.506 -0.018 17919 121529 1 296 . 1 1 51 51 GLU C C 51 175.870 175.870 176.836 -0.966 17919 121530 1 296 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.695 0.265 17919 121531 1 296 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.462 0.107 17919 121532 1 296 . 1 1 51 51 GLU H H 51 8.400 8.400 8.189 0.211 17919 121533 1 296 . 1 1 52 52 ASP N N 52 120.030 120.030 125.179 -5.149 17919 121534 1 296 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.414 -0.055 17919 121535 1 296 . 1 1 52 52 ASP C C 52 177.330 177.330 177.866 -0.536 17919 121536 1 296 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.626 -0.666 17919 121537 1 296 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.697 0.153 17919 121538 1 296 . 1 1 52 52 ASP H H 52 8.160 8.160 8.792 -0.632 17919 121539 1 296 . 1 1 53 53 GLY N N 53 106.660 106.660 105.409 1.251 17919 121540 1 296 . 1 1 53 53 GLY C C 53 174.870 174.870 174.529 0.341 17919 121541 1 296 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.222 -0.052 17919 121542 1 296 . 1 1 53 53 GLY H H 53 9.390 9.390 8.583 0.807 17919 121543 1 296 . 1 1 54 54 ARG N N 54 119.050 119.050 120.175 -1.125 17919 121544 1 296 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.710 -0.015 17919 121545 1 296 . 1 1 54 54 ARG C C 54 175.350 175.350 175.309 0.041 17919 121546 1 296 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.187 0.203 17919 121547 1 296 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.593 0.057 17919 121548 1 296 . 1 1 54 54 ARG H H 54 7.460 7.460 7.515 -0.055 17919 121549 1 296 . 1 1 55 55 THR N N 55 108.400 108.400 111.595 -3.195 17919 121550 1 296 . 1 1 55 55 THR HA H 55 5.240 5.240 5.143 0.097 17919 121551 1 296 . 1 1 55 55 THR C C 55 176.560 176.560 176.090 0.470 17919 121552 1 296 . 1 1 55 55 THR CA C 55 59.690 59.690 59.514 0.176 17919 121553 1 296 . 1 1 55 55 THR CB C 55 72.260 72.260 71.771 0.489 17919 121554 1 296 . 1 1 55 55 THR H H 55 8.730 8.730 8.841 -0.111 17919 121555 1 296 . 1 1 56 56 LEU N N 56 117.920 117.920 121.323 -3.403 17919 121556 1 296 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.985 0.075 17919 121557 1 296 . 1 1 56 56 LEU C C 56 180.810 180.810 178.955 1.855 17919 121558 1 296 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.575 0.135 17919 121559 1 296 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.404 -1.034 17919 121560 1 296 . 1 1 56 56 LEU H H 56 8.140 8.140 8.942 -0.802 17919 121561 1 296 . 1 1 57 57 SER N N 57 113.330 113.330 113.927 -0.597 17919 121562 1 296 . 1 1 57 57 SER HA H 57 4.370 4.370 4.291 0.079 17919 121563 1 296 . 1 1 57 57 SER C C 57 178.310 178.310 177.063 1.247 17919 121564 1 296 . 1 1 57 57 SER CA C 57 61.080 61.080 61.364 -0.284 17919 121565 1 296 . 1 1 57 57 SER CB C 57 62.530 62.530 62.370 0.160 17919 121566 1 296 . 1 1 57 57 SER H H 57 8.470 8.470 8.111 0.359 17919 121567 1 296 . 1 1 58 58 ASP N N 58 124.190 124.190 123.301 0.889 17919 121568 1 296 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.324 -0.028 17919 121569 1 296 . 1 1 58 58 ASP C C 58 177.400 177.400 177.757 -0.357 17919 121570 1 296 . 1 1 58 58 ASP CA C 58 57.180 57.180 57.128 0.052 17919 121571 1 296 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.364 -0.264 17919 121572 1 296 . 1 1 58 58 ASP H H 58 7.930 7.930 7.919 0.011 17919 121573 1 296 . 1 1 59 59 TYR N N 59 115.510 115.510 115.473 0.037 17919 121574 1 296 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.522 0.148 17919 121575 1 296 . 1 1 59 59 TYR C C 59 174.700 174.700 175.829 -1.129 17919 121576 1 296 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.585 0.665 17919 121577 1 296 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.047 2.023 17919 121578 1 296 . 1 1 59 59 TYR H H 59 7.250 7.250 7.063 0.187 17919 121579 1 296 . 1 1 60 60 ASN N N 60 115.900 115.900 118.636 -2.736 17919 121580 1 296 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.394 -0.039 17919 121581 1 296 . 1 1 60 60 ASN C C 60 174.340 174.340 174.652 -0.312 17919 121582 1 296 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.291 -0.171 17919 121583 1 296 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.154 0.256 17919 121584 1 296 . 1 1 60 60 ASN H H 60 8.150 8.150 8.222 -0.072 17919 121585 1 296 . 1 1 61 61 ILE N N 61 118.600 118.600 119.611 -1.011 17919 121586 1 296 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.911 -0.518 17919 121587 1 296 . 1 1 61 61 ILE C C 61 174.610 174.610 175.209 -0.599 17919 121588 1 296 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.728 0.692 17919 121589 1 296 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.706 -0.966 17919 121590 1 296 . 1 1 61 61 ILE H H 61 7.250 7.250 8.356 -1.106 17919 121591 1 296 . 1 1 62 62 GLN N N 62 124.740 124.740 125.352 -0.612 17919 121592 1 296 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.849 -0.343 17919 121593 1 296 . 1 1 62 62 GLN C C 62 175.970 175.970 175.245 0.725 17919 121594 1 296 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.134 0.526 17919 121595 1 296 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.577 0.073 17919 121596 1 296 . 1 1 62 62 GLN H H 62 7.610 7.610 8.045 -0.435 17919 121597 1 296 . 1 1 63 63 LYS N N 63 120.300 120.300 122.269 -1.969 17919 121598 1 296 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.032 -0.031 17919 121599 1 296 . 1 1 63 63 LYS C C 63 175.810 175.810 176.948 -1.138 17919 121600 1 296 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.160 -0.370 17919 121601 1 296 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.395 0.255 17919 121602 1 296 . 1 1 63 63 LYS H H 63 8.490 8.490 8.556 -0.066 17919 121603 1 296 . 1 1 64 64 GLU N N 64 113.950 113.950 120.081 -6.131 17919 121604 1 296 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.984 -0.519 17919 121605 1 296 . 1 1 64 64 GLU C C 64 175.250 175.250 176.189 -0.939 17919 121606 1 296 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.563 0.327 17919 121607 1 296 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.609 -2.709 17919 121608 1 296 . 1 1 64 64 GLU H H 64 9.280 9.280 8.764 0.516 17919 121609 1 296 . 1 1 65 65 SER N N 65 114.730 114.730 116.793 -2.063 17919 121610 1 296 . 1 1 65 65 SER HA H 65 4.640 4.640 4.509 0.131 17919 121611 1 296 . 1 1 65 65 SER C C 65 172.160 172.160 173.569 -1.409 17919 121612 1 296 . 1 1 65 65 SER CA C 65 60.890 60.890 60.813 0.077 17919 121613 1 296 . 1 1 65 65 SER CB C 65 64.910 64.910 63.863 1.047 17919 121614 1 296 . 1 1 65 65 SER H H 65 7.670 7.670 7.648 0.022 17919 121615 1 296 . 1 1 66 66 THR N N 66 117.110 117.110 120.276 -3.166 17919 121616 1 296 . 1 1 66 66 THR HA H 66 5.270 5.270 5.313 -0.043 17919 121617 1 296 . 1 1 66 66 THR C C 66 173.950 173.950 174.247 -0.297 17919 121618 1 296 . 1 1 66 66 THR CA C 66 62.340 62.340 62.111 0.229 17919 121619 1 296 . 1 1 66 66 THR CB C 66 70.080 70.080 69.828 0.252 17919 121620 1 296 . 1 1 66 66 THR H H 66 8.730 8.730 8.403 0.327 17919 121621 1 296 . 1 1 67 67 LEU N N 67 127.110 127.110 127.955 -0.845 17919 121622 1 296 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.977 0.083 17919 121623 1 296 . 1 1 67 67 LEU C C 67 175.770 175.770 175.661 0.109 17919 121624 1 296 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.995 -0.095 17919 121625 1 296 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.524 -0.264 17919 121626 1 296 . 1 1 67 67 LEU H H 67 9.410 9.410 9.304 0.106 17919 121627 1 296 . 1 1 68 68 HIS N N 68 118.380 118.380 120.251 -1.871 17919 121628 1 296 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.352 -0.112 17919 121629 1 296 . 1 1 68 68 HIS C C 68 173.150 173.150 173.851 -0.701 17919 121630 1 296 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.528 0.472 17919 121631 1 296 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.983 -2.453 17919 121632 1 296 . 1 1 68 68 HIS H H 68 9.230 9.230 8.743 0.487 17919 121633 1 296 . 1 1 69 69 LEU N N 69 124.460 124.460 128.889 -4.429 17919 121634 1 296 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.207 -0.017 17919 121635 1 296 . 1 1 69 69 LEU C C 69 175.270 175.270 174.199 1.071 17919 121636 1 296 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.697 0.193 17919 121637 1 296 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.931 -0.551 17919 121638 1 296 . 1 1 69 69 LEU H H 69 8.340 8.340 8.671 -0.331 17919 121639 1 296 . 1 1 70 70 VAL N N 70 126.940 126.940 125.903 1.037 17919 121640 1 296 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.400 -0.050 17919 121641 1 296 . 1 1 70 70 VAL C C 70 174.000 174.000 174.679 -0.679 17919 121642 1 296 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.782 0.018 17919 121643 1 296 . 1 1 70 70 VAL CB C 70 34.910 34.910 34.905 0.005 17919 121644 1 296 . 1 1 70 70 VAL H H 70 9.200 9.200 8.848 0.352 17919 121645 1 296 . 1 1 71 71 LEU N N 71 123.130 123.130 123.954 -0.824 17919 121646 1 296 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.092 -0.032 17919 121647 1 296 . 1 1 71 71 LEU C C 71 177.830 177.830 177.235 0.595 17919 121648 1 296 . 1 1 71 71 LEU CA C 71 53.940 53.940 52.585 1.355 17919 121649 1 296 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.226 -0.376 17919 121650 1 296 . 1 1 71 71 LEU H H 71 8.120 8.120 8.340 -0.220 17919 121651 1 296 . 1 1 72 72 ARG N N 72 123.490 123.490 122.781 0.709 17919 121652 1 296 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.431 -0.130 17919 121653 1 296 . 1 1 72 72 ARG C C 72 175.350 175.350 175.153 0.197 17919 121654 1 296 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.577 0.033 17919 121655 1 296 . 1 1 72 72 ARG CB C 72 31.350 31.350 31.074 0.276 17919 121656 1 296 . 1 1 72 72 ARG H H 72 8.580 8.580 8.527 0.053 17919 121657 1 297 . 1 1 2 2 GLN N N 2 123.220 123.220 120.974 2.246 17919 121658 1 297 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.359 -0.110 17919 121659 1 297 . 1 1 2 2 GLN C C 2 175.920 175.920 174.805 1.115 17919 121660 1 297 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.646 0.434 17919 121661 1 297 . 1 1 2 2 GLN CB C 2 30.760 30.760 31.211 -0.451 17919 121662 1 297 . 1 1 2 2 GLN H H 2 8.900 8.900 8.380 0.520 17919 121663 1 297 . 1 1 3 3 ILE N N 3 115.340 115.340 117.414 -2.074 17919 121664 1 297 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.677 -0.464 17919 121665 1 297 . 1 1 3 3 ILE C C 3 172.450 172.450 173.182 -0.732 17919 121666 1 297 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.232 0.338 17919 121667 1 297 . 1 1 3 3 ILE CB C 3 42.210 42.210 42.151 0.059 17919 121668 1 297 . 1 1 3 3 ILE H H 3 8.320 8.320 8.696 -0.376 17919 121669 1 297 . 1 1 4 4 PHE N N 4 118.110 118.110 120.047 -1.937 17919 121670 1 297 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.428 0.202 17919 121671 1 297 . 1 1 4 4 PHE C C 4 175.320 175.320 175.007 0.313 17919 121672 1 297 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.766 -0.556 17919 121673 1 297 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.214 0.266 17919 121674 1 297 . 1 1 4 4 PHE H H 4 8.610 8.610 8.988 -0.378 17919 121675 1 297 . 1 1 5 5 VAL N N 5 121.000 121.000 124.691 -3.691 17919 121676 1 297 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.735 -0.010 17919 121677 1 297 . 1 1 5 5 VAL C C 5 174.870 174.870 174.755 0.115 17919 121678 1 297 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.695 -1.075 17919 121679 1 297 . 1 1 5 5 VAL CB C 5 34.230 34.230 32.916 1.314 17919 121680 1 297 . 1 1 5 5 VAL H H 5 9.300 9.300 9.303 -0.003 17919 121681 1 297 . 1 1 6 6 LYS N N 6 127.520 127.520 129.169 -1.649 17919 121682 1 297 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.540 -0.173 17919 121683 1 297 . 1 1 6 6 LYS C C 6 177.140 177.140 176.131 1.009 17919 121684 1 297 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.171 0.349 17919 121685 1 297 . 1 1 6 6 LYS CB C 6 35.050 35.050 36.321 -1.271 17919 121686 1 297 . 1 1 6 6 LYS H H 6 8.820 8.820 9.305 -0.485 17919 121687 1 297 . 1 1 7 7 THR N N 7 115.400 115.400 116.012 -0.612 17919 121688 1 297 . 1 1 7 7 THR HA H 7 4.970 4.970 5.099 -0.129 17919 121689 1 297 . 1 1 7 7 THR C C 7 176.910 176.910 176.520 0.390 17919 121690 1 297 . 1 1 7 7 THR CA C 7 60.470 60.470 59.432 1.038 17919 121691 1 297 . 1 1 7 7 THR CB C 7 70.630 70.630 71.407 -0.777 17919 121692 1 297 . 1 1 7 7 THR H H 7 8.730 8.730 8.493 0.237 17919 121693 1 297 . 1 1 8 8 LEU N N 8 121.330 121.330 120.042 1.288 17919 121694 1 297 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.423 -0.113 17919 121695 1 297 . 1 1 8 8 LEU C C 8 178.800 178.800 177.842 0.958 17919 121696 1 297 . 1 1 8 8 LEU CA C 8 57.580 57.580 56.845 0.735 17919 121697 1 297 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.755 0.215 17919 121698 1 297 . 1 1 8 8 LEU H H 8 9.100 9.100 8.923 0.177 17919 121699 1 297 . 1 1 9 9 THR N N 9 105.590 105.590 109.182 -3.592 17919 121700 1 297 . 1 1 9 9 THR HA H 9 4.428 4.428 4.319 0.109 17919 121701 1 297 . 1 1 9 9 THR C C 9 175.520 175.520 175.540 -0.020 17919 121702 1 297 . 1 1 9 9 THR CA C 9 61.400 61.400 62.122 -0.722 17919 121703 1 297 . 1 1 9 9 THR CB C 9 69.140 69.140 68.775 0.365 17919 121704 1 297 . 1 1 9 9 THR H H 9 7.630 7.630 7.638 -0.008 17919 121705 1 297 . 1 1 10 10 GLY N N 10 108.890 108.890 110.165 -1.275 17919 121706 1 297 . 1 1 10 10 GLY C C 10 174.070 174.070 173.783 0.287 17919 121707 1 297 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.194 0.266 17919 121708 1 297 . 1 1 10 10 GLY H H 10 7.810 7.810 7.560 0.250 17919 121709 1 297 . 1 1 11 11 LYS N N 11 121.600 121.600 121.003 0.597 17919 121710 1 297 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.321 0.040 17919 121711 1 297 . 1 1 11 11 LYS C C 11 175.940 175.940 175.611 0.329 17919 121712 1 297 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.531 -0.251 17919 121713 1 297 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.337 -0.137 17919 121714 1 297 . 1 1 11 11 LYS H H 11 7.280 7.280 7.835 -0.555 17919 121715 1 297 . 1 1 12 12 THR N N 12 120.440 120.440 120.722 -0.282 17919 121716 1 297 . 1 1 12 12 THR HA H 12 5.046 5.046 4.797 0.249 17919 121717 1 297 . 1 1 12 12 THR C C 12 174.320 174.320 174.391 -0.071 17919 121718 1 297 . 1 1 12 12 THR CA C 12 62.390 62.390 62.383 0.007 17919 121719 1 297 . 1 1 12 12 THR CB C 12 69.910 69.910 69.395 0.515 17919 121720 1 297 . 1 1 12 12 THR H H 12 8.650 8.650 8.267 0.383 17919 121721 1 297 . 1 1 13 13 ILE N N 13 127.110 127.110 127.791 -0.681 17919 121722 1 297 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.357 0.187 17919 121723 1 297 . 1 1 13 13 ILE C C 13 175.220 175.220 175.282 -0.062 17919 121724 1 297 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.883 -0.903 17919 121725 1 297 . 1 1 13 13 ILE CB C 13 40.950 40.950 39.613 1.337 17919 121726 1 297 . 1 1 13 13 ILE H H 13 9.450 9.450 9.074 0.376 17919 121727 1 297 . 1 1 14 14 THR N N 14 121.520 121.520 122.864 -1.344 17919 121728 1 297 . 1 1 14 14 THR HA H 14 4.964 4.964 5.004 -0.040 17919 121729 1 297 . 1 1 14 14 THR C C 14 173.790 173.790 173.813 -0.023 17919 121730 1 297 . 1 1 14 14 THR CA C 14 61.940 61.940 61.543 0.397 17919 121731 1 297 . 1 1 14 14 THR CB C 14 69.650 69.650 69.750 -0.100 17919 121732 1 297 . 1 1 14 14 THR H H 14 8.710 8.710 8.470 0.240 17919 121733 1 297 . 1 1 15 15 LEU N N 15 124.800 124.800 128.208 -3.408 17919 121734 1 297 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.752 0.028 17919 121735 1 297 . 1 1 15 15 LEU C C 15 174.670 174.670 175.088 -0.418 17919 121736 1 297 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.660 -0.830 17919 121737 1 297 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.783 1.286 17919 121738 1 297 . 1 1 15 15 LEU H H 15 8.710 8.710 8.600 0.110 17919 121739 1 297 . 1 1 16 16 GLU N N 16 122.160 122.160 123.374 -1.214 17919 121740 1 297 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.388 -0.471 17919 121741 1 297 . 1 1 16 16 GLU C C 16 175.860 175.860 176.062 -0.202 17919 121742 1 297 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.092 -0.272 17919 121743 1 297 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.581 -1.131 17919 121744 1 297 . 1 1 16 16 GLU H H 16 8.140 8.140 8.545 -0.405 17919 121745 1 297 . 1 1 17 17 VAL N N 17 117.210 117.210 117.670 -0.460 17919 121746 1 297 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.735 -0.021 17919 121747 1 297 . 1 1 17 17 VAL C C 17 174.160 174.160 174.771 -0.611 17919 121748 1 297 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.578 -0.147 17919 121749 1 297 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.268 1.132 17919 121750 1 297 . 1 1 17 17 VAL H H 17 8.900 8.900 8.945 -0.045 17919 121751 1 297 . 1 1 18 18 GLU N N 18 118.990 118.990 121.321 -2.331 17919 121752 1 297 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.842 0.237 17919 121753 1 297 . 1 1 18 18 GLU C C 18 176.160 176.160 175.929 0.231 17919 121754 1 297 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.055 0.665 17919 121755 1 297 . 1 1 18 18 GLU CB C 18 30.310 30.310 31.036 -0.726 17919 121756 1 297 . 1 1 18 18 GLU H H 18 8.640 8.640 8.527 0.113 17919 121757 1 297 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.363 -0.222 17919 121758 1 297 . 1 1 19 19 PRO C C 19 175.310 175.310 177.297 -1.987 17919 121759 1 297 . 1 1 19 19 PRO CA C 19 65.470 65.470 64.994 0.476 17919 121760 1 297 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.064 -0.114 17919 121761 1 297 . 1 1 20 20 SER N N 20 103.400 103.400 110.474 -7.074 17919 121762 1 297 . 1 1 20 20 SER HA H 20 4.370 4.370 4.324 0.046 17919 121763 1 297 . 1 1 20 20 SER C C 20 174.660 174.660 174.369 0.291 17919 121764 1 297 . 1 1 20 20 SER CA C 20 57.400 57.400 58.544 -1.144 17919 121765 1 297 . 1 1 20 20 SER CB C 20 63.370 63.370 62.891 0.479 17919 121766 1 297 . 1 1 20 20 SER H H 20 7.040 7.040 7.975 -0.935 17919 121767 1 297 . 1 1 21 21 ASP N N 21 123.480 123.480 124.086 -0.606 17919 121768 1 297 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.576 0.119 17919 121769 1 297 . 1 1 21 21 ASP C C 21 176.360 176.360 176.384 -0.024 17919 121770 1 297 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.466 0.234 17919 121771 1 297 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.318 -0.518 17919 121772 1 297 . 1 1 21 21 ASP H H 21 8.030 8.030 7.551 0.479 17919 121773 1 297 . 1 1 22 22 THR N N 22 108.800 108.800 112.137 -3.337 17919 121774 1 297 . 1 1 22 22 THR HA H 22 4.920 4.920 4.962 -0.042 17919 121775 1 297 . 1 1 22 22 THR C C 22 176.750 176.750 176.498 0.252 17919 121776 1 297 . 1 1 22 22 THR CA C 22 59.690 59.690 60.293 -0.603 17919 121777 1 297 . 1 1 22 22 THR CB C 22 71.200 71.200 71.179 0.021 17919 121778 1 297 . 1 1 22 22 THR H H 22 7.900 7.900 7.886 0.014 17919 121779 1 297 . 1 1 23 23 ILE N N 23 121.190 121.190 122.120 -0.930 17919 121780 1 297 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.768 -0.111 17919 121781 1 297 . 1 1 23 23 ILE C C 23 179.040 179.040 177.856 1.184 17919 121782 1 297 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.774 -0.514 17919 121783 1 297 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.056 -1.706 17919 121784 1 297 . 1 1 23 23 ILE H H 23 8.560 8.560 8.555 0.005 17919 121785 1 297 . 1 1 24 24 GLU N N 24 120.830 120.830 120.951 -0.121 17919 121786 1 297 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.826 0.091 17919 121787 1 297 . 1 1 24 24 GLU C C 24 178.640 178.640 178.343 0.297 17919 121788 1 297 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.495 -0.275 17919 121789 1 297 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.426 -1.146 17919 121790 1 297 . 1 1 24 24 GLU H H 24 9.760 9.760 8.426 1.334 17919 121791 1 297 . 1 1 25 25 ASN N N 25 120.570 120.570 117.681 2.889 17919 121792 1 297 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.505 0.020 17919 121793 1 297 . 1 1 25 25 ASN C C 25 178.380 178.380 178.158 0.222 17919 121794 1 297 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.658 0.402 17919 121795 1 297 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.827 -0.377 17919 121796 1 297 . 1 1 25 25 ASN H H 25 7.920 7.920 7.597 0.323 17919 121797 1 297 . 1 1 26 26 VAL N N 26 121.710 121.710 121.406 0.304 17919 121798 1 297 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.554 -0.157 17919 121799 1 297 . 1 1 26 26 VAL C C 26 177.950 177.950 177.500 0.450 17919 121800 1 297 . 1 1 26 26 VAL CA C 26 67.660 67.660 67.188 0.472 17919 121801 1 297 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.535 -0.695 17919 121802 1 297 . 1 1 26 26 VAL H H 26 8.070 8.070 8.645 -0.575 17919 121803 1 297 . 1 1 27 27 LYS N N 27 118.860 118.860 119.977 -1.117 17919 121804 1 297 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.288 0.292 17919 121805 1 297 . 1 1 27 27 LYS C C 27 180.550 180.550 178.896 1.654 17919 121806 1 297 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.371 -0.121 17919 121807 1 297 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.298 1.431 17919 121808 1 297 . 1 1 27 27 LYS H H 27 8.560 8.560 8.408 0.152 17919 121809 1 297 . 1 1 28 28 ALA N N 28 123.440 123.440 122.860 0.580 17919 121810 1 297 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.170 -0.010 17919 121811 1 297 . 1 1 28 28 ALA C C 28 180.300 180.300 179.032 1.268 17919 121812 1 297 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.981 0.389 17919 121813 1 297 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.448 -0.739 17919 121814 1 297 . 1 1 28 28 ALA H H 28 8.060 8.060 7.836 0.224 17919 121815 1 297 . 1 1 29 29 LYS N N 29 119.940 119.940 119.604 0.336 17919 121816 1 297 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.021 0.186 17919 121817 1 297 . 1 1 29 29 LYS C C 29 180.320 180.320 179.014 1.306 17919 121818 1 297 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.518 0.132 17919 121819 1 297 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.412 0.878 17919 121820 1 297 . 1 1 29 29 LYS H H 29 7.850 7.850 7.733 0.117 17919 121821 1 297 . 1 1 30 30 ILE N N 30 121.080 121.080 120.070 1.010 17919 121822 1 297 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.635 -0.128 17919 121823 1 297 . 1 1 30 30 ILE C C 30 178.310 178.310 177.287 1.023 17919 121824 1 297 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.459 0.691 17919 121825 1 297 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.929 -1.129 17919 121826 1 297 . 1 1 30 30 ILE H H 30 8.280 8.280 8.352 -0.072 17919 121827 1 297 . 1 1 31 31 GLN N N 31 123.490 123.490 120.545 2.945 17919 121828 1 297 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.874 -0.045 17919 121829 1 297 . 1 1 31 31 GLN C C 31 178.890 178.890 178.195 0.695 17919 121830 1 297 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.265 0.735 17919 121831 1 297 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.364 -0.644 17919 121832 1 297 . 1 1 31 31 GLN H H 31 8.580 8.580 8.049 0.531 17919 121833 1 297 . 1 1 32 32 ASP N N 32 119.360 119.360 120.012 -0.652 17919 121834 1 297 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.342 0.012 17919 121835 1 297 . 1 1 32 32 ASP C C 32 177.250 177.250 177.923 -0.673 17919 121836 1 297 . 1 1 32 32 ASP CA C 32 57.190 57.190 57.048 0.142 17919 121837 1 297 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.798 -0.218 17919 121838 1 297 . 1 1 32 32 ASP H H 32 8.010 8.010 8.543 -0.533 17919 121839 1 297 . 1 1 33 33 LYS N N 33 115.130 115.130 117.286 -2.156 17919 121840 1 297 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.390 -0.053 17919 121841 1 297 . 1 1 33 33 LYS C C 33 177.870 177.870 178.185 -0.315 17919 121842 1 297 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.540 0.510 17919 121843 1 297 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.401 0.769 17919 121844 1 297 . 1 1 33 33 LYS H H 33 7.430 7.430 7.481 -0.051 17919 121845 1 297 . 1 1 34 34 GLU N N 34 113.870 113.870 114.963 -1.093 17919 121846 1 297 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.504 0.121 17919 121847 1 297 . 1 1 34 34 GLU C C 34 177.840 177.840 177.150 0.690 17919 121848 1 297 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.279 -1.109 17919 121849 1 297 . 1 1 34 34 GLU CB C 34 32.660 32.660 32.583 0.077 17919 121850 1 297 . 1 1 34 34 GLU H H 34 8.740 8.740 7.927 0.813 17919 121851 1 297 . 1 1 35 35 GLY N N 35 108.650 108.650 108.719 -0.069 17919 121852 1 297 . 1 1 35 35 GLY C C 35 173.960 173.960 174.173 -0.213 17919 121853 1 297 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.465 0.616 17919 121854 1 297 . 1 1 35 35 GLY H H 35 8.530 8.530 8.254 0.276 17919 121855 1 297 . 1 1 36 36 ILE N N 36 119.880 119.880 121.995 -2.115 17919 121856 1 297 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.298 0.147 17919 121857 1 297 . 1 1 36 36 ILE C C 36 173.590 173.590 174.039 -0.449 17919 121858 1 297 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.662 -0.912 17919 121859 1 297 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.641 1.939 17919 121860 1 297 . 1 1 36 36 ILE H H 36 6.150 6.150 7.802 -1.652 17919 121861 1 297 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.616 0.018 17919 121862 1 297 . 1 1 37 37 PRO C C 37 176.940 176.940 176.041 0.899 17919 121863 1 297 . 1 1 37 37 PRO CA C 37 61.660 61.660 62.124 -0.465 17919 121864 1 297 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.491 0.359 17919 121865 1 297 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.152 -0.035 17919 121866 1 297 . 1 1 38 38 PRO C C 38 178.320 178.320 178.560 -0.240 17919 121867 1 297 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.729 0.531 17919 121868 1 297 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.845 1.045 17919 121869 1 297 . 1 1 39 39 ASP N N 39 113.380 113.380 115.275 -1.895 17919 121870 1 297 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.426 0.004 17919 121871 1 297 . 1 1 39 39 ASP C C 39 177.090 177.090 177.116 -0.026 17919 121872 1 297 . 1 1 39 39 ASP CA C 39 55.640 55.640 55.961 -0.321 17919 121873 1 297 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.264 -0.723 17919 121874 1 297 . 1 1 39 39 ASP H H 39 8.550 8.550 8.624 -0.074 17919 121875 1 297 . 1 1 40 40 GLN N N 40 116.780 116.780 116.814 -0.034 17919 121876 1 297 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.313 0.151 17919 121877 1 297 . 1 1 40 40 GLN C C 40 175.380 175.380 175.494 -0.114 17919 121878 1 297 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.634 0.006 17919 121879 1 297 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.749 0.391 17919 121880 1 297 . 1 1 40 40 GLN H H 40 7.820 7.820 7.917 -0.097 17919 121881 1 297 . 1 1 41 41 GLN N N 41 117.720 117.720 118.872 -1.152 17919 121882 1 297 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.758 -0.514 17919 121883 1 297 . 1 1 41 41 GLN C C 41 176.300 176.300 175.670 0.630 17919 121884 1 297 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.517 0.953 17919 121885 1 297 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.697 1.954 17919 121886 1 297 . 1 1 41 41 GLN H H 41 7.480 7.480 7.302 0.178 17919 121887 1 297 . 1 1 42 42 ARG N N 42 122.680 122.680 123.292 -0.612 17919 121888 1 297 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.705 -0.205 17919 121889 1 297 . 1 1 42 42 ARG C C 42 174.050 174.050 173.822 0.228 17919 121890 1 297 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.705 0.345 17919 121891 1 297 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.162 -0.412 17919 121892 1 297 . 1 1 42 42 ARG H H 42 8.530 8.530 8.725 -0.195 17919 121893 1 297 . 1 1 43 43 LEU N N 43 124.040 124.040 125.409 -1.369 17919 121894 1 297 . 1 1 43 43 LEU C C 43 175.290 175.290 175.857 -0.567 17919 121895 1 297 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.992 -1.012 17919 121896 1 297 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.300 1.490 17919 121897 1 297 . 1 1 43 43 LEU H H 43 8.820 8.820 8.750 0.070 17919 121898 1 297 . 1 1 44 44 ILE N N 44 121.920 121.920 122.449 -0.529 17919 121899 1 297 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.084 -0.092 17919 121900 1 297 . 1 1 44 44 ILE C C 44 176.060 176.060 174.112 1.948 17919 121901 1 297 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.486 -1.506 17919 121902 1 297 . 1 1 44 44 ILE CB C 44 41.420 41.420 42.138 -0.718 17919 121903 1 297 . 1 1 44 44 ILE H H 44 9.030 9.030 8.640 0.390 17919 121904 1 297 . 1 1 45 45 PHE N N 45 125.390 125.390 126.453 -1.063 17919 121905 1 297 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.064 -0.019 17919 121906 1 297 . 1 1 45 45 PHE C C 45 174.470 174.470 174.661 -0.191 17919 121907 1 297 . 1 1 45 45 PHE CA C 45 57.020 57.020 55.980 1.040 17919 121908 1 297 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.958 0.802 17919 121909 1 297 . 1 1 45 45 PHE H H 45 8.830 8.830 8.974 -0.144 17919 121910 1 297 . 1 1 46 46 ALA N N 46 132.200 132.200 130.023 2.177 17919 121911 1 297 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.626 0.064 17919 121912 1 297 . 1 1 46 46 ALA C C 46 177.290 177.290 177.271 0.019 17919 121913 1 297 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.996 -0.456 17919 121914 1 297 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.748 -0.178 17919 121915 1 297 . 1 1 46 46 ALA H H 46 8.810 8.810 9.002 -0.192 17919 121916 1 297 . 1 1 47 47 GLY N N 47 102.340 102.340 103.688 -1.348 17919 121917 1 297 . 1 1 47 47 GLY C C 47 173.810 173.810 174.192 -0.382 17919 121918 1 297 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.148 0.202 17919 121919 1 297 . 1 1 47 47 GLY H H 47 8.130 8.130 8.318 -0.188 17919 121920 1 297 . 1 1 48 48 LYS N N 48 121.570 121.570 121.321 0.249 17919 121921 1 297 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.565 0.057 17919 121922 1 297 . 1 1 48 48 LYS C C 48 174.700 174.700 175.337 -0.637 17919 121923 1 297 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.096 -0.546 17919 121924 1 297 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.565 -0.035 17919 121925 1 297 . 1 1 48 48 LYS H H 48 7.980 7.980 8.030 -0.051 17919 121926 1 297 . 1 1 49 49 GLN N N 49 122.410 122.410 126.316 -3.906 17919 121927 1 297 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.385 0.175 17919 121928 1 297 . 1 1 49 49 GLN C C 49 175.670 175.670 175.633 0.037 17919 121929 1 297 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.121 -0.381 17919 121930 1 297 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.140 -0.140 17919 121931 1 297 . 1 1 49 49 GLN H H 49 8.600 8.600 8.625 -0.025 17919 121932 1 297 . 1 1 50 50 LEU N N 50 125.520 125.520 128.783 -3.263 17919 121933 1 297 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.089 0.001 17919 121934 1 297 . 1 1 50 50 LEU C C 50 176.660 176.660 176.554 0.106 17919 121935 1 297 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.417 -0.177 17919 121936 1 297 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.637 -0.067 17919 121937 1 297 . 1 1 50 50 LEU H H 50 8.530 8.530 8.477 0.053 17919 121938 1 297 . 1 1 51 51 GLU N N 51 122.940 122.940 123.288 -0.348 17919 121939 1 297 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.610 -0.122 17919 121940 1 297 . 1 1 51 51 GLU C C 51 175.870 175.870 176.912 -1.042 17919 121941 1 297 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.234 0.726 17919 121942 1 297 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.515 0.055 17919 121943 1 297 . 1 1 51 51 GLU H H 51 8.400 8.400 8.817 -0.417 17919 121944 1 297 . 1 1 52 52 ASP N N 52 120.030 120.030 124.122 -4.092 17919 121945 1 297 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.415 -0.056 17919 121946 1 297 . 1 1 52 52 ASP C C 52 177.330 177.330 177.691 -0.361 17919 121947 1 297 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.276 -0.317 17919 121948 1 297 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.666 0.184 17919 121949 1 297 . 1 1 52 52 ASP H H 52 8.160 8.160 8.817 -0.657 17919 121950 1 297 . 1 1 53 53 GLY N N 53 106.660 106.660 105.144 1.516 17919 121951 1 297 . 1 1 53 53 GLY C C 53 174.870 174.870 174.146 0.724 17919 121952 1 297 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.776 0.394 17919 121953 1 297 . 1 1 53 53 GLY H H 53 9.390 9.390 8.625 0.765 17919 121954 1 297 . 1 1 54 54 ARG N N 54 119.050 119.050 120.484 -1.434 17919 121955 1 297 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.640 0.055 17919 121956 1 297 . 1 1 54 54 ARG C C 54 175.350 175.350 175.232 0.118 17919 121957 1 297 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.123 0.267 17919 121958 1 297 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.658 -0.008 17919 121959 1 297 . 1 1 54 54 ARG H H 54 7.460 7.460 7.421 0.039 17919 121960 1 297 . 1 1 55 55 THR N N 55 108.400 108.400 111.098 -2.698 17919 121961 1 297 . 1 1 55 55 THR HA H 55 5.240 5.240 5.204 0.036 17919 121962 1 297 . 1 1 55 55 THR C C 55 176.560 176.560 176.162 0.398 17919 121963 1 297 . 1 1 55 55 THR CA C 55 59.690 59.690 59.637 0.053 17919 121964 1 297 . 1 1 55 55 THR CB C 55 72.260 72.260 71.699 0.561 17919 121965 1 297 . 1 1 55 55 THR H H 55 8.730 8.730 8.762 -0.032 17919 121966 1 297 . 1 1 56 56 LEU N N 56 117.920 117.920 122.519 -4.599 17919 121967 1 297 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.989 0.071 17919 121968 1 297 . 1 1 56 56 LEU C C 56 180.810 180.810 178.678 2.132 17919 121969 1 297 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.689 0.021 17919 121970 1 297 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.190 -0.820 17919 121971 1 297 . 1 1 56 56 LEU H H 56 8.140 8.140 8.496 -0.356 17919 121972 1 297 . 1 1 57 57 SER N N 57 113.330 113.330 113.740 -0.410 17919 121973 1 297 . 1 1 57 57 SER HA H 57 4.370 4.370 4.307 0.063 17919 121974 1 297 . 1 1 57 57 SER C C 57 178.310 178.310 177.152 1.158 17919 121975 1 297 . 1 1 57 57 SER CA C 57 61.080 61.080 60.837 0.243 17919 121976 1 297 . 1 1 57 57 SER CB C 57 62.530 62.530 62.388 0.142 17919 121977 1 297 . 1 1 57 57 SER H H 57 8.470 8.470 8.192 0.278 17919 121978 1 297 . 1 1 58 58 ASP N N 58 124.190 124.190 124.255 -0.065 17919 121979 1 297 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.286 0.010 17919 121980 1 297 . 1 1 58 58 ASP C C 58 177.400 177.400 177.357 0.043 17919 121981 1 297 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.894 0.286 17919 121982 1 297 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.219 -0.119 17919 121983 1 297 . 1 1 58 58 ASP H H 58 7.930 7.930 7.707 0.223 17919 121984 1 297 . 1 1 59 59 TYR N N 59 115.510 115.510 115.386 0.124 17919 121985 1 297 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.618 0.052 17919 121986 1 297 . 1 1 59 59 TYR C C 59 174.700 174.700 175.615 -0.915 17919 121987 1 297 . 1 1 59 59 TYR CA C 59 58.250 58.250 56.913 1.337 17919 121988 1 297 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.185 1.885 17919 121989 1 297 . 1 1 59 59 TYR H H 59 7.250 7.250 7.336 -0.086 17919 121990 1 297 . 1 1 60 60 ASN N N 60 115.900 115.900 117.003 -1.103 17919 121991 1 297 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.391 -0.036 17919 121992 1 297 . 1 1 60 60 ASN C C 60 174.340 174.340 174.357 -0.017 17919 121993 1 297 . 1 1 60 60 ASN CA C 60 54.120 54.120 53.938 0.182 17919 121994 1 297 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.756 -0.346 17919 121995 1 297 . 1 1 60 60 ASN H H 60 8.150 8.150 7.738 0.412 17919 121996 1 297 . 1 1 61 61 ILE N N 61 118.600 118.600 120.604 -2.004 17919 121997 1 297 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.741 -0.348 17919 121998 1 297 . 1 1 61 61 ILE C C 61 174.610 174.610 175.356 -0.746 17919 121999 1 297 . 1 1 61 61 ILE CA C 61 62.420 62.420 62.521 -0.101 17919 122000 1 297 . 1 1 61 61 ILE CB C 61 36.740 36.740 36.877 -0.137 17919 122001 1 297 . 1 1 61 61 ILE H H 61 7.250 7.250 8.336 -1.086 17919 122002 1 297 . 1 1 62 62 GLN N N 62 124.740 124.740 126.139 -1.399 17919 122003 1 297 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.801 -0.295 17919 122004 1 297 . 1 1 62 62 GLN C C 62 175.970 175.970 175.956 0.014 17919 122005 1 297 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.672 -0.012 17919 122006 1 297 . 1 1 62 62 GLN CB C 62 31.650 31.650 32.717 -1.067 17919 122007 1 297 . 1 1 62 62 GLN H H 62 7.610 7.610 7.985 -0.375 17919 122008 1 297 . 1 1 63 63 LYS N N 63 120.300 120.300 120.298 0.002 17919 122009 1 297 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.100 -0.099 17919 122010 1 297 . 1 1 63 63 LYS C C 63 175.810 175.810 176.732 -0.922 17919 122011 1 297 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.684 0.106 17919 122012 1 297 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.182 0.468 17919 122013 1 297 . 1 1 63 63 LYS H H 63 8.490 8.490 8.602 -0.112 17919 122014 1 297 . 1 1 64 64 GLU N N 64 113.950 113.950 118.422 -4.472 17919 122015 1 297 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.891 -0.426 17919 122016 1 297 . 1 1 64 64 GLU C C 64 175.250 175.250 175.946 -0.696 17919 122017 1 297 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.764 0.126 17919 122018 1 297 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.936 -3.035 17919 122019 1 297 . 1 1 64 64 GLU H H 64 9.280 9.280 8.938 0.342 17919 122020 1 297 . 1 1 65 65 SER N N 65 114.730 114.730 115.038 -0.308 17919 122021 1 297 . 1 1 65 65 SER HA H 65 4.640 4.640 4.544 0.096 17919 122022 1 297 . 1 1 65 65 SER C C 65 172.160 172.160 174.168 -2.008 17919 122023 1 297 . 1 1 65 65 SER CA C 65 60.890 60.890 60.538 0.352 17919 122024 1 297 . 1 1 65 65 SER CB C 65 64.910 64.910 64.277 0.633 17919 122025 1 297 . 1 1 65 65 SER H H 65 7.670 7.670 7.556 0.114 17919 122026 1 297 . 1 1 66 66 THR N N 66 117.110 117.110 119.276 -2.166 17919 122027 1 297 . 1 1 66 66 THR HA H 66 5.270 5.270 5.411 -0.141 17919 122028 1 297 . 1 1 66 66 THR C C 66 173.950 173.950 174.031 -0.081 17919 122029 1 297 . 1 1 66 66 THR CA C 66 62.340 62.340 62.153 0.187 17919 122030 1 297 . 1 1 66 66 THR CB C 66 70.080 70.080 70.203 -0.123 17919 122031 1 297 . 1 1 66 66 THR H H 66 8.730 8.730 8.623 0.107 17919 122032 1 297 . 1 1 67 67 LEU N N 67 127.110 127.110 126.819 0.291 17919 122033 1 297 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.908 0.152 17919 122034 1 297 . 1 1 67 67 LEU C C 67 175.770 175.770 175.320 0.450 17919 122035 1 297 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.235 -0.335 17919 122036 1 297 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.245 0.014 17919 122037 1 297 . 1 1 67 67 LEU H H 67 9.410 9.410 9.267 0.143 17919 122038 1 297 . 1 1 68 68 HIS N N 68 118.380 118.380 122.631 -4.251 17919 122039 1 297 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.419 -0.179 17919 122040 1 297 . 1 1 68 68 HIS C C 68 173.150 173.150 173.427 -0.277 17919 122041 1 297 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.155 0.845 17919 122042 1 297 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.610 -2.080 17919 122043 1 297 . 1 1 68 68 HIS H H 68 9.230 9.230 9.211 0.019 17919 122044 1 297 . 1 1 69 69 LEU N N 69 124.460 124.460 130.583 -6.123 17919 122045 1 297 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.097 0.093 17919 122046 1 297 . 1 1 69 69 LEU C C 69 175.270 175.270 174.248 1.022 17919 122047 1 297 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.290 0.600 17919 122048 1 297 . 1 1 69 69 LEU CB C 69 44.380 44.380 43.995 0.386 17919 122049 1 297 . 1 1 69 69 LEU H H 69 8.340 8.340 8.331 0.009 17919 122050 1 297 . 1 1 70 70 VAL N N 70 126.940 126.940 127.315 -0.375 17919 122051 1 297 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.360 -0.010 17919 122052 1 297 . 1 1 70 70 VAL C C 70 174.000 174.000 174.543 -0.543 17919 122053 1 297 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.755 0.045 17919 122054 1 297 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.086 -0.176 17919 122055 1 297 . 1 1 70 70 VAL H H 70 9.200 9.200 8.673 0.527 17919 122056 1 297 . 1 1 71 71 LEU N N 71 123.130 123.130 123.210 -0.080 17919 122057 1 297 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.036 0.024 17919 122058 1 297 . 1 1 71 71 LEU C C 71 177.830 177.830 177.144 0.686 17919 122059 1 297 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.350 0.590 17919 122060 1 297 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.821 -0.971 17919 122061 1 297 . 1 1 71 71 LEU H H 71 8.120 8.120 8.426 -0.306 17919 122062 1 297 . 1 1 72 72 ARG N N 72 123.490 123.490 121.466 2.024 17919 122063 1 297 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.424 -0.123 17919 122064 1 297 . 1 1 72 72 ARG C C 72 175.350 175.350 175.395 -0.045 17919 122065 1 297 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.919 -0.309 17919 122066 1 297 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.370 0.980 17919 122067 1 297 . 1 1 72 72 ARG H H 72 8.580 8.580 8.222 0.358 17919 122068 1 298 . 1 1 2 2 GLN N N 2 123.220 123.220 119.645 3.575 17919 122069 1 298 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.504 -0.255 17919 122070 1 298 . 1 1 2 2 GLN C C 2 175.920 175.920 175.379 0.541 17919 122071 1 298 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.454 0.626 17919 122072 1 298 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.834 -0.074 17919 122073 1 298 . 1 1 2 2 GLN H H 2 8.900 8.900 8.379 0.521 17919 122074 1 298 . 1 1 3 3 ILE N N 3 115.340 115.340 116.520 -1.180 17919 122075 1 298 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.538 -0.325 17919 122076 1 298 . 1 1 3 3 ILE C C 3 172.450 172.450 173.336 -0.886 17919 122077 1 298 . 1 1 3 3 ILE CA C 3 59.570 59.570 58.832 0.738 17919 122078 1 298 . 1 1 3 3 ILE CB C 3 42.210 42.210 42.067 0.143 17919 122079 1 298 . 1 1 3 3 ILE H H 3 8.320 8.320 8.566 -0.246 17919 122080 1 298 . 1 1 4 4 PHE N N 4 118.110 118.110 119.306 -1.196 17919 122081 1 298 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.556 0.074 17919 122082 1 298 . 1 1 4 4 PHE C C 4 175.320 175.320 175.491 -0.171 17919 122083 1 298 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.407 -0.198 17919 122084 1 298 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.681 -0.201 17919 122085 1 298 . 1 1 4 4 PHE H H 4 8.610 8.610 8.728 -0.118 17919 122086 1 298 . 1 1 5 5 VAL N N 5 121.000 121.000 122.621 -1.621 17919 122087 1 298 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.665 0.060 17919 122088 1 298 . 1 1 5 5 VAL C C 5 174.870 174.870 175.225 -0.355 17919 122089 1 298 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.219 -0.599 17919 122090 1 298 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.467 -0.237 17919 122091 1 298 . 1 1 5 5 VAL H H 5 9.300 9.300 9.283 0.017 17919 122092 1 298 . 1 1 6 6 LYS N N 6 127.520 127.520 127.875 -0.355 17919 122093 1 298 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.379 -0.012 17919 122094 1 298 . 1 1 6 6 LYS C C 6 177.140 177.140 177.451 -0.311 17919 122095 1 298 . 1 1 6 6 LYS CA C 6 54.520 54.520 53.598 0.922 17919 122096 1 298 . 1 1 6 6 LYS CB C 6 35.050 35.050 33.100 1.950 17919 122097 1 298 . 1 1 6 6 LYS H H 6 8.820 8.820 9.245 -0.425 17919 122098 1 298 . 1 1 7 7 THR N N 7 115.400 115.400 115.348 0.052 17919 122099 1 298 . 1 1 7 7 THR HA H 7 4.970 4.970 4.514 0.456 17919 122100 1 298 . 1 1 7 7 THR C C 7 176.910 176.910 176.816 0.094 17919 122101 1 298 . 1 1 7 7 THR CA C 7 60.470 60.470 61.145 -0.675 17919 122102 1 298 . 1 1 7 7 THR CB C 7 70.630 70.630 70.421 0.209 17919 122103 1 298 . 1 1 7 7 THR H H 7 8.730 8.730 8.195 0.535 17919 122104 1 298 . 1 1 8 8 LEU N N 8 121.330 121.330 119.338 1.992 17919 122105 1 298 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.516 -0.206 17919 122106 1 298 . 1 1 8 8 LEU C C 8 178.800 178.800 177.436 1.364 17919 122107 1 298 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.587 -0.007 17919 122108 1 298 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.642 0.328 17919 122109 1 298 . 1 1 8 8 LEU H H 8 9.100 9.100 8.903 0.197 17919 122110 1 298 . 1 1 9 9 THR N N 9 105.590 105.590 110.192 -4.602 17919 122111 1 298 . 1 1 9 9 THR HA H 9 4.428 4.428 4.362 0.066 17919 122112 1 298 . 1 1 9 9 THR C C 9 175.520 175.520 176.119 -0.599 17919 122113 1 298 . 1 1 9 9 THR CA C 9 61.400 61.400 61.498 -0.098 17919 122114 1 298 . 1 1 9 9 THR CB C 9 69.140 69.140 68.994 0.146 17919 122115 1 298 . 1 1 9 9 THR H H 9 7.630 7.630 7.510 0.120 17919 122116 1 298 . 1 1 10 10 GLY N N 10 108.890 108.890 110.587 -1.697 17919 122117 1 298 . 1 1 10 10 GLY C C 10 174.070 174.070 173.779 0.291 17919 122118 1 298 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.420 0.040 17919 122119 1 298 . 1 1 10 10 GLY H H 10 7.810 7.810 8.329 -0.519 17919 122120 1 298 . 1 1 11 11 LYS N N 11 121.600 121.600 121.251 0.349 17919 122121 1 298 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.402 -0.041 17919 122122 1 298 . 1 1 11 11 LYS C C 11 175.940 175.940 175.840 0.100 17919 122123 1 298 . 1 1 11 11 LYS CA C 11 56.280 56.280 56.131 0.149 17919 122124 1 298 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.346 -0.146 17919 122125 1 298 . 1 1 11 11 LYS H H 11 7.280 7.280 7.585 -0.305 17919 122126 1 298 . 1 1 12 12 THR N N 12 120.440 120.440 119.330 1.110 17919 122127 1 298 . 1 1 12 12 THR HA H 12 5.046 5.046 4.566 0.480 17919 122128 1 298 . 1 1 12 12 THR C C 12 174.320 174.320 174.214 0.106 17919 122129 1 298 . 1 1 12 12 THR CA C 12 62.390 62.390 62.486 -0.096 17919 122130 1 298 . 1 1 12 12 THR CB C 12 69.910 69.910 69.183 0.727 17919 122131 1 298 . 1 1 12 12 THR H H 12 8.650 8.650 8.298 0.352 17919 122132 1 298 . 1 1 13 13 ILE N N 13 127.110 127.110 128.680 -1.570 17919 122133 1 298 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.556 -0.012 17919 122134 1 298 . 1 1 13 13 ILE C C 13 175.220 175.220 175.787 -0.567 17919 122135 1 298 . 1 1 13 13 ILE CA C 13 59.980 59.980 60.388 -0.408 17919 122136 1 298 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.693 0.257 17919 122137 1 298 . 1 1 13 13 ILE H H 13 9.450 9.450 8.880 0.570 17919 122138 1 298 . 1 1 14 14 THR N N 14 121.520 121.520 123.706 -2.186 17919 122139 1 298 . 1 1 14 14 THR HA H 14 4.964 4.964 5.190 -0.226 17919 122140 1 298 . 1 1 14 14 THR C C 14 173.790 173.790 173.932 -0.142 17919 122141 1 298 . 1 1 14 14 THR CA C 14 61.940 61.940 61.680 0.260 17919 122142 1 298 . 1 1 14 14 THR CB C 14 69.650 69.650 69.877 -0.227 17919 122143 1 298 . 1 1 14 14 THR H H 14 8.710 8.710 8.460 0.250 17919 122144 1 298 . 1 1 15 15 LEU N N 15 124.800 124.800 125.847 -1.047 17919 122145 1 298 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.787 -0.007 17919 122146 1 298 . 1 1 15 15 LEU C C 15 174.670 174.670 175.286 -0.616 17919 122147 1 298 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.380 -0.550 17919 122148 1 298 . 1 1 15 15 LEU CB C 15 47.070 47.070 46.071 0.999 17919 122149 1 298 . 1 1 15 15 LEU H H 15 8.710 8.710 8.764 -0.054 17919 122150 1 298 . 1 1 16 16 GLU N N 16 122.160 122.160 122.557 -0.397 17919 122151 1 298 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.283 -0.366 17919 122152 1 298 . 1 1 16 16 GLU C C 16 175.860 175.860 176.018 -0.158 17919 122153 1 298 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.210 -0.390 17919 122154 1 298 . 1 1 16 16 GLU CB C 16 29.450 29.450 31.288 -1.838 17919 122155 1 298 . 1 1 16 16 GLU H H 16 8.140 8.140 8.498 -0.358 17919 122156 1 298 . 1 1 17 17 VAL N N 17 117.210 117.210 121.148 -3.938 17919 122157 1 298 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.756 -0.042 17919 122158 1 298 . 1 1 17 17 VAL C C 17 174.160 174.160 174.281 -0.121 17919 122159 1 298 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.718 -1.288 17919 122160 1 298 . 1 1 17 17 VAL CB C 17 36.400 36.400 34.703 1.697 17919 122161 1 298 . 1 1 17 17 VAL H H 17 8.900 8.900 8.828 0.072 17919 122162 1 298 . 1 1 18 18 GLU N N 18 118.990 118.990 120.623 -1.633 17919 122163 1 298 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.865 0.214 17919 122164 1 298 . 1 1 18 18 GLU C C 18 176.160 176.160 176.125 0.035 17919 122165 1 298 . 1 1 18 18 GLU CA C 18 52.720 52.720 53.303 -0.583 17919 122166 1 298 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.761 -0.451 17919 122167 1 298 . 1 1 18 18 GLU H H 18 8.640 8.640 9.392 -0.752 17919 122168 1 298 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.318 -0.177 17919 122169 1 298 . 1 1 19 19 PRO C C 19 175.310 175.310 178.087 -2.777 17919 122170 1 298 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.408 0.062 17919 122171 1 298 . 1 1 19 19 PRO CB C 19 31.950 31.950 32.045 -0.095 17919 122172 1 298 . 1 1 20 20 SER N N 20 103.400 103.400 111.529 -8.129 17919 122173 1 298 . 1 1 20 20 SER HA H 20 4.370 4.370 4.276 0.094 17919 122174 1 298 . 1 1 20 20 SER C C 20 174.660 174.660 174.274 0.386 17919 122175 1 298 . 1 1 20 20 SER CA C 20 57.400 57.400 59.354 -1.954 17919 122176 1 298 . 1 1 20 20 SER CB C 20 63.370 63.370 62.661 0.709 17919 122177 1 298 . 1 1 20 20 SER H H 20 7.040 7.040 8.272 -1.232 17919 122178 1 298 . 1 1 21 21 ASP N N 21 123.480 123.480 124.873 -1.393 17919 122179 1 298 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.641 0.054 17919 122180 1 298 . 1 1 21 21 ASP C C 21 176.360 176.360 175.685 0.675 17919 122181 1 298 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.042 0.658 17919 122182 1 298 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.410 -0.610 17919 122183 1 298 . 1 1 21 21 ASP H H 21 8.030 8.030 7.739 0.291 17919 122184 1 298 . 1 1 22 22 THR N N 22 108.800 108.800 112.776 -3.976 17919 122185 1 298 . 1 1 22 22 THR HA H 22 4.920 4.920 4.646 0.274 17919 122186 1 298 . 1 1 22 22 THR C C 22 176.750 176.750 176.053 0.697 17919 122187 1 298 . 1 1 22 22 THR CA C 22 59.690 59.690 62.060 -2.370 17919 122188 1 298 . 1 1 22 22 THR CB C 22 71.200 71.200 70.946 0.254 17919 122189 1 298 . 1 1 22 22 THR H H 22 7.900 7.900 8.203 -0.303 17919 122190 1 298 . 1 1 23 23 ILE N N 23 121.190 121.190 122.125 -0.935 17919 122191 1 298 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.941 -0.284 17919 122192 1 298 . 1 1 23 23 ILE C C 23 179.040 179.040 177.738 1.302 17919 122193 1 298 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.063 0.196 17919 122194 1 298 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.697 -2.347 17919 122195 1 298 . 1 1 23 23 ILE H H 23 8.560 8.560 8.757 -0.197 17919 122196 1 298 . 1 1 24 24 GLU N N 24 120.830 120.830 121.077 -0.247 17919 122197 1 298 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.870 0.047 17919 122198 1 298 . 1 1 24 24 GLU C C 24 178.640 178.640 178.342 0.298 17919 122199 1 298 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.017 0.203 17919 122200 1 298 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.453 -1.173 17919 122201 1 298 . 1 1 24 24 GLU H H 24 9.760 9.760 8.278 1.482 17919 122202 1 298 . 1 1 25 25 ASN N N 25 120.570 120.570 117.419 3.151 17919 122203 1 298 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.547 -0.022 17919 122204 1 298 . 1 1 25 25 ASN C C 25 178.380 178.380 177.896 0.484 17919 122205 1 298 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.899 0.161 17919 122206 1 298 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.564 -0.114 17919 122207 1 298 . 1 1 25 25 ASN H H 25 7.920 7.920 7.674 0.246 17919 122208 1 298 . 1 1 26 26 VAL N N 26 121.710 121.710 121.105 0.605 17919 122209 1 298 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.702 -0.305 17919 122210 1 298 . 1 1 26 26 VAL C C 26 177.950 177.950 177.474 0.476 17919 122211 1 298 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.107 1.553 17919 122212 1 298 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.785 -0.945 17919 122213 1 298 . 1 1 26 26 VAL H H 26 8.070 8.070 7.736 0.334 17919 122214 1 298 . 1 1 27 27 LYS N N 27 118.860 118.860 120.851 -1.991 17919 122215 1 298 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.232 0.348 17919 122216 1 298 . 1 1 27 27 LYS C C 27 180.550 180.550 178.910 1.640 17919 122217 1 298 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.806 -0.556 17919 122218 1 298 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.424 1.306 17919 122219 1 298 . 1 1 27 27 LYS H H 27 8.560 8.560 8.354 0.206 17919 122220 1 298 . 1 1 28 28 ALA N N 28 123.440 123.440 120.978 2.462 17919 122221 1 298 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.078 0.082 17919 122222 1 298 . 1 1 28 28 ALA C C 28 180.300 180.300 179.134 1.166 17919 122223 1 298 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.081 0.289 17919 122224 1 298 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.304 -0.594 17919 122225 1 298 . 1 1 28 28 ALA H H 28 8.060 8.060 8.065 -0.005 17919 122226 1 298 . 1 1 29 29 LYS N N 29 119.940 119.940 119.539 0.401 17919 122227 1 298 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.018 0.189 17919 122228 1 298 . 1 1 29 29 LYS C C 29 180.320 180.320 178.524 1.796 17919 122229 1 298 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.002 0.649 17919 122230 1 298 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.360 0.930 17919 122231 1 298 . 1 1 29 29 LYS H H 29 7.850 7.850 7.463 0.387 17919 122232 1 298 . 1 1 30 30 ILE N N 30 121.080 121.080 120.187 0.893 17919 122233 1 298 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.736 -0.229 17919 122234 1 298 . 1 1 30 30 ILE C C 30 178.310 178.310 177.388 0.922 17919 122235 1 298 . 1 1 30 30 ILE CA C 30 66.150 66.150 64.660 1.490 17919 122236 1 298 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.902 -1.102 17919 122237 1 298 . 1 1 30 30 ILE H H 30 8.280 8.280 7.866 0.414 17919 122238 1 298 . 1 1 31 31 GLN N N 31 123.490 123.490 121.683 1.807 17919 122239 1 298 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.140 -0.311 17919 122240 1 298 . 1 1 31 31 GLN C C 31 178.890 178.890 178.238 0.652 17919 122241 1 298 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.137 0.863 17919 122242 1 298 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.796 -1.076 17919 122243 1 298 . 1 1 31 31 GLN H H 31 8.580 8.580 8.373 0.207 17919 122244 1 298 . 1 1 32 32 ASP N N 32 119.360 119.360 118.240 1.120 17919 122245 1 298 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.587 -0.233 17919 122246 1 298 . 1 1 32 32 ASP C C 32 177.250 177.250 176.790 0.460 17919 122247 1 298 . 1 1 32 32 ASP CA C 32 57.190 57.190 55.788 1.402 17919 122248 1 298 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.046 0.534 17919 122249 1 298 . 1 1 32 32 ASP H H 32 8.010 8.010 8.327 -0.317 17919 122250 1 298 . 1 1 33 33 LYS N N 33 115.130 115.130 118.838 -3.708 17919 122251 1 298 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.450 -0.113 17919 122252 1 298 . 1 1 33 33 LYS C C 33 177.870 177.870 176.990 0.880 17919 122253 1 298 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.751 0.299 17919 122254 1 298 . 1 1 33 33 LYS CB C 33 34.170 34.170 34.428 -0.258 17919 122255 1 298 . 1 1 33 33 LYS H H 33 7.430 7.430 7.490 -0.060 17919 122256 1 298 . 1 1 34 34 GLU N N 34 113.870 113.870 116.963 -3.093 17919 122257 1 298 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.504 0.121 17919 122258 1 298 . 1 1 34 34 GLU C C 34 177.840 177.840 177.239 0.601 17919 122259 1 298 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.288 -1.118 17919 122260 1 298 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.356 1.304 17919 122261 1 298 . 1 1 34 34 GLU H H 34 8.740 8.740 8.465 0.275 17919 122262 1 298 . 1 1 35 35 GLY N N 35 108.650 108.650 109.519 -0.869 17919 122263 1 298 . 1 1 35 35 GLY C C 35 173.960 173.960 174.259 -0.299 17919 122264 1 298 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.939 0.141 17919 122265 1 298 . 1 1 35 35 GLY H H 35 8.530 8.530 8.370 0.160 17919 122266 1 298 . 1 1 36 36 ILE N N 36 119.880 119.880 122.563 -2.683 17919 122267 1 298 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.353 0.092 17919 122268 1 298 . 1 1 36 36 ILE C C 36 173.590 173.590 174.772 -1.182 17919 122269 1 298 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.832 -0.082 17919 122270 1 298 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.511 2.069 17919 122271 1 298 . 1 1 36 36 ILE H H 36 6.150 6.150 7.751 -1.601 17919 122272 1 298 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.723 -0.089 17919 122273 1 298 . 1 1 37 37 PRO C C 37 176.940 176.940 176.377 0.563 17919 122274 1 298 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.443 0.217 17919 122275 1 298 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.060 0.790 17919 122276 1 298 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.117 -0.000 17919 122277 1 298 . 1 1 38 38 PRO C C 38 178.320 178.320 178.422 -0.102 17919 122278 1 298 . 1 1 38 38 PRO CA C 38 66.260 66.260 66.037 0.223 17919 122279 1 298 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.800 1.090 17919 122280 1 298 . 1 1 39 39 ASP N N 39 113.380 113.380 114.217 -0.837 17919 122281 1 298 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.327 0.103 17919 122282 1 298 . 1 1 39 39 ASP C C 39 177.090 177.090 177.297 -0.207 17919 122283 1 298 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.795 -1.155 17919 122284 1 298 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.467 -0.927 17919 122285 1 298 . 1 1 39 39 ASP H H 39 8.550 8.550 8.732 -0.182 17919 122286 1 298 . 1 1 40 40 GLN N N 40 116.780 116.780 115.306 1.474 17919 122287 1 298 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.366 0.098 17919 122288 1 298 . 1 1 40 40 GLN C C 40 175.380 175.380 176.077 -0.697 17919 122289 1 298 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.260 0.380 17919 122290 1 298 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.396 0.744 17919 122291 1 298 . 1 1 40 40 GLN H H 40 7.820 7.820 7.595 0.225 17919 122292 1 298 . 1 1 41 41 GLN N N 41 117.720 117.720 119.894 -2.174 17919 122293 1 298 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.389 -0.145 17919 122294 1 298 . 1 1 41 41 GLN C C 41 176.300 176.300 174.674 1.626 17919 122295 1 298 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.974 0.496 17919 122296 1 298 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.795 1.855 17919 122297 1 298 . 1 1 41 41 GLN H H 41 7.480 7.480 7.511 -0.031 17919 122298 1 298 . 1 1 42 42 ARG N N 42 122.680 122.680 125.141 -2.461 17919 122299 1 298 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.568 -0.068 17919 122300 1 298 . 1 1 42 42 ARG C C 42 174.050 174.050 173.909 0.141 17919 122301 1 298 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.137 -0.087 17919 122302 1 298 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.485 -0.735 17919 122303 1 298 . 1 1 42 42 ARG H H 42 8.530 8.530 8.837 -0.307 17919 122304 1 298 . 1 1 43 43 LEU N N 43 124.040 124.040 127.850 -3.810 17919 122305 1 298 . 1 1 43 43 LEU C C 43 175.290 175.290 175.171 0.119 17919 122306 1 298 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.524 -1.544 17919 122307 1 298 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.541 2.249 17919 122308 1 298 . 1 1 43 43 LEU H H 43 8.820 8.820 8.847 -0.027 17919 122309 1 298 . 1 1 44 44 ILE N N 44 121.920 121.920 122.410 -0.490 17919 122310 1 298 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.984 0.008 17919 122311 1 298 . 1 1 44 44 ILE C C 44 176.060 176.060 175.149 0.911 17919 122312 1 298 . 1 1 44 44 ILE CA C 44 58.980 58.980 60.477 -1.497 17919 122313 1 298 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.071 0.349 17919 122314 1 298 . 1 1 44 44 ILE H H 44 9.030 9.030 8.586 0.444 17919 122315 1 298 . 1 1 45 45 PHE N N 45 125.390 125.390 127.919 -2.529 17919 122316 1 298 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.716 0.329 17919 122317 1 298 . 1 1 45 45 PHE C C 45 174.470 174.470 175.816 -1.346 17919 122318 1 298 . 1 1 45 45 PHE CA C 45 57.020 57.020 58.884 -1.864 17919 122319 1 298 . 1 1 45 45 PHE CB C 45 43.760 43.760 40.428 3.332 17919 122320 1 298 . 1 1 45 45 PHE H H 45 8.830 8.830 8.171 0.659 17919 122321 1 298 . 1 1 46 46 ALA N N 46 132.200 132.200 119.856 12.344 17919 122322 1 298 . 1 1 46 46 ALA HA H 46 3.690 3.690 4.335 -0.645 17919 122323 1 298 . 1 1 46 46 ALA C C 46 177.290 177.290 178.329 -1.039 17919 122324 1 298 . 1 1 46 46 ALA CA C 46 52.540 52.540 53.029 -0.489 17919 122325 1 298 . 1 1 46 46 ALA CB C 46 16.570 16.570 19.177 -2.607 17919 122326 1 298 . 1 1 46 46 ALA H H 46 8.810 8.810 8.341 0.469 17919 122327 1 298 . 1 1 47 47 GLY N N 47 102.340 102.340 105.284 -2.944 17919 122328 1 298 . 1 1 47 47 GLY C C 47 173.810 173.810 173.488 0.322 17919 122329 1 298 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.183 0.167 17919 122330 1 298 . 1 1 47 47 GLY H H 47 8.130 8.130 8.056 0.074 17919 122331 1 298 . 1 1 48 48 LYS N N 48 121.570 121.570 120.316 1.254 17919 122332 1 298 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.570 0.052 17919 122333 1 298 . 1 1 48 48 LYS C C 48 174.700 174.700 175.073 -0.373 17919 122334 1 298 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.476 -0.926 17919 122335 1 298 . 1 1 48 48 LYS CB C 48 34.530 34.530 35.691 -1.161 17919 122336 1 298 . 1 1 48 48 LYS H H 48 7.980 7.980 7.875 0.105 17919 122337 1 298 . 1 1 49 49 GLN N N 49 122.410 122.410 121.159 1.251 17919 122338 1 298 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.689 -0.129 17919 122339 1 298 . 1 1 49 49 GLN C C 49 175.670 175.670 175.498 0.172 17919 122340 1 298 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.660 0.081 17919 122341 1 298 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.091 -0.091 17919 122342 1 298 . 1 1 49 49 GLN H H 49 8.600 8.600 8.443 0.157 17919 122343 1 298 . 1 1 50 50 LEU N N 50 125.520 125.520 125.661 -0.141 17919 122344 1 298 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.445 -0.355 17919 122345 1 298 . 1 1 50 50 LEU C C 50 176.660 176.660 175.764 0.896 17919 122346 1 298 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.187 0.053 17919 122347 1 298 . 1 1 50 50 LEU CB C 50 41.570 41.570 43.184 -1.614 17919 122348 1 298 . 1 1 50 50 LEU H H 50 8.530 8.530 8.906 -0.376 17919 122349 1 298 . 1 1 51 51 GLU N N 51 122.940 122.940 121.765 1.175 17919 122350 1 298 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.546 -0.058 17919 122351 1 298 . 1 1 51 51 GLU C C 51 175.870 175.870 177.160 -1.290 17919 122352 1 298 . 1 1 51 51 GLU CA C 51 55.960 55.960 54.981 0.979 17919 122353 1 298 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.528 -0.958 17919 122354 1 298 . 1 1 51 51 GLU H H 51 8.400 8.400 8.505 -0.105 17919 122355 1 298 . 1 1 52 52 ASP N N 52 120.030 120.030 125.155 -5.125 17919 122356 1 298 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.490 -0.131 17919 122357 1 298 . 1 1 52 52 ASP C C 52 177.330 177.330 177.212 0.118 17919 122358 1 298 . 1 1 52 52 ASP CA C 52 56.960 56.960 56.936 0.024 17919 122359 1 298 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.967 -0.117 17919 122360 1 298 . 1 1 52 52 ASP H H 52 8.160 8.160 8.783 -0.623 17919 122361 1 298 . 1 1 53 53 GLY N N 53 106.660 106.660 105.730 0.930 17919 122362 1 298 . 1 1 53 53 GLY C C 53 174.870 174.870 173.816 1.054 17919 122363 1 298 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.781 0.390 17919 122364 1 298 . 1 1 53 53 GLY H H 53 9.390 9.390 8.554 0.836 17919 122365 1 298 . 1 1 54 54 ARG N N 54 119.050 119.050 120.702 -1.652 17919 122366 1 298 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.718 -0.023 17919 122367 1 298 . 1 1 54 54 ARG C C 54 175.350 175.350 175.493 -0.143 17919 122368 1 298 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.179 0.210 17919 122369 1 298 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.324 -0.673 17919 122370 1 298 . 1 1 54 54 ARG H H 54 7.460 7.460 7.417 0.043 17919 122371 1 298 . 1 1 55 55 THR N N 55 108.400 108.400 112.461 -4.061 17919 122372 1 298 . 1 1 55 55 THR HA H 55 5.240 5.240 5.222 0.018 17919 122373 1 298 . 1 1 55 55 THR C C 55 176.560 176.560 176.255 0.305 17919 122374 1 298 . 1 1 55 55 THR CA C 55 59.690 59.690 60.217 -0.527 17919 122375 1 298 . 1 1 55 55 THR CB C 55 72.260 72.260 71.084 1.177 17919 122376 1 298 . 1 1 55 55 THR H H 55 8.730 8.730 9.038 -0.308 17919 122377 1 298 . 1 1 56 56 LEU N N 56 117.920 117.920 123.045 -5.125 17919 122378 1 298 . 1 1 56 56 LEU HA H 56 4.060 4.060 3.877 0.183 17919 122379 1 298 . 1 1 56 56 LEU C C 56 180.810 180.810 179.076 1.734 17919 122380 1 298 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.806 -0.096 17919 122381 1 298 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.252 -0.882 17919 122382 1 298 . 1 1 56 56 LEU H H 56 8.140 8.140 9.143 -1.003 17919 122383 1 298 . 1 1 57 57 SER N N 57 113.330 113.330 115.118 -1.788 17919 122384 1 298 . 1 1 57 57 SER HA H 57 4.370 4.370 4.077 0.293 17919 122385 1 298 . 1 1 57 57 SER C C 57 178.310 178.310 177.015 1.295 17919 122386 1 298 . 1 1 57 57 SER CA C 57 61.080 61.080 62.333 -1.253 17919 122387 1 298 . 1 1 57 57 SER CB C 57 62.530 62.530 62.714 -0.184 17919 122388 1 298 . 1 1 57 57 SER H H 57 8.470 8.470 8.318 0.152 17919 122389 1 298 . 1 1 58 58 ASP N N 58 124.190 124.190 120.595 3.595 17919 122390 1 298 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.339 -0.043 17919 122391 1 298 . 1 1 58 58 ASP C C 58 177.400 177.400 176.858 0.542 17919 122392 1 298 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.855 0.325 17919 122393 1 298 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.692 -0.592 17919 122394 1 298 . 1 1 58 58 ASP H H 58 7.930 7.930 7.859 0.071 17919 122395 1 298 . 1 1 59 59 TYR N N 59 115.510 115.510 115.018 0.492 17919 122396 1 298 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.611 0.059 17919 122397 1 298 . 1 1 59 59 TYR C C 59 174.700 174.700 174.436 0.264 17919 122398 1 298 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.543 0.707 17919 122399 1 298 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.585 1.485 17919 122400 1 298 . 1 1 59 59 TYR H H 59 7.250 7.250 7.281 -0.031 17919 122401 1 298 . 1 1 60 60 ASN N N 60 115.900 115.900 115.130 0.770 17919 122402 1 298 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.372 -0.017 17919 122403 1 298 . 1 1 60 60 ASN C C 60 174.340 174.340 174.544 -0.204 17919 122404 1 298 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.303 -0.183 17919 122405 1 298 . 1 1 60 60 ASN CB C 60 37.410 37.410 36.424 0.986 17919 122406 1 298 . 1 1 60 60 ASN H H 60 8.150 8.150 7.910 0.240 17919 122407 1 298 . 1 1 61 61 ILE N N 61 118.600 118.600 120.414 -1.814 17919 122408 1 298 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.943 -0.550 17919 122409 1 298 . 1 1 61 61 ILE C C 61 174.610 174.610 174.950 -0.340 17919 122410 1 298 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.669 0.751 17919 122411 1 298 . 1 1 61 61 ILE CB C 61 36.740 36.740 36.966 -0.226 17919 122412 1 298 . 1 1 61 61 ILE H H 61 7.250 7.250 7.937 -0.687 17919 122413 1 298 . 1 1 62 62 GLN N N 62 124.740 124.740 124.916 -0.176 17919 122414 1 298 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.875 -0.369 17919 122415 1 298 . 1 1 62 62 GLN C C 62 175.970 175.970 175.673 0.297 17919 122416 1 298 . 1 1 62 62 GLN CA C 62 53.660 53.660 52.928 0.732 17919 122417 1 298 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.873 -0.223 17919 122418 1 298 . 1 1 62 62 GLN H H 62 7.610 7.610 7.862 -0.252 17919 122419 1 298 . 1 1 63 63 LYS N N 63 120.300 120.300 122.459 -2.159 17919 122420 1 298 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.948 0.053 17919 122421 1 298 . 1 1 63 63 LYS C C 63 175.810 175.810 177.282 -1.472 17919 122422 1 298 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.383 -0.593 17919 122423 1 298 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.389 0.261 17919 122424 1 298 . 1 1 63 63 LYS H H 63 8.490 8.490 8.744 -0.254 17919 122425 1 298 . 1 1 64 64 GLU N N 64 113.950 113.950 121.357 -7.407 17919 122426 1 298 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.552 -0.087 17919 122427 1 298 . 1 1 64 64 GLU C C 64 175.250 175.250 175.905 -0.655 17919 122428 1 298 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.763 0.127 17919 122429 1 298 . 1 1 64 64 GLU CB C 64 25.900 25.900 29.054 -3.154 17919 122430 1 298 . 1 1 64 64 GLU H H 64 9.280 9.280 8.958 0.322 17919 122431 1 298 . 1 1 65 65 SER N N 65 114.730 114.730 115.878 -1.148 17919 122432 1 298 . 1 1 65 65 SER HA H 65 4.640 4.640 4.434 0.206 17919 122433 1 298 . 1 1 65 65 SER C C 65 172.160 172.160 173.748 -1.588 17919 122434 1 298 . 1 1 65 65 SER CA C 65 60.890 60.890 60.864 0.026 17919 122435 1 298 . 1 1 65 65 SER CB C 65 64.910 64.910 64.104 0.806 17919 122436 1 298 . 1 1 65 65 SER H H 65 7.670 7.670 7.744 -0.074 17919 122437 1 298 . 1 1 66 66 THR N N 66 117.110 117.110 119.999 -2.889 17919 122438 1 298 . 1 1 66 66 THR HA H 66 5.270 5.270 5.016 0.254 17919 122439 1 298 . 1 1 66 66 THR C C 66 173.950 173.950 173.874 0.076 17919 122440 1 298 . 1 1 66 66 THR CA C 66 62.340 62.340 61.966 0.374 17919 122441 1 298 . 1 1 66 66 THR CB C 66 70.080 70.080 70.879 -0.799 17919 122442 1 298 . 1 1 66 66 THR H H 66 8.730 8.730 8.604 0.126 17919 122443 1 298 . 1 1 67 67 LEU N N 67 127.110 127.110 126.689 0.421 17919 122444 1 298 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.989 0.071 17919 122445 1 298 . 1 1 67 67 LEU C C 67 175.770 175.770 175.106 0.664 17919 122446 1 298 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.850 0.050 17919 122447 1 298 . 1 1 67 67 LEU CB C 67 44.260 44.260 45.270 -1.010 17919 122448 1 298 . 1 1 67 67 LEU H H 67 9.410 9.410 9.152 0.258 17919 122449 1 298 . 1 1 68 68 HIS N N 68 118.380 118.380 120.903 -2.523 17919 122450 1 298 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.382 -0.142 17919 122451 1 298 . 1 1 68 68 HIS C C 68 173.150 173.150 173.959 -0.809 17919 122452 1 298 . 1 1 68 68 HIS CA C 68 55.000 55.000 53.946 1.054 17919 122453 1 298 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.227 -1.697 17919 122454 1 298 . 1 1 68 68 HIS H H 68 9.230 9.230 9.302 -0.072 17919 122455 1 298 . 1 1 69 69 LEU N N 69 124.460 124.460 130.034 -5.574 17919 122456 1 298 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.105 0.085 17919 122457 1 298 . 1 1 69 69 LEU C C 69 175.270 175.270 174.770 0.500 17919 122458 1 298 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.671 0.219 17919 122459 1 298 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.094 0.286 17919 122460 1 298 . 1 1 69 69 LEU H H 69 8.340 8.340 8.540 -0.200 17919 122461 1 298 . 1 1 70 70 VAL N N 70 126.940 126.940 121.017 5.923 17919 122462 1 298 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.440 -0.090 17919 122463 1 298 . 1 1 70 70 VAL C C 70 174.000 174.000 174.032 -0.032 17919 122464 1 298 . 1 1 70 70 VAL CA C 70 60.800 60.800 59.653 1.147 17919 122465 1 298 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.719 -0.810 17919 122466 1 298 . 1 1 70 70 VAL H H 70 9.200 9.200 8.890 0.310 17919 122467 1 298 . 1 1 71 71 LEU N N 71 123.130 123.130 122.419 0.711 17919 122468 1 298 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.034 0.026 17919 122469 1 298 . 1 1 71 71 LEU C C 71 177.830 177.830 177.250 0.580 17919 122470 1 298 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.243 0.697 17919 122471 1 298 . 1 1 71 71 LEU CB C 71 42.850 42.850 41.168 1.682 17919 122472 1 298 . 1 1 71 71 LEU H H 71 8.120 8.120 8.312 -0.193 17919 122473 1 298 . 1 1 72 72 ARG N N 72 123.490 123.490 125.752 -2.262 17919 122474 1 298 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.324 -0.023 17919 122475 1 298 . 1 1 72 72 ARG C C 72 175.350 175.350 175.292 0.058 17919 122476 1 298 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.006 -0.396 17919 122477 1 298 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.821 0.529 17919 122478 1 298 . 1 1 72 72 ARG H H 72 8.580 8.580 8.143 0.437 17919 122479 1 299 . 1 1 2 2 GLN N N 2 123.220 123.220 122.008 1.212 17919 122480 1 299 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.385 -0.136 17919 122481 1 299 . 1 1 2 2 GLN C C 2 175.920 175.920 174.822 1.098 17919 122482 1 299 . 1 1 2 2 GLN CA C 2 55.080 55.080 55.013 0.067 17919 122483 1 299 . 1 1 2 2 GLN CB C 2 30.760 30.760 31.115 -0.355 17919 122484 1 299 . 1 1 2 2 GLN H H 2 8.900 8.900 8.456 0.444 17919 122485 1 299 . 1 1 3 3 ILE N N 3 115.340 115.340 117.942 -2.602 17919 122486 1 299 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.755 -0.542 17919 122487 1 299 . 1 1 3 3 ILE C C 3 172.450 172.450 173.255 -0.805 17919 122488 1 299 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.029 0.541 17919 122489 1 299 . 1 1 3 3 ILE CB C 3 42.210 42.210 42.057 0.153 17919 122490 1 299 . 1 1 3 3 ILE H H 3 8.320 8.320 8.769 -0.449 17919 122491 1 299 . 1 1 4 4 PHE N N 4 118.110 118.110 117.999 0.111 17919 122492 1 299 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.548 0.082 17919 122493 1 299 . 1 1 4 4 PHE C C 4 175.320 175.320 175.149 0.171 17919 122494 1 299 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.868 -0.659 17919 122495 1 299 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.700 -0.220 17919 122496 1 299 . 1 1 4 4 PHE H H 4 8.610 8.610 8.313 0.297 17919 122497 1 299 . 1 1 5 5 VAL N N 5 121.000 121.000 122.567 -1.567 17919 122498 1 299 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.647 0.078 17919 122499 1 299 . 1 1 5 5 VAL C C 5 174.870 174.870 174.917 -0.047 17919 122500 1 299 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.394 -0.774 17919 122501 1 299 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.281 -0.051 17919 122502 1 299 . 1 1 5 5 VAL H H 5 9.300 9.300 9.184 0.116 17919 122503 1 299 . 1 1 6 6 LYS N N 6 127.520 127.520 128.496 -0.976 17919 122504 1 299 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.358 0.009 17919 122505 1 299 . 1 1 6 6 LYS C C 6 177.140 177.140 176.418 0.722 17919 122506 1 299 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.447 0.073 17919 122507 1 299 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.554 0.496 17919 122508 1 299 . 1 1 6 6 LYS H H 6 8.820 8.820 9.060 -0.240 17919 122509 1 299 . 1 1 7 7 THR N N 7 115.400 115.400 116.464 -1.064 17919 122510 1 299 . 1 1 7 7 THR HA H 7 4.970 4.970 4.512 0.458 17919 122511 1 299 . 1 1 7 7 THR C C 7 176.910 176.910 176.098 0.812 17919 122512 1 299 . 1 1 7 7 THR CA C 7 60.470 60.470 61.473 -1.003 17919 122513 1 299 . 1 1 7 7 THR CB C 7 70.630 70.630 70.549 0.081 17919 122514 1 299 . 1 1 7 7 THR H H 7 8.730 8.730 8.640 0.090 17919 122515 1 299 . 1 1 8 8 LEU N N 8 121.330 121.330 124.335 -3.005 17919 122516 1 299 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.141 0.169 17919 122517 1 299 . 1 1 8 8 LEU C C 8 178.800 178.800 177.692 1.108 17919 122518 1 299 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.735 -0.155 17919 122519 1 299 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.128 -0.158 17919 122520 1 299 . 1 1 8 8 LEU H H 8 9.100 9.100 8.679 0.421 17919 122521 1 299 . 1 1 9 9 THR N N 9 105.590 105.590 109.084 -3.494 17919 122522 1 299 . 1 1 9 9 THR HA H 9 4.428 4.428 4.335 0.093 17919 122523 1 299 . 1 1 9 9 THR C C 9 175.520 175.520 175.193 0.327 17919 122524 1 299 . 1 1 9 9 THR CA C 9 61.400 61.400 61.517 -0.117 17919 122525 1 299 . 1 1 9 9 THR CB C 9 69.140 69.140 69.198 -0.059 17919 122526 1 299 . 1 1 9 9 THR H H 9 7.630 7.630 7.641 -0.011 17919 122527 1 299 . 1 1 10 10 GLY N N 10 108.890 108.890 111.353 -2.463 17919 122528 1 299 . 1 1 10 10 GLY C C 10 174.070 174.070 173.589 0.481 17919 122529 1 299 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.335 0.125 17919 122530 1 299 . 1 1 10 10 GLY H H 10 7.810 7.810 8.289 -0.479 17919 122531 1 299 . 1 1 11 11 LYS N N 11 121.600 121.600 120.040 1.560 17919 122532 1 299 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.612 -0.251 17919 122533 1 299 . 1 1 11 11 LYS C C 11 175.940 175.940 175.677 0.263 17919 122534 1 299 . 1 1 11 11 LYS CA C 11 56.280 56.280 54.711 1.569 17919 122535 1 299 . 1 1 11 11 LYS CB C 11 33.200 33.200 34.905 -1.705 17919 122536 1 299 . 1 1 11 11 LYS H H 11 7.280 7.280 7.563 -0.283 17919 122537 1 299 . 1 1 12 12 THR N N 12 120.440 120.440 119.676 0.764 17919 122538 1 299 . 1 1 12 12 THR HA H 12 5.046 5.046 5.024 0.022 17919 122539 1 299 . 1 1 12 12 THR C C 12 174.320 174.320 174.275 0.045 17919 122540 1 299 . 1 1 12 12 THR CA C 12 62.390 62.390 61.654 0.737 17919 122541 1 299 . 1 1 12 12 THR CB C 12 69.910 69.910 69.936 -0.026 17919 122542 1 299 . 1 1 12 12 THR H H 12 8.650 8.650 8.482 0.168 17919 122543 1 299 . 1 1 13 13 ILE N N 13 127.110 127.110 122.369 4.741 17919 122544 1 299 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.785 -0.241 17919 122545 1 299 . 1 1 13 13 ILE C C 13 175.220 175.220 174.680 0.540 17919 122546 1 299 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.118 0.862 17919 122547 1 299 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.537 -0.587 17919 122548 1 299 . 1 1 13 13 ILE H H 13 9.450 9.450 8.953 0.497 17919 122549 1 299 . 1 1 14 14 THR N N 14 121.520 121.520 117.043 4.477 17919 122550 1 299 . 1 1 14 14 THR HA H 14 4.964 4.964 5.192 -0.228 17919 122551 1 299 . 1 1 14 14 THR C C 14 173.790 173.790 174.282 -0.492 17919 122552 1 299 . 1 1 14 14 THR CA C 14 61.940 61.940 60.921 1.019 17919 122553 1 299 . 1 1 14 14 THR CB C 14 69.650 69.650 69.724 -0.074 17919 122554 1 299 . 1 1 14 14 THR H H 14 8.710 8.710 8.275 0.435 17919 122555 1 299 . 1 1 15 15 LEU N N 15 124.800 124.800 127.526 -2.726 17919 122556 1 299 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.727 0.053 17919 122557 1 299 . 1 1 15 15 LEU C C 15 174.670 174.670 175.355 -0.685 17919 122558 1 299 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.849 -1.019 17919 122559 1 299 . 1 1 15 15 LEU CB C 15 47.070 47.070 46.143 0.927 17919 122560 1 299 . 1 1 15 15 LEU H H 15 8.710 8.710 8.829 -0.119 17919 122561 1 299 . 1 1 16 16 GLU N N 16 122.160 122.160 122.034 0.126 17919 122562 1 299 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.309 -0.392 17919 122563 1 299 . 1 1 16 16 GLU C C 16 175.860 175.860 176.045 -0.185 17919 122564 1 299 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.762 -0.942 17919 122565 1 299 . 1 1 16 16 GLU CB C 16 29.450 29.450 31.088 -1.638 17919 122566 1 299 . 1 1 16 16 GLU H H 16 8.140 8.140 8.679 -0.539 17919 122567 1 299 . 1 1 17 17 VAL N N 17 117.210 117.210 118.949 -1.739 17919 122568 1 299 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.826 -0.112 17919 122569 1 299 . 1 1 17 17 VAL C C 17 174.160 174.160 174.788 -0.628 17919 122570 1 299 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.282 -0.852 17919 122571 1 299 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.709 0.691 17919 122572 1 299 . 1 1 17 17 VAL H H 17 8.900 8.900 8.965 -0.065 17919 122573 1 299 . 1 1 18 18 GLU N N 18 118.990 118.990 122.300 -3.310 17919 122574 1 299 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.872 0.207 17919 122575 1 299 . 1 1 18 18 GLU C C 18 176.160 176.160 175.308 0.852 17919 122576 1 299 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.404 0.316 17919 122577 1 299 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.174 0.136 17919 122578 1 299 . 1 1 18 18 GLU H H 18 8.640 8.640 8.543 0.097 17919 122579 1 299 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.314 -0.173 17919 122580 1 299 . 1 1 19 19 PRO C C 19 175.310 175.310 177.257 -1.947 17919 122581 1 299 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.269 0.202 17919 122582 1 299 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.789 0.161 17919 122583 1 299 . 1 1 20 20 SER N N 20 103.400 103.400 110.752 -7.352 17919 122584 1 299 . 1 1 20 20 SER HA H 20 4.370 4.370 4.324 0.046 17919 122585 1 299 . 1 1 20 20 SER C C 20 174.660 174.660 174.597 0.063 17919 122586 1 299 . 1 1 20 20 SER CA C 20 57.400 57.400 58.596 -1.196 17919 122587 1 299 . 1 1 20 20 SER CB C 20 63.370 63.370 62.847 0.523 17919 122588 1 299 . 1 1 20 20 SER H H 20 7.040 7.040 8.276 -1.236 17919 122589 1 299 . 1 1 21 21 ASP N N 21 123.480 123.480 124.645 -1.165 17919 122590 1 299 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.878 -0.183 17919 122591 1 299 . 1 1 21 21 ASP C C 21 176.360 176.360 176.140 0.220 17919 122592 1 299 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.626 1.074 17919 122593 1 299 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.743 -0.943 17919 122594 1 299 . 1 1 21 21 ASP H H 21 8.030 8.030 7.847 0.183 17919 122595 1 299 . 1 1 22 22 THR N N 22 108.800 108.800 113.565 -4.765 17919 122596 1 299 . 1 1 22 22 THR HA H 22 4.920 4.920 5.046 -0.126 17919 122597 1 299 . 1 1 22 22 THR C C 22 176.750 176.750 176.413 0.337 17919 122598 1 299 . 1 1 22 22 THR CA C 22 59.690 59.690 61.396 -1.706 17919 122599 1 299 . 1 1 22 22 THR CB C 22 71.200 71.200 70.277 0.923 17919 122600 1 299 . 1 1 22 22 THR H H 22 7.900 7.900 8.215 -0.315 17919 122601 1 299 . 1 1 23 23 ILE N N 23 121.190 121.190 121.845 -0.655 17919 122602 1 299 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.752 -0.095 17919 122603 1 299 . 1 1 23 23 ILE C C 23 179.040 179.040 177.668 1.372 17919 122604 1 299 . 1 1 23 23 ILE CA C 23 62.260 62.260 63.154 -0.894 17919 122605 1 299 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.287 -1.937 17919 122606 1 299 . 1 1 23 23 ILE H H 23 8.560 8.560 8.337 0.223 17919 122607 1 299 . 1 1 24 24 GLU N N 24 120.830 120.830 121.189 -0.359 17919 122608 1 299 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.825 0.092 17919 122609 1 299 . 1 1 24 24 GLU C C 24 178.640 178.640 178.630 0.010 17919 122610 1 299 . 1 1 24 24 GLU CA C 24 60.220 60.220 60.114 0.106 17919 122611 1 299 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.384 -1.104 17919 122612 1 299 . 1 1 24 24 GLU H H 24 9.760 9.760 7.975 1.785 17919 122613 1 299 . 1 1 25 25 ASN N N 25 120.570 120.570 117.980 2.590 17919 122614 1 299 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.433 0.092 17919 122615 1 299 . 1 1 25 25 ASN C C 25 178.380 178.380 177.817 0.563 17919 122616 1 299 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.361 -0.301 17919 122617 1 299 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.634 -0.184 17919 122618 1 299 . 1 1 25 25 ASN H H 25 7.920 7.920 7.670 0.250 17919 122619 1 299 . 1 1 26 26 VAL N N 26 121.710 121.710 119.651 2.059 17919 122620 1 299 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.661 -0.264 17919 122621 1 299 . 1 1 26 26 VAL C C 26 177.950 177.950 178.158 -0.208 17919 122622 1 299 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.181 1.479 17919 122623 1 299 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.031 -0.191 17919 122624 1 299 . 1 1 26 26 VAL H H 26 8.070 8.070 7.862 0.208 17919 122625 1 299 . 1 1 27 27 LYS N N 27 118.860 118.860 119.808 -0.948 17919 122626 1 299 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.180 0.400 17919 122627 1 299 . 1 1 27 27 LYS C C 27 180.550 180.550 179.204 1.346 17919 122628 1 299 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.544 -0.294 17919 122629 1 299 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.093 1.637 17919 122630 1 299 . 1 1 27 27 LYS H H 27 8.560 8.560 8.480 0.080 17919 122631 1 299 . 1 1 28 28 ALA N N 28 123.440 123.440 122.368 1.072 17919 122632 1 299 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.126 0.034 17919 122633 1 299 . 1 1 28 28 ALA C C 28 180.300 180.300 179.218 1.082 17919 122634 1 299 . 1 1 28 28 ALA CA C 28 55.370 55.370 54.937 0.433 17919 122635 1 299 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.506 -0.796 17919 122636 1 299 . 1 1 28 28 ALA H H 28 8.060 8.060 8.107 -0.047 17919 122637 1 299 . 1 1 29 29 LYS N N 29 119.940 119.940 118.594 1.346 17919 122638 1 299 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.050 0.157 17919 122639 1 299 . 1 1 29 29 LYS C C 29 180.320 180.320 179.310 1.010 17919 122640 1 299 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.217 0.433 17919 122641 1 299 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.398 0.892 17919 122642 1 299 . 1 1 29 29 LYS H H 29 7.850 7.850 8.017 -0.167 17919 122643 1 299 . 1 1 30 30 ILE N N 30 121.080 121.080 120.611 0.469 17919 122644 1 299 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.630 -0.123 17919 122645 1 299 . 1 1 30 30 ILE C C 30 178.310 178.310 177.387 0.923 17919 122646 1 299 . 1 1 30 30 ILE CA C 30 66.150 66.150 64.957 1.193 17919 122647 1 299 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.698 -0.898 17919 122648 1 299 . 1 1 30 30 ILE H H 30 8.280 8.280 7.904 0.376 17919 122649 1 299 . 1 1 31 31 GLN N N 31 123.490 123.490 120.539 2.951 17919 122650 1 299 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.890 -0.061 17919 122651 1 299 . 1 1 31 31 GLN C C 31 178.890 178.890 178.390 0.500 17919 122652 1 299 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.420 0.579 17919 122653 1 299 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.432 -0.712 17919 122654 1 299 . 1 1 31 31 GLN H H 31 8.580 8.580 7.880 0.700 17919 122655 1 299 . 1 1 32 32 ASP N N 32 119.360 119.360 119.205 0.155 17919 122656 1 299 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.402 -0.048 17919 122657 1 299 . 1 1 32 32 ASP C C 32 177.250 177.250 177.848 -0.598 17919 122658 1 299 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.837 0.353 17919 122659 1 299 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.745 -0.165 17919 122660 1 299 . 1 1 32 32 ASP H H 32 8.010 8.010 7.930 0.080 17919 122661 1 299 . 1 1 33 33 LYS N N 33 115.130 115.130 117.084 -1.954 17919 122662 1 299 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.368 -0.031 17919 122663 1 299 . 1 1 33 33 LYS C C 33 177.870 177.870 177.776 0.094 17919 122664 1 299 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.753 0.297 17919 122665 1 299 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.404 0.766 17919 122666 1 299 . 1 1 33 33 LYS H H 33 7.430 7.430 7.412 0.018 17919 122667 1 299 . 1 1 34 34 GLU N N 34 113.870 113.870 114.261 -0.391 17919 122668 1 299 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.505 0.120 17919 122669 1 299 . 1 1 34 34 GLU C C 34 177.840 177.840 177.042 0.798 17919 122670 1 299 . 1 1 34 34 GLU CA C 34 55.170 55.170 56.220 -1.050 17919 122671 1 299 . 1 1 34 34 GLU CB C 34 32.660 32.660 32.740 -0.080 17919 122672 1 299 . 1 1 34 34 GLU H H 34 8.740 8.740 8.219 0.521 17919 122673 1 299 . 1 1 35 35 GLY N N 35 108.650 108.650 109.090 -0.440 17919 122674 1 299 . 1 1 35 35 GLY C C 35 173.960 173.960 174.302 -0.342 17919 122675 1 299 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.764 0.316 17919 122676 1 299 . 1 1 35 35 GLY H H 35 8.530 8.530 8.408 0.122 17919 122677 1 299 . 1 1 36 36 ILE N N 36 119.880 119.880 121.953 -2.073 17919 122678 1 299 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.288 0.157 17919 122679 1 299 . 1 1 36 36 ILE C C 36 173.590 173.590 174.115 -0.525 17919 122680 1 299 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.220 -0.470 17919 122681 1 299 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.269 2.311 17919 122682 1 299 . 1 1 36 36 ILE H H 36 6.150 6.150 7.736 -1.586 17919 122683 1 299 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.748 -0.114 17919 122684 1 299 . 1 1 37 37 PRO C C 37 176.940 176.940 175.758 1.182 17919 122685 1 299 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.758 -0.098 17919 122686 1 299 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.373 0.477 17919 122687 1 299 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.128 -0.011 17919 122688 1 299 . 1 1 38 38 PRO C C 38 178.320 178.320 178.446 -0.126 17919 122689 1 299 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.950 0.310 17919 122690 1 299 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.641 1.249 17919 122691 1 299 . 1 1 39 39 ASP N N 39 113.380 113.380 114.464 -1.084 17919 122692 1 299 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.330 0.100 17919 122693 1 299 . 1 1 39 39 ASP C C 39 177.090 177.090 177.864 -0.774 17919 122694 1 299 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.930 -1.290 17919 122695 1 299 . 1 1 39 39 ASP CB C 39 39.540 39.540 39.447 0.093 17919 122696 1 299 . 1 1 39 39 ASP H H 39 8.550 8.550 8.879 -0.329 17919 122697 1 299 . 1 1 40 40 GLN N N 40 116.780 116.780 117.226 -0.446 17919 122698 1 299 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.417 0.047 17919 122699 1 299 . 1 1 40 40 GLN C C 40 175.380 175.380 176.441 -1.061 17919 122700 1 299 . 1 1 40 40 GLN CA C 40 55.640 55.640 55.252 0.388 17919 122701 1 299 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.128 1.012 17919 122702 1 299 . 1 1 40 40 GLN H H 40 7.820 7.820 7.596 0.224 17919 122703 1 299 . 1 1 41 41 GLN N N 41 117.720 117.720 120.305 -2.585 17919 122704 1 299 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.177 0.067 17919 122705 1 299 . 1 1 41 41 GLN C C 41 176.300 176.300 174.932 1.368 17919 122706 1 299 . 1 1 41 41 GLN CA C 41 56.470 56.470 57.072 -0.602 17919 122707 1 299 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.365 2.285 17919 122708 1 299 . 1 1 41 41 GLN H H 41 7.480 7.480 7.837 -0.357 17919 122709 1 299 . 1 1 42 42 ARG N N 42 122.680 122.680 124.613 -1.933 17919 122710 1 299 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.615 -0.115 17919 122711 1 299 . 1 1 42 42 ARG C C 42 174.050 174.050 174.161 -0.111 17919 122712 1 299 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.028 0.022 17919 122713 1 299 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.710 -0.960 17919 122714 1 299 . 1 1 42 42 ARG H H 42 8.530 8.530 8.506 0.024 17919 122715 1 299 . 1 1 43 43 LEU N N 43 124.040 124.040 128.001 -3.961 17919 122716 1 299 . 1 1 43 43 LEU C C 43 175.290 175.290 175.649 -0.359 17919 122717 1 299 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.849 -0.869 17919 122718 1 299 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.850 1.940 17919 122719 1 299 . 1 1 43 43 LEU H H 43 8.820 8.820 8.776 0.044 17919 122720 1 299 . 1 1 44 44 ILE N N 44 121.920 121.920 121.578 0.342 17919 122721 1 299 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.344 -0.352 17919 122722 1 299 . 1 1 44 44 ILE C C 44 176.060 176.060 174.470 1.590 17919 122723 1 299 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.845 -0.865 17919 122724 1 299 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.480 -0.060 17919 122725 1 299 . 1 1 44 44 ILE H H 44 9.030 9.030 9.216 -0.186 17919 122726 1 299 . 1 1 45 45 PHE N N 45 125.390 125.390 127.080 -1.690 17919 122727 1 299 . 1 1 45 45 PHE HA H 45 5.045 5.045 5.057 -0.012 17919 122728 1 299 . 1 1 45 45 PHE C C 45 174.470 174.470 174.461 0.009 17919 122729 1 299 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.567 0.453 17919 122730 1 299 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.974 0.786 17919 122731 1 299 . 1 1 45 45 PHE H H 45 8.830 8.830 8.838 -0.007 17919 122732 1 299 . 1 1 46 46 ALA N N 46 132.200 132.200 130.737 1.463 17919 122733 1 299 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.680 0.010 17919 122734 1 299 . 1 1 46 46 ALA C C 46 177.290 177.290 177.480 -0.190 17919 122735 1 299 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.800 -0.260 17919 122736 1 299 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.360 0.210 17919 122737 1 299 . 1 1 46 46 ALA H H 46 8.810 8.810 8.917 -0.107 17919 122738 1 299 . 1 1 47 47 GLY N N 47 102.340 102.340 104.831 -2.491 17919 122739 1 299 . 1 1 47 47 GLY C C 47 173.810 173.810 174.649 -0.839 17919 122740 1 299 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.400 -0.050 17919 122741 1 299 . 1 1 47 47 GLY H H 47 8.130 8.130 8.549 -0.419 17919 122742 1 299 . 1 1 48 48 LYS N N 48 121.570 121.570 121.335 0.235 17919 122743 1 299 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.563 0.059 17919 122744 1 299 . 1 1 48 48 LYS C C 48 174.700 174.700 175.228 -0.528 17919 122745 1 299 . 1 1 48 48 LYS CA C 48 54.550 54.550 55.199 -0.649 17919 122746 1 299 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.351 0.179 17919 122747 1 299 . 1 1 48 48 LYS H H 48 7.980 7.980 7.792 0.188 17919 122748 1 299 . 1 1 49 49 GLN N N 49 122.410 122.410 123.579 -1.169 17919 122749 1 299 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.618 -0.058 17919 122750 1 299 . 1 1 49 49 GLN C C 49 175.670 175.670 175.757 -0.087 17919 122751 1 299 . 1 1 49 49 GLN CA C 49 55.740 55.740 55.450 0.290 17919 122752 1 299 . 1 1 49 49 GLN CB C 49 29.000 29.000 28.923 0.077 17919 122753 1 299 . 1 1 49 49 GLN H H 49 8.600 8.600 8.540 0.060 17919 122754 1 299 . 1 1 50 50 LEU N N 50 125.520 125.520 129.974 -4.454 17919 122755 1 299 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.459 -0.369 17919 122756 1 299 . 1 1 50 50 LEU C C 50 176.660 176.660 176.319 0.341 17919 122757 1 299 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.736 -0.495 17919 122758 1 299 . 1 1 50 50 LEU CB C 50 41.570 41.570 41.589 -0.019 17919 122759 1 299 . 1 1 50 50 LEU H H 50 8.530 8.530 8.693 -0.163 17919 122760 1 299 . 1 1 51 51 GLU N N 51 122.940 122.940 124.461 -1.521 17919 122761 1 299 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.602 -0.114 17919 122762 1 299 . 1 1 51 51 GLU C C 51 175.870 175.870 176.894 -1.024 17919 122763 1 299 . 1 1 51 51 GLU CA C 51 55.960 55.960 54.913 1.047 17919 122764 1 299 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.436 0.134 17919 122765 1 299 . 1 1 51 51 GLU H H 51 8.400 8.400 8.833 -0.433 17919 122766 1 299 . 1 1 52 52 ASP N N 52 120.030 120.030 121.901 -1.871 17919 122767 1 299 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.476 -0.117 17919 122768 1 299 . 1 1 52 52 ASP C C 52 177.330 177.330 177.614 -0.284 17919 122769 1 299 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.320 -0.360 17919 122770 1 299 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.643 0.207 17919 122771 1 299 . 1 1 52 52 ASP H H 52 8.160 8.160 8.843 -0.683 17919 122772 1 299 . 1 1 53 53 GLY N N 53 106.660 106.660 106.411 0.249 17919 122773 1 299 . 1 1 53 53 GLY C C 53 174.870 174.870 173.837 1.033 17919 122774 1 299 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.905 0.265 17919 122775 1 299 . 1 1 53 53 GLY H H 53 9.390 9.390 8.564 0.826 17919 122776 1 299 . 1 1 54 54 ARG N N 54 119.050 119.050 119.857 -0.807 17919 122777 1 299 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.478 0.217 17919 122778 1 299 . 1 1 54 54 ARG C C 54 175.350 175.350 176.482 -1.132 17919 122779 1 299 . 1 1 54 54 ARG CA C 54 54.390 54.390 55.008 -0.618 17919 122780 1 299 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.222 0.428 17919 122781 1 299 . 1 1 54 54 ARG H H 54 7.460 7.460 7.260 0.200 17919 122782 1 299 . 1 1 55 55 THR N N 55 108.400 108.400 112.798 -4.398 17919 122783 1 299 . 1 1 55 55 THR HA H 55 5.240 5.240 4.621 0.619 17919 122784 1 299 . 1 1 55 55 THR C C 55 176.560 176.560 175.983 0.577 17919 122785 1 299 . 1 1 55 55 THR CA C 55 59.690 59.690 61.145 -1.455 17919 122786 1 299 . 1 1 55 55 THR CB C 55 72.260 72.260 70.403 1.858 17919 122787 1 299 . 1 1 55 55 THR H H 55 8.730 8.730 9.112 -0.382 17919 122788 1 299 . 1 1 56 56 LEU N N 56 117.920 117.920 121.754 -3.834 17919 122789 1 299 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.067 -0.007 17919 122790 1 299 . 1 1 56 56 LEU C C 56 180.810 180.810 178.763 2.047 17919 122791 1 299 . 1 1 56 56 LEU CA C 56 58.710 58.710 57.953 0.757 17919 122792 1 299 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.534 -1.164 17919 122793 1 299 . 1 1 56 56 LEU H H 56 8.140 8.140 8.723 -0.583 17919 122794 1 299 . 1 1 57 57 SER N N 57 113.330 113.330 116.183 -2.853 17919 122795 1 299 . 1 1 57 57 SER HA H 57 4.370 4.370 4.119 0.251 17919 122796 1 299 . 1 1 57 57 SER C C 57 178.310 178.310 176.653 1.657 17919 122797 1 299 . 1 1 57 57 SER CA C 57 61.080 61.080 62.596 -1.516 17919 122798 1 299 . 1 1 57 57 SER CB C 57 62.530 62.530 62.821 -0.291 17919 122799 1 299 . 1 1 57 57 SER H H 57 8.470 8.470 8.349 0.121 17919 122800 1 299 . 1 1 58 58 ASP N N 58 124.190 124.190 121.147 3.043 17919 122801 1 299 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.309 -0.013 17919 122802 1 299 . 1 1 58 58 ASP C C 58 177.400 177.400 176.710 0.690 17919 122803 1 299 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.684 0.496 17919 122804 1 299 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.434 -0.334 17919 122805 1 299 . 1 1 58 58 ASP H H 58 7.930 7.930 7.956 -0.026 17919 122806 1 299 . 1 1 59 59 TYR N N 59 115.510 115.510 115.559 -0.049 17919 122807 1 299 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.669 0.001 17919 122808 1 299 . 1 1 59 59 TYR C C 59 174.700 174.700 174.462 0.238 17919 122809 1 299 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.396 0.854 17919 122810 1 299 . 1 1 59 59 TYR CB C 59 40.070 40.070 39.127 0.943 17919 122811 1 299 . 1 1 59 59 TYR H H 59 7.250 7.250 7.355 -0.105 17919 122812 1 299 . 1 1 60 60 ASN N N 60 115.900 115.900 115.330 0.570 17919 122813 1 299 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.382 -0.027 17919 122814 1 299 . 1 1 60 60 ASN C C 60 174.340 174.340 174.930 -0.590 17919 122815 1 299 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.239 -0.119 17919 122816 1 299 . 1 1 60 60 ASN CB C 60 37.410 37.410 36.968 0.442 17919 122817 1 299 . 1 1 60 60 ASN H H 60 8.150 8.150 8.052 0.098 17919 122818 1 299 . 1 1 61 61 ILE N N 61 118.600 118.600 118.382 0.218 17919 122819 1 299 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.736 -0.343 17919 122820 1 299 . 1 1 61 61 ILE C C 61 174.610 174.610 175.937 -1.327 17919 122821 1 299 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.154 1.266 17919 122822 1 299 . 1 1 61 61 ILE CB C 61 36.740 36.740 36.969 -0.229 17919 122823 1 299 . 1 1 61 61 ILE H H 61 7.250 7.250 7.452 -0.202 17919 122824 1 299 . 1 1 62 62 GLN N N 62 124.740 124.740 123.380 1.360 17919 122825 1 299 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.795 -0.289 17919 122826 1 299 . 1 1 62 62 GLN C C 62 175.970 175.970 175.418 0.552 17919 122827 1 299 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.499 0.161 17919 122828 1 299 . 1 1 62 62 GLN CB C 62 31.650 31.650 32.845 -1.195 17919 122829 1 299 . 1 1 62 62 GLN H H 62 7.610 7.610 7.898 -0.288 17919 122830 1 299 . 1 1 63 63 LYS N N 63 120.300 120.300 122.231 -1.931 17919 122831 1 299 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.104 -0.103 17919 122832 1 299 . 1 1 63 63 LYS C C 63 175.810 175.810 177.072 -1.262 17919 122833 1 299 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.725 0.065 17919 122834 1 299 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.327 0.323 17919 122835 1 299 . 1 1 63 63 LYS H H 63 8.490 8.490 8.611 -0.121 17919 122836 1 299 . 1 1 64 64 GLU N N 64 113.950 113.950 118.925 -4.975 17919 122837 1 299 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.896 -0.431 17919 122838 1 299 . 1 1 64 64 GLU C C 64 175.250 175.250 175.364 -0.114 17919 122839 1 299 . 1 1 64 64 GLU CA C 64 57.890 57.890 58.115 -0.225 17919 122840 1 299 . 1 1 64 64 GLU CB C 64 25.900 25.900 29.408 -3.508 17919 122841 1 299 . 1 1 64 64 GLU H H 64 9.280 9.280 8.919 0.361 17919 122842 1 299 . 1 1 65 65 SER N N 65 114.730 114.730 115.584 -0.854 17919 122843 1 299 . 1 1 65 65 SER HA H 65 4.640 4.640 4.620 0.020 17919 122844 1 299 . 1 1 65 65 SER C C 65 172.160 172.160 173.700 -1.540 17919 122845 1 299 . 1 1 65 65 SER CA C 65 60.890 60.890 60.264 0.626 17919 122846 1 299 . 1 1 65 65 SER CB C 65 64.910 64.910 63.796 1.114 17919 122847 1 299 . 1 1 65 65 SER H H 65 7.670 7.670 7.607 0.063 17919 122848 1 299 . 1 1 66 66 THR N N 66 117.110 117.110 119.885 -2.775 17919 122849 1 299 . 1 1 66 66 THR HA H 66 5.270 5.270 5.226 0.044 17919 122850 1 299 . 1 1 66 66 THR C C 66 173.950 173.950 174.326 -0.376 17919 122851 1 299 . 1 1 66 66 THR CA C 66 62.340 62.340 61.999 0.341 17919 122852 1 299 . 1 1 66 66 THR CB C 66 70.080 70.080 70.014 0.066 17919 122853 1 299 . 1 1 66 66 THR H H 66 8.730 8.730 8.428 0.302 17919 122854 1 299 . 1 1 67 67 LEU N N 67 127.110 127.110 128.133 -1.023 17919 122855 1 299 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.757 0.303 17919 122856 1 299 . 1 1 67 67 LEU C C 67 175.770 175.770 175.630 0.140 17919 122857 1 299 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.955 -0.055 17919 122858 1 299 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.434 -0.174 17919 122859 1 299 . 1 1 67 67 LEU H H 67 9.410 9.410 9.084 0.326 17919 122860 1 299 . 1 1 68 68 HIS N N 68 118.380 118.380 118.764 -0.384 17919 122861 1 299 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.272 -0.032 17919 122862 1 299 . 1 1 68 68 HIS C C 68 173.150 173.150 174.151 -1.001 17919 122863 1 299 . 1 1 68 68 HIS CA C 68 55.000 55.000 55.243 -0.243 17919 122864 1 299 . 1 1 68 68 HIS CB C 68 30.530 30.530 31.656 -1.126 17919 122865 1 299 . 1 1 68 68 HIS H H 68 9.230 9.230 8.986 0.244 17919 122866 1 299 . 1 1 69 69 LEU N N 69 124.460 124.460 125.910 -1.450 17919 122867 1 299 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.626 -0.436 17919 122868 1 299 . 1 1 69 69 LEU C C 69 175.270 175.270 174.711 0.559 17919 122869 1 299 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.094 0.796 17919 122870 1 299 . 1 1 69 69 LEU CB C 69 44.380 44.380 45.188 -0.808 17919 122871 1 299 . 1 1 69 69 LEU H H 69 8.340 8.340 8.924 -0.584 17919 122872 1 299 . 1 1 70 70 VAL N N 70 126.940 126.940 118.845 8.095 17919 122873 1 299 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.566 -0.216 17919 122874 1 299 . 1 1 70 70 VAL C C 70 174.000 174.000 173.864 0.136 17919 122875 1 299 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.018 0.782 17919 122876 1 299 . 1 1 70 70 VAL CB C 70 34.910 34.910 35.648 -0.738 17919 122877 1 299 . 1 1 70 70 VAL H H 70 9.200 9.200 9.019 0.181 17919 122878 1 299 . 1 1 71 71 LEU N N 71 123.130 123.130 120.908 2.222 17919 122879 1 299 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.986 0.074 17919 122880 1 299 . 1 1 71 71 LEU C C 71 177.830 177.830 177.057 0.773 17919 122881 1 299 . 1 1 71 71 LEU CA C 71 53.940 53.940 52.910 1.030 17919 122882 1 299 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.974 -1.124 17919 122883 1 299 . 1 1 71 71 LEU H H 71 8.120 8.120 8.234 -0.114 17919 122884 1 299 . 1 1 72 72 ARG N N 72 123.490 123.490 120.777 2.713 17919 122885 1 299 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.227 0.074 17919 122886 1 299 . 1 1 72 72 ARG C C 72 175.350 175.350 176.505 -1.155 17919 122887 1 299 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.127 -0.517 17919 122888 1 299 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.757 0.593 17919 122889 1 299 . 1 1 72 72 ARG H H 72 8.580 8.580 7.957 0.623 17919 122890 1 300 . 1 1 2 2 GLN N N 2 123.220 123.220 120.576 2.644 17919 122891 1 300 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.131 0.118 17919 122892 1 300 . 1 1 2 2 GLN C C 2 175.920 175.920 175.318 0.602 17919 122893 1 300 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.837 0.242 17919 122894 1 300 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.219 0.541 17919 122895 1 300 . 1 1 2 2 GLN H H 2 8.900 8.900 8.268 0.632 17919 122896 1 300 . 1 1 3 3 ILE N N 3 115.340 115.340 118.576 -3.236 17919 122897 1 300 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.581 -0.368 17919 122898 1 300 . 1 1 3 3 ILE C C 3 172.450 172.450 173.461 -1.011 17919 122899 1 300 . 1 1 3 3 ILE CA C 3 59.570 59.570 58.851 0.719 17919 122900 1 300 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.904 0.306 17919 122901 1 300 . 1 1 3 3 ILE H H 3 8.320 8.320 8.839 -0.519 17919 122902 1 300 . 1 1 4 4 PHE N N 4 118.110 118.110 118.491 -0.381 17919 122903 1 300 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.302 0.328 17919 122904 1 300 . 1 1 4 4 PHE C C 4 175.320 175.320 174.975 0.345 17919 122905 1 300 . 1 1 4 4 PHE CA C 4 55.210 55.210 56.080 -0.870 17919 122906 1 300 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.948 -0.468 17919 122907 1 300 . 1 1 4 4 PHE H H 4 8.610 8.610 8.705 -0.095 17919 122908 1 300 . 1 1 5 5 VAL N N 5 121.000 121.000 122.464 -1.464 17919 122909 1 300 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.875 -0.150 17919 122910 1 300 . 1 1 5 5 VAL C C 5 174.870 174.870 174.743 0.127 17919 122911 1 300 . 1 1 5 5 VAL CA C 5 60.620 60.620 60.913 -0.293 17919 122912 1 300 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.020 0.210 17919 122913 1 300 . 1 1 5 5 VAL H H 5 9.300 9.300 9.387 -0.087 17919 122914 1 300 . 1 1 6 6 LYS N N 6 127.520 127.520 126.044 1.476 17919 122915 1 300 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.442 -0.075 17919 122916 1 300 . 1 1 6 6 LYS C C 6 177.140 177.140 176.403 0.737 17919 122917 1 300 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.086 0.434 17919 122918 1 300 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.919 -0.869 17919 122919 1 300 . 1 1 6 6 LYS H H 6 8.820 8.820 9.298 -0.478 17919 122920 1 300 . 1 1 7 7 THR N N 7 115.400 115.400 115.348 0.052 17919 122921 1 300 . 1 1 7 7 THR HA H 7 4.970 4.970 4.571 0.399 17919 122922 1 300 . 1 1 7 7 THR C C 7 176.910 176.910 176.795 0.115 17919 122923 1 300 . 1 1 7 7 THR CA C 7 60.470 60.470 61.792 -1.322 17919 122924 1 300 . 1 1 7 7 THR CB C 7 70.630 70.630 70.386 0.244 17919 122925 1 300 . 1 1 7 7 THR H H 7 8.730 8.730 8.829 -0.099 17919 122926 1 300 . 1 1 8 8 LEU N N 8 121.330 121.330 123.695 -2.365 17919 122927 1 300 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.384 -0.074 17919 122928 1 300 . 1 1 8 8 LEU C C 8 178.800 178.800 177.343 1.457 17919 122929 1 300 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.351 0.229 17919 122930 1 300 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.290 -0.320 17919 122931 1 300 . 1 1 8 8 LEU H H 8 9.100 9.100 8.539 0.561 17919 122932 1 300 . 1 1 9 9 THR N N 9 105.590 105.590 109.973 -4.383 17919 122933 1 300 . 1 1 9 9 THR HA H 9 4.428 4.428 4.399 0.029 17919 122934 1 300 . 1 1 9 9 THR C C 9 175.520 175.520 175.189 0.331 17919 122935 1 300 . 1 1 9 9 THR CA C 9 61.400 61.400 61.216 0.184 17919 122936 1 300 . 1 1 9 9 THR CB C 9 69.140 69.140 68.828 0.312 17919 122937 1 300 . 1 1 9 9 THR H H 9 7.630 7.630 7.672 -0.042 17919 122938 1 300 . 1 1 10 10 GLY N N 10 108.890 108.890 111.477 -2.587 17919 122939 1 300 . 1 1 10 10 GLY C C 10 174.070 174.070 173.149 0.921 17919 122940 1 300 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.429 0.031 17919 122941 1 300 . 1 1 10 10 GLY H H 10 7.810 7.810 8.053 -0.243 17919 122942 1 300 . 1 1 11 11 LYS N N 11 121.600 121.600 118.877 2.723 17919 122943 1 300 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.746 -0.385 17919 122944 1 300 . 1 1 11 11 LYS C C 11 175.940 175.940 174.686 1.254 17919 122945 1 300 . 1 1 11 11 LYS CA C 11 56.280 56.280 54.868 1.412 17919 122946 1 300 . 1 1 11 11 LYS CB C 11 33.200 33.200 35.487 -2.287 17919 122947 1 300 . 1 1 11 11 LYS H H 11 7.280 7.280 7.718 -0.438 17919 122948 1 300 . 1 1 12 12 THR N N 12 120.440 120.440 118.151 2.289 17919 122949 1 300 . 1 1 12 12 THR HA H 12 5.046 5.046 5.235 -0.189 17919 122950 1 300 . 1 1 12 12 THR C C 12 174.320 174.320 174.337 -0.017 17919 122951 1 300 . 1 1 12 12 THR CA C 12 62.390 62.390 61.254 1.136 17919 122952 1 300 . 1 1 12 12 THR CB C 12 69.910 69.910 70.187 -0.277 17919 122953 1 300 . 1 1 12 12 THR H H 12 8.650 8.650 8.344 0.306 17919 122954 1 300 . 1 1 13 13 ILE N N 13 127.110 127.110 123.135 3.975 17919 122955 1 300 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.839 -0.295 17919 122956 1 300 . 1 1 13 13 ILE C C 13 175.220 175.220 174.816 0.404 17919 122957 1 300 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.343 0.638 17919 122958 1 300 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.783 0.167 17919 122959 1 300 . 1 1 13 13 ILE H H 13 9.450 9.450 9.155 0.295 17919 122960 1 300 . 1 1 14 14 THR N N 14 121.520 121.520 122.466 -0.946 17919 122961 1 300 . 1 1 14 14 THR HA H 14 4.964 4.964 4.932 0.032 17919 122962 1 300 . 1 1 14 14 THR C C 14 173.790 173.790 173.920 -0.130 17919 122963 1 300 . 1 1 14 14 THR CA C 14 61.940 61.940 62.111 -0.171 17919 122964 1 300 . 1 1 14 14 THR CB C 14 69.650 69.650 69.711 -0.061 17919 122965 1 300 . 1 1 14 14 THR H H 14 8.710 8.710 8.361 0.349 17919 122966 1 300 . 1 1 15 15 LEU N N 15 124.800 124.800 128.645 -3.845 17919 122967 1 300 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.630 0.150 17919 122968 1 300 . 1 1 15 15 LEU C C 15 174.670 174.670 174.725 -0.055 17919 122969 1 300 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.694 -0.864 17919 122970 1 300 . 1 1 15 15 LEU CB C 15 47.070 47.070 46.432 0.638 17919 122971 1 300 . 1 1 15 15 LEU H H 15 8.710 8.710 8.867 -0.157 17919 122972 1 300 . 1 1 16 16 GLU N N 16 122.160 122.160 123.686 -1.526 17919 122973 1 300 . 1 1 16 16 GLU HA H 16 4.917 4.917 5.338 -0.421 17919 122974 1 300 . 1 1 16 16 GLU C C 16 175.860 175.860 175.758 0.102 17919 122975 1 300 . 1 1 16 16 GLU CA C 16 54.820 54.820 54.037 0.783 17919 122976 1 300 . 1 1 16 16 GLU CB C 16 29.450 29.450 29.992 -0.542 17919 122977 1 300 . 1 1 16 16 GLU H H 16 8.140 8.140 8.558 -0.418 17919 122978 1 300 . 1 1 17 17 VAL N N 17 117.210 117.210 119.490 -2.280 17919 122979 1 300 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.732 -0.018 17919 122980 1 300 . 1 1 17 17 VAL C C 17 174.160 174.160 174.537 -0.377 17919 122981 1 300 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.298 -0.868 17919 122982 1 300 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.214 1.186 17919 122983 1 300 . 1 1 17 17 VAL H H 17 8.900 8.900 8.542 0.358 17919 122984 1 300 . 1 1 18 18 GLU N N 18 118.990 118.990 120.472 -1.482 17919 122985 1 300 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.769 0.310 17919 122986 1 300 . 1 1 18 18 GLU C C 18 176.160 176.160 176.174 -0.014 17919 122987 1 300 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.800 -0.080 17919 122988 1 300 . 1 1 18 18 GLU CB C 18 30.310 30.310 29.927 0.383 17919 122989 1 300 . 1 1 18 18 GLU H H 18 8.640 8.640 8.098 0.542 17919 122990 1 300 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.299 -0.158 17919 122991 1 300 . 1 1 19 19 PRO C C 19 175.310 175.310 177.248 -1.938 17919 122992 1 300 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.315 0.155 17919 122993 1 300 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.974 -0.024 17919 122994 1 300 . 1 1 20 20 SER N N 20 103.400 103.400 108.848 -5.448 17919 122995 1 300 . 1 1 20 20 SER HA H 20 4.370 4.370 4.253 0.117 17919 122996 1 300 . 1 1 20 20 SER C C 20 174.660 174.660 174.131 0.529 17919 122997 1 300 . 1 1 20 20 SER CA C 20 57.400 57.400 58.354 -0.954 17919 122998 1 300 . 1 1 20 20 SER CB C 20 63.370 63.370 62.456 0.914 17919 122999 1 300 . 1 1 20 20 SER H H 20 7.040 7.040 8.291 -1.251 17919 123000 1 300 . 1 1 21 21 ASP N N 21 123.480 123.480 124.843 -1.363 17919 123001 1 300 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.708 -0.013 17919 123002 1 300 . 1 1 21 21 ASP C C 21 176.360 176.360 176.025 0.335 17919 123003 1 300 . 1 1 21 21 ASP CA C 21 55.700 55.700 54.991 0.709 17919 123004 1 300 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.322 -0.522 17919 123005 1 300 . 1 1 21 21 ASP H H 21 8.030 8.030 7.696 0.334 17919 123006 1 300 . 1 1 22 22 THR N N 22 108.800 108.800 112.804 -4.004 17919 123007 1 300 . 1 1 22 22 THR HA H 22 4.920 4.920 4.876 0.044 17919 123008 1 300 . 1 1 22 22 THR C C 22 176.750 176.750 176.118 0.632 17919 123009 1 300 . 1 1 22 22 THR CA C 22 59.690 59.690 60.894 -1.204 17919 123010 1 300 . 1 1 22 22 THR CB C 22 71.200 71.200 70.776 0.424 17919 123011 1 300 . 1 1 22 22 THR H H 22 7.900 7.900 8.172 -0.272 17919 123012 1 300 . 1 1 23 23 ILE N N 23 121.190 121.190 122.785 -1.595 17919 123013 1 300 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.773 -0.116 17919 123014 1 300 . 1 1 23 23 ILE C C 23 179.040 179.040 177.780 1.260 17919 123015 1 300 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.338 -0.078 17919 123016 1 300 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.296 -1.946 17919 123017 1 300 . 1 1 23 23 ILE H H 23 8.560 8.560 8.642 -0.082 17919 123018 1 300 . 1 1 24 24 GLU N N 24 120.830 120.830 120.880 -0.050 17919 123019 1 300 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.893 0.024 17919 123020 1 300 . 1 1 24 24 GLU C C 24 178.640 178.640 178.450 0.190 17919 123021 1 300 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.901 0.319 17919 123022 1 300 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.511 -1.231 17919 123023 1 300 . 1 1 24 24 GLU H H 24 9.760 9.760 7.908 1.852 17919 123024 1 300 . 1 1 25 25 ASN N N 25 120.570 120.570 117.848 2.722 17919 123025 1 300 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.549 -0.024 17919 123026 1 300 . 1 1 25 25 ASN C C 25 178.380 178.380 177.905 0.475 17919 123027 1 300 . 1 1 25 25 ASN CA C 25 56.060 56.060 56.110 -0.050 17919 123028 1 300 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.755 -0.305 17919 123029 1 300 . 1 1 25 25 ASN H H 25 7.920 7.920 7.619 0.301 17919 123030 1 300 . 1 1 26 26 VAL N N 26 121.710 121.710 120.542 1.168 17919 123031 1 300 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.551 -0.154 17919 123032 1 300 . 1 1 26 26 VAL C C 26 177.950 177.950 177.911 0.039 17919 123033 1 300 . 1 1 26 26 VAL CA C 26 67.660 67.660 67.026 0.634 17919 123034 1 300 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.422 -0.582 17919 123035 1 300 . 1 1 26 26 VAL H H 26 8.070 8.070 8.138 -0.068 17919 123036 1 300 . 1 1 27 27 LYS N N 27 118.860 118.860 119.697 -0.837 17919 123037 1 300 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.229 0.351 17919 123038 1 300 . 1 1 27 27 LYS C C 27 180.550 180.550 179.075 1.475 17919 123039 1 300 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.412 -0.162 17919 123040 1 300 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.282 1.448 17919 123041 1 300 . 1 1 27 27 LYS H H 27 8.560 8.560 7.815 0.745 17919 123042 1 300 . 1 1 28 28 ALA N N 28 123.440 123.440 122.505 0.935 17919 123043 1 300 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.132 0.028 17919 123044 1 300 . 1 1 28 28 ALA C C 28 180.300 180.300 179.283 1.017 17919 123045 1 300 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.023 0.347 17919 123046 1 300 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.379 -0.669 17919 123047 1 300 . 1 1 28 28 ALA H H 28 8.060 8.060 8.034 0.026 17919 123048 1 300 . 1 1 29 29 LYS N N 29 119.940 119.940 119.067 0.873 17919 123049 1 300 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.059 0.148 17919 123050 1 300 . 1 1 29 29 LYS C C 29 180.320 180.320 179.298 1.022 17919 123051 1 300 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.419 0.231 17919 123052 1 300 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.387 0.903 17919 123053 1 300 . 1 1 29 29 LYS H H 29 7.850 7.850 7.703 0.147 17919 123054 1 300 . 1 1 30 30 ILE N N 30 121.080 121.080 120.462 0.618 17919 123055 1 300 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.678 -0.171 17919 123056 1 300 . 1 1 30 30 ILE C C 30 178.310 178.310 177.131 1.179 17919 123057 1 300 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.349 0.801 17919 123058 1 300 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.712 -0.912 17919 123059 1 300 . 1 1 30 30 ILE H H 30 8.280 8.280 7.767 0.513 17919 123060 1 300 . 1 1 31 31 GLN N N 31 123.490 123.490 121.378 2.112 17919 123061 1 300 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.055 -0.226 17919 123062 1 300 . 1 1 31 31 GLN C C 31 178.890 178.890 178.350 0.540 17919 123063 1 300 . 1 1 31 31 GLN CA C 31 60.000 60.000 58.992 1.008 17919 123064 1 300 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.534 -0.814 17919 123065 1 300 . 1 1 31 31 GLN H H 31 8.580 8.580 8.225 0.355 17919 123066 1 300 . 1 1 32 32 ASP N N 32 119.360 119.360 119.801 -0.441 17919 123067 1 300 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.373 -0.019 17919 123068 1 300 . 1 1 32 32 ASP C C 32 177.250 177.250 177.752 -0.502 17919 123069 1 300 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.987 0.203 17919 123070 1 300 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.929 -0.349 17919 123071 1 300 . 1 1 32 32 ASP H H 32 8.010 8.010 8.514 -0.504 17919 123072 1 300 . 1 1 33 33 LYS N N 33 115.130 115.130 119.271 -4.141 17919 123073 1 300 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.234 0.103 17919 123074 1 300 . 1 1 33 33 LYS C C 33 177.870 177.870 178.225 -0.355 17919 123075 1 300 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.906 0.144 17919 123076 1 300 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.394 0.776 17919 123077 1 300 . 1 1 33 33 LYS H H 33 7.430 7.430 7.516 -0.086 17919 123078 1 300 . 1 1 34 34 GLU N N 34 113.870 113.870 114.064 -0.194 17919 123079 1 300 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.535 0.090 17919 123080 1 300 . 1 1 34 34 GLU C C 34 177.840 177.840 176.683 1.157 17919 123081 1 300 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.754 -0.584 17919 123082 1 300 . 1 1 34 34 GLU CB C 34 32.660 32.660 32.040 0.620 17919 123083 1 300 . 1 1 34 34 GLU H H 34 8.740 8.740 8.319 0.421 17919 123084 1 300 . 1 1 35 35 GLY N N 35 108.650 108.650 108.613 0.037 17919 123085 1 300 . 1 1 35 35 GLY C C 35 173.960 173.960 174.587 -0.627 17919 123086 1 300 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.606 0.474 17919 123087 1 300 . 1 1 35 35 GLY H H 35 8.530 8.530 8.067 0.463 17919 123088 1 300 . 1 1 36 36 ILE N N 36 119.880 119.880 121.929 -2.049 17919 123089 1 300 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.339 0.106 17919 123090 1 300 . 1 1 36 36 ILE C C 36 173.590 173.590 174.279 -0.689 17919 123091 1 300 . 1 1 36 36 ILE CA C 36 57.750 57.750 58.461 -0.711 17919 123092 1 300 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.106 2.474 17919 123093 1 300 . 1 1 36 36 ILE H H 36 6.150 6.150 7.740 -1.590 17919 123094 1 300 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.719 -0.085 17919 123095 1 300 . 1 1 37 37 PRO C C 37 176.940 176.940 175.963 0.977 17919 123096 1 300 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.597 0.063 17919 123097 1 300 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.244 0.606 17919 123098 1 300 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.159 -0.042 17919 123099 1 300 . 1 1 38 38 PRO C C 38 178.320 178.320 178.680 -0.360 17919 123100 1 300 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.907 0.353 17919 123101 1 300 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.858 1.032 17919 123102 1 300 . 1 1 39 39 ASP N N 39 113.380 113.380 115.681 -2.301 17919 123103 1 300 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.356 0.074 17919 123104 1 300 . 1 1 39 39 ASP C C 39 177.090 177.090 177.635 -0.545 17919 123105 1 300 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.861 -1.221 17919 123106 1 300 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.424 -0.884 17919 123107 1 300 . 1 1 39 39 ASP H H 39 8.550 8.550 8.698 -0.148 17919 123108 1 300 . 1 1 40 40 GLN N N 40 116.780 116.780 115.504 1.276 17919 123109 1 300 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.511 -0.047 17919 123110 1 300 . 1 1 40 40 GLN C C 40 175.380 175.380 175.352 0.028 17919 123111 1 300 . 1 1 40 40 GLN CA C 40 55.640 55.640 54.558 1.082 17919 123112 1 300 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.175 0.965 17919 123113 1 300 . 1 1 40 40 GLN H H 40 7.820 7.820 8.183 -0.363 17919 123114 1 300 . 1 1 41 41 GLN N N 41 117.720 117.720 119.949 -2.229 17919 123115 1 300 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.428 -0.184 17919 123116 1 300 . 1 1 41 41 GLN C C 41 176.300 176.300 175.067 1.233 17919 123117 1 300 . 1 1 41 41 GLN CA C 41 56.470 56.470 56.388 0.082 17919 123118 1 300 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.628 2.022 17919 123119 1 300 . 1 1 41 41 GLN H H 41 7.480 7.480 7.371 0.109 17919 123120 1 300 . 1 1 42 42 ARG N N 42 122.680 122.680 123.091 -0.411 17919 123121 1 300 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.688 -0.188 17919 123122 1 300 . 1 1 42 42 ARG C C 42 174.050 174.050 174.715 -0.665 17919 123123 1 300 . 1 1 42 42 ARG CA C 42 55.050 55.050 53.118 1.932 17919 123124 1 300 . 1 1 42 42 ARG CB C 42 31.750 31.750 31.984 -0.234 17919 123125 1 300 . 1 1 42 42 ARG H H 42 8.530 8.530 8.870 -0.340 17919 123126 1 300 . 1 1 43 43 LEU N N 43 124.040 124.040 126.469 -2.429 17919 123127 1 300 . 1 1 43 43 LEU C C 43 175.290 175.290 175.628 -0.338 17919 123128 1 300 . 1 1 43 43 LEU CA C 43 52.980 52.980 54.176 -1.196 17919 123129 1 300 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.317 2.473 17919 123130 1 300 . 1 1 43 43 LEU H H 43 8.820 8.820 8.861 -0.041 17919 123131 1 300 . 1 1 44 44 ILE N N 44 121.920 121.920 122.813 -0.893 17919 123132 1 300 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.997 -0.005 17919 123133 1 300 . 1 1 44 44 ILE C C 44 176.060 176.060 174.671 1.389 17919 123134 1 300 . 1 1 44 44 ILE CA C 44 58.980 58.980 58.301 0.679 17919 123135 1 300 . 1 1 44 44 ILE CB C 44 41.420 41.420 39.501 1.919 17919 123136 1 300 . 1 1 44 44 ILE H H 44 9.030 9.030 8.879 0.151 17919 123137 1 300 . 1 1 45 45 PHE N N 45 125.390 125.390 127.999 -2.609 17919 123138 1 300 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.935 0.110 17919 123139 1 300 . 1 1 45 45 PHE C C 45 174.470 174.470 174.954 -0.484 17919 123140 1 300 . 1 1 45 45 PHE CA C 45 57.020 57.020 55.837 1.183 17919 123141 1 300 . 1 1 45 45 PHE CB C 45 43.760 43.760 41.854 1.906 17919 123142 1 300 . 1 1 45 45 PHE H H 45 8.830 8.830 8.388 0.442 17919 123143 1 300 . 1 1 46 46 ALA N N 46 132.200 132.200 129.482 2.718 17919 123144 1 300 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.673 0.017 17919 123145 1 300 . 1 1 46 46 ALA C C 46 177.290 177.290 176.992 0.298 17919 123146 1 300 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.590 -0.050 17919 123147 1 300 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.444 0.126 17919 123148 1 300 . 1 1 46 46 ALA H H 46 8.810 8.810 8.726 0.084 17919 123149 1 300 . 1 1 47 47 GLY N N 47 102.340 102.340 103.373 -1.033 17919 123150 1 300 . 1 1 47 47 GLY C C 47 173.810 173.810 174.519 -0.709 17919 123151 1 300 . 1 1 47 47 GLY CA C 47 45.350 45.350 44.871 0.479 17919 123152 1 300 . 1 1 47 47 GLY H H 47 8.130 8.130 8.170 -0.040 17919 123153 1 300 . 1 1 48 48 LYS N N 48 121.570 121.570 120.061 1.509 17919 123154 1 300 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.515 0.107 17919 123155 1 300 . 1 1 48 48 LYS C C 48 174.700 174.700 174.601 0.099 17919 123156 1 300 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.606 -0.056 17919 123157 1 300 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.970 -0.440 17919 123158 1 300 . 1 1 48 48 LYS H H 48 7.980 7.980 7.999 -0.019 17919 123159 1 300 . 1 1 49 49 GLN N N 49 122.410 122.410 125.476 -3.066 17919 123160 1 300 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.248 0.312 17919 123161 1 300 . 1 1 49 49 GLN C C 49 175.670 175.670 175.514 0.156 17919 123162 1 300 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.141 -0.401 17919 123163 1 300 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.173 -0.173 17919 123164 1 300 . 1 1 49 49 GLN H H 49 8.600 8.600 8.580 0.020 17919 123165 1 300 . 1 1 50 50 LEU N N 50 125.520 125.520 129.084 -3.564 17919 123166 1 300 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.222 -0.132 17919 123167 1 300 . 1 1 50 50 LEU C C 50 176.660 176.660 176.468 0.192 17919 123168 1 300 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.339 -0.099 17919 123169 1 300 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.115 -0.545 17919 123170 1 300 . 1 1 50 50 LEU H H 50 8.530 8.530 8.208 0.322 17919 123171 1 300 . 1 1 51 51 GLU N N 51 122.940 122.940 122.775 0.165 17919 123172 1 300 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.590 -0.102 17919 123173 1 300 . 1 1 51 51 GLU C C 51 175.870 175.870 176.930 -1.060 17919 123174 1 300 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.083 0.877 17919 123175 1 300 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.414 0.156 17919 123176 1 300 . 1 1 51 51 GLU H H 51 8.400 8.400 8.824 -0.424 17919 123177 1 300 . 1 1 52 52 ASP N N 52 120.030 120.030 123.240 -3.210 17919 123178 1 300 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.399 -0.040 17919 123179 1 300 . 1 1 52 52 ASP C C 52 177.330 177.330 177.455 -0.125 17919 123180 1 300 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.585 -0.625 17919 123181 1 300 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.900 -0.050 17919 123182 1 300 . 1 1 52 52 ASP H H 52 8.160 8.160 8.837 -0.677 17919 123183 1 300 . 1 1 53 53 GLY N N 53 106.660 106.660 104.615 2.045 17919 123184 1 300 . 1 1 53 53 GLY C C 53 174.870 174.870 174.109 0.761 17919 123185 1 300 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.695 0.475 17919 123186 1 300 . 1 1 53 53 GLY H H 53 9.390 9.390 8.598 0.792 17919 123187 1 300 . 1 1 54 54 ARG N N 54 119.050 119.050 120.774 -1.724 17919 123188 1 300 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.709 -0.014 17919 123189 1 300 . 1 1 54 54 ARG C C 54 175.350 175.350 174.688 0.662 17919 123190 1 300 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.463 -0.073 17919 123191 1 300 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.749 -1.099 17919 123192 1 300 . 1 1 54 54 ARG H H 54 7.460 7.460 7.472 -0.012 17919 123193 1 300 . 1 1 55 55 THR N N 55 108.400 108.400 110.450 -2.050 17919 123194 1 300 . 1 1 55 55 THR HA H 55 5.240 5.240 5.059 0.181 17919 123195 1 300 . 1 1 55 55 THR C C 55 176.560 176.560 175.915 0.645 17919 123196 1 300 . 1 1 55 55 THR CA C 55 59.690 59.690 59.513 0.177 17919 123197 1 300 . 1 1 55 55 THR CB C 55 72.260 72.260 71.453 0.807 17919 123198 1 300 . 1 1 55 55 THR H H 55 8.730 8.730 8.834 -0.104 17919 123199 1 300 . 1 1 56 56 LEU N N 56 117.920 117.920 120.955 -3.035 17919 123200 1 300 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.087 -0.027 17919 123201 1 300 . 1 1 56 56 LEU C C 56 180.810 180.810 179.064 1.746 17919 123202 1 300 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.472 0.237 17919 123203 1 300 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.304 -0.934 17919 123204 1 300 . 1 1 56 56 LEU H H 56 8.140 8.140 8.641 -0.501 17919 123205 1 300 . 1 1 57 57 SER N N 57 113.330 113.330 115.526 -2.196 17919 123206 1 300 . 1 1 57 57 SER HA H 57 4.370 4.370 4.056 0.314 17919 123207 1 300 . 1 1 57 57 SER C C 57 178.310 178.310 176.938 1.372 17919 123208 1 300 . 1 1 57 57 SER CA C 57 61.080 61.080 61.802 -0.722 17919 123209 1 300 . 1 1 57 57 SER CB C 57 62.530 62.530 62.166 0.364 17919 123210 1 300 . 1 1 57 57 SER H H 57 8.470 8.470 8.427 0.043 17919 123211 1 300 . 1 1 58 58 ASP N N 58 124.190 124.190 123.413 0.777 17919 123212 1 300 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.276 0.021 17919 123213 1 300 . 1 1 58 58 ASP C C 58 177.400 177.400 177.891 -0.491 17919 123214 1 300 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.797 0.383 17919 123215 1 300 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.249 -0.149 17919 123216 1 300 . 1 1 58 58 ASP H H 58 7.930 7.930 7.651 0.279 17919 123217 1 300 . 1 1 59 59 TYR N N 59 115.510 115.510 115.407 0.103 17919 123218 1 300 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.610 0.060 17919 123219 1 300 . 1 1 59 59 TYR C C 59 174.700 174.700 175.297 -0.597 17919 123220 1 300 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.329 0.921 17919 123221 1 300 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.240 1.830 17919 123222 1 300 . 1 1 59 59 TYR H H 59 7.250 7.250 7.453 -0.203 17919 123223 1 300 . 1 1 60 60 ASN N N 60 115.900 115.900 118.049 -2.149 17919 123224 1 300 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.350 0.005 17919 123225 1 300 . 1 1 60 60 ASN C C 60 174.340 174.340 174.400 -0.060 17919 123226 1 300 . 1 1 60 60 ASN CA C 60 54.120 54.120 53.956 0.164 17919 123227 1 300 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.400 0.010 17919 123228 1 300 . 1 1 60 60 ASN H H 60 8.150 8.150 8.256 -0.106 17919 123229 1 300 . 1 1 61 61 ILE N N 61 118.600 118.600 120.249 -1.649 17919 123230 1 300 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.808 -0.415 17919 123231 1 300 . 1 1 61 61 ILE C C 61 174.610 174.610 174.796 -0.186 17919 123232 1 300 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.933 0.487 17919 123233 1 300 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.907 -1.167 17919 123234 1 300 . 1 1 61 61 ILE H H 61 7.250 7.250 8.021 -0.771 17919 123235 1 300 . 1 1 62 62 GLN N N 62 124.740 124.740 126.612 -1.872 17919 123236 1 300 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.595 -0.089 17919 123237 1 300 . 1 1 62 62 GLN C C 62 175.970 175.970 175.355 0.615 17919 123238 1 300 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.724 -0.064 17919 123239 1 300 . 1 1 62 62 GLN CB C 62 31.650 31.650 32.743 -1.093 17919 123240 1 300 . 1 1 62 62 GLN H H 62 7.610 7.610 7.923 -0.313 17919 123241 1 300 . 1 1 63 63 LYS N N 63 120.300 120.300 121.706 -1.406 17919 123242 1 300 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.076 -0.075 17919 123243 1 300 . 1 1 63 63 LYS C C 63 175.810 175.810 177.281 -1.471 17919 123244 1 300 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.062 -0.272 17919 123245 1 300 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.437 0.213 17919 123246 1 300 . 1 1 63 63 LYS H H 63 8.490 8.490 8.724 -0.234 17919 123247 1 300 . 1 1 64 64 GLU N N 64 113.950 113.950 122.701 -8.751 17919 123248 1 300 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.870 -0.405 17919 123249 1 300 . 1 1 64 64 GLU C C 64 175.250 175.250 176.045 -0.795 17919 123250 1 300 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.688 0.202 17919 123251 1 300 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.461 -2.561 17919 123252 1 300 . 1 1 64 64 GLU H H 64 9.280 9.280 8.931 0.349 17919 123253 1 300 . 1 1 65 65 SER N N 65 114.730 114.730 115.059 -0.329 17919 123254 1 300 . 1 1 65 65 SER HA H 65 4.640 4.640 4.520 0.120 17919 123255 1 300 . 1 1 65 65 SER C C 65 172.160 172.160 173.842 -1.682 17919 123256 1 300 . 1 1 65 65 SER CA C 65 60.890 60.890 60.677 0.213 17919 123257 1 300 . 1 1 65 65 SER CB C 65 64.910 64.910 63.958 0.952 17919 123258 1 300 . 1 1 65 65 SER H H 65 7.670 7.670 7.781 -0.111 17919 123259 1 300 . 1 1 66 66 THR N N 66 117.110 117.110 119.293 -2.183 17919 123260 1 300 . 1 1 66 66 THR HA H 66 5.270 5.270 5.322 -0.052 17919 123261 1 300 . 1 1 66 66 THR C C 66 173.950 173.950 173.662 0.288 17919 123262 1 300 . 1 1 66 66 THR CA C 66 62.340 62.340 61.726 0.614 17919 123263 1 300 . 1 1 66 66 THR CB C 66 70.080 70.080 70.216 -0.136 17919 123264 1 300 . 1 1 66 66 THR H H 66 8.730 8.730 8.353 0.377 17919 123265 1 300 . 1 1 67 67 LEU N N 67 127.110 127.110 126.582 0.528 17919 123266 1 300 . 1 1 67 67 LEU HA H 67 5.060 5.060 5.088 -0.028 17919 123267 1 300 . 1 1 67 67 LEU C C 67 175.770 175.770 175.065 0.705 17919 123268 1 300 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.661 0.239 17919 123269 1 300 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.882 -0.622 17919 123270 1 300 . 1 1 67 67 LEU H H 67 9.410 9.410 9.159 0.251 17919 123271 1 300 . 1 1 68 68 HIS N N 68 118.380 118.380 122.725 -4.345 17919 123272 1 300 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.306 -0.066 17919 123273 1 300 . 1 1 68 68 HIS C C 68 173.150 173.150 173.790 -0.640 17919 123274 1 300 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.320 0.680 17919 123275 1 300 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.161 -1.631 17919 123276 1 300 . 1 1 68 68 HIS H H 68 9.230 9.230 9.192 0.038 17919 123277 1 300 . 1 1 69 69 LEU N N 69 124.460 124.460 130.912 -6.452 17919 123278 1 300 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.956 0.234 17919 123279 1 300 . 1 1 69 69 LEU C C 69 175.270 175.270 174.123 1.147 17919 123280 1 300 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.527 0.363 17919 123281 1 300 . 1 1 69 69 LEU CB C 69 44.380 44.380 43.401 0.979 17919 123282 1 300 . 1 1 69 69 LEU H H 69 8.340 8.340 8.562 -0.222 17919 123283 1 300 . 1 1 70 70 VAL N N 70 126.940 126.940 126.726 0.214 17919 123284 1 300 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.390 -0.040 17919 123285 1 300 . 1 1 70 70 VAL C C 70 174.000 174.000 174.712 -0.712 17919 123286 1 300 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.975 -0.175 17919 123287 1 300 . 1 1 70 70 VAL CB C 70 34.910 34.910 34.634 0.276 17919 123288 1 300 . 1 1 70 70 VAL H H 70 9.200 9.200 9.007 0.193 17919 123289 1 300 . 1 1 71 71 LEU N N 71 123.130 123.130 124.121 -0.991 17919 123290 1 300 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.049 0.011 17919 123291 1 300 . 1 1 71 71 LEU C C 71 177.830 177.830 178.056 -0.226 17919 123292 1 300 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.605 0.335 17919 123293 1 300 . 1 1 71 71 LEU CB C 71 42.850 42.850 42.754 0.096 17919 123294 1 300 . 1 1 71 71 LEU H H 71 8.120 8.120 8.423 -0.303 17919 123295 1 300 . 1 1 72 72 ARG N N 72 123.490 123.490 123.693 -0.203 17919 123296 1 300 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.186 0.115 17919 123297 1 300 . 1 1 72 72 ARG C C 72 175.350 175.350 175.745 -0.395 17919 123298 1 300 . 1 1 72 72 ARG CA C 72 55.610 55.610 56.195 -0.585 17919 123299 1 300 . 1 1 72 72 ARG CB C 72 31.350 31.350 28.803 2.546 17919 123300 1 300 . 1 1 72 72 ARG H H 72 8.580 8.580 8.622 -0.042 17919 123301 1 301 . 1 1 2 2 GLN N N 2 123.220 123.220 120.117 3.103 17919 123302 1 301 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.120 0.129 17919 123303 1 301 . 1 1 2 2 GLN C C 2 175.920 175.920 175.744 0.176 17919 123304 1 301 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.925 0.155 17919 123305 1 301 . 1 1 2 2 GLN CB C 2 30.760 30.760 29.868 0.892 17919 123306 1 301 . 1 1 2 2 GLN H H 2 8.900 8.900 8.383 0.517 17919 123307 1 301 . 1 1 3 3 ILE N N 3 115.340 115.340 115.593 -0.253 17919 123308 1 301 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.190 0.023 17919 123309 1 301 . 1 1 3 3 ILE C C 3 172.450 172.450 173.783 -1.333 17919 123310 1 301 . 1 1 3 3 ILE CA C 3 59.570 59.570 58.982 0.588 17919 123311 1 301 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.291 0.919 17919 123312 1 301 . 1 1 3 3 ILE H H 3 8.320 8.320 8.251 0.069 17919 123313 1 301 . 1 1 4 4 PHE N N 4 118.110 118.110 120.342 -2.232 17919 123314 1 301 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.268 0.362 17919 123315 1 301 . 1 1 4 4 PHE C C 4 175.320 175.320 175.626 -0.306 17919 123316 1 301 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.697 -0.487 17919 123317 1 301 . 1 1 4 4 PHE CB C 4 41.480 41.480 40.732 0.748 17919 123318 1 301 . 1 1 4 4 PHE H H 4 8.610 8.610 8.587 0.023 17919 123319 1 301 . 1 1 5 5 VAL N N 5 121.000 121.000 118.826 2.174 17919 123320 1 301 . 1 1 5 5 VAL HA H 5 4.725 4.725 5.127 -0.402 17919 123321 1 301 . 1 1 5 5 VAL C C 5 174.870 174.870 174.646 0.224 17919 123322 1 301 . 1 1 5 5 VAL CA C 5 60.620 60.620 60.982 -0.362 17919 123323 1 301 . 1 1 5 5 VAL CB C 5 34.230 34.230 34.460 -0.230 17919 123324 1 301 . 1 1 5 5 VAL H H 5 9.300 9.300 9.211 0.089 17919 123325 1 301 . 1 1 6 6 LYS N N 6 127.520 127.520 127.756 -0.236 17919 123326 1 301 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.332 0.035 17919 123327 1 301 . 1 1 6 6 LYS C C 6 177.140 177.140 176.425 0.715 17919 123328 1 301 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.012 0.508 17919 123329 1 301 . 1 1 6 6 LYS CB C 6 35.050 35.050 35.802 -0.752 17919 123330 1 301 . 1 1 6 6 LYS H H 6 8.820 8.820 9.210 -0.390 17919 123331 1 301 . 1 1 7 7 THR N N 7 115.400 115.400 118.917 -3.517 17919 123332 1 301 . 1 1 7 7 THR HA H 7 4.970 4.970 4.548 0.422 17919 123333 1 301 . 1 1 7 7 THR C C 7 176.910 176.910 176.306 0.604 17919 123334 1 301 . 1 1 7 7 THR CA C 7 60.470 60.470 61.157 -0.687 17919 123335 1 301 . 1 1 7 7 THR CB C 7 70.630 70.630 69.863 0.767 17919 123336 1 301 . 1 1 7 7 THR H H 7 8.730 8.730 8.874 -0.144 17919 123337 1 301 . 1 1 8 8 LEU N N 8 121.330 121.330 124.922 -3.592 17919 123338 1 301 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.246 0.064 17919 123339 1 301 . 1 1 8 8 LEU C C 8 178.800 178.800 177.997 0.803 17919 123340 1 301 . 1 1 8 8 LEU CA C 8 57.580 57.580 58.108 -0.528 17919 123341 1 301 . 1 1 8 8 LEU CB C 8 41.970 41.970 42.122 -0.152 17919 123342 1 301 . 1 1 8 8 LEU H H 8 9.100 9.100 8.684 0.416 17919 123343 1 301 . 1 1 9 9 THR N N 9 105.590 105.590 108.010 -2.420 17919 123344 1 301 . 1 1 9 9 THR HA H 9 4.428 4.428 4.202 0.226 17919 123345 1 301 . 1 1 9 9 THR C C 9 175.520 175.520 175.171 0.349 17919 123346 1 301 . 1 1 9 9 THR CA C 9 61.400 61.400 63.062 -1.662 17919 123347 1 301 . 1 1 9 9 THR CB C 9 69.140 69.140 69.017 0.123 17919 123348 1 301 . 1 1 9 9 THR H H 9 7.630 7.630 8.113 -0.483 17919 123349 1 301 . 1 1 10 10 GLY N N 10 108.890 108.890 110.173 -1.283 17919 123350 1 301 . 1 1 10 10 GLY C C 10 174.070 174.070 173.311 0.759 17919 123351 1 301 . 1 1 10 10 GLY CA C 10 45.460 45.460 44.609 0.851 17919 123352 1 301 . 1 1 10 10 GLY H H 10 7.810 7.810 7.801 0.009 17919 123353 1 301 . 1 1 11 11 LYS N N 11 121.600 121.600 120.605 0.995 17919 123354 1 301 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.697 -0.336 17919 123355 1 301 . 1 1 11 11 LYS C C 11 175.940 175.940 174.766 1.174 17919 123356 1 301 . 1 1 11 11 LYS CA C 11 56.280 56.280 54.447 1.833 17919 123357 1 301 . 1 1 11 11 LYS CB C 11 33.200 33.200 35.426 -2.226 17919 123358 1 301 . 1 1 11 11 LYS H H 11 7.280 7.280 8.103 -0.823 17919 123359 1 301 . 1 1 12 12 THR N N 12 120.440 120.440 122.617 -2.177 17919 123360 1 301 . 1 1 12 12 THR HA H 12 5.046 5.046 5.367 -0.321 17919 123361 1 301 . 1 1 12 12 THR C C 12 174.320 174.320 174.235 0.085 17919 123362 1 301 . 1 1 12 12 THR CA C 12 62.390 62.390 61.458 0.932 17919 123363 1 301 . 1 1 12 12 THR CB C 12 69.910 69.910 69.803 0.107 17919 123364 1 301 . 1 1 12 12 THR H H 12 8.650 8.650 8.444 0.206 17919 123365 1 301 . 1 1 13 13 ILE N N 13 127.110 127.110 121.789 5.321 17919 123366 1 301 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.852 -0.308 17919 123367 1 301 . 1 1 13 13 ILE C C 13 175.220 175.220 174.217 1.003 17919 123368 1 301 . 1 1 13 13 ILE CA C 13 59.980 59.980 58.967 1.013 17919 123369 1 301 . 1 1 13 13 ILE CB C 13 40.950 40.950 41.719 -0.769 17919 123370 1 301 . 1 1 13 13 ILE H H 13 9.450 9.450 8.897 0.553 17919 123371 1 301 . 1 1 14 14 THR N N 14 121.520 121.520 118.287 3.233 17919 123372 1 301 . 1 1 14 14 THR HA H 14 4.964 4.964 5.159 -0.195 17919 123373 1 301 . 1 1 14 14 THR C C 14 173.790 173.790 173.592 0.198 17919 123374 1 301 . 1 1 14 14 THR CA C 14 61.940 61.940 61.727 0.213 17919 123375 1 301 . 1 1 14 14 THR CB C 14 69.650 69.650 70.395 -0.745 17919 123376 1 301 . 1 1 14 14 THR H H 14 8.710 8.710 8.330 0.380 17919 123377 1 301 . 1 1 15 15 LEU N N 15 124.800 124.800 125.198 -0.398 17919 123378 1 301 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.749 0.031 17919 123379 1 301 . 1 1 15 15 LEU C C 15 174.670 174.670 175.705 -1.035 17919 123380 1 301 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.715 -0.885 17919 123381 1 301 . 1 1 15 15 LEU CB C 15 47.070 47.070 44.064 3.006 17919 123382 1 301 . 1 1 15 15 LEU H H 15 8.710 8.710 8.678 0.032 17919 123383 1 301 . 1 1 16 16 GLU N N 16 122.160 122.160 124.828 -2.668 17919 123384 1 301 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.676 0.241 17919 123385 1 301 . 1 1 16 16 GLU C C 16 175.860 175.860 176.440 -0.580 17919 123386 1 301 . 1 1 16 16 GLU CA C 16 54.820 54.820 56.611 -1.791 17919 123387 1 301 . 1 1 16 16 GLU CB C 16 29.450 29.450 29.326 0.124 17919 123388 1 301 . 1 1 16 16 GLU H H 16 8.140 8.140 8.788 -0.648 17919 123389 1 301 . 1 1 17 17 VAL N N 17 117.210 117.210 118.930 -1.720 17919 123390 1 301 . 1 1 17 17 VAL HA H 17 4.714 4.714 5.001 -0.287 17919 123391 1 301 . 1 1 17 17 VAL C C 17 174.160 174.160 174.998 -0.838 17919 123392 1 301 . 1 1 17 17 VAL CA C 17 58.430 58.430 58.402 0.028 17919 123393 1 301 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.873 0.527 17919 123394 1 301 . 1 1 17 17 VAL H H 17 8.900 8.900 8.860 0.040 17919 123395 1 301 . 1 1 18 18 GLU N N 18 118.990 118.990 120.027 -1.037 17919 123396 1 301 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.762 0.317 17919 123397 1 301 . 1 1 18 18 GLU C C 18 176.160 176.160 174.878 1.282 17919 123398 1 301 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.596 0.124 17919 123399 1 301 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.669 -0.359 17919 123400 1 301 . 1 1 18 18 GLU H H 18 8.640 8.640 8.173 0.467 17919 123401 1 301 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.069 0.072 17919 123402 1 301 . 1 1 19 19 PRO C C 19 175.310 175.310 177.735 -2.425 17919 123403 1 301 . 1 1 19 19 PRO CA C 19 65.470 65.470 66.054 -0.584 17919 123404 1 301 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.849 0.101 17919 123405 1 301 . 1 1 20 20 SER N N 20 103.400 103.400 109.060 -5.660 17919 123406 1 301 . 1 1 20 20 SER HA H 20 4.370 4.370 4.398 -0.028 17919 123407 1 301 . 1 1 20 20 SER C C 20 174.660 174.660 174.515 0.145 17919 123408 1 301 . 1 1 20 20 SER CA C 20 57.400 57.400 58.880 -1.480 17919 123409 1 301 . 1 1 20 20 SER CB C 20 63.370 63.370 62.736 0.634 17919 123410 1 301 . 1 1 20 20 SER H H 20 7.040 7.040 8.113 -1.073 17919 123411 1 301 . 1 1 21 21 ASP N N 21 123.480 123.480 123.397 0.083 17919 123412 1 301 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.580 0.115 17919 123413 1 301 . 1 1 21 21 ASP C C 21 176.360 176.360 175.929 0.431 17919 123414 1 301 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.345 0.355 17919 123415 1 301 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.448 -0.648 17919 123416 1 301 . 1 1 21 21 ASP H H 21 8.030 8.030 7.959 0.071 17919 123417 1 301 . 1 1 22 22 THR N N 22 108.800 108.800 111.883 -3.083 17919 123418 1 301 . 1 1 22 22 THR HA H 22 4.920 4.920 4.910 0.010 17919 123419 1 301 . 1 1 22 22 THR C C 22 176.750 176.750 175.846 0.904 17919 123420 1 301 . 1 1 22 22 THR CA C 22 59.690 59.690 60.601 -0.911 17919 123421 1 301 . 1 1 22 22 THR CB C 22 71.200 71.200 71.107 0.093 17919 123422 1 301 . 1 1 22 22 THR H H 22 7.900 7.900 8.062 -0.162 17919 123423 1 301 . 1 1 23 23 ILE N N 23 121.190 121.190 120.895 0.295 17919 123424 1 301 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.777 -0.120 17919 123425 1 301 . 1 1 23 23 ILE C C 23 179.040 179.040 177.489 1.551 17919 123426 1 301 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.548 -0.288 17919 123427 1 301 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.449 -2.099 17919 123428 1 301 . 1 1 23 23 ILE H H 23 8.560 8.560 8.383 0.177 17919 123429 1 301 . 1 1 24 24 GLU N N 24 120.830 120.830 120.559 0.271 17919 123430 1 301 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.867 0.050 17919 123431 1 301 . 1 1 24 24 GLU C C 24 178.640 178.640 178.709 -0.069 17919 123432 1 301 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.895 0.326 17919 123433 1 301 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.379 -1.099 17919 123434 1 301 . 1 1 24 24 GLU H H 24 9.760 9.760 7.800 1.960 17919 123435 1 301 . 1 1 25 25 ASN N N 25 120.570 120.570 116.924 3.646 17919 123436 1 301 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.548 -0.023 17919 123437 1 301 . 1 1 25 25 ASN C C 25 178.380 178.380 177.718 0.662 17919 123438 1 301 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.463 0.597 17919 123439 1 301 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.835 -0.385 17919 123440 1 301 . 1 1 25 25 ASN H H 25 7.920 7.920 7.609 0.311 17919 123441 1 301 . 1 1 26 26 VAL N N 26 121.710 121.710 121.159 0.551 17919 123442 1 301 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.559 -0.162 17919 123443 1 301 . 1 1 26 26 VAL C C 26 177.950 177.950 177.596 0.354 17919 123444 1 301 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.714 0.946 17919 123445 1 301 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.706 -0.866 17919 123446 1 301 . 1 1 26 26 VAL H H 26 8.070 8.070 7.997 0.073 17919 123447 1 301 . 1 1 27 27 LYS N N 27 118.860 118.860 119.623 -0.763 17919 123448 1 301 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.226 0.354 17919 123449 1 301 . 1 1 27 27 LYS C C 27 180.550 180.550 179.156 1.394 17919 123450 1 301 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.466 -0.216 17919 123451 1 301 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.177 1.553 17919 123452 1 301 . 1 1 27 27 LYS H H 27 8.560 8.560 7.939 0.621 17919 123453 1 301 . 1 1 28 28 ALA N N 28 123.440 123.440 121.908 1.532 17919 123454 1 301 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.100 0.060 17919 123455 1 301 . 1 1 28 28 ALA C C 28 180.300 180.300 179.448 0.852 17919 123456 1 301 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.060 0.310 17919 123457 1 301 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.126 -0.416 17919 123458 1 301 . 1 1 28 28 ALA H H 28 8.060 8.060 7.719 0.341 17919 123459 1 301 . 1 1 29 29 LYS N N 29 119.940 119.940 119.072 0.868 17919 123460 1 301 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.135 0.072 17919 123461 1 301 . 1 1 29 29 LYS C C 29 180.320 180.320 178.984 1.336 17919 123462 1 301 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.036 0.614 17919 123463 1 301 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.661 0.629 17919 123464 1 301 . 1 1 29 29 LYS H H 29 7.850 7.850 7.499 0.351 17919 123465 1 301 . 1 1 30 30 ILE N N 30 121.080 121.080 120.700 0.380 17919 123466 1 301 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.553 -0.046 17919 123467 1 301 . 1 1 30 30 ILE C C 30 178.310 178.310 177.598 0.712 17919 123468 1 301 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.597 0.553 17919 123469 1 301 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.644 -0.844 17919 123470 1 301 . 1 1 30 30 ILE H H 30 8.280 8.280 8.342 -0.062 17919 123471 1 301 . 1 1 31 31 GLN N N 31 123.490 123.490 120.396 3.094 17919 123472 1 301 . 1 1 31 31 GLN HA H 31 3.829 3.829 4.076 -0.247 17919 123473 1 301 . 1 1 31 31 GLN C C 31 178.890 178.890 178.476 0.414 17919 123474 1 301 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.102 0.898 17919 123475 1 301 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.581 -0.861 17919 123476 1 301 . 1 1 31 31 GLN H H 31 8.580 8.580 8.304 0.276 17919 123477 1 301 . 1 1 32 32 ASP N N 32 119.360 119.360 119.507 -0.147 17919 123478 1 301 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.388 -0.034 17919 123479 1 301 . 1 1 32 32 ASP C C 32 177.250 177.250 178.226 -0.976 17919 123480 1 301 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.688 0.502 17919 123481 1 301 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.728 -0.148 17919 123482 1 301 . 1 1 32 32 ASP H H 32 8.010 8.010 8.162 -0.152 17919 123483 1 301 . 1 1 33 33 LYS N N 33 115.130 115.130 117.778 -2.648 17919 123484 1 301 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.277 0.060 17919 123485 1 301 . 1 1 33 33 LYS C C 33 177.870 177.870 178.122 -0.252 17919 123486 1 301 . 1 1 33 33 LYS CA C 33 58.050 58.050 58.115 -0.065 17919 123487 1 301 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.380 0.790 17919 123488 1 301 . 1 1 33 33 LYS H H 33 7.430 7.430 7.528 -0.098 17919 123489 1 301 . 1 1 34 34 GLU N N 34 113.870 113.870 114.649 -0.779 17919 123490 1 301 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.483 0.142 17919 123491 1 301 . 1 1 34 34 GLU C C 34 177.840 177.840 177.243 0.597 17919 123492 1 301 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.632 -0.462 17919 123493 1 301 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.581 1.079 17919 123494 1 301 . 1 1 34 34 GLU H H 34 8.740 8.740 8.132 0.608 17919 123495 1 301 . 1 1 35 35 GLY N N 35 108.650 108.650 109.372 -0.722 17919 123496 1 301 . 1 1 35 35 GLY C C 35 173.960 173.960 174.077 -0.117 17919 123497 1 301 . 1 1 35 35 GLY CA C 35 46.080 46.080 46.076 0.004 17919 123498 1 301 . 1 1 35 35 GLY H H 35 8.530 8.530 7.975 0.555 17919 123499 1 301 . 1 1 36 36 ILE N N 36 119.880 119.880 121.698 -1.818 17919 123500 1 301 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.418 0.027 17919 123501 1 301 . 1 1 36 36 ILE C C 36 173.590 173.590 174.277 -0.687 17919 123502 1 301 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.528 0.222 17919 123503 1 301 . 1 1 36 36 ILE CB C 36 40.580 40.580 39.553 1.027 17919 123504 1 301 . 1 1 36 36 ILE H H 36 6.150 6.150 7.620 -1.470 17919 123505 1 301 . 1 1 37 37 PRO HA H 37 4.634 4.634 5.103 -0.469 17919 123506 1 301 . 1 1 37 37 PRO C C 37 176.940 176.940 176.463 0.477 17919 123507 1 301 . 1 1 37 37 PRO CA C 37 61.660 61.660 60.983 0.677 17919 123508 1 301 . 1 1 37 37 PRO CB C 37 31.850 31.850 30.760 1.090 17919 123509 1 301 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.151 -0.034 17919 123510 1 301 . 1 1 38 38 PRO C C 38 178.320 178.320 178.653 -0.333 17919 123511 1 301 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.970 0.290 17919 123512 1 301 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.503 1.387 17919 123513 1 301 . 1 1 39 39 ASP N N 39 113.380 113.380 114.920 -1.540 17919 123514 1 301 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.395 0.035 17919 123515 1 301 . 1 1 39 39 ASP C C 39 177.090 177.090 176.424 0.666 17919 123516 1 301 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.129 -0.489 17919 123517 1 301 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.187 -0.647 17919 123518 1 301 . 1 1 39 39 ASP H H 39 8.550 8.550 8.703 -0.153 17919 123519 1 301 . 1 1 40 40 GLN N N 40 116.780 116.780 113.624 3.156 17919 123520 1 301 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.583 -0.119 17919 123521 1 301 . 1 1 40 40 GLN C C 40 175.380 175.380 174.790 0.590 17919 123522 1 301 . 1 1 40 40 GLN CA C 40 55.640 55.640 54.580 1.060 17919 123523 1 301 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.681 0.459 17919 123524 1 301 . 1 1 40 40 GLN H H 40 7.820 7.820 7.658 0.162 17919 123525 1 301 . 1 1 41 41 GLN N N 41 117.720 117.720 119.748 -2.028 17919 123526 1 301 . 1 1 41 41 GLN HA H 41 4.244 4.244 5.126 -0.882 17919 123527 1 301 . 1 1 41 41 GLN C C 41 176.300 176.300 174.814 1.486 17919 123528 1 301 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.024 1.446 17919 123529 1 301 . 1 1 41 41 GLN CB C 41 31.650 31.650 31.983 -0.333 17919 123530 1 301 . 1 1 41 41 GLN H H 41 7.480 7.480 7.620 -0.140 17919 123531 1 301 . 1 1 42 42 ARG N N 42 122.680 122.680 123.144 -0.464 17919 123532 1 301 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.659 -0.159 17919 123533 1 301 . 1 1 42 42 ARG C C 42 174.050 174.050 173.563 0.487 17919 123534 1 301 . 1 1 42 42 ARG CA C 42 55.050 55.050 55.162 -0.112 17919 123535 1 301 . 1 1 42 42 ARG CB C 42 31.750 31.750 34.254 -2.504 17919 123536 1 301 . 1 1 42 42 ARG H H 42 8.530 8.530 8.501 0.029 17919 123537 1 301 . 1 1 43 43 LEU N N 43 124.040 124.040 127.827 -3.787 17919 123538 1 301 . 1 1 43 43 LEU C C 43 175.290 175.290 175.082 0.208 17919 123539 1 301 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.767 -0.787 17919 123540 1 301 . 1 1 43 43 LEU CB C 43 45.790 45.790 44.270 1.520 17919 123541 1 301 . 1 1 43 43 LEU H H 43 8.820 8.820 8.908 -0.088 17919 123542 1 301 . 1 1 44 44 ILE N N 44 121.920 121.920 123.243 -1.323 17919 123543 1 301 . 1 1 44 44 ILE HA H 44 4.992 4.992 4.953 0.039 17919 123544 1 301 . 1 1 44 44 ILE C C 44 176.060 176.060 174.586 1.474 17919 123545 1 301 . 1 1 44 44 ILE CA C 44 58.980 58.980 58.372 0.608 17919 123546 1 301 . 1 1 44 44 ILE CB C 44 41.420 41.420 38.470 2.950 17919 123547 1 301 . 1 1 44 44 ILE H H 44 9.030 9.030 8.438 0.592 17919 123548 1 301 . 1 1 45 45 PHE N N 45 125.390 125.390 128.213 -2.823 17919 123549 1 301 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.882 0.163 17919 123550 1 301 . 1 1 45 45 PHE C C 45 174.470 174.470 174.489 -0.019 17919 123551 1 301 . 1 1 45 45 PHE CA C 45 57.020 57.020 57.190 -0.170 17919 123552 1 301 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.540 1.220 17919 123553 1 301 . 1 1 45 45 PHE H H 45 8.830 8.830 8.828 0.002 17919 123554 1 301 . 1 1 46 46 ALA N N 46 132.200 132.200 129.597 2.603 17919 123555 1 301 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.695 -0.005 17919 123556 1 301 . 1 1 46 46 ALA C C 46 177.290 177.290 177.753 -0.463 17919 123557 1 301 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.275 0.265 17919 123558 1 301 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.795 -0.225 17919 123559 1 301 . 1 1 46 46 ALA H H 46 8.810 8.810 8.520 0.290 17919 123560 1 301 . 1 1 47 47 GLY N N 47 102.340 102.340 104.363 -2.023 17919 123561 1 301 . 1 1 47 47 GLY C C 47 173.810 173.810 173.873 -0.063 17919 123562 1 301 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.046 0.304 17919 123563 1 301 . 1 1 47 47 GLY H H 47 8.130 8.130 8.465 -0.335 17919 123564 1 301 . 1 1 48 48 LYS N N 48 121.570 121.570 119.022 2.548 17919 123565 1 301 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.499 0.123 17919 123566 1 301 . 1 1 48 48 LYS C C 48 174.700 174.700 174.147 0.553 17919 123567 1 301 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.704 -0.154 17919 123568 1 301 . 1 1 48 48 LYS CB C 48 34.530 34.530 35.007 -0.477 17919 123569 1 301 . 1 1 48 48 LYS H H 48 7.980 7.980 7.600 0.380 17919 123570 1 301 . 1 1 49 49 GLN N N 49 122.410 122.410 124.249 -1.839 17919 123571 1 301 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.717 -0.157 17919 123572 1 301 . 1 1 49 49 GLN C C 49 175.670 175.670 175.602 0.068 17919 123573 1 301 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.023 -0.283 17919 123574 1 301 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.910 -0.910 17919 123575 1 301 . 1 1 49 49 GLN H H 49 8.600 8.600 8.548 0.052 17919 123576 1 301 . 1 1 50 50 LEU N N 50 125.520 125.520 127.986 -2.466 17919 123577 1 301 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.207 -0.117 17919 123578 1 301 . 1 1 50 50 LEU C C 50 176.660 176.660 175.855 0.805 17919 123579 1 301 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.029 0.211 17919 123580 1 301 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.209 -0.639 17919 123581 1 301 . 1 1 50 50 LEU H H 50 8.530 8.530 8.437 0.093 17919 123582 1 301 . 1 1 51 51 GLU N N 51 122.940 122.940 122.944 -0.004 17919 123583 1 301 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.508 -0.020 17919 123584 1 301 . 1 1 51 51 GLU C C 51 175.870 175.870 176.697 -0.827 17919 123585 1 301 . 1 1 51 51 GLU CA C 51 55.960 55.960 54.909 1.051 17919 123586 1 301 . 1 1 51 51 GLU CB C 51 31.570 31.570 32.009 -0.439 17919 123587 1 301 . 1 1 51 51 GLU H H 51 8.400 8.400 8.267 0.133 17919 123588 1 301 . 1 1 52 52 ASP N N 52 120.030 120.030 121.135 -1.105 17919 123589 1 301 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.532 -0.173 17919 123590 1 301 . 1 1 52 52 ASP C C 52 177.330 177.330 177.497 -0.167 17919 123591 1 301 . 1 1 52 52 ASP CA C 52 56.960 56.960 56.836 0.124 17919 123592 1 301 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.627 0.223 17919 123593 1 301 . 1 1 52 52 ASP H H 52 8.160 8.160 8.901 -0.741 17919 123594 1 301 . 1 1 53 53 GLY N N 53 106.660 106.660 106.548 0.112 17919 123595 1 301 . 1 1 53 53 GLY C C 53 174.870 174.870 173.877 0.993 17919 123596 1 301 . 1 1 53 53 GLY CA C 53 45.170 45.170 45.137 0.033 17919 123597 1 301 . 1 1 53 53 GLY H H 53 9.390 9.390 8.665 0.725 17919 123598 1 301 . 1 1 54 54 ARG N N 54 119.050 119.050 119.760 -0.710 17919 123599 1 301 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.699 -0.004 17919 123600 1 301 . 1 1 54 54 ARG C C 54 175.350 175.350 175.206 0.144 17919 123601 1 301 . 1 1 54 54 ARG CA C 54 54.390 54.390 53.556 0.834 17919 123602 1 301 . 1 1 54 54 ARG CB C 54 32.650 32.650 33.720 -1.070 17919 123603 1 301 . 1 1 54 54 ARG H H 54 7.460 7.460 7.252 0.208 17919 123604 1 301 . 1 1 55 55 THR N N 55 108.400 108.400 111.837 -3.437 17919 123605 1 301 . 1 1 55 55 THR HA H 55 5.240 5.240 4.919 0.321 17919 123606 1 301 . 1 1 55 55 THR C C 55 176.560 176.560 175.930 0.630 17919 123607 1 301 . 1 1 55 55 THR CA C 55 59.690 59.690 60.507 -0.817 17919 123608 1 301 . 1 1 55 55 THR CB C 55 72.260 72.260 71.123 1.137 17919 123609 1 301 . 1 1 55 55 THR H H 55 8.730 8.730 8.649 0.081 17919 123610 1 301 . 1 1 56 56 LEU N N 56 117.920 117.920 121.176 -3.256 17919 123611 1 301 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.160 -0.100 17919 123612 1 301 . 1 1 56 56 LEU C C 56 180.810 180.810 178.851 1.959 17919 123613 1 301 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.120 0.590 17919 123614 1 301 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.636 -1.266 17919 123615 1 301 . 1 1 56 56 LEU H H 56 8.140 8.140 8.868 -0.728 17919 123616 1 301 . 1 1 57 57 SER N N 57 113.330 113.330 114.885 -1.555 17919 123617 1 301 . 1 1 57 57 SER HA H 57 4.370 4.370 4.131 0.239 17919 123618 1 301 . 1 1 57 57 SER C C 57 178.310 178.310 176.809 1.501 17919 123619 1 301 . 1 1 57 57 SER CA C 57 61.080 61.080 62.002 -0.922 17919 123620 1 301 . 1 1 57 57 SER CB C 57 62.530 62.530 62.894 -0.364 17919 123621 1 301 . 1 1 57 57 SER H H 57 8.470 8.470 8.102 0.368 17919 123622 1 301 . 1 1 58 58 ASP N N 58 124.190 124.190 121.679 2.511 17919 123623 1 301 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.361 -0.065 17919 123624 1 301 . 1 1 58 58 ASP C C 58 177.400 177.400 177.144 0.256 17919 123625 1 301 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.075 1.105 17919 123626 1 301 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.356 -0.257 17919 123627 1 301 . 1 1 58 58 ASP H H 58 7.930 7.930 7.792 0.138 17919 123628 1 301 . 1 1 59 59 TYR N N 59 115.510 115.510 116.008 -0.498 17919 123629 1 301 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.553 0.117 17919 123630 1 301 . 1 1 59 59 TYR C C 59 174.700 174.700 175.187 -0.487 17919 123631 1 301 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.456 0.794 17919 123632 1 301 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.240 1.830 17919 123633 1 301 . 1 1 59 59 TYR H H 59 7.250 7.250 7.210 0.040 17919 123634 1 301 . 1 1 60 60 ASN N N 60 115.900 115.900 118.149 -2.249 17919 123635 1 301 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.319 0.036 17919 123636 1 301 . 1 1 60 60 ASN C C 60 174.340 174.340 174.313 0.027 17919 123637 1 301 . 1 1 60 60 ASN CA C 60 54.120 54.120 53.889 0.231 17919 123638 1 301 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.714 -0.304 17919 123639 1 301 . 1 1 60 60 ASN H H 60 8.150 8.150 7.963 0.187 17919 123640 1 301 . 1 1 61 61 ILE N N 61 118.600 118.600 120.305 -1.705 17919 123641 1 301 . 1 1 61 61 ILE HA H 61 3.393 3.393 4.063 -0.670 17919 123642 1 301 . 1 1 61 61 ILE C C 61 174.610 174.610 175.743 -1.133 17919 123643 1 301 . 1 1 61 61 ILE CA C 61 62.420 62.420 59.801 2.619 17919 123644 1 301 . 1 1 61 61 ILE CB C 61 36.740 36.740 36.584 0.157 17919 123645 1 301 . 1 1 61 61 ILE H H 61 7.250 7.250 7.628 -0.378 17919 123646 1 301 . 1 1 62 62 GLN N N 62 124.740 124.740 126.298 -1.558 17919 123647 1 301 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.552 -0.046 17919 123648 1 301 . 1 1 62 62 GLN C C 62 175.970 175.970 175.935 0.035 17919 123649 1 301 . 1 1 62 62 GLN CA C 62 53.660 53.660 54.541 -0.881 17919 123650 1 301 . 1 1 62 62 GLN CB C 62 31.650 31.650 30.448 1.202 17919 123651 1 301 . 1 1 62 62 GLN H H 62 7.610 7.610 8.381 -0.771 17919 123652 1 301 . 1 1 63 63 LYS N N 63 120.300 120.300 121.333 -1.033 17919 123653 1 301 . 1 1 63 63 LYS HA H 63 4.001 4.001 3.862 0.139 17919 123654 1 301 . 1 1 63 63 LYS C C 63 175.810 175.810 176.816 -1.006 17919 123655 1 301 . 1 1 63 63 LYS CA C 63 57.790 57.790 58.427 -0.637 17919 123656 1 301 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.540 0.110 17919 123657 1 301 . 1 1 63 63 LYS H H 63 8.490 8.490 8.453 0.037 17919 123658 1 301 . 1 1 64 64 GLU N N 64 113.950 113.950 120.391 -6.441 17919 123659 1 301 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.441 0.024 17919 123660 1 301 . 1 1 64 64 GLU C C 64 175.250 175.250 175.997 -0.747 17919 123661 1 301 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.686 0.204 17919 123662 1 301 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.961 -3.061 17919 123663 1 301 . 1 1 64 64 GLU H H 64 9.280 9.280 8.730 0.550 17919 123664 1 301 . 1 1 65 65 SER N N 65 114.730 114.730 114.421 0.309 17919 123665 1 301 . 1 1 65 65 SER HA H 65 4.640 4.640 4.417 0.223 17919 123666 1 301 . 1 1 65 65 SER C C 65 172.160 172.160 173.878 -1.718 17919 123667 1 301 . 1 1 65 65 SER CA C 65 60.890 60.890 60.391 0.499 17919 123668 1 301 . 1 1 65 65 SER CB C 65 64.910 64.910 63.897 1.013 17919 123669 1 301 . 1 1 65 65 SER H H 65 7.670 7.670 7.457 0.213 17919 123670 1 301 . 1 1 66 66 THR N N 66 117.110 117.110 118.376 -1.266 17919 123671 1 301 . 1 1 66 66 THR HA H 66 5.270 5.270 4.957 0.313 17919 123672 1 301 . 1 1 66 66 THR C C 66 173.950 173.950 173.986 -0.036 17919 123673 1 301 . 1 1 66 66 THR CA C 66 62.340 62.340 62.231 0.109 17919 123674 1 301 . 1 1 66 66 THR CB C 66 70.080 70.080 69.538 0.542 17919 123675 1 301 . 1 1 66 66 THR H H 66 8.730 8.730 8.529 0.201 17919 123676 1 301 . 1 1 67 67 LEU N N 67 127.110 127.110 128.177 -1.067 17919 123677 1 301 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.487 0.573 17919 123678 1 301 . 1 1 67 67 LEU C C 67 175.770 175.770 175.643 0.127 17919 123679 1 301 . 1 1 67 67 LEU CA C 67 53.900 53.900 54.813 -0.913 17919 123680 1 301 . 1 1 67 67 LEU CB C 67 44.260 44.260 42.742 1.518 17919 123681 1 301 . 1 1 67 67 LEU H H 67 9.410 9.410 9.147 0.263 17919 123682 1 301 . 1 1 68 68 HIS N N 68 118.380 118.380 124.445 -6.065 17919 123683 1 301 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.402 -0.162 17919 123684 1 301 . 1 1 68 68 HIS C C 68 173.150 173.150 173.440 -0.290 17919 123685 1 301 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.373 0.627 17919 123686 1 301 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.434 -1.904 17919 123687 1 301 . 1 1 68 68 HIS H H 68 9.230 9.230 8.369 0.861 17919 123688 1 301 . 1 1 69 69 LEU N N 69 124.460 124.460 129.095 -4.635 17919 123689 1 301 . 1 1 69 69 LEU HA H 69 5.190 5.190 5.373 -0.183 17919 123690 1 301 . 1 1 69 69 LEU C C 69 175.270 175.270 174.370 0.900 17919 123691 1 301 . 1 1 69 69 LEU CA C 69 53.890 53.890 53.142 0.748 17919 123692 1 301 . 1 1 69 69 LEU CB C 69 44.380 44.380 45.781 -1.401 17919 123693 1 301 . 1 1 69 69 LEU H H 69 8.340 8.340 8.100 0.240 17919 123694 1 301 . 1 1 70 70 VAL N N 70 126.940 126.940 127.076 -0.136 17919 123695 1 301 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.362 -0.012 17919 123696 1 301 . 1 1 70 70 VAL C C 70 174.000 174.000 174.484 -0.484 17919 123697 1 301 . 1 1 70 70 VAL CA C 70 60.800 60.800 61.640 -0.840 17919 123698 1 301 . 1 1 70 70 VAL CB C 70 34.910 34.910 33.321 1.589 17919 123699 1 301 . 1 1 70 70 VAL H H 70 9.200 9.200 9.040 0.160 17919 123700 1 301 . 1 1 71 71 LEU N N 71 123.130 123.130 125.960 -2.830 17919 123701 1 301 . 1 1 71 71 LEU HA H 71 5.060 5.060 5.252 -0.192 17919 123702 1 301 . 1 1 71 71 LEU C C 71 177.830 177.830 177.237 0.593 17919 123703 1 301 . 1 1 71 71 LEU CA C 71 53.940 53.940 52.951 0.989 17919 123704 1 301 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.671 -0.821 17919 123705 1 301 . 1 1 71 71 LEU H H 71 8.120 8.120 8.376 -0.256 17919 123706 1 301 . 1 1 72 72 ARG N N 72 123.490 123.490 124.554 -1.064 17919 123707 1 301 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.259 0.042 17919 123708 1 301 . 1 1 72 72 ARG C C 72 175.350 175.350 175.700 -0.350 17919 123709 1 301 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.825 -0.215 17919 123710 1 301 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.684 0.666 17919 123711 1 301 . 1 1 72 72 ARG H H 72 8.580 8.580 8.247 0.333 17919 stop_ loop_ _SPARTA_output.Data_ID _SPARTA_output.Entity_delta_chem_shifts_ID _SPARTA_output.Conformer_ID _SPARTA_output.Data_type _SPARTA_output.Data_atom _SPARTA_output.Data_num_shifts _SPARTA_output.Data_value _SPARTA_output.Data_low_range _SPARTA_output.Data_high_range _SPARTA_output.Entry_ID 1 1 1 "Average Difference" N 68 2.601 1.168 2.341 17919 2 1 1 "Average Difference" HA 74 0.261 -0.085 0.248 17919 3 1 1 "Average Difference" C 71 0.916 -0.106 0.916 17919 4 1 1 "Average Difference" CA 71 0.718 0.026 0.723 17919 5 1 1 "Average Difference" CB 67 1.095 -0.120 1.097 17919 6 1 1 "Average Difference" HN 68 0.535 -0.097 0.530 17919 7 1 2 "Average Difference" N 68 2.634 0.947 2.476 17919 8 1 2 "Average Difference" HA 74 0.247 -0.081 0.235 17919 9 1 2 "Average Difference" C 71 0.869 -0.015 0.875 17919 10 1 2 "Average Difference" CA 71 0.682 0.037 0.685 17919 11 1 2 "Average Difference" CB 67 1.080 -0.258 1.057 17919 12 1 2 "Average Difference" HN 68 0.577 -0.168 0.556 17919 13 1 3 "Average Difference" N 68 2.661 1.213 2.386 17919 14 1 3 "Average Difference" HA 74 0.254 -0.047 0.251 17919 15 1 3 "Average Difference" C 71 0.869 -0.152 0.862 17919 16 1 3 "Average Difference" CA 71 0.814 0.000 0.820 17919 17 1 3 "Average Difference" CB 67 1.001 -0.123 1.001 17919 18 1 3 "Average Difference" HN 68 0.482 -0.079 0.479 17919 19 1 4 "Average Difference" N 68 2.296 0.606 2.231 17919 20 1 4 "Average Difference" HA 74 0.256 -0.072 0.247 17919 21 1 4 "Average Difference" C 71 0.866 -0.098 0.866 17919 22 1 4 "Average Difference" CA 71 1.158 -0.125 1.160 17919 23 1 4 "Average Difference" CB 67 1.267 -0.120 1.271 17919 24 1 4 "Average Difference" HN 68 0.524 -0.121 0.513 17919 25 1 5 "Average Difference" N 68 2.885 1.300 2.595 17919 26 1 5 "Average Difference" HA 74 0.277 -0.088 0.265 17919 27 1 5 "Average Difference" C 71 0.905 -0.116 0.904 17919 28 1 5 "Average Difference" CA 71 0.815 0.166 0.804 17919 29 1 5 "Average Difference" CB 67 1.175 -0.160 1.172 17919 30 1 5 "Average Difference" HN 68 0.615 -0.188 0.590 17919 31 1 6 "Average Difference" N 68 2.455 0.970 2.272 17919 32 1 6 "Average Difference" HA 74 0.259 -0.092 0.244 17919 33 1 6 "Average Difference" C 71 0.882 -0.053 0.886 17919 34 1 6 "Average Difference" CA 71 0.787 0.086 0.788 17919 35 1 6 "Average Difference" CB 67 1.131 -0.303 1.098 17919 36 1 6 "Average Difference" HN 68 0.514 -0.192 0.480 17919 37 1 7 "Average Difference" N 68 2.541 0.942 2.378 17919 38 1 7 "Average Difference" HA 74 0.224 -0.078 0.212 17919 39 1 7 "Average Difference" C 71 0.898 -0.100 0.899 17919 40 1 7 "Average Difference" CA 71 0.766 0.025 0.771 17919 41 1 7 "Average Difference" CB 67 1.120 -0.212 1.108 17919 42 1 7 "Average Difference" HN 68 0.537 -0.145 0.521 17919 43 1 8 "Average Difference" N 68 2.620 1.059 2.415 17919 44 1 8 "Average Difference" HA 74 0.246 -0.096 0.228 17919 45 1 8 "Average Difference" C 71 0.848 -0.116 0.846 17919 46 1 8 "Average Difference" CA 71 0.772 0.035 0.777 17919 47 1 8 "Average Difference" CB 67 1.030 -0.290 0.996 17919 48 1 8 "Average Difference" HN 68 0.568 -0.176 0.544 17919 49 1 9 "Average Difference" N 68 2.717 0.477 2.694 17919 50 1 9 "Average Difference" HA 74 0.248 -0.054 0.244 17919 51 1 9 "Average Difference" C 71 0.872 -0.126 0.869 17919 52 1 9 "Average Difference" CA 71 0.794 -0.085 0.795 17919 53 1 9 "Average Difference" CB 67 1.107 -0.178 1.101 17919 54 1 9 "Average Difference" HN 68 0.524 -0.154 0.504 17919 55 1 10 "Average Difference" N 68 2.699 0.988 2.530 17919 56 1 10 "Average Difference" HA 74 0.256 -0.083 0.243 17919 57 1 10 "Average Difference" C 71 0.877 -0.083 0.879 17919 58 1 10 "Average Difference" CA 71 0.780 0.109 0.778 17919 59 1 10 "Average Difference" CB 67 1.097 -0.113 1.100 17919 60 1 10 "Average Difference" HN 68 0.546 -0.154 0.528 17919 61 1 11 "Average Difference" N 68 2.351 0.563 2.300 17919 62 1 11 "Average Difference" HA 74 0.235 -0.048 0.232 17919 63 1 11 "Average Difference" C 71 0.893 -0.128 0.890 17919 64 1 11 "Average Difference" CA 71 0.832 -0.090 0.833 17919 65 1 11 "Average Difference" CB 67 1.309 -0.194 1.304 17919 66 1 11 "Average Difference" HN 68 0.505 -0.109 0.497 17919 67 1 12 "Average Difference" N 68 2.812 1.293 2.516 17919 68 1 12 "Average Difference" HA 74 0.256 -0.088 0.243 17919 69 1 12 "Average Difference" C 71 0.902 -0.171 0.891 17919 70 1 12 "Average Difference" CA 71 0.849 -0.017 0.855 17919 71 1 12 "Average Difference" CB 67 1.114 -0.202 1.104 17919 72 1 12 "Average Difference" HN 68 0.521 -0.124 0.510 17919 73 1 13 "Average Difference" N 68 2.679 0.937 2.528 17919 74 1 13 "Average Difference" HA 74 0.257 -0.049 0.254 17919 75 1 13 "Average Difference" C 71 0.895 -0.105 0.896 17919 76 1 13 "Average Difference" CA 71 0.924 0.070 0.928 17919 77 1 13 "Average Difference" CB 67 1.064 -0.115 1.065 17919 78 1 13 "Average Difference" HN 68 0.481 -0.069 0.480 17919 79 1 14 "Average Difference" N 68 2.722 0.997 2.551 17919 80 1 14 "Average Difference" HA 74 0.234 -0.047 0.231 17919 81 1 14 "Average Difference" C 71 0.842 -0.162 0.833 17919 82 1 14 "Average Difference" CA 71 0.718 -0.059 0.721 17919 83 1 14 "Average Difference" CB 67 1.101 -0.148 1.099 17919 84 1 14 "Average Difference" HN 68 0.482 -0.066 0.481 17919 85 1 15 "Average Difference" N 68 2.296 0.893 2.131 17919 86 1 15 "Average Difference" HA 74 0.249 -0.043 0.247 17919 87 1 15 "Average Difference" C 71 0.893 -0.151 0.887 17919 88 1 15 "Average Difference" CA 71 0.773 -0.035 0.777 17919 89 1 15 "Average Difference" CB 67 1.205 -0.044 1.213 17919 90 1 15 "Average Difference" HN 68 0.487 -0.095 0.481 17919 91 1 16 "Average Difference" N 68 2.349 1.102 2.090 17919 92 1 16 "Average Difference" HA 74 0.251 -0.066 0.244 17919 93 1 16 "Average Difference" C 71 0.776 -0.041 0.780 17919 94 1 16 "Average Difference" CA 71 0.714 0.014 0.719 17919 95 1 16 "Average Difference" CB 67 1.107 -0.224 1.092 17919 96 1 16 "Average Difference" HN 68 0.558 -0.162 0.538 17919 97 1 17 "Average Difference" N 68 3.293 0.848 3.206 17919 98 1 17 "Average Difference" HA 74 0.261 -0.044 0.259 17919 99 1 17 "Average Difference" C 71 0.883 -0.167 0.873 17919 100 1 17 "Average Difference" CA 71 0.814 0.024 0.820 17919 101 1 17 "Average Difference" CB 67 1.141 -0.092 1.146 17919 102 1 17 "Average Difference" HN 68 0.552 -0.143 0.537 17919 103 1 18 "Average Difference" N 68 2.481 0.893 2.331 17919 104 1 18 "Average Difference" HA 74 0.217 -0.036 0.216 17919 105 1 18 "Average Difference" C 71 0.899 -0.074 0.902 17919 106 1 18 "Average Difference" CA 71 0.819 -0.031 0.824 17919 107 1 18 "Average Difference" CB 67 1.065 -0.051 1.071 17919 108 1 18 "Average Difference" HN 68 0.536 -0.096 0.531 17919 109 1 19 "Average Difference" N 68 2.382 1.024 2.167 17919 110 1 19 "Average Difference" HA 74 0.247 -0.095 0.230 17919 111 1 19 "Average Difference" C 71 0.845 -0.061 0.849 17919 112 1 19 "Average Difference" CA 71 0.702 0.078 0.703 17919 113 1 19 "Average Difference" CB 67 1.190 -0.258 1.170 17919 114 1 19 "Average Difference" HN 68 0.480 -0.075 0.477 17919 115 1 20 "Average Difference" N 68 2.673 1.360 2.318 17919 116 1 20 "Average Difference" HA 74 0.252 -0.095 0.235 17919 117 1 20 "Average Difference" C 71 0.909 -0.119 0.908 17919 118 1 20 "Average Difference" CA 71 0.676 0.173 0.659 17919 119 1 20 "Average Difference" CB 67 1.239 -0.223 1.228 17919 120 1 20 "Average Difference" HN 68 0.472 -0.085 0.468 17919 121 1 21 "Average Difference" N 68 2.703 1.312 2.381 17919 122 1 21 "Average Difference" HA 74 0.249 -0.110 0.225 17919 123 1 21 "Average Difference" C 71 0.851 -0.143 0.845 17919 124 1 21 "Average Difference" CA 71 0.795 0.062 0.798 17919 125 1 21 "Average Difference" CB 67 0.949 -0.190 0.936 17919 126 1 21 "Average Difference" HN 68 0.490 -0.129 0.476 17919 127 1 22 "Average Difference" N 68 2.407 0.785 2.292 17919 128 1 22 "Average Difference" HA 74 0.244 -0.069 0.236 17919 129 1 22 "Average Difference" C 71 0.819 -0.028 0.825 17919 130 1 22 "Average Difference" CA 71 0.745 -0.018 0.750 17919 131 1 22 "Average Difference" CB 67 1.194 -0.181 1.189 17919 132 1 22 "Average Difference" HN 68 0.497 -0.168 0.471 17919 133 1 23 "Average Difference" N 68 2.576 1.064 2.363 17919 134 1 23 "Average Difference" HA 74 0.220 -0.065 0.212 17919 135 1 23 "Average Difference" C 71 0.849 -0.097 0.849 17919 136 1 23 "Average Difference" CA 71 0.747 0.036 0.752 17919 137 1 23 "Average Difference" CB 67 1.156 -0.102 1.160 17919 138 1 23 "Average Difference" HN 68 0.498 -0.069 0.497 17919 139 1 24 "Average Difference" N 68 2.256 0.769 2.137 17919 140 1 24 "Average Difference" HA 74 0.232 -0.029 0.232 17919 141 1 24 "Average Difference" C 71 0.886 -0.093 0.887 17919 142 1 24 "Average Difference" CA 71 0.743 0.059 0.746 17919 143 1 24 "Average Difference" CB 67 1.159 -0.117 1.162 17919 144 1 24 "Average Difference" HN 68 0.527 -0.097 0.522 17919 145 1 25 "Average Difference" N 68 2.730 0.729 2.650 17919 146 1 25 "Average Difference" HA 74 0.257 -0.041 0.255 17919 147 1 25 "Average Difference" C 71 0.843 -0.155 0.834 17919 148 1 25 "Average Difference" CA 71 0.941 -0.061 0.945 17919 149 1 25 "Average Difference" CB 67 1.138 -0.185 1.131 17919 150 1 25 "Average Difference" HN 68 0.521 -0.138 0.506 17919 151 1 26 "Average Difference" N 68 2.503 1.059 2.285 17919 152 1 26 "Average Difference" HA 74 0.239 -0.064 0.232 17919 153 1 26 "Average Difference" C 71 0.911 -0.195 0.896 17919 154 1 26 "Average Difference" CA 71 0.793 0.048 0.798 17919 155 1 26 "Average Difference" CB 67 1.047 -0.135 1.046 17919 156 1 26 "Average Difference" HN 68 0.514 -0.132 0.501 17919 157 1 27 "Average Difference" N 68 2.363 0.983 2.165 17919 158 1 27 "Average Difference" HA 74 0.264 -0.093 0.249 17919 159 1 27 "Average Difference" C 71 0.859 -0.062 0.863 17919 160 1 27 "Average Difference" CA 71 0.670 0.121 0.663 17919 161 1 27 "Average Difference" CB 67 1.236 -0.203 1.228 17919 162 1 27 "Average Difference" HN 68 0.500 -0.099 0.494 17919 163 1 28 "Average Difference" N 68 2.649 0.924 2.502 17919 164 1 28 "Average Difference" HA 74 0.266 -0.065 0.260 17919 165 1 28 "Average Difference" C 71 0.841 -0.068 0.845 17919 166 1 28 "Average Difference" CA 71 0.797 0.142 0.790 17919 167 1 28 "Average Difference" CB 67 1.099 -0.101 1.103 17919 168 1 28 "Average Difference" HN 68 0.518 -0.092 0.513 17919 169 1 29 "Average Difference" N 68 2.905 0.960 2.762 17919 170 1 29 "Average Difference" HA 74 0.251 -0.057 0.246 17919 171 1 29 "Average Difference" C 71 0.974 -0.196 0.961 17919 172 1 29 "Average Difference" CA 71 0.807 0.040 0.811 17919 173 1 29 "Average Difference" CB 67 1.102 -0.052 1.110 17919 174 1 29 "Average Difference" HN 68 0.491 -0.124 0.479 17919 175 1 30 "Average Difference" N 68 2.739 1.378 2.385 17919 176 1 30 "Average Difference" HA 74 0.253 -0.054 0.249 17919 177 1 30 "Average Difference" C 71 0.896 -0.105 0.896 17919 178 1 30 "Average Difference" CA 71 0.826 0.005 0.831 17919 179 1 30 "Average Difference" CB 67 1.061 -0.188 1.053 17919 180 1 30 "Average Difference" HN 68 0.474 -0.031 0.477 17919 181 1 31 "Average Difference" N 68 2.314 0.787 2.193 17919 182 1 31 "Average Difference" HA 74 0.258 -0.076 0.248 17919 183 1 31 "Average Difference" C 71 0.873 -0.078 0.876 17919 184 1 31 "Average Difference" CA 71 0.824 -0.002 0.830 17919 185 1 31 "Average Difference" CB 67 1.117 -0.145 1.116 17919 186 1 31 "Average Difference" HN 68 0.497 -0.133 0.483 17919 187 1 32 "Average Difference" N 68 2.630 1.006 2.448 17919 188 1 32 "Average Difference" HA 74 0.237 -0.069 0.228 17919 189 1 32 "Average Difference" C 71 0.847 -0.128 0.843 17919 190 1 32 "Average Difference" CA 71 0.739 0.051 0.743 17919 191 1 32 "Average Difference" CB 67 1.073 -0.111 1.075 17919 192 1 32 "Average Difference" HN 68 0.529 -0.111 0.522 17919 193 1 33 "Average Difference" N 68 2.747 1.158 2.509 17919 194 1 33 "Average Difference" HA 74 0.268 -0.098 0.251 17919 195 1 33 "Average Difference" C 71 0.926 -0.130 0.923 17919 196 1 33 "Average Difference" CA 71 0.722 0.053 0.725 17919 197 1 33 "Average Difference" CB 67 1.198 -0.251 1.180 17919 198 1 33 "Average Difference" HN 68 0.465 -0.063 0.464 17919 199 1 34 "Average Difference" N 68 2.601 0.906 2.456 17919 200 1 34 "Average Difference" HA 74 0.243 -0.064 0.236 17919 201 1 34 "Average Difference" C 71 0.931 -0.087 0.933 17919 202 1 34 "Average Difference" CA 71 0.778 0.042 0.782 17919 203 1 34 "Average Difference" CB 67 1.115 -0.120 1.117 17919 204 1 34 "Average Difference" HN 68 0.542 -0.104 0.536 17919 205 1 35 "Average Difference" N 68 2.360 1.022 2.143 17919 206 1 35 "Average Difference" HA 74 0.278 -0.042 0.277 17919 207 1 35 "Average Difference" C 71 0.896 -0.087 0.898 17919 208 1 35 "Average Difference" CA 71 0.776 -0.019 0.781 17919 209 1 35 "Average Difference" CB 67 1.048 -0.137 1.047 17919 210 1 35 "Average Difference" HN 68 0.482 -0.099 0.475 17919 211 1 36 "Average Difference" N 68 2.660 1.258 2.361 17919 212 1 36 "Average Difference" HA 74 0.259 -0.082 0.248 17919 213 1 36 "Average Difference" C 71 0.845 -0.156 0.837 17919 214 1 36 "Average Difference" CA 71 0.787 0.012 0.792 17919 215 1 36 "Average Difference" CB 67 1.087 -0.106 1.090 17919 216 1 36 "Average Difference" HN 68 0.444 -0.116 0.431 17919 217 1 37 "Average Difference" N 68 2.976 1.152 2.765 17919 218 1 37 "Average Difference" HA 74 0.262 -0.078 0.252 17919 219 1 37 "Average Difference" C 71 0.985 -0.220 0.967 17919 220 1 37 "Average Difference" CA 71 1.051 0.108 1.053 17919 221 1 37 "Average Difference" CB 67 1.136 -0.030 1.145 17919 222 1 37 "Average Difference" HN 68 0.551 -0.131 0.539 17919 223 1 38 "Average Difference" N 68 2.670 1.215 2.395 17919 224 1 38 "Average Difference" HA 74 0.276 -0.104 0.258 17919 225 1 38 "Average Difference" C 71 0.861 -0.061 0.864 17919 226 1 38 "Average Difference" CA 71 0.774 0.171 0.760 17919 227 1 38 "Average Difference" CB 67 1.172 -0.270 1.149 17919 228 1 38 "Average Difference" HN 68 0.481 -0.098 0.474 17919 229 1 39 "Average Difference" N 68 2.432 1.076 2.197 17919 230 1 39 "Average Difference" HA 74 0.298 -0.094 0.285 17919 231 1 39 "Average Difference" C 71 0.904 -0.175 0.893 17919 232 1 39 "Average Difference" CA 71 0.752 0.012 0.757 17919 233 1 39 "Average Difference" CB 67 1.208 -0.241 1.193 17919 234 1 39 "Average Difference" HN 68 0.563 -0.102 0.558 17919 235 1 40 "Average Difference" N 68 2.479 1.033 2.270 17919 236 1 40 "Average Difference" HA 74 0.275 -0.055 0.271 17919 237 1 40 "Average Difference" C 71 0.844 -0.253 0.810 17919 238 1 40 "Average Difference" CA 71 0.786 -0.010 0.792 17919 239 1 40 "Average Difference" CB 67 1.205 -0.131 1.207 17919 240 1 40 "Average Difference" HN 68 0.527 -0.106 0.520 17919 241 1 41 "Average Difference" N 68 2.634 0.796 2.530 17919 242 1 41 "Average Difference" HA 74 0.249 -0.030 0.249 17919 243 1 41 "Average Difference" C 71 0.862 -0.202 0.844 17919 244 1 41 "Average Difference" CA 71 0.893 -0.010 0.899 17919 245 1 41 "Average Difference" CB 67 1.190 -0.071 1.197 17919 246 1 41 "Average Difference" HN 68 0.526 -0.123 0.515 17919 247 1 42 "Average Difference" N 68 2.514 1.037 2.307 17919 248 1 42 "Average Difference" HA 74 0.242 -0.065 0.235 17919 249 1 42 "Average Difference" C 71 0.865 -0.074 0.868 17919 250 1 42 "Average Difference" CA 71 0.720 -0.042 0.724 17919 251 1 42 "Average Difference" CB 67 1.064 -0.114 1.066 17919 252 1 42 "Average Difference" HN 68 0.476 -0.088 0.472 17919 253 1 43 "Average Difference" N 68 2.654 0.386 2.645 17919 254 1 43 "Average Difference" HA 74 0.251 -0.036 0.250 17919 255 1 43 "Average Difference" C 71 0.856 -0.150 0.848 17919 256 1 43 "Average Difference" CA 71 0.799 -0.051 0.803 17919 257 1 43 "Average Difference" CB 67 1.088 -0.066 1.094 17919 258 1 43 "Average Difference" HN 68 0.536 -0.142 0.521 17919 259 1 44 "Average Difference" N 68 2.826 0.834 2.720 17919 260 1 44 "Average Difference" HA 74 0.271 -0.114 0.248 17919 261 1 44 "Average Difference" C 71 0.868 -0.110 0.867 17919 262 1 44 "Average Difference" CA 71 0.758 0.126 0.752 17919 263 1 44 "Average Difference" CB 67 1.309 -0.290 1.286 17919 264 1 44 "Average Difference" HN 68 0.520 -0.168 0.496 17919 265 1 45 "Average Difference" N 68 2.267 0.701 2.172 17919 266 1 45 "Average Difference" HA 74 0.217 -0.068 0.207 17919 267 1 45 "Average Difference" C 71 0.913 -0.108 0.913 17919 268 1 45 "Average Difference" CA 71 0.733 0.086 0.733 17919 269 1 45 "Average Difference" CB 67 1.147 -0.151 1.145 17919 270 1 45 "Average Difference" HN 68 0.512 -0.114 0.502 17919 271 1 46 "Average Difference" N 68 2.614 1.430 2.205 17919 272 1 46 "Average Difference" HA 74 0.250 -0.078 0.239 17919 273 1 46 "Average Difference" C 71 0.890 -0.134 0.887 17919 274 1 46 "Average Difference" CA 71 0.775 -0.028 0.780 17919 275 1 46 "Average Difference" CB 67 1.073 -0.252 1.051 17919 276 1 46 "Average Difference" HN 68 0.501 -0.127 0.489 17919 277 1 47 "Average Difference" N 68 2.485 0.823 2.363 17919 278 1 47 "Average Difference" HA 74 0.219 -0.049 0.215 17919 279 1 47 "Average Difference" C 71 0.922 -0.145 0.917 17919 280 1 47 "Average Difference" CA 71 0.903 0.008 0.909 17919 281 1 47 "Average Difference" CB 67 1.167 -0.072 1.174 17919 282 1 47 "Average Difference" HN 68 0.482 -0.096 0.476 17919 283 1 48 "Average Difference" N 68 2.472 0.486 2.441 17919 284 1 48 "Average Difference" HA 74 0.217 -0.044 0.214 17919 285 1 48 "Average Difference" C 71 0.808 -0.163 0.797 17919 286 1 48 "Average Difference" CA 71 0.768 -0.111 0.765 17919 287 1 48 "Average Difference" CB 67 0.987 -0.006 0.994 17919 288 1 48 "Average Difference" HN 68 0.472 -0.092 0.466 17919 289 1 49 "Average Difference" N 68 2.595 1.019 2.405 17919 290 1 49 "Average Difference" HA 74 0.282 -0.074 0.274 17919 291 1 49 "Average Difference" C 71 0.858 -0.232 0.832 17919 292 1 49 "Average Difference" CA 71 0.839 0.019 0.845 17919 293 1 49 "Average Difference" CB 67 1.262 -0.249 1.246 17919 294 1 49 "Average Difference" HN 68 0.551 -0.182 0.524 17919 295 1 50 "Average Difference" N 68 2.397 1.166 2.110 17919 296 1 50 "Average Difference" HA 74 0.250 -0.060 0.245 17919 297 1 50 "Average Difference" C 71 0.828 -0.165 0.817 17919 298 1 50 "Average Difference" CA 71 0.760 0.036 0.764 17919 299 1 50 "Average Difference" CB 67 0.956 -0.034 0.963 17919 300 1 50 "Average Difference" HN 68 0.490 -0.042 0.492 17919 301 1 51 "Average Difference" N 68 2.947 1.009 2.789 17919 302 1 51 "Average Difference" HA 74 0.254 -0.077 0.244 17919 303 1 51 "Average Difference" C 71 0.953 -0.187 0.941 17919 304 1 51 "Average Difference" CA 71 0.816 0.038 0.820 17919 305 1 51 "Average Difference" CB 67 1.135 -0.026 1.143 17919 306 1 51 "Average Difference" HN 68 0.561 -0.109 0.555 17919 307 1 52 "Average Difference" N 68 2.568 0.880 2.431 17919 308 1 52 "Average Difference" HA 74 0.259 -0.045 0.256 17919 309 1 52 "Average Difference" C 71 0.863 -0.138 0.858 17919 310 1 52 "Average Difference" CA 71 0.841 -0.095 0.841 17919 311 1 52 "Average Difference" CB 67 0.961 -0.120 0.961 17919 312 1 52 "Average Difference" HN 68 0.538 -0.099 0.533 17919 313 1 53 "Average Difference" N 68 2.259 0.869 2.101 17919 314 1 53 "Average Difference" HA 74 0.283 -0.100 0.267 17919 315 1 53 "Average Difference" C 71 0.866 -0.149 0.859 17919 316 1 53 "Average Difference" CA 71 0.799 -0.005 0.804 17919 317 1 53 "Average Difference" CB 67 1.187 -0.251 1.169 17919 318 1 53 "Average Difference" HN 68 0.512 -0.169 0.486 17919 319 1 54 "Average Difference" N 68 2.425 1.128 2.163 17919 320 1 54 "Average Difference" HA 74 0.265 -0.097 0.249 17919 321 1 54 "Average Difference" C 71 0.941 -0.071 0.945 17919 322 1 54 "Average Difference" CA 71 0.828 0.155 0.819 17919 323 1 54 "Average Difference" CB 67 1.187 -0.168 1.184 17919 324 1 54 "Average Difference" HN 68 0.545 -0.150 0.528 17919 325 1 55 "Average Difference" N 68 2.300 0.788 2.177 17919 326 1 55 "Average Difference" HA 74 0.228 -0.038 0.226 17919 327 1 55 "Average Difference" C 71 0.836 -0.184 0.821 17919 328 1 55 "Average Difference" CA 71 0.737 -0.058 0.740 17919 329 1 55 "Average Difference" CB 67 1.102 -0.055 1.109 17919 330 1 55 "Average Difference" HN 68 0.499 -0.047 0.500 17919 331 1 56 "Average Difference" N 68 2.452 1.036 2.239 17919 332 1 56 "Average Difference" HA 74 0.294 -0.090 0.281 17919 333 1 56 "Average Difference" C 71 0.919 -0.152 0.913 17919 334 1 56 "Average Difference" CA 71 0.959 0.144 0.955 17919 335 1 56 "Average Difference" CB 67 1.175 -0.251 1.157 17919 336 1 56 "Average Difference" HN 68 0.532 -0.024 0.535 17919 337 1 57 "Average Difference" N 68 2.536 0.847 2.408 17919 338 1 57 "Average Difference" HA 74 0.275 -0.085 0.263 17919 339 1 57 "Average Difference" C 71 0.890 -0.114 0.889 17919 340 1 57 "Average Difference" CA 71 0.899 0.082 0.902 17919 341 1 57 "Average Difference" CB 67 1.296 -0.247 1.282 17919 342 1 57 "Average Difference" HN 68 0.584 -0.132 0.573 17919 343 1 58 "Average Difference" N 68 2.930 0.948 2.793 17919 344 1 58 "Average Difference" HA 74 0.259 -0.051 0.256 17919 345 1 58 "Average Difference" C 71 0.874 -0.115 0.873 17919 346 1 58 "Average Difference" CA 71 0.827 0.041 0.832 17919 347 1 58 "Average Difference" CB 67 1.064 -0.228 1.047 17919 348 1 58 "Average Difference" HN 68 0.531 -0.150 0.514 17919 349 1 59 "Average Difference" N 68 2.929 0.982 2.780 17919 350 1 59 "Average Difference" HA 74 0.255 -0.048 0.252 17919 351 1 59 "Average Difference" C 71 0.891 -0.141 0.886 17919 352 1 59 "Average Difference" CA 71 0.783 0.015 0.788 17919 353 1 59 "Average Difference" CB 67 1.041 -0.109 1.043 17919 354 1 59 "Average Difference" HN 68 0.490 -0.077 0.488 17919 355 1 60 "Average Difference" N 68 2.568 0.826 2.450 17919 356 1 60 "Average Difference" HA 74 0.278 -0.049 0.275 17919 357 1 60 "Average Difference" C 71 0.857 -0.151 0.850 17919 358 1 60 "Average Difference" CA 71 0.795 0.036 0.800 17919 359 1 60 "Average Difference" CB 67 1.158 -0.030 1.166 17919 360 1 60 "Average Difference" HN 68 0.543 -0.125 0.533 17919 361 1 61 "Average Difference" N 68 2.789 0.921 2.653 17919 362 1 61 "Average Difference" HA 74 0.252 -0.066 0.245 17919 363 1 61 "Average Difference" C 71 0.917 -0.137 0.913 17919 364 1 61 "Average Difference" CA 71 0.666 -0.029 0.670 17919 365 1 61 "Average Difference" CB 67 1.104 -0.097 1.108 17919 366 1 61 "Average Difference" HN 68 0.545 -0.120 0.536 17919 367 1 62 "Average Difference" N 68 2.565 1.239 2.262 17919 368 1 62 "Average Difference" HA 74 0.263 -0.076 0.254 17919 369 1 62 "Average Difference" C 71 0.841 -0.175 0.829 17919 370 1 62 "Average Difference" CA 71 0.756 0.030 0.760 17919 371 1 62 "Average Difference" CB 67 1.256 -0.180 1.252 17919 372 1 62 "Average Difference" HN 68 0.499 -0.017 0.503 17919 373 1 63 "Average Difference" N 68 2.756 0.912 2.620 17919 374 1 63 "Average Difference" HA 74 0.242 -0.006 0.244 17919 375 1 63 "Average Difference" C 71 0.853 -0.190 0.838 17919 376 1 63 "Average Difference" CA 71 0.801 0.023 0.807 17919 377 1 63 "Average Difference" CB 67 1.053 -0.138 1.052 17919 378 1 63 "Average Difference" HN 68 0.556 -0.153 0.538 17919 379 1 64 "Average Difference" N 68 2.422 1.129 2.159 17919 380 1 64 "Average Difference" HA 74 0.281 -0.124 0.253 17919 381 1 64 "Average Difference" C 71 0.936 -0.044 0.941 17919 382 1 64 "Average Difference" CA 71 0.875 0.136 0.871 17919 383 1 64 "Average Difference" CB 67 1.286 -0.304 1.259 17919 384 1 64 "Average Difference" HN 68 0.530 -0.178 0.503 17919 385 1 65 "Average Difference" N 68 2.485 1.102 2.244 17919 386 1 65 "Average Difference" HA 74 0.263 -0.078 0.253 17919 387 1 65 "Average Difference" C 71 0.945 -0.156 0.939 17919 388 1 65 "Average Difference" CA 71 0.852 -0.061 0.856 17919 389 1 65 "Average Difference" CB 67 1.142 -0.227 1.127 17919 390 1 65 "Average Difference" HN 68 0.501 -0.112 0.492 17919 391 1 66 "Average Difference" N 68 2.309 0.853 2.162 17919 392 1 66 "Average Difference" HA 74 0.217 -0.044 0.214 17919 393 1 66 "Average Difference" C 71 0.839 -0.191 0.823 17919 394 1 66 "Average Difference" CA 71 0.682 -0.101 0.680 17919 395 1 66 "Average Difference" CB 67 1.029 -0.030 1.036 17919 396 1 66 "Average Difference" HN 68 0.514 -0.128 0.501 17919 397 1 67 "Average Difference" N 68 2.230 0.868 2.069 17919 398 1 67 "Average Difference" HA 74 0.283 -0.126 0.255 17919 399 1 67 "Average Difference" C 71 0.813 -0.130 0.808 17919 400 1 67 "Average Difference" CA 71 0.793 0.088 0.794 17919 401 1 67 "Average Difference" CB 67 1.007 -0.183 0.998 17919 402 1 67 "Average Difference" HN 68 0.555 -0.133 0.543 17919 403 1 68 "Average Difference" N 68 2.742 0.596 2.696 17919 404 1 68 "Average Difference" HA 74 0.274 -0.058 0.270 17919 405 1 68 "Average Difference" C 71 0.845 -0.135 0.840 17919 406 1 68 "Average Difference" CA 71 0.824 0.056 0.828 17919 407 1 68 "Average Difference" CB 67 1.065 -0.117 1.066 17919 408 1 68 "Average Difference" HN 68 0.520 -0.134 0.506 17919 409 1 69 "Average Difference" N 68 2.563 1.110 2.328 17919 410 1 69 "Average Difference" HA 74 0.244 -0.033 0.243 17919 411 1 69 "Average Difference" C 71 0.865 -0.125 0.862 17919 412 1 69 "Average Difference" CA 71 0.699 -0.036 0.703 17919 413 1 69 "Average Difference" CB 67 1.040 -0.164 1.035 17919 414 1 69 "Average Difference" HN 68 0.509 -0.107 0.501 17919 415 1 70 "Average Difference" N 68 2.518 1.081 2.291 17919 416 1 70 "Average Difference" HA 74 0.237 -0.083 0.224 17919 417 1 70 "Average Difference" C 71 0.842 -0.098 0.842 17919 418 1 70 "Average Difference" CA 71 0.912 0.061 0.917 17919 419 1 70 "Average Difference" CB 67 1.181 -0.199 1.173 17919 420 1 70 "Average Difference" HN 68 0.538 -0.099 0.533 17919 421 1 71 "Average Difference" N 68 2.677 0.804 2.572 17919 422 1 71 "Average Difference" HA 74 0.242 -0.031 0.242 17919 423 1 71 "Average Difference" C 71 0.919 -0.167 0.910 17919 424 1 71 "Average Difference" CA 71 0.725 -0.001 0.730 17919 425 1 71 "Average Difference" CB 67 1.109 -0.074 1.115 17919 426 1 71 "Average Difference" HN 68 0.513 -0.075 0.512 17919 427 1 72 "Average Difference" N 68 2.633 1.029 2.441 17919 428 1 72 "Average Difference" HA 74 0.231 -0.033 0.230 17919 429 1 72 "Average Difference" C 71 0.876 -0.198 0.860 17919 430 1 72 "Average Difference" CA 71 0.741 -0.063 0.744 17919 431 1 72 "Average Difference" CB 67 1.027 -0.131 1.026 17919 432 1 72 "Average Difference" HN 68 0.472 -0.101 0.465 17919 433 1 73 "Average Difference" N 68 2.196 0.718 2.091 17919 434 1 73 "Average Difference" HA 74 0.266 -0.052 0.263 17919 435 1 73 "Average Difference" C 71 0.897 -0.160 0.889 17919 436 1 73 "Average Difference" CA 71 0.774 -0.093 0.774 17919 437 1 73 "Average Difference" CB 67 1.016 -0.134 1.014 17919 438 1 73 "Average Difference" HN 68 0.508 -0.114 0.499 17919 439 1 74 "Average Difference" N 68 2.928 0.809 2.835 17919 440 1 74 "Average Difference" HA 74 0.275 -0.088 0.263 17919 441 1 74 "Average Difference" C 71 0.854 -0.193 0.838 17919 442 1 74 "Average Difference" CA 71 0.836 -0.127 0.832 17919 443 1 74 "Average Difference" CB 67 0.962 -0.221 0.943 17919 444 1 74 "Average Difference" HN 68 0.538 -0.159 0.518 17919 445 1 75 "Average Difference" N 68 2.684 1.109 2.462 17919 446 1 75 "Average Difference" HA 74 0.228 -0.039 0.226 17919 447 1 75 "Average Difference" C 71 0.847 -0.154 0.839 17919 448 1 75 "Average Difference" CA 71 0.761 -0.015 0.766 17919 449 1 75 "Average Difference" CB 67 1.008 -0.069 1.013 17919 450 1 75 "Average Difference" HN 68 0.464 -0.091 0.459 17919 451 1 76 "Average Difference" N 68 2.436 0.964 2.254 17919 452 1 76 "Average Difference" HA 74 0.283 -0.060 0.279 17919 453 1 76 "Average Difference" C 71 0.846 -0.128 0.842 17919 454 1 76 "Average Difference" CA 71 0.752 -0.071 0.754 17919 455 1 76 "Average Difference" CB 67 1.408 -0.342 1.376 17919 456 1 76 "Average Difference" HN 68 0.544 -0.140 0.529 17919 457 1 77 "Average Difference" N 68 2.359 0.772 2.245 17919 458 1 77 "Average Difference" HA 74 0.252 -0.099 0.233 17919 459 1 77 "Average Difference" C 71 0.846 -0.107 0.846 17919 460 1 77 "Average Difference" CA 71 0.830 0.055 0.834 17919 461 1 77 "Average Difference" CB 67 1.203 -0.191 1.197 17919 462 1 77 "Average Difference" HN 68 0.520 -0.141 0.505 17919 463 1 78 "Average Difference" N 68 2.417 0.680 2.337 17919 464 1 78 "Average Difference" HA 74 0.215 -0.060 0.208 17919 465 1 78 "Average Difference" C 71 0.908 -0.051 0.913 17919 466 1 78 "Average Difference" CA 71 0.843 -0.155 0.835 17919 467 1 78 "Average Difference" CB 67 1.074 -0.121 1.075 17919 468 1 78 "Average Difference" HN 68 0.542 -0.129 0.531 17919 469 1 79 "Average Difference" N 68 2.483 0.776 2.376 17919 470 1 79 "Average Difference" HA 74 0.247 -0.079 0.235 17919 471 1 79 "Average Difference" C 71 0.835 -0.007 0.840 17919 472 1 79 "Average Difference" CA 71 0.711 0.099 0.709 17919 473 1 79 "Average Difference" CB 67 1.285 -0.242 1.271 17919 474 1 79 "Average Difference" HN 68 0.521 -0.130 0.508 17919 475 1 80 "Average Difference" N 68 2.524 0.996 2.337 17919 476 1 80 "Average Difference" HA 74 0.262 -0.083 0.251 17919 477 1 80 "Average Difference" C 71 0.909 -0.155 0.903 17919 478 1 80 "Average Difference" CA 71 0.805 0.012 0.811 17919 479 1 80 "Average Difference" CB 67 1.118 -0.156 1.115 17919 480 1 80 "Average Difference" HN 68 0.545 -0.064 0.546 17919 481 1 81 "Average Difference" N 68 2.492 0.776 2.386 17919 482 1 81 "Average Difference" HA 74 0.278 -0.081 0.268 17919 483 1 81 "Average Difference" C 71 0.890 -0.062 0.895 17919 484 1 81 "Average Difference" CA 71 0.894 -0.007 0.901 17919 485 1 81 "Average Difference" CB 67 1.167 -0.342 1.124 17919 486 1 81 "Average Difference" HN 68 0.539 -0.156 0.520 17919 487 1 82 "Average Difference" N 68 2.583 0.853 2.456 17919 488 1 82 "Average Difference" HA 74 0.227 -0.055 0.222 17919 489 1 82 "Average Difference" C 71 0.899 -0.095 0.900 17919 490 1 82 "Average Difference" CA 71 0.826 -0.009 0.832 17919 491 1 82 "Average Difference" CB 67 1.130 -0.222 1.116 17919 492 1 82 "Average Difference" HN 68 0.534 -0.147 0.517 17919 493 1 83 "Average Difference" N 68 2.696 1.136 2.464 17919 494 1 83 "Average Difference" HA 74 0.223 -0.075 0.211 17919 495 1 83 "Average Difference" C 71 0.851 -0.078 0.854 17919 496 1 83 "Average Difference" CA 71 0.734 0.035 0.738 17919 497 1 83 "Average Difference" CB 67 1.031 -0.222 1.014 17919 498 1 83 "Average Difference" HN 68 0.524 -0.114 0.515 17919 499 1 84 "Average Difference" N 68 2.331 0.435 2.307 17919 500 1 84 "Average Difference" HA 74 0.213 -0.047 0.209 17919 501 1 84 "Average Difference" C 71 0.893 -0.197 0.877 17919 502 1 84 "Average Difference" CA 71 0.821 -0.025 0.827 17919 503 1 84 "Average Difference" CB 67 1.119 0.042 1.127 17919 504 1 84 "Average Difference" HN 68 0.524 -0.125 0.512 17919 505 1 85 "Average Difference" N 68 2.537 1.213 2.245 17919 506 1 85 "Average Difference" HA 74 0.265 -0.084 0.253 17919 507 1 85 "Average Difference" C 71 0.913 -0.175 0.903 17919 508 1 85 "Average Difference" CA 71 0.862 0.197 0.845 17919 509 1 85 "Average Difference" CB 67 1.120 -0.264 1.097 17919 510 1 85 "Average Difference" HN 68 0.467 -0.120 0.455 17919 511 1 86 "Average Difference" N 68 2.611 1.005 2.428 17919 512 1 86 "Average Difference" HA 74 0.284 -0.079 0.274 17919 513 1 86 "Average Difference" C 71 0.926 -0.109 0.927 17919 514 1 86 "Average Difference" CA 71 0.818 -0.009 0.824 17919 515 1 86 "Average Difference" CB 67 1.164 -0.367 1.113 17919 516 1 86 "Average Difference" HN 68 0.516 -0.105 0.509 17919 517 1 87 "Average Difference" N 68 2.637 1.031 2.445 17919 518 1 87 "Average Difference" HA 74 0.240 -0.057 0.234 17919 519 1 87 "Average Difference" C 71 0.909 -0.195 0.894 17919 520 1 87 "Average Difference" CA 71 0.715 0.059 0.718 17919 521 1 87 "Average Difference" CB 67 1.154 -0.067 1.160 17919 522 1 87 "Average Difference" HN 68 0.499 -0.081 0.497 17919 523 1 88 "Average Difference" N 68 3.035 1.535 2.638 17919 524 1 88 "Average Difference" HA 74 0.278 -0.077 0.268 17919 525 1 88 "Average Difference" C 71 0.964 -0.108 0.964 17919 526 1 88 "Average Difference" CA 71 0.999 0.118 0.999 17919 527 1 88 "Average Difference" CB 67 1.234 -0.178 1.231 17919 528 1 88 "Average Difference" HN 68 0.503 -0.004 0.506 17919 529 1 89 "Average Difference" N 68 2.369 0.770 2.257 17919 530 1 89 "Average Difference" HA 74 0.258 -0.072 0.250 17919 531 1 89 "Average Difference" C 71 0.879 -0.167 0.869 17919 532 1 89 "Average Difference" CA 71 0.747 -0.047 0.751 17919 533 1 89 "Average Difference" CB 67 1.260 -0.205 1.252 17919 534 1 89 "Average Difference" HN 68 0.467 -0.106 0.459 17919 535 1 90 "Average Difference" N 68 2.619 0.874 2.487 17919 536 1 90 "Average Difference" HA 74 0.234 -0.047 0.230 17919 537 1 90 "Average Difference" C 71 0.974 -0.104 0.975 17919 538 1 90 "Average Difference" CA 71 0.831 0.057 0.835 17919 539 1 90 "Average Difference" CB 67 1.346 -0.095 1.353 17919 540 1 90 "Average Difference" HN 68 0.558 -0.134 0.546 17919 541 1 91 "Average Difference" N 68 2.432 0.982 2.242 17919 542 1 91 "Average Difference" HA 74 0.270 -0.108 0.249 17919 543 1 91 "Average Difference" C 71 0.943 -0.139 0.939 17919 544 1 91 "Average Difference" CA 71 0.760 0.042 0.765 17919 545 1 91 "Average Difference" CB 67 1.155 -0.354 1.108 17919 546 1 91 "Average Difference" HN 68 0.550 -0.177 0.525 17919 547 1 92 "Average Difference" N 68 2.731 0.910 2.594 17919 548 1 92 "Average Difference" HA 74 0.232 -0.081 0.218 17919 549 1 92 "Average Difference" C 71 0.844 -0.142 0.838 17919 550 1 92 "Average Difference" CA 71 0.693 0.034 0.698 17919 551 1 92 "Average Difference" CB 67 1.194 -0.153 1.193 17919 552 1 92 "Average Difference" HN 68 0.567 -0.151 0.551 17919 553 1 93 "Average Difference" N 68 2.613 1.044 2.413 17919 554 1 93 "Average Difference" HA 74 0.256 -0.068 0.249 17919 555 1 93 "Average Difference" C 71 0.845 -0.081 0.847 17919 556 1 93 "Average Difference" CA 71 0.754 -0.091 0.754 17919 557 1 93 "Average Difference" CB 67 1.189 -0.206 1.180 17919 558 1 93 "Average Difference" HN 68 0.532 -0.116 0.523 17919 559 1 94 "Average Difference" N 68 2.607 1.121 2.371 17919 560 1 94 "Average Difference" HA 74 0.318 -0.125 0.295 17919 561 1 94 "Average Difference" C 71 0.859 -0.110 0.858 17919 562 1 94 "Average Difference" CA 71 0.704 0.093 0.703 17919 563 1 94 "Average Difference" CB 67 1.225 -0.287 1.200 17919 564 1 94 "Average Difference" HN 68 0.544 -0.114 0.536 17919 565 1 95 "Average Difference" N 68 2.633 0.567 2.590 17919 566 1 95 "Average Difference" HA 74 0.283 -0.071 0.276 17919 567 1 95 "Average Difference" C 71 0.887 -0.086 0.889 17919 568 1 95 "Average Difference" CA 71 0.876 -0.015 0.882 17919 569 1 95 "Average Difference" CB 67 1.177 -0.198 1.169 17919 570 1 95 "Average Difference" HN 68 0.586 -0.196 0.556 17919 571 1 96 "Average Difference" N 68 2.562 0.327 2.560 17919 572 1 96 "Average Difference" HA 74 0.242 -0.046 0.239 17919 573 1 96 "Average Difference" C 71 0.924 -0.168 0.915 17919 574 1 96 "Average Difference" CA 71 0.780 0.009 0.785 17919 575 1 96 "Average Difference" CB 67 1.160 0.045 1.167 17919 576 1 96 "Average Difference" HN 68 0.531 -0.171 0.506 17919 577 1 97 "Average Difference" N 68 2.537 1.004 2.347 17919 578 1 97 "Average Difference" HA 74 0.262 -0.081 0.251 17919 579 1 97 "Average Difference" C 71 0.910 -0.074 0.913 17919 580 1 97 "Average Difference" CA 71 0.902 0.019 0.908 17919 581 1 97 "Average Difference" CB 67 1.200 -0.140 1.201 17919 582 1 97 "Average Difference" HN 68 0.576 -0.136 0.564 17919 583 1 98 "Average Difference" N 68 2.673 1.125 2.443 17919 584 1 98 "Average Difference" HA 74 0.243 -0.075 0.232 17919 585 1 98 "Average Difference" C 71 0.843 -0.063 0.847 17919 586 1 98 "Average Difference" CA 71 0.757 -0.020 0.762 17919 587 1 98 "Average Difference" CB 67 1.200 -0.293 1.172 17919 588 1 98 "Average Difference" HN 68 0.520 -0.082 0.517 17919 589 1 99 "Average Difference" N 68 2.382 0.959 2.196 17919 590 1 99 "Average Difference" HA 74 0.247 -0.081 0.234 17919 591 1 99 "Average Difference" C 71 0.930 -0.158 0.923 17919 592 1 99 "Average Difference" CA 71 0.735 0.052 0.739 17919 593 1 99 "Average Difference" CB 67 1.103 -0.227 1.088 17919 594 1 99 "Average Difference" HN 68 0.586 -0.159 0.568 17919 595 1 100 "Average Difference" N 68 2.768 1.093 2.561 17919 596 1 100 "Average Difference" HA 74 0.270 -0.080 0.259 17919 597 1 100 "Average Difference" C 71 0.933 -0.092 0.936 17919 598 1 100 "Average Difference" CA 71 0.855 0.019 0.861 17919 599 1 100 "Average Difference" CB 67 1.113 -0.286 1.084 17919 600 1 100 "Average Difference" HN 68 0.456 -0.122 0.442 17919 601 1 101 "Average Difference" N 68 2.866 0.706 2.798 17919 602 1 101 "Average Difference" HA 74 0.267 -0.039 0.266 17919 603 1 101 "Average Difference" C 71 0.876 -0.178 0.864 17919 604 1 101 "Average Difference" CA 71 0.805 0.011 0.810 17919 605 1 101 "Average Difference" CB 67 1.257 -0.164 1.255 17919 606 1 101 "Average Difference" HN 68 0.557 -0.160 0.538 17919 607 1 102 "Average Difference" N 68 2.524 0.485 2.495 17919 608 1 102 "Average Difference" HA 74 0.237 -0.024 0.237 17919 609 1 102 "Average Difference" C 71 0.841 -0.179 0.827 17919 610 1 102 "Average Difference" CA 71 0.694 -0.090 0.693 17919 611 1 102 "Average Difference" CB 67 1.147 -0.060 1.154 17919 612 1 102 "Average Difference" HN 68 0.461 -0.111 0.451 17919 613 1 103 "Average Difference" N 68 2.642 0.924 2.493 17919 614 1 103 "Average Difference" HA 74 0.232 -0.079 0.220 17919 615 1 103 "Average Difference" C 71 0.837 -0.047 0.841 17919 616 1 103 "Average Difference" CA 71 0.737 -0.001 0.742 17919 617 1 103 "Average Difference" CB 67 1.102 -0.119 1.104 17919 618 1 103 "Average Difference" HN 68 0.502 -0.113 0.492 17919 619 1 104 "Average Difference" N 68 2.672 0.864 2.547 17919 620 1 104 "Average Difference" HA 74 0.284 -0.066 0.278 17919 621 1 104 "Average Difference" C 71 0.934 -0.215 0.915 17919 622 1 104 "Average Difference" CA 71 0.967 -0.075 0.971 17919 623 1 104 "Average Difference" CB 67 1.383 -0.199 1.379 17919 624 1 104 "Average Difference" HN 68 0.513 -0.173 0.487 17919 625 1 105 "Average Difference" N 68 2.879 1.091 2.684 17919 626 1 105 "Average Difference" HA 74 0.251 -0.071 0.242 17919 627 1 105 "Average Difference" C 71 0.918 -0.168 0.909 17919 628 1 105 "Average Difference" CA 71 0.788 0.001 0.793 17919 629 1 105 "Average Difference" CB 67 1.055 -0.087 1.060 17919 630 1 105 "Average Difference" HN 68 0.497 -0.126 0.484 17919 631 1 106 "Average Difference" N 68 2.741 1.109 2.526 17919 632 1 106 "Average Difference" HA 74 0.278 -0.100 0.262 17919 633 1 106 "Average Difference" C 71 0.962 -0.079 0.965 17919 634 1 106 "Average Difference" CA 71 0.955 0.079 0.958 17919 635 1 106 "Average Difference" CB 67 1.172 -0.009 1.181 17919 636 1 106 "Average Difference" HN 68 0.549 -0.132 0.537 17919 637 1 107 "Average Difference" N 68 2.601 0.744 2.511 17919 638 1 107 "Average Difference" HA 74 0.227 -0.056 0.222 17919 639 1 107 "Average Difference" C 71 0.846 -0.095 0.847 17919 640 1 107 "Average Difference" CA 71 0.709 -0.044 0.712 17919 641 1 107 "Average Difference" CB 67 1.041 -0.073 1.046 17919 642 1 107 "Average Difference" HN 68 0.529 -0.113 0.520 17919 643 1 108 "Average Difference" N 68 2.414 0.676 2.335 17919 644 1 108 "Average Difference" HA 74 0.254 -0.076 0.244 17919 645 1 108 "Average Difference" C 71 0.921 -0.187 0.909 17919 646 1 108 "Average Difference" CA 71 0.770 0.071 0.772 17919 647 1 108 "Average Difference" CB 67 1.105 -0.070 1.111 17919 648 1 108 "Average Difference" HN 68 0.531 -0.110 0.523 17919 649 1 109 "Average Difference" N 68 2.626 0.960 2.462 17919 650 1 109 "Average Difference" HA 74 0.282 -0.062 0.277 17919 651 1 109 "Average Difference" C 71 0.909 -0.118 0.908 17919 652 1 109 "Average Difference" CA 71 0.927 0.057 0.932 17919 653 1 109 "Average Difference" CB 67 1.078 -0.138 1.078 17919 654 1 109 "Average Difference" HN 68 0.492 -0.112 0.483 17919 655 1 110 "Average Difference" N 68 2.508 0.860 2.374 17919 656 1 110 "Average Difference" HA 74 0.265 -0.094 0.249 17919 657 1 110 "Average Difference" C 71 0.905 -0.160 0.897 17919 658 1 110 "Average Difference" CA 71 0.893 -0.035 0.899 17919 659 1 110 "Average Difference" CB 67 1.276 -0.051 1.284 17919 660 1 110 "Average Difference" HN 68 0.513 -0.151 0.494 17919 661 1 111 "Average Difference" N 68 2.663 1.061 2.461 17919 662 1 111 "Average Difference" HA 74 0.254 -0.088 0.240 17919 663 1 111 "Average Difference" C 71 0.947 -0.062 0.952 17919 664 1 111 "Average Difference" CA 71 0.769 0.099 0.768 17919 665 1 111 "Average Difference" CB 67 1.219 -0.308 1.188 17919 666 1 111 "Average Difference" HN 68 0.500 -0.086 0.496 17919 667 1 112 "Average Difference" N 68 2.620 0.748 2.530 17919 668 1 112 "Average Difference" HA 74 0.286 -0.086 0.275 17919 669 1 112 "Average Difference" C 71 0.917 -0.038 0.923 17919 670 1 112 "Average Difference" CA 71 0.804 0.112 0.802 17919 671 1 112 "Average Difference" CB 67 1.244 -0.210 1.236 17919 672 1 112 "Average Difference" HN 68 0.544 -0.139 0.530 17919 673 1 113 "Average Difference" N 68 2.549 1.033 2.348 17919 674 1 113 "Average Difference" HA 74 0.215 -0.070 0.205 17919 675 1 113 "Average Difference" C 71 0.869 -0.081 0.871 17919 676 1 113 "Average Difference" CA 71 0.752 0.061 0.755 17919 677 1 113 "Average Difference" CB 67 1.030 0.001 1.038 17919 678 1 113 "Average Difference" HN 68 0.520 -0.101 0.514 17919 679 1 114 "Average Difference" N 68 2.521 1.106 2.282 17919 680 1 114 "Average Difference" HA 74 0.237 -0.062 0.230 17919 681 1 114 "Average Difference" C 71 0.935 -0.130 0.932 17919 682 1 114 "Average Difference" CA 71 0.765 0.013 0.770 17919 683 1 114 "Average Difference" CB 67 1.191 -0.304 1.160 17919 684 1 114 "Average Difference" HN 68 0.534 -0.141 0.518 17919 685 1 115 "Average Difference" N 68 2.318 1.006 2.104 17919 686 1 115 "Average Difference" HA 74 0.232 -0.082 0.219 17919 687 1 115 "Average Difference" C 71 0.783 -0.150 0.773 17919 688 1 115 "Average Difference" CA 71 0.746 -0.016 0.751 17919 689 1 115 "Average Difference" CB 67 1.115 -0.186 1.108 17919 690 1 115 "Average Difference" HN 68 0.506 -0.092 0.502 17919 691 1 116 "Average Difference" N 68 2.267 0.809 2.134 17919 692 1 116 "Average Difference" HA 74 0.213 -0.034 0.212 17919 693 1 116 "Average Difference" C 71 0.827 -0.103 0.826 17919 694 1 116 "Average Difference" CA 71 0.815 -0.099 0.814 17919 695 1 116 "Average Difference" CB 67 1.070 -0.139 1.069 17919 696 1 116 "Average Difference" HN 68 0.508 -0.070 0.507 17919 697 1 117 "Average Difference" N 68 3.150 0.810 3.067 17919 698 1 117 "Average Difference" HA 74 0.267 -0.104 0.248 17919 699 1 117 "Average Difference" C 71 0.837 -0.144 0.831 17919 700 1 117 "Average Difference" CA 71 0.750 0.001 0.756 17919 701 1 117 "Average Difference" CB 67 1.025 -0.173 1.018 17919 702 1 117 "Average Difference" HN 68 0.532 -0.122 0.522 17919 703 1 118 "Average Difference" N 68 2.749 0.918 2.610 17919 704 1 118 "Average Difference" HA 74 0.239 -0.052 0.234 17919 705 1 118 "Average Difference" C 71 0.861 -0.153 0.854 17919 706 1 118 "Average Difference" CA 71 0.705 0.093 0.704 17919 707 1 118 "Average Difference" CB 67 1.142 -0.071 1.149 17919 708 1 118 "Average Difference" HN 68 0.544 -0.128 0.533 17919 709 1 119 "Average Difference" N 68 2.324 0.898 2.160 17919 710 1 119 "Average Difference" HA 74 0.267 -0.047 0.264 17919 711 1 119 "Average Difference" C 71 0.832 -0.056 0.836 17919 712 1 119 "Average Difference" CA 71 0.816 -0.001 0.822 17919 713 1 119 "Average Difference" CB 67 1.150 -0.147 1.149 17919 714 1 119 "Average Difference" HN 68 0.541 -0.169 0.518 17919 715 1 120 "Average Difference" N 68 2.690 0.650 2.630 17919 716 1 120 "Average Difference" HA 74 0.298 -0.038 0.297 17919 717 1 120 "Average Difference" C 71 0.877 -0.180 0.864 17919 718 1 120 "Average Difference" CA 71 0.871 -0.158 0.863 17919 719 1 120 "Average Difference" CB 67 1.148 -0.125 1.150 17919 720 1 120 "Average Difference" HN 68 0.483 -0.099 0.477 17919 721 1 121 "Average Difference" N 68 2.764 0.956 2.613 17919 722 1 121 "Average Difference" HA 74 0.308 -0.120 0.285 17919 723 1 121 "Average Difference" C 71 0.974 -0.183 0.964 17919 724 1 121 "Average Difference" CA 71 0.951 0.056 0.956 17919 725 1 121 "Average Difference" CB 67 1.191 -0.369 1.141 17919 726 1 121 "Average Difference" HN 68 0.580 -0.195 0.550 17919 727 1 122 "Average Difference" N 68 2.551 0.928 2.393 17919 728 1 122 "Average Difference" HA 74 0.266 -0.090 0.252 17919 729 1 122 "Average Difference" C 71 0.958 -0.068 0.962 17919 730 1 122 "Average Difference" CA 71 0.864 0.075 0.867 17919 731 1 122 "Average Difference" CB 67 1.315 -0.263 1.298 17919 732 1 122 "Average Difference" HN 68 0.517 -0.160 0.495 17919 733 1 123 "Average Difference" N 68 2.689 0.816 2.581 17919 734 1 123 "Average Difference" HA 74 0.216 -0.055 0.211 17919 735 1 123 "Average Difference" C 71 0.864 -0.058 0.868 17919 736 1 123 "Average Difference" CA 71 0.822 0.011 0.828 17919 737 1 123 "Average Difference" CB 67 1.026 -0.157 1.021 17919 738 1 123 "Average Difference" HN 68 0.525 -0.105 0.518 17919 739 1 124 "Average Difference" N 68 2.574 0.582 2.526 17919 740 1 124 "Average Difference" HA 74 0.264 -0.050 0.261 17919 741 1 124 "Average Difference" C 71 0.815 -0.099 0.815 17919 742 1 124 "Average Difference" CA 71 0.838 0.041 0.843 17919 743 1 124 "Average Difference" CB 67 1.198 -0.316 1.165 17919 744 1 124 "Average Difference" HN 68 0.524 -0.155 0.504 17919 745 1 125 "Average Difference" N 68 2.729 1.088 2.521 17919 746 1 125 "Average Difference" HA 74 0.243 -0.058 0.237 17919 747 1 125 "Average Difference" C 71 0.869 -0.169 0.858 17919 748 1 125 "Average Difference" CA 71 0.867 -0.124 0.864 17919 749 1 125 "Average Difference" CB 67 1.188 -0.107 1.192 17919 750 1 125 "Average Difference" HN 68 0.503 -0.090 0.498 17919 751 1 126 "Average Difference" N 68 2.577 1.038 2.376 17919 752 1 126 "Average Difference" HA 74 0.243 -0.077 0.232 17919 753 1 126 "Average Difference" C 71 0.932 -0.105 0.932 17919 754 1 126 "Average Difference" CA 71 0.781 0.069 0.783 17919 755 1 126 "Average Difference" CB 67 1.159 -0.179 1.153 17919 756 1 126 "Average Difference" HN 68 0.468 -0.067 0.466 17919 757 1 127 "Average Difference" N 68 2.593 1.023 2.401 17919 758 1 127 "Average Difference" HA 74 0.249 -0.057 0.244 17919 759 1 127 "Average Difference" C 71 0.924 -0.147 0.918 17919 760 1 127 "Average Difference" CA 71 0.812 0.062 0.815 17919 761 1 127 "Average Difference" CB 67 1.185 -0.205 1.176 17919 762 1 127 "Average Difference" HN 68 0.516 -0.119 0.506 17919 763 1 128 "Average Difference" N 68 2.711 0.998 2.539 17919 764 1 128 "Average Difference" HA 74 0.213 -0.064 0.205 17919 765 1 128 "Average Difference" C 71 0.966 -0.163 0.959 17919 766 1 128 "Average Difference" CA 71 0.829 0.081 0.831 17919 767 1 128 "Average Difference" CB 67 1.094 -0.020 1.102 17919 768 1 128 "Average Difference" HN 68 0.511 -0.075 0.509 17919 769 1 129 "Average Difference" N 68 2.735 1.248 2.451 17919 770 1 129 "Average Difference" HA 74 0.287 -0.083 0.276 17919 771 1 129 "Average Difference" C 71 0.823 -0.046 0.828 17919 772 1 129 "Average Difference" CA 71 0.820 0.120 0.817 17919 773 1 129 "Average Difference" CB 67 1.113 -0.194 1.105 17919 774 1 129 "Average Difference" HN 68 0.491 -0.077 0.488 17919 775 1 130 "Average Difference" N 68 2.785 1.465 2.386 17919 776 1 130 "Average Difference" HA 74 0.253 -0.053 0.250 17919 777 1 130 "Average Difference" C 71 0.868 -0.197 0.851 17919 778 1 130 "Average Difference" CA 71 0.805 -0.068 0.808 17919 779 1 130 "Average Difference" CB 67 1.085 -0.120 1.087 17919 780 1 130 "Average Difference" HN 68 0.507 -0.017 0.510 17919 781 1 131 "Average Difference" N 68 2.535 1.181 2.259 17919 782 1 131 "Average Difference" HA 74 0.287 -0.095 0.272 17919 783 1 131 "Average Difference" C 71 0.934 -0.103 0.935 17919 784 1 131 "Average Difference" CA 71 0.960 0.099 0.962 17919 785 1 131 "Average Difference" CB 67 1.162 -0.260 1.141 17919 786 1 131 "Average Difference" HN 68 0.491 -0.131 0.476 17919 787 1 132 "Average Difference" N 68 2.769 1.027 2.590 17919 788 1 132 "Average Difference" HA 74 0.241 -0.068 0.232 17919 789 1 132 "Average Difference" C 71 0.877 -0.023 0.883 17919 790 1 132 "Average Difference" CA 71 0.807 0.026 0.813 17919 791 1 132 "Average Difference" CB 67 1.172 -0.181 1.166 17919 792 1 132 "Average Difference" HN 68 0.517 -0.137 0.502 17919 793 1 133 "Average Difference" N 68 2.607 0.913 2.460 17919 794 1 133 "Average Difference" HA 74 0.253 -0.088 0.239 17919 795 1 133 "Average Difference" C 71 0.881 -0.047 0.886 17919 796 1 133 "Average Difference" CA 71 0.808 0.100 0.807 17919 797 1 133 "Average Difference" CB 67 1.199 -0.180 1.195 17919 798 1 133 "Average Difference" HN 68 0.557 -0.084 0.555 17919 799 1 134 "Average Difference" N 68 2.670 1.360 2.316 17919 800 1 134 "Average Difference" HA 74 0.270 -0.100 0.253 17919 801 1 134 "Average Difference" C 71 0.844 -0.147 0.837 17919 802 1 134 "Average Difference" CA 71 0.723 0.058 0.726 17919 803 1 134 "Average Difference" CB 67 1.109 -0.184 1.102 17919 804 1 134 "Average Difference" HN 68 0.459 -0.087 0.454 17919 805 1 135 "Average Difference" N 68 2.612 1.201 2.336 17919 806 1 135 "Average Difference" HA 74 0.243 -0.074 0.233 17919 807 1 135 "Average Difference" C 71 0.845 -0.047 0.850 17919 808 1 135 "Average Difference" CA 71 0.815 0.027 0.820 17919 809 1 135 "Average Difference" CB 67 1.148 -0.154 1.147 17919 810 1 135 "Average Difference" HN 68 0.493 -0.046 0.495 17919 811 1 136 "Average Difference" N 68 2.228 0.814 2.090 17919 812 1 136 "Average Difference" HA 74 0.286 -0.063 0.281 17919 813 1 136 "Average Difference" C 71 0.889 -0.187 0.875 17919 814 1 136 "Average Difference" CA 71 0.862 -0.040 0.868 17919 815 1 136 "Average Difference" CB 67 1.171 -0.165 1.168 17919 816 1 136 "Average Difference" HN 68 0.504 -0.137 0.488 17919 817 1 137 "Average Difference" N 68 2.612 1.136 2.370 17919 818 1 137 "Average Difference" HA 74 0.259 -0.101 0.240 17919 819 1 137 "Average Difference" C 71 0.934 -0.000 0.941 17919 820 1 137 "Average Difference" CA 71 0.867 0.049 0.871 17919 821 1 137 "Average Difference" CB 67 1.099 -0.279 1.071 17919 822 1 137 "Average Difference" HN 68 0.524 -0.111 0.516 17919 823 1 138 "Average Difference" N 68 2.825 0.735 2.748 17919 824 1 138 "Average Difference" HA 74 0.229 -0.044 0.227 17919 825 1 138 "Average Difference" C 71 0.958 -0.182 0.947 17919 826 1 138 "Average Difference" CA 71 0.880 -0.032 0.885 17919 827 1 138 "Average Difference" CB 67 1.051 -0.011 1.059 17919 828 1 138 "Average Difference" HN 68 0.529 -0.134 0.515 17919 829 1 139 "Average Difference" N 68 2.576 1.230 2.280 17919 830 1 139 "Average Difference" HA 74 0.246 -0.075 0.236 17919 831 1 139 "Average Difference" C 71 0.871 -0.107 0.870 17919 832 1 139 "Average Difference" CA 71 0.757 0.044 0.761 17919 833 1 139 "Average Difference" CB 67 0.974 -0.282 0.939 17919 834 1 139 "Average Difference" HN 68 0.545 -0.111 0.537 17919 835 1 140 "Average Difference" N 68 2.398 1.056 2.169 17919 836 1 140 "Average Difference" HA 74 0.256 -0.090 0.242 17919 837 1 140 "Average Difference" C 71 0.798 -0.118 0.795 17919 838 1 140 "Average Difference" CA 71 0.821 0.103 0.820 17919 839 1 140 "Average Difference" CB 67 1.103 -0.159 1.099 17919 840 1 140 "Average Difference" HN 68 0.486 -0.125 0.473 17919 841 1 141 "Average Difference" N 68 2.872 0.769 2.788 17919 842 1 141 "Average Difference" HA 74 0.262 -0.051 0.259 17919 843 1 141 "Average Difference" C 71 0.869 -0.088 0.870 17919 844 1 141 "Average Difference" CA 71 0.839 -0.013 0.845 17919 845 1 141 "Average Difference" CB 67 1.170 -0.137 1.171 17919 846 1 141 "Average Difference" HN 68 0.485 -0.177 0.455 17919 847 1 142 "Average Difference" N 68 2.439 0.653 2.368 17919 848 1 142 "Average Difference" HA 74 0.257 -0.054 0.253 17919 849 1 142 "Average Difference" C 71 0.849 -0.124 0.846 17919 850 1 142 "Average Difference" CA 71 0.783 -0.040 0.788 17919 851 1 142 "Average Difference" CB 67 1.131 -0.141 1.131 17919 852 1 142 "Average Difference" HN 68 0.506 -0.057 0.507 17919 853 1 143 "Average Difference" N 68 2.733 0.989 2.566 17919 854 1 143 "Average Difference" HA 74 0.262 -0.050 0.259 17919 855 1 143 "Average Difference" C 71 0.851 -0.180 0.838 17919 856 1 143 "Average Difference" CA 71 0.676 -0.071 0.677 17919 857 1 143 "Average Difference" CB 67 1.163 -0.223 1.150 17919 858 1 143 "Average Difference" HN 68 0.526 -0.156 0.506 17919 859 1 144 "Average Difference" N 68 2.306 0.734 2.202 17919 860 1 144 "Average Difference" HA 74 0.209 -0.036 0.207 17919 861 1 144 "Average Difference" C 71 0.843 -0.067 0.846 17919 862 1 144 "Average Difference" CA 71 0.717 -0.106 0.714 17919 863 1 144 "Average Difference" CB 67 1.174 -0.278 1.149 17919 864 1 144 "Average Difference" HN 68 0.533 -0.164 0.511 17919 865 1 145 "Average Difference" N 68 2.500 1.229 2.193 17919 866 1 145 "Average Difference" HA 74 0.273 -0.099 0.256 17919 867 1 145 "Average Difference" C 71 0.842 -0.147 0.835 17919 868 1 145 "Average Difference" CA 71 0.877 0.022 0.883 17919 869 1 145 "Average Difference" CB 67 1.344 -0.243 1.332 17919 870 1 145 "Average Difference" HN 68 0.555 -0.132 0.544 17919 871 1 146 "Average Difference" N 68 2.622 0.785 2.520 17919 872 1 146 "Average Difference" HA 74 0.241 -0.063 0.234 17919 873 1 146 "Average Difference" C 71 0.933 -0.208 0.916 17919 874 1 146 "Average Difference" CA 71 0.862 -0.005 0.869 17919 875 1 146 "Average Difference" CB 67 1.048 -0.191 1.038 17919 876 1 146 "Average Difference" HN 68 0.573 -0.153 0.557 17919 877 1 147 "Average Difference" N 68 2.208 0.812 2.069 17919 878 1 147 "Average Difference" HA 74 0.231 -0.043 0.228 17919 879 1 147 "Average Difference" C 71 0.892 -0.058 0.897 17919 880 1 147 "Average Difference" CA 71 0.762 -0.022 0.767 17919 881 1 147 "Average Difference" CB 67 1.152 -0.015 1.160 17919 882 1 147 "Average Difference" HN 68 0.469 -0.058 0.469 17919 883 1 148 "Average Difference" N 68 2.454 1.124 2.197 17919 884 1 148 "Average Difference" HA 74 0.218 -0.066 0.209 17919 885 1 148 "Average Difference" C 71 0.868 -0.067 0.871 17919 886 1 148 "Average Difference" CA 71 0.807 0.082 0.808 17919 887 1 148 "Average Difference" CB 67 1.162 -0.238 1.146 17919 888 1 148 "Average Difference" HN 68 0.548 -0.142 0.533 17919 889 1 149 "Average Difference" N 68 2.513 1.155 2.249 17919 890 1 149 "Average Difference" HA 74 0.258 -0.057 0.253 17919 891 1 149 "Average Difference" C 71 0.846 -0.012 0.851 17919 892 1 149 "Average Difference" CA 71 0.739 0.154 0.728 17919 893 1 149 "Average Difference" CB 67 1.173 -0.138 1.173 17919 894 1 149 "Average Difference" HN 68 0.499 -0.124 0.487 17919 895 1 150 "Average Difference" N 68 2.490 1.202 2.197 17919 896 1 150 "Average Difference" HA 74 0.234 -0.084 0.220 17919 897 1 150 "Average Difference" C 71 0.885 -0.133 0.881 17919 898 1 150 "Average Difference" CA 71 0.692 0.010 0.697 17919 899 1 150 "Average Difference" CB 67 1.169 -0.126 1.171 17919 900 1 150 "Average Difference" HN 68 0.506 -0.057 0.506 17919 901 1 151 "Average Difference" N 68 2.788 1.513 2.359 17919 902 1 151 "Average Difference" HA 74 0.261 -0.096 0.244 17919 903 1 151 "Average Difference" C 71 0.846 -0.063 0.850 17919 904 1 151 "Average Difference" CA 71 0.739 0.056 0.742 17919 905 1 151 "Average Difference" CB 67 1.028 -0.216 1.013 17919 906 1 151 "Average Difference" HN 68 0.490 -0.105 0.482 17919 907 1 152 "Average Difference" N 68 2.523 1.143 2.266 17919 908 1 152 "Average Difference" HA 74 0.245 -0.046 0.242 17919 909 1 152 "Average Difference" C 71 0.847 -0.164 0.837 17919 910 1 152 "Average Difference" CA 71 0.747 0.000 0.752 17919 911 1 152 "Average Difference" CB 67 1.032 -0.098 1.035 17919 912 1 152 "Average Difference" HN 68 0.497 -0.008 0.501 17919 913 1 153 "Average Difference" N 68 2.395 0.755 2.290 17919 914 1 153 "Average Difference" HA 74 0.226 -0.034 0.225 17919 915 1 153 "Average Difference" C 71 0.775 -0.040 0.779 17919 916 1 153 "Average Difference" CA 71 0.787 0.010 0.793 17919 917 1 153 "Average Difference" CB 67 1.019 -0.065 1.025 17919 918 1 153 "Average Difference" HN 68 0.445 -0.026 0.447 17919 919 1 154 "Average Difference" N 68 2.314 1.088 2.058 17919 920 1 154 "Average Difference" HA 74 0.208 -0.016 0.208 17919 921 1 154 "Average Difference" C 71 0.820 -0.115 0.818 17919 922 1 154 "Average Difference" CA 71 0.685 -0.049 0.688 17919 923 1 154 "Average Difference" CB 67 0.989 -0.049 0.995 17919 924 1 154 "Average Difference" HN 68 0.470 -0.046 0.471 17919 925 1 155 "Average Difference" N 68 2.741 1.017 2.565 17919 926 1 155 "Average Difference" HA 74 0.237 -0.038 0.235 17919 927 1 155 "Average Difference" C 71 0.901 -0.122 0.899 17919 928 1 155 "Average Difference" CA 71 0.718 -0.078 0.719 17919 929 1 155 "Average Difference" CB 67 1.093 -0.041 1.100 17919 930 1 155 "Average Difference" HN 68 0.455 0.005 0.458 17919 931 1 156 "Average Difference" N 68 2.300 0.475 2.267 17919 932 1 156 "Average Difference" HA 74 0.255 -0.058 0.250 17919 933 1 156 "Average Difference" C 71 0.838 -0.162 0.828 17919 934 1 156 "Average Difference" CA 71 0.797 -0.085 0.798 17919 935 1 156 "Average Difference" CB 67 1.095 -0.013 1.103 17919 936 1 156 "Average Difference" HN 68 0.500 -0.072 0.498 17919 937 1 157 "Average Difference" N 68 2.612 0.952 2.450 17919 938 1 157 "Average Difference" HA 74 0.232 -0.034 0.232 17919 939 1 157 "Average Difference" C 71 0.856 -0.122 0.854 17919 940 1 157 "Average Difference" CA 71 0.605 -0.037 0.609 17919 941 1 157 "Average Difference" CB 67 0.918 -0.060 0.923 17919 942 1 157 "Average Difference" HN 68 0.450 -0.022 0.452 17919 943 1 158 "Average Difference" N 68 2.170 0.916 1.981 17919 944 1 158 "Average Difference" HA 74 0.199 -0.026 0.199 17919 945 1 158 "Average Difference" C 71 0.801 -0.093 0.801 17919 946 1 158 "Average Difference" CA 71 0.707 -0.000 0.712 17919 947 1 158 "Average Difference" CB 67 0.992 0.016 0.999 17919 948 1 158 "Average Difference" HN 68 0.439 -0.045 0.440 17919 949 1 159 "Average Difference" N 68 2.691 1.185 2.433 17919 950 1 159 "Average Difference" HA 74 0.233 -0.034 0.232 17919 951 1 159 "Average Difference" C 71 0.820 -0.162 0.810 17919 952 1 159 "Average Difference" CA 71 0.582 0.013 0.586 17919 953 1 159 "Average Difference" CB 67 0.957 0.011 0.964 17919 954 1 159 "Average Difference" HN 68 0.456 0.024 0.459 17919 955 1 160 "Average Difference" N 68 2.314 1.231 1.975 17919 956 1 160 "Average Difference" HA 74 0.254 -0.022 0.254 17919 957 1 160 "Average Difference" C 71 0.870 -0.093 0.871 17919 958 1 160 "Average Difference" CA 71 0.775 -0.028 0.780 17919 959 1 160 "Average Difference" CB 67 1.099 -0.139 1.099 17919 960 1 160 "Average Difference" HN 68 0.439 0.035 0.441 17919 961 1 161 "Average Difference" N 68 2.267 1.051 2.023 17919 962 1 161 "Average Difference" HA 74 0.204 -0.016 0.205 17919 963 1 161 "Average Difference" C 71 0.863 -0.179 0.850 17919 964 1 161 "Average Difference" CA 71 0.573 -0.063 0.574 17919 965 1 161 "Average Difference" CB 67 1.033 0.057 1.039 17919 966 1 161 "Average Difference" HN 68 0.499 -0.017 0.502 17919 967 1 162 "Average Difference" N 68 2.360 0.893 2.200 17919 968 1 162 "Average Difference" HA 74 0.218 -0.045 0.215 17919 969 1 162 "Average Difference" C 71 0.808 -0.114 0.805 17919 970 1 162 "Average Difference" CA 71 0.852 -0.136 0.847 17919 971 1 162 "Average Difference" CB 67 0.960 -0.107 0.962 17919 972 1 162 "Average Difference" HN 68 0.448 -0.012 0.451 17919 973 1 163 "Average Difference" N 68 2.734 1.267 2.441 17919 974 1 163 "Average Difference" HA 74 0.249 -0.045 0.247 17919 975 1 163 "Average Difference" C 71 0.826 -0.105 0.826 17919 976 1 163 "Average Difference" CA 71 0.703 0.022 0.708 17919 977 1 163 "Average Difference" CB 67 1.017 -0.060 1.023 17919 978 1 163 "Average Difference" HN 68 0.485 -0.044 0.487 17919 979 1 164 "Average Difference" N 68 2.191 0.998 1.965 17919 980 1 164 "Average Difference" HA 74 0.222 -0.044 0.219 17919 981 1 164 "Average Difference" C 71 0.805 -0.156 0.796 17919 982 1 164 "Average Difference" CA 71 0.636 -0.010 0.641 17919 983 1 164 "Average Difference" CB 67 0.942 -0.050 0.948 17919 984 1 164 "Average Difference" HN 68 0.468 -0.053 0.469 17919 985 1 165 "Average Difference" N 68 2.498 1.100 2.259 17919 986 1 165 "Average Difference" HA 74 0.216 -0.037 0.214 17919 987 1 165 "Average Difference" C 71 0.817 -0.083 0.818 17919 988 1 165 "Average Difference" CA 71 0.660 -0.135 0.650 17919 989 1 165 "Average Difference" CB 67 1.070 -0.147 1.068 17919 990 1 165 "Average Difference" HN 68 0.461 -0.029 0.463 17919 991 1 166 "Average Difference" N 68 2.429 1.044 2.210 17919 992 1 166 "Average Difference" HA 74 0.247 -0.056 0.242 17919 993 1 166 "Average Difference" C 71 0.821 -0.102 0.820 17919 994 1 166 "Average Difference" CA 71 0.697 0.081 0.697 17919 995 1 166 "Average Difference" CB 67 1.058 -0.118 1.059 17919 996 1 166 "Average Difference" HN 68 0.482 -0.032 0.484 17919 997 1 167 "Average Difference" N 68 2.401 0.892 2.245 17919 998 1 167 "Average Difference" HA 74 0.246 -0.033 0.246 17919 999 1 167 "Average Difference" C 71 0.759 -0.103 0.758 17919 1000 1 167 "Average Difference" CA 71 0.694 -0.068 0.695 17919 1001 1 167 "Average Difference" CB 67 1.010 -0.074 1.014 17919 1002 1 167 "Average Difference" HN 68 0.471 0.015 0.474 17919 1003 1 168 "Average Difference" N 68 3.109 0.881 3.004 17919 1004 1 168 "Average Difference" HA 74 0.277 0.008 0.279 17919 1005 1 168 "Average Difference" C 71 0.828 -0.193 0.810 17919 1006 1 168 "Average Difference" CA 71 0.874 0.084 0.876 17919 1007 1 168 "Average Difference" CB 67 1.241 0.000 1.250 17919 1008 1 168 "Average Difference" HN 68 0.503 -0.028 0.506 17919 1009 1 169 "Average Difference" N 68 2.797 0.788 2.704 17919 1010 1 169 "Average Difference" HA 74 0.245 0.017 0.246 17919 1011 1 169 "Average Difference" C 71 0.883 -0.146 0.877 17919 1012 1 169 "Average Difference" CA 71 0.843 -0.208 0.822 17919 1013 1 169 "Average Difference" CB 67 1.095 0.028 1.103 17919 1014 1 169 "Average Difference" HN 68 0.472 0.002 0.475 17919 1015 1 170 "Average Difference" N 68 2.646 1.029 2.456 17919 1016 1 170 "Average Difference" HA 74 0.221 -0.020 0.221 17919 1017 1 170 "Average Difference" C 71 0.870 -0.106 0.870 17919 1018 1 170 "Average Difference" CA 71 0.657 0.010 0.662 17919 1019 1 170 "Average Difference" CB 67 1.005 -0.031 1.012 17919 1020 1 170 "Average Difference" HN 68 0.419 -0.014 0.422 17919 1021 1 171 "Average Difference" N 68 2.141 0.899 1.957 17919 1022 1 171 "Average Difference" HA 74 0.256 -0.043 0.254 17919 1023 1 171 "Average Difference" C 71 0.851 -0.136 0.846 17919 1024 1 171 "Average Difference" CA 71 0.612 -0.057 0.613 17919 1025 1 171 "Average Difference" CB 67 0.929 -0.132 0.927 17919 1026 1 171 "Average Difference" HN 68 0.437 -0.006 0.440 17919 1027 1 172 "Average Difference" N 68 2.252 0.974 2.046 17919 1028 1 172 "Average Difference" HA 74 0.232 -0.011 0.233 17919 1029 1 172 "Average Difference" C 71 0.856 -0.069 0.859 17919 1030 1 172 "Average Difference" CA 71 0.688 -0.018 0.693 17919 1031 1 172 "Average Difference" CB 67 0.997 -0.064 1.002 17919 1032 1 172 "Average Difference" HN 68 0.442 -0.028 0.444 17919 1033 1 173 "Average Difference" N 68 2.774 1.137 2.549 17919 1034 1 173 "Average Difference" HA 74 0.243 -0.019 0.244 17919 1035 1 173 "Average Difference" C 71 0.868 -0.200 0.851 17919 1036 1 173 "Average Difference" CA 71 0.749 -0.097 0.748 17919 1037 1 173 "Average Difference" CB 67 1.061 0.011 1.069 17919 1038 1 173 "Average Difference" HN 68 0.457 -0.005 0.460 17919 1039 1 174 "Average Difference" N 68 2.497 1.038 2.288 17919 1040 1 174 "Average Difference" HA 74 0.271 -0.011 0.272 17919 1041 1 174 "Average Difference" C 71 0.841 -0.132 0.837 17919 1042 1 174 "Average Difference" CA 71 0.726 0.018 0.731 17919 1043 1 174 "Average Difference" CB 67 1.039 -0.010 1.046 17919 1044 1 174 "Average Difference" HN 68 0.420 -0.021 0.423 17919 1045 1 175 "Average Difference" N 68 2.078 0.900 1.887 17919 1046 1 175 "Average Difference" HA 74 0.249 -0.033 0.249 17919 1047 1 175 "Average Difference" C 71 0.818 -0.056 0.822 17919 1048 1 175 "Average Difference" CA 71 0.654 -0.014 0.659 17919 1049 1 175 "Average Difference" CB 67 0.998 -0.127 0.998 17919 1050 1 175 "Average Difference" HN 68 0.427 0.011 0.430 17919 1051 1 176 "Average Difference" N 68 2.433 1.001 2.234 17919 1052 1 176 "Average Difference" HA 74 0.212 -0.011 0.213 17919 1053 1 176 "Average Difference" C 71 0.810 -0.100 0.810 17919 1054 1 176 "Average Difference" CA 71 0.663 -0.029 0.667 17919 1055 1 176 "Average Difference" CB 67 0.888 0.023 0.895 17919 1056 1 176 "Average Difference" HN 68 0.478 0.014 0.481 17919 1057 1 177 "Average Difference" N 68 2.288 1.086 2.029 17919 1058 1 177 "Average Difference" HA 74 0.218 -0.052 0.213 17919 1059 1 177 "Average Difference" C 71 0.824 -0.085 0.826 17919 1060 1 177 "Average Difference" CA 71 0.734 0.019 0.739 17919 1061 1 177 "Average Difference" CB 67 1.191 -0.117 1.194 17919 1062 1 177 "Average Difference" HN 68 0.449 -0.040 0.451 17919 1063 1 178 "Average Difference" N 68 2.295 1.259 1.933 17919 1064 1 178 "Average Difference" HA 74 0.238 -0.046 0.235 17919 1065 1 178 "Average Difference" C 71 0.860 -0.100 0.860 17919 1066 1 178 "Average Difference" CA 71 0.686 0.034 0.690 17919 1067 1 178 "Average Difference" CB 67 1.091 -0.120 1.093 17919 1068 1 178 "Average Difference" HN 68 0.435 0.000 0.438 17919 1069 1 179 "Average Difference" N 68 2.406 1.205 2.098 17919 1070 1 179 "Average Difference" HA 74 0.211 -0.019 0.212 17919 1071 1 179 "Average Difference" C 71 0.836 -0.165 0.826 17919 1072 1 179 "Average Difference" CA 71 0.724 -0.054 0.727 17919 1073 1 179 "Average Difference" CB 67 0.979 0.082 0.983 17919 1074 1 179 "Average Difference" HN 68 0.435 0.013 0.438 17919 1075 1 180 "Average Difference" N 68 2.311 0.876 2.155 17919 1076 1 180 "Average Difference" HA 74 0.246 -0.073 0.237 17919 1077 1 180 "Average Difference" C 71 0.795 -0.053 0.798 17919 1078 1 180 "Average Difference" CA 71 0.776 -0.043 0.780 17919 1079 1 180 "Average Difference" CB 67 1.011 -0.141 1.009 17919 1080 1 180 "Average Difference" HN 68 0.442 -0.014 0.445 17919 1081 1 181 "Average Difference" N 68 2.493 0.883 2.348 17919 1082 1 181 "Average Difference" HA 74 0.233 -0.013 0.234 17919 1083 1 181 "Average Difference" C 71 0.906 -0.068 0.910 17919 1084 1 181 "Average Difference" CA 71 0.726 -0.034 0.730 17919 1085 1 181 "Average Difference" CB 67 1.142 -0.102 1.146 17919 1086 1 181 "Average Difference" HN 68 0.483 0.018 0.487 17919 1087 1 182 "Average Difference" N 68 2.379 1.140 2.104 17919 1088 1 182 "Average Difference" HA 74 0.242 -0.033 0.241 17919 1089 1 182 "Average Difference" C 71 0.802 -0.144 0.795 17919 1090 1 182 "Average Difference" CA 71 0.710 -0.058 0.713 17919 1091 1 182 "Average Difference" CB 67 1.070 -0.051 1.077 17919 1092 1 182 "Average Difference" HN 68 0.485 -0.012 0.489 17919 1093 1 183 "Average Difference" N 68 2.395 0.880 2.244 17919 1094 1 183 "Average Difference" HA 74 0.245 -0.045 0.242 17919 1095 1 183 "Average Difference" C 71 0.920 -0.151 0.914 17919 1096 1 183 "Average Difference" CA 71 0.728 -0.028 0.733 17919 1097 1 183 "Average Difference" CB 67 1.074 0.003 1.082 17919 1098 1 183 "Average Difference" HN 68 0.497 -0.062 0.497 17919 1099 1 184 "Average Difference" N 68 2.386 0.893 2.229 17919 1100 1 184 "Average Difference" HA 74 0.262 -0.051 0.258 17919 1101 1 184 "Average Difference" C 71 0.868 -0.128 0.865 17919 1102 1 184 "Average Difference" CA 71 0.753 -0.027 0.758 17919 1103 1 184 "Average Difference" CB 67 1.102 -0.165 1.098 17919 1104 1 184 "Average Difference" HN 68 0.476 -0.026 0.479 17919 1105 1 185 "Average Difference" N 68 2.398 1.073 2.161 17919 1106 1 185 "Average Difference" HA 74 0.250 -0.027 0.250 17919 1107 1 185 "Average Difference" C 71 0.829 -0.133 0.824 17919 1108 1 185 "Average Difference" CA 71 0.695 -0.022 0.699 17919 1109 1 185 "Average Difference" CB 67 1.067 -0.137 1.066 17919 1110 1 185 "Average Difference" HN 68 0.430 -0.054 0.430 17919 1111 1 186 "Average Difference" N 68 2.484 0.949 2.312 17919 1112 1 186 "Average Difference" HA 74 0.270 -0.030 0.270 17919 1113 1 186 "Average Difference" C 71 0.862 -0.114 0.861 17919 1114 1 186 "Average Difference" CA 71 0.732 -0.060 0.735 17919 1115 1 186 "Average Difference" CB 67 1.044 -0.142 1.042 17919 1116 1 186 "Average Difference" HN 68 0.460 -0.032 0.462 17919 1117 1 187 "Average Difference" N 68 3.097 0.793 3.016 17919 1118 1 187 "Average Difference" HA 74 0.270 -0.024 0.271 17919 1119 1 187 "Average Difference" C 71 0.832 -0.120 0.829 17919 1120 1 187 "Average Difference" CA 71 0.965 0.084 0.968 17919 1121 1 187 "Average Difference" CB 67 1.255 -0.016 1.264 17919 1122 1 187 "Average Difference" HN 68 0.444 -0.015 0.447 17919 1123 1 188 "Average Difference" N 68 2.533 0.799 2.422 17919 1124 1 188 "Average Difference" HA 74 0.237 -0.020 0.237 17919 1125 1 188 "Average Difference" C 71 0.818 -0.177 0.805 17919 1126 1 188 "Average Difference" CA 71 0.767 -0.161 0.755 17919 1127 1 188 "Average Difference" CB 67 1.000 0.013 1.007 17919 1128 1 188 "Average Difference" HN 68 0.418 0.032 0.419 17919 1129 1 189 "Average Difference" N 68 2.614 0.858 2.488 17919 1130 1 189 "Average Difference" HA 74 0.243 -0.013 0.245 17919 1131 1 189 "Average Difference" C 71 0.770 -0.067 0.773 17919 1132 1 189 "Average Difference" CA 71 0.903 -0.095 0.905 17919 1133 1 189 "Average Difference" CB 67 0.993 0.053 1.000 17919 1134 1 189 "Average Difference" HN 68 0.444 -0.005 0.447 17919 1135 1 190 "Average Difference" N 68 2.541 0.925 2.384 17919 1136 1 190 "Average Difference" HA 74 0.221 0.001 0.223 17919 1137 1 190 "Average Difference" C 71 0.912 -0.238 0.886 17919 1138 1 190 "Average Difference" CA 71 0.620 -0.155 0.604 17919 1139 1 190 "Average Difference" CB 67 1.039 -0.010 1.047 17919 1140 1 190 "Average Difference" HN 68 0.485 -0.021 0.488 17919 1141 1 191 "Average Difference" N 68 2.505 0.961 2.331 17919 1142 1 191 "Average Difference" HA 74 0.214 -0.014 0.215 17919 1143 1 191 "Average Difference" C 71 0.878 -0.021 0.884 17919 1144 1 191 "Average Difference" CA 71 0.657 -0.024 0.661 17919 1145 1 191 "Average Difference" CB 67 0.957 -0.063 0.962 17919 1146 1 191 "Average Difference" HN 68 0.462 -0.007 0.466 17919 1147 1 192 "Average Difference" N 68 2.714 1.046 2.523 17919 1148 1 192 "Average Difference" HA 74 0.224 -0.009 0.226 17919 1149 1 192 "Average Difference" C 71 0.857 -0.166 0.847 17919 1150 1 192 "Average Difference" CA 71 0.692 -0.105 0.689 17919 1151 1 192 "Average Difference" CB 67 0.967 0.021 0.974 17919 1152 1 192 "Average Difference" HN 68 0.515 0.063 0.515 17919 1153 1 193 "Average Difference" N 68 2.238 1.151 1.934 17919 1154 1 193 "Average Difference" HA 74 0.239 -0.025 0.239 17919 1155 1 193 "Average Difference" C 71 0.828 -0.083 0.830 17919 1156 1 193 "Average Difference" CA 71 0.666 -0.023 0.670 17919 1157 1 193 "Average Difference" CB 67 1.013 0.021 1.020 17919 1158 1 193 "Average Difference" HN 68 0.435 0.005 0.438 17919 1159 1 194 "Average Difference" N 68 2.542 0.987 2.359 17919 1160 1 194 "Average Difference" HA 74 0.244 -0.040 0.243 17919 1161 1 194 "Average Difference" C 71 0.807 -0.204 0.787 17919 1162 1 194 "Average Difference" CA 71 0.794 -0.050 0.798 17919 1163 1 194 "Average Difference" CB 67 1.116 0.042 1.123 17919 1164 1 194 "Average Difference" HN 68 0.440 -0.018 0.443 17919 1165 1 195 "Average Difference" N 68 2.210 0.921 2.024 17919 1166 1 195 "Average Difference" HA 74 0.219 -0.021 0.220 17919 1167 1 195 "Average Difference" C 71 0.843 -0.092 0.844 17919 1168 1 195 "Average Difference" CA 71 0.724 -0.085 0.724 17919 1169 1 195 "Average Difference" CB 67 1.047 -0.016 1.055 17919 1170 1 195 "Average Difference" HN 68 0.467 -0.046 0.468 17919 1171 1 196 "Average Difference" N 68 2.619 1.296 2.293 17919 1172 1 196 "Average Difference" HA 74 0.232 -0.019 0.233 17919 1173 1 196 "Average Difference" C 71 0.843 -0.173 0.831 17919 1174 1 196 "Average Difference" CA 71 0.827 -0.031 0.832 17919 1175 1 196 "Average Difference" CB 67 1.035 0.014 1.043 17919 1176 1 196 "Average Difference" HN 68 0.470 -0.001 0.474 17919 1177 1 197 "Average Difference" N 68 2.630 1.241 2.336 17919 1178 1 197 "Average Difference" HA 74 0.221 -0.038 0.219 17919 1179 1 197 "Average Difference" C 71 0.878 -0.199 0.862 17919 1180 1 197 "Average Difference" CA 71 0.676 0.030 0.680 17919 1181 1 197 "Average Difference" CB 67 1.090 -0.023 1.098 17919 1182 1 197 "Average Difference" HN 68 0.462 -0.044 0.463 17919 1183 1 198 "Average Difference" N 68 2.526 0.900 2.378 17919 1184 1 198 "Average Difference" HA 74 0.210 -0.002 0.212 17919 1185 1 198 "Average Difference" C 71 0.882 -0.179 0.870 17919 1186 1 198 "Average Difference" CA 71 0.832 -0.109 0.830 17919 1187 1 198 "Average Difference" CB 67 1.113 0.038 1.120 17919 1188 1 198 "Average Difference" HN 68 0.454 -0.005 0.457 17919 1189 1 199 "Average Difference" N 68 2.130 0.951 1.920 17919 1190 1 199 "Average Difference" HA 74 0.244 -0.047 0.241 17919 1191 1 199 "Average Difference" C 71 0.853 -0.119 0.851 17919 1192 1 199 "Average Difference" CA 71 0.695 0.000 0.700 17919 1193 1 199 "Average Difference" CB 67 1.025 -0.069 1.030 17919 1194 1 199 "Average Difference" HN 68 0.493 -0.034 0.496 17919 1195 1 200 "Average Difference" N 68 2.393 0.872 2.245 17919 1196 1 200 "Average Difference" HA 74 0.276 -0.003 0.278 17919 1197 1 200 "Average Difference" C 71 0.861 -0.171 0.850 17919 1198 1 200 "Average Difference" CA 71 0.787 -0.126 0.782 17919 1199 1 200 "Average Difference" CB 67 1.120 0.031 1.128 17919 1200 1 200 "Average Difference" HN 68 0.436 -0.017 0.439 17919 1201 1 201 "Average Difference" N 68 2.210 0.810 2.071 17919 1202 1 201 "Average Difference" HA 74 0.247 -0.033 0.247 17919 1203 1 201 "Average Difference" C 71 0.930 -0.137 0.927 17919 1204 1 201 "Average Difference" CA 71 0.763 0.003 0.768 17919 1205 1 201 "Average Difference" CB 67 1.002 -0.024 1.009 17919 1206 1 201 "Average Difference" HN 68 0.468 -0.044 0.470 17919 1207 1 202 "Average Difference" N 68 2.310 0.678 2.225 17919 1208 1 202 "Average Difference" HA 74 0.211 -0.024 0.211 17919 1209 1 202 "Average Difference" C 71 0.740 -0.122 0.735 17919 1210 1 202 "Average Difference" CA 71 0.830 -0.006 0.836 17919 1211 1 202 "Average Difference" CB 67 1.101 0.011 1.110 17919 1212 1 202 "Average Difference" HN 68 0.442 -0.003 0.446 17919 1213 1 203 "Average Difference" N 68 2.658 0.785 2.559 17919 1214 1 203 "Average Difference" HA 74 0.223 -0.044 0.221 17919 1215 1 203 "Average Difference" C 71 0.767 -0.087 0.768 17919 1216 1 203 "Average Difference" CA 71 0.656 0.035 0.659 17919 1217 1 203 "Average Difference" CB 67 1.090 -0.117 1.092 17919 1218 1 203 "Average Difference" HN 68 0.444 -0.049 0.444 17919 1219 1 204 "Average Difference" N 68 2.749 1.148 2.516 17919 1220 1 204 "Average Difference" HA 74 0.228 -0.023 0.229 17919 1221 1 204 "Average Difference" C 71 0.888 -0.119 0.886 17919 1222 1 204 "Average Difference" CA 71 0.790 0.062 0.793 17919 1223 1 204 "Average Difference" CB 67 1.034 -0.061 1.040 17919 1224 1 204 "Average Difference" HN 68 0.483 -0.039 0.485 17919 1225 1 205 "Average Difference" N 68 2.441 0.807 2.320 17919 1226 1 205 "Average Difference" HA 74 0.227 -0.024 0.228 17919 1227 1 205 "Average Difference" C 71 0.866 -0.100 0.866 17919 1228 1 205 "Average Difference" CA 71 0.675 -0.079 0.675 17919 1229 1 205 "Average Difference" CB 67 1.072 0.038 1.079 17919 1230 1 205 "Average Difference" HN 68 0.463 -0.092 0.457 17919 1231 1 206 "Average Difference" N 68 2.582 0.656 2.516 17919 1232 1 206 "Average Difference" HA 74 0.222 -0.019 0.223 17919 1233 1 206 "Average Difference" C 71 0.835 -0.089 0.836 17919 1234 1 206 "Average Difference" CA 71 0.855 -0.036 0.861 17919 1235 1 206 "Average Difference" CB 67 1.004 -0.041 1.011 17919 1236 1 206 "Average Difference" HN 68 0.419 -0.023 0.421 17919 1237 1 207 "Average Difference" N 68 2.470 1.196 2.177 17919 1238 1 207 "Average Difference" HA 74 0.218 -0.018 0.218 17919 1239 1 207 "Average Difference" C 71 0.834 -0.197 0.816 17919 1240 1 207 "Average Difference" CA 71 0.540 -0.043 0.542 17919 1241 1 207 "Average Difference" CB 67 0.968 -0.014 0.976 17919 1242 1 207 "Average Difference" HN 68 0.435 0.012 0.438 17919 1243 1 208 "Average Difference" N 68 2.493 1.208 2.197 17919 1244 1 208 "Average Difference" HA 74 0.239 -0.021 0.239 17919 1245 1 208 "Average Difference" C 71 0.771 -0.186 0.753 17919 1246 1 208 "Average Difference" CA 71 0.708 0.031 0.712 17919 1247 1 208 "Average Difference" CB 67 0.913 0.042 0.919 17919 1248 1 208 "Average Difference" HN 68 0.440 0.059 0.439 17919 1249 1 209 "Average Difference" N 68 2.851 1.307 2.553 17919 1250 1 209 "Average Difference" HA 74 0.243 -0.017 0.244 17919 1251 1 209 "Average Difference" C 71 0.962 -0.244 0.938 17919 1252 1 209 "Average Difference" CA 71 0.837 -0.104 0.836 17919 1253 1 209 "Average Difference" CB 67 1.022 0.072 1.027 17919 1254 1 209 "Average Difference" HN 68 0.483 0.002 0.487 17919 1255 1 210 "Average Difference" N 68 2.366 0.883 2.211 17919 1256 1 210 "Average Difference" HA 74 0.240 -0.010 0.241 17919 1257 1 210 "Average Difference" C 71 0.873 -0.064 0.877 17919 1258 1 210 "Average Difference" CA 71 0.687 -0.117 0.682 17919 1259 1 210 "Average Difference" CB 67 1.053 -0.021 1.061 17919 1260 1 210 "Average Difference" HN 68 0.461 -0.035 0.464 17919 1261 1 211 "Average Difference" N 68 2.408 0.750 2.305 17919 1262 1 211 "Average Difference" HA 74 0.206 -0.010 0.208 17919 1263 1 211 "Average Difference" C 71 0.873 -0.112 0.872 17919 1264 1 211 "Average Difference" CA 71 0.720 -0.038 0.724 17919 1265 1 211 "Average Difference" CB 67 1.047 0.011 1.055 17919 1266 1 211 "Average Difference" HN 68 0.491 -0.064 0.491 17919 1267 1 212 "Average Difference" N 68 2.642 1.189 2.377 17919 1268 1 212 "Average Difference" HA 74 0.239 -0.022 0.240 17919 1269 1 212 "Average Difference" C 71 0.883 -0.188 0.869 17919 1270 1 212 "Average Difference" CA 71 0.777 -0.071 0.779 17919 1271 1 212 "Average Difference" CB 67 1.231 -0.048 1.240 17919 1272 1 212 "Average Difference" HN 68 0.448 0.017 0.451 17919 1273 1 213 "Average Difference" N 68 2.177 0.989 1.954 17919 1274 1 213 "Average Difference" HA 74 0.222 -0.015 0.223 17919 1275 1 213 "Average Difference" C 71 0.763 -0.114 0.760 17919 1276 1 213 "Average Difference" CA 71 0.638 -0.088 0.636 17919 1277 1 213 "Average Difference" CB 67 1.121 -0.045 1.129 17919 1278 1 213 "Average Difference" HN 68 0.458 -0.047 0.459 17919 1279 1 214 "Average Difference" N 68 2.405 1.091 2.160 17919 1280 1 214 "Average Difference" HA 74 0.199 -0.029 0.199 17919 1281 1 214 "Average Difference" C 71 0.848 -0.081 0.850 17919 1282 1 214 "Average Difference" CA 71 0.643 -0.048 0.646 17919 1283 1 214 "Average Difference" CB 67 1.065 -0.032 1.073 17919 1284 1 214 "Average Difference" HN 68 0.468 -0.029 0.471 17919 1285 1 215 "Average Difference" N 68 2.492 0.962 2.316 17919 1286 1 215 "Average Difference" HA 74 0.245 -0.008 0.246 17919 1287 1 215 "Average Difference" C 71 0.832 -0.154 0.824 17919 1288 1 215 "Average Difference" CA 71 0.734 -0.002 0.739 17919 1289 1 215 "Average Difference" CB 67 1.065 -0.038 1.073 17919 1290 1 215 "Average Difference" HN 68 0.465 0.007 0.468 17919 1291 1 216 "Average Difference" N 68 2.271 1.084 2.011 17919 1292 1 216 "Average Difference" HA 74 0.228 -0.017 0.228 17919 1293 1 216 "Average Difference" C 71 0.801 -0.157 0.790 17919 1294 1 216 "Average Difference" CA 71 0.751 -0.082 0.752 17919 1295 1 216 "Average Difference" CB 67 1.078 -0.063 1.084 17919 1296 1 216 "Average Difference" HN 68 0.440 0.013 0.443 17919 1297 1 217 "Average Difference" N 68 2.577 1.123 2.337 17919 1298 1 217 "Average Difference" HA 74 0.213 -0.045 0.209 17919 1299 1 217 "Average Difference" C 71 0.864 -0.111 0.863 17919 1300 1 217 "Average Difference" CA 71 0.650 -0.016 0.655 17919 1301 1 217 "Average Difference" CB 67 1.104 -0.142 1.103 17919 1302 1 217 "Average Difference" HN 68 0.490 -0.048 0.491 17919 1303 1 218 "Average Difference" N 68 2.676 1.196 2.412 17919 1304 1 218 "Average Difference" HA 74 0.249 -0.029 0.249 17919 1305 1 218 "Average Difference" C 71 0.759 -0.123 0.754 17919 1306 1 218 "Average Difference" CA 71 0.701 0.011 0.706 17919 1307 1 218 "Average Difference" CB 67 1.024 -0.092 1.028 17919 1308 1 218 "Average Difference" HN 68 0.429 0.001 0.432 17919 1309 1 219 "Average Difference" N 68 2.235 0.696 2.140 17919 1310 1 219 "Average Difference" HA 74 0.255 -0.043 0.253 17919 1311 1 219 "Average Difference" C 71 0.812 -0.117 0.809 17919 1312 1 219 "Average Difference" CA 71 0.792 0.021 0.798 17919 1313 1 219 "Average Difference" CB 67 1.146 -0.191 1.139 17919 1314 1 219 "Average Difference" HN 68 0.508 -0.092 0.503 17919 1315 1 220 "Average Difference" N 68 2.471 0.760 2.368 17919 1316 1 220 "Average Difference" HA 74 0.225 -0.011 0.226 17919 1317 1 220 "Average Difference" C 71 0.891 -0.142 0.886 17919 1318 1 220 "Average Difference" CA 71 0.766 -0.066 0.769 17919 1319 1 220 "Average Difference" CB 67 1.156 -0.036 1.164 17919 1320 1 220 "Average Difference" HN 68 0.469 -0.023 0.472 17919 1321 1 221 "Average Difference" N 68 2.340 1.023 2.121 17919 1322 1 221 "Average Difference" HA 74 0.216 -0.019 0.216 17919 1323 1 221 "Average Difference" C 71 0.857 -0.093 0.858 17919 1324 1 221 "Average Difference" CA 71 0.688 -0.069 0.689 17919 1325 1 221 "Average Difference" CB 67 1.083 -0.136 1.083 17919 1326 1 221 "Average Difference" HN 68 0.420 0.003 0.423 17919 1327 1 222 "Average Difference" N 68 2.404 0.962 2.219 17919 1328 1 222 "Average Difference" HA 74 0.253 -0.035 0.252 17919 1329 1 222 "Average Difference" C 71 0.934 -0.142 0.930 17919 1330 1 222 "Average Difference" CA 71 0.838 0.092 0.839 17919 1331 1 222 "Average Difference" CB 67 1.059 -0.040 1.067 17919 1332 1 222 "Average Difference" HN 68 0.477 -0.016 0.481 17919 1333 1 223 "Average Difference" N 68 2.554 1.044 2.348 17919 1334 1 223 "Average Difference" HA 74 0.229 -0.019 0.229 17919 1335 1 223 "Average Difference" C 71 0.826 -0.133 0.821 17919 1336 1 223 "Average Difference" CA 71 0.729 -0.075 0.730 17919 1337 1 223 "Average Difference" CB 67 0.982 0.050 0.988 17919 1338 1 223 "Average Difference" HN 68 0.503 -0.036 0.505 17919 1339 1 224 "Average Difference" N 68 2.603 0.935 2.447 17919 1340 1 224 "Average Difference" HA 74 0.232 -0.039 0.230 17919 1341 1 224 "Average Difference" C 71 0.811 -0.065 0.814 17919 1342 1 224 "Average Difference" CA 71 0.683 -0.045 0.686 17919 1343 1 224 "Average Difference" CB 67 0.926 -0.078 0.930 17919 1344 1 224 "Average Difference" HN 68 0.465 -0.011 0.468 17919 1345 1 225 "Average Difference" N 68 2.798 1.045 2.615 17919 1346 1 225 "Average Difference" HA 74 0.261 -0.015 0.263 17919 1347 1 225 "Average Difference" C 71 0.781 -0.125 0.776 17919 1348 1 225 "Average Difference" CA 71 0.811 0.033 0.816 17919 1349 1 225 "Average Difference" CB 67 1.062 -0.098 1.066 17919 1350 1 225 "Average Difference" HN 68 0.464 -0.031 0.466 17919 1351 1 226 "Average Difference" N 68 2.537 0.759 2.438 17919 1352 1 226 "Average Difference" HA 74 0.217 -0.011 0.218 17919 1353 1 226 "Average Difference" C 71 0.837 -0.114 0.835 17919 1354 1 226 "Average Difference" CA 71 0.704 -0.066 0.706 17919 1355 1 226 "Average Difference" CB 67 1.005 -0.050 1.012 17919 1356 1 226 "Average Difference" HN 68 0.418 -0.025 0.420 17919 1357 1 227 "Average Difference" N 68 2.447 0.584 2.394 17919 1358 1 227 "Average Difference" HA 74 0.222 -0.023 0.223 17919 1359 1 227 "Average Difference" C 71 0.849 -0.023 0.854 17919 1360 1 227 "Average Difference" CA 71 0.785 -0.079 0.787 17919 1361 1 227 "Average Difference" CB 67 0.930 -0.013 0.937 17919 1362 1 227 "Average Difference" HN 68 0.487 -0.003 0.490 17919 1363 1 228 "Average Difference" N 68 2.374 1.092 2.124 17919 1364 1 228 "Average Difference" HA 74 0.209 -0.047 0.205 17919 1365 1 228 "Average Difference" C 71 0.841 -0.156 0.832 17919 1366 1 228 "Average Difference" CA 71 0.631 0.022 0.635 17919 1367 1 228 "Average Difference" CB 67 1.030 -0.066 1.036 17919 1368 1 228 "Average Difference" HN 68 0.456 -0.050 0.456 17919 1369 1 229 "Average Difference" N 68 2.411 0.909 2.250 17919 1370 1 229 "Average Difference" HA 74 0.220 -0.027 0.220 17919 1371 1 229 "Average Difference" C 71 0.841 -0.121 0.838 17919 1372 1 229 "Average Difference" CA 71 0.671 -0.094 0.670 17919 1373 1 229 "Average Difference" CB 67 1.056 -0.210 1.043 17919 1374 1 229 "Average Difference" HN 68 0.429 -0.021 0.432 17919 1375 1 230 "Average Difference" N 68 2.685 1.095 2.469 17919 1376 1 230 "Average Difference" HA 74 0.225 -0.025 0.225 17919 1377 1 230 "Average Difference" C 71 0.912 -0.218 0.891 17919 1378 1 230 "Average Difference" CA 71 0.706 0.014 0.711 17919 1379 1 230 "Average Difference" CB 67 1.156 0.026 1.164 17919 1380 1 230 "Average Difference" HN 68 0.483 -0.017 0.487 17919 1381 1 231 "Average Difference" N 68 2.925 1.111 2.725 17919 1382 1 231 "Average Difference" HA 74 0.250 -0.017 0.251 17919 1383 1 231 "Average Difference" C 71 0.958 -0.166 0.950 17919 1384 1 231 "Average Difference" CA 71 0.854 0.012 0.860 17919 1385 1 231 "Average Difference" CB 67 1.048 0.095 1.052 17919 1386 1 231 "Average Difference" HN 68 0.433 0.036 0.435 17919 1387 1 232 "Average Difference" N 68 2.432 0.924 2.266 17919 1388 1 232 "Average Difference" HA 74 0.253 -0.015 0.255 17919 1389 1 232 "Average Difference" C 71 0.879 -0.122 0.877 17919 1390 1 232 "Average Difference" CA 71 0.753 -0.108 0.751 17919 1391 1 232 "Average Difference" CB 67 1.091 0.030 1.099 17919 1392 1 232 "Average Difference" HN 68 0.507 -0.044 0.509 17919 1393 1 233 "Average Difference" N 68 2.494 0.872 2.355 17919 1394 1 233 "Average Difference" HA 74 0.198 -0.006 0.199 17919 1395 1 233 "Average Difference" C 71 0.933 -0.173 0.923 17919 1396 1 233 "Average Difference" CA 71 0.656 -0.117 0.651 17919 1397 1 233 "Average Difference" CB 67 0.992 -0.008 0.999 17919 1398 1 233 "Average Difference" HN 68 0.456 -0.069 0.454 17919 1399 1 234 "Average Difference" N 68 2.381 0.796 2.261 17919 1400 1 234 "Average Difference" HA 74 0.250 -0.010 0.251 17919 1401 1 234 "Average Difference" C 71 0.847 -0.127 0.843 17919 1402 1 234 "Average Difference" CA 71 0.686 -0.045 0.689 17919 1403 1 234 "Average Difference" CB 67 1.077 -0.013 1.085 17919 1404 1 234 "Average Difference" HN 68 0.488 0.020 0.491 17919 1405 1 235 "Average Difference" N 68 2.641 1.109 2.415 17919 1406 1 235 "Average Difference" HA 74 0.234 -0.020 0.235 17919 1407 1 235 "Average Difference" C 71 0.865 -0.130 0.861 17919 1408 1 235 "Average Difference" CA 71 0.740 -0.023 0.745 17919 1409 1 235 "Average Difference" CB 67 1.016 -0.010 1.024 17919 1410 1 235 "Average Difference" HN 68 0.432 -0.009 0.435 17919 1411 1 236 "Average Difference" N 68 2.644 1.195 2.376 17919 1412 1 236 "Average Difference" HA 74 0.233 -0.047 0.230 17919 1413 1 236 "Average Difference" C 71 0.845 -0.092 0.846 17919 1414 1 236 "Average Difference" CA 71 0.774 -0.055 0.777 17919 1415 1 236 "Average Difference" CB 67 1.068 -0.157 1.064 17919 1416 1 236 "Average Difference" HN 68 0.507 -0.029 0.510 17919 1417 1 237 "Average Difference" N 68 2.404 1.110 2.149 17919 1418 1 237 "Average Difference" HA 74 0.214 -0.020 0.214 17919 1419 1 237 "Average Difference" C 71 0.818 -0.117 0.815 17919 1420 1 237 "Average Difference" CA 71 0.716 -0.117 0.711 17919 1421 1 237 "Average Difference" CB 67 1.070 -0.050 1.076 17919 1422 1 237 "Average Difference" HN 68 0.436 0.006 0.440 17919 1423 1 238 "Average Difference" N 68 2.258 0.880 2.095 17919 1424 1 238 "Average Difference" HA 74 0.250 -0.012 0.252 17919 1425 1 238 "Average Difference" C 71 0.848 -0.076 0.850 17919 1426 1 238 "Average Difference" CA 71 0.705 -0.049 0.708 17919 1427 1 238 "Average Difference" CB 67 1.212 -0.085 1.218 17919 1428 1 238 "Average Difference" HN 68 0.442 -0.083 0.438 17919 1429 1 239 "Average Difference" N 68 2.424 0.870 2.280 17919 1430 1 239 "Average Difference" HA 74 0.230 -0.013 0.231 17919 1431 1 239 "Average Difference" C 71 0.855 -0.092 0.856 17919 1432 1 239 "Average Difference" CA 71 0.715 -0.044 0.718 17919 1433 1 239 "Average Difference" CB 67 1.101 -0.066 1.107 17919 1434 1 239 "Average Difference" HN 68 0.447 -0.011 0.450 17919 1435 1 240 "Average Difference" N 68 2.488 0.710 2.402 17919 1436 1 240 "Average Difference" HA 74 0.231 -0.009 0.233 17919 1437 1 240 "Average Difference" C 71 0.821 -0.188 0.805 17919 1438 1 240 "Average Difference" CA 71 0.789 -0.117 0.785 17919 1439 1 240 "Average Difference" CB 67 1.083 0.064 1.089 17919 1440 1 240 "Average Difference" HN 68 0.450 -0.035 0.452 17919 1441 1 241 "Average Difference" N 68 2.383 0.885 2.229 17919 1442 1 241 "Average Difference" HA 74 0.213 -0.042 0.210 17919 1443 1 241 "Average Difference" C 71 0.899 -0.093 0.900 17919 1444 1 241 "Average Difference" CA 71 0.738 0.025 0.743 17919 1445 1 241 "Average Difference" CB 67 1.098 -0.008 1.106 17919 1446 1 241 "Average Difference" HN 68 0.453 -0.013 0.456 17919 1447 1 242 "Average Difference" N 68 2.472 0.960 2.295 17919 1448 1 242 "Average Difference" HA 74 0.249 -0.020 0.250 17919 1449 1 242 "Average Difference" C 71 0.831 -0.107 0.830 17919 1450 1 242 "Average Difference" CA 71 0.803 -0.096 0.803 17919 1451 1 242 "Average Difference" CB 67 1.194 -0.112 1.198 17919 1452 1 242 "Average Difference" HN 68 0.442 0.001 0.445 17919 1453 1 243 "Average Difference" N 68 2.558 0.714 2.475 17919 1454 1 243 "Average Difference" HA 74 0.230 -0.036 0.228 17919 1455 1 243 "Average Difference" C 71 0.808 -0.177 0.794 17919 1456 1 243 "Average Difference" CA 71 0.729 -0.117 0.725 17919 1457 1 243 "Average Difference" CB 67 0.980 -0.077 0.985 17919 1458 1 243 "Average Difference" HN 68 0.488 -0.064 0.487 17919 1459 1 244 "Average Difference" N 68 2.858 0.798 2.765 17919 1460 1 244 "Average Difference" HA 74 0.229 -0.013 0.231 17919 1461 1 244 "Average Difference" C 71 0.876 -0.164 0.867 17919 1462 1 244 "Average Difference" CA 71 0.778 -0.047 0.782 17919 1463 1 244 "Average Difference" CB 67 1.011 -0.091 1.015 17919 1464 1 244 "Average Difference" HN 68 0.456 -0.012 0.460 17919 1465 1 245 "Average Difference" N 68 2.574 0.742 2.483 17919 1466 1 245 "Average Difference" HA 74 0.228 -0.008 0.229 17919 1467 1 245 "Average Difference" C 71 0.826 -0.159 0.817 17919 1468 1 245 "Average Difference" CA 71 0.711 -0.083 0.711 17919 1469 1 245 "Average Difference" CB 67 0.947 0.011 0.954 17919 1470 1 245 "Average Difference" HN 68 0.418 0.011 0.421 17919 1471 1 246 "Average Difference" N 68 2.426 0.871 2.281 17919 1472 1 246 "Average Difference" HA 74 0.209 -0.023 0.209 17919 1473 1 246 "Average Difference" C 71 0.794 -0.063 0.797 17919 1474 1 246 "Average Difference" CA 71 0.727 -0.078 0.728 17919 1475 1 246 "Average Difference" CB 67 0.973 -0.059 0.979 17919 1476 1 246 "Average Difference" HN 68 0.470 -0.023 0.473 17919 1477 1 247 "Average Difference" N 68 2.634 1.048 2.434 17919 1478 1 247 "Average Difference" HA 74 0.219 -0.064 0.211 17919 1479 1 247 "Average Difference" C 71 0.860 -0.046 0.865 17919 1480 1 247 "Average Difference" CA 71 0.690 0.099 0.688 17919 1481 1 247 "Average Difference" CB 67 1.024 -0.105 1.027 17919 1482 1 247 "Average Difference" HN 68 0.479 -0.014 0.482 17919 1483 1 248 "Average Difference" N 68 2.468 0.907 2.313 17919 1484 1 248 "Average Difference" HA 74 0.242 -0.044 0.239 17919 1485 1 248 "Average Difference" C 71 0.930 -0.196 0.916 17919 1486 1 248 "Average Difference" CA 71 0.871 -0.088 0.873 17919 1487 1 248 "Average Difference" CB 67 1.088 -0.139 1.087 17919 1488 1 248 "Average Difference" HN 68 0.446 -0.077 0.443 17919 1489 1 249 "Average Difference" N 68 2.648 1.075 2.438 17919 1490 1 249 "Average Difference" HA 74 0.214 -0.009 0.216 17919 1491 1 249 "Average Difference" C 71 0.876 -0.141 0.870 17919 1492 1 249 "Average Difference" CA 71 0.669 -0.046 0.672 17919 1493 1 249 "Average Difference" CB 67 0.965 0.038 0.972 17919 1494 1 249 "Average Difference" HN 68 0.472 0.005 0.476 17919 1495 1 250 "Average Difference" N 68 2.620 1.328 2.275 17919 1496 1 250 "Average Difference" HA 74 0.227 -0.081 0.214 17919 1497 1 250 "Average Difference" C 71 0.904 -0.099 0.905 17919 1498 1 250 "Average Difference" CA 71 0.705 0.064 0.707 17919 1499 1 250 "Average Difference" CB 67 0.970 -0.026 0.977 17919 1500 1 250 "Average Difference" HN 68 0.463 0.001 0.467 17919 1501 1 251 "Average Difference" N 68 2.610 0.947 2.451 17919 1502 1 251 "Average Difference" HA 74 0.231 -0.034 0.230 17919 1503 1 251 "Average Difference" C 71 0.929 -0.107 0.930 17919 1504 1 251 "Average Difference" CA 71 0.777 -0.128 0.772 17919 1505 1 251 "Average Difference" CB 67 1.121 -0.175 1.116 17919 1506 1 251 "Average Difference" HN 68 0.467 -0.034 0.469 17919 1507 1 252 "Average Difference" N 68 2.637 0.793 2.534 17919 1508 1 252 "Average Difference" HA 74 0.230 -0.006 0.231 17919 1509 1 252 "Average Difference" C 71 0.891 -0.219 0.870 17919 1510 1 252 "Average Difference" CA 71 0.779 -0.046 0.783 17919 1511 1 252 "Average Difference" CB 67 1.088 0.053 1.095 17919 1512 1 252 "Average Difference" HN 68 0.486 -0.035 0.488 17919 1513 1 253 "Average Difference" N 68 2.716 0.887 2.586 17919 1514 1 253 "Average Difference" HA 74 0.207 -0.036 0.206 17919 1515 1 253 "Average Difference" C 71 0.922 -0.083 0.925 17919 1516 1 253 "Average Difference" CA 71 0.664 -0.055 0.667 17919 1517 1 253 "Average Difference" CB 67 1.060 -0.078 1.065 17919 1518 1 253 "Average Difference" HN 68 0.511 -0.111 0.502 17919 1519 1 254 "Average Difference" N 68 2.511 1.081 2.284 17919 1520 1 254 "Average Difference" HA 74 0.256 -0.007 0.257 17919 1521 1 254 "Average Difference" C 71 0.861 -0.133 0.857 17919 1522 1 254 "Average Difference" CA 71 0.729 -0.087 0.729 17919 1523 1 254 "Average Difference" CB 67 1.079 -0.003 1.087 17919 1524 1 254 "Average Difference" HN 68 0.431 -0.014 0.434 17919 1525 1 255 "Average Difference" N 68 2.183 0.844 2.028 17919 1526 1 255 "Average Difference" HA 74 0.233 -0.054 0.228 17919 1527 1 255 "Average Difference" C 71 0.814 -0.024 0.820 17919 1528 1 255 "Average Difference" CA 71 0.698 -0.023 0.703 17919 1529 1 255 "Average Difference" CB 67 1.064 -0.042 1.071 17919 1530 1 255 "Average Difference" HN 68 0.509 -0.045 0.511 17919 1531 1 256 "Average Difference" N 68 2.486 1.166 2.212 17919 1532 1 256 "Average Difference" HA 74 0.230 -0.037 0.229 17919 1533 1 256 "Average Difference" C 71 0.801 -0.090 0.802 17919 1534 1 256 "Average Difference" CA 71 0.659 -0.082 0.659 17919 1535 1 256 "Average Difference" CB 67 0.937 -0.129 0.935 17919 1536 1 256 "Average Difference" HN 68 0.483 -0.030 0.486 17919 1537 1 257 "Average Difference" N 68 2.381 1.020 2.168 17919 1538 1 257 "Average Difference" HA 74 0.243 -0.033 0.242 17919 1539 1 257 "Average Difference" C 71 0.864 -0.202 0.846 17919 1540 1 257 "Average Difference" CA 71 0.703 -0.089 0.703 17919 1541 1 257 "Average Difference" CB 67 1.026 -0.005 1.034 17919 1542 1 257 "Average Difference" HN 68 0.449 -0.006 0.452 17919 1543 1 258 "Average Difference" N 68 2.483 0.637 2.418 17919 1544 1 258 "Average Difference" HA 74 0.269 -0.037 0.268 17919 1545 1 258 "Average Difference" C 71 0.858 -0.137 0.853 17919 1546 1 258 "Average Difference" CA 71 0.735 0.010 0.740 17919 1547 1 258 "Average Difference" CB 67 1.058 -0.013 1.066 17919 1548 1 258 "Average Difference" HN 68 0.492 -0.072 0.490 17919 1549 1 259 "Average Difference" N 68 2.226 0.886 2.058 17919 1550 1 259 "Average Difference" HA 74 0.279 -0.038 0.279 17919 1551 1 259 "Average Difference" C 71 0.808 -0.138 0.802 17919 1552 1 259 "Average Difference" CA 71 0.778 -0.035 0.783 17919 1553 1 259 "Average Difference" CB 67 0.994 -0.038 1.001 17919 1554 1 259 "Average Difference" HN 68 0.450 -0.023 0.453 17919 1555 1 260 "Average Difference" N 68 2.379 0.576 2.325 17919 1556 1 260 "Average Difference" HA 74 0.217 -0.038 0.215 17919 1557 1 260 "Average Difference" C 71 0.827 -0.093 0.827 17919 1558 1 260 "Average Difference" CA 71 0.759 -0.039 0.764 17919 1559 1 260 "Average Difference" CB 67 1.041 0.047 1.048 17919 1560 1 260 "Average Difference" HN 68 0.476 0.004 0.480 17919 1561 1 261 "Average Difference" N 68 2.573 1.350 2.207 17919 1562 1 261 "Average Difference" HA 74 0.229 -0.054 0.225 17919 1563 1 261 "Average Difference" C 71 0.858 -0.128 0.854 17919 1564 1 261 "Average Difference" CA 71 0.665 -0.015 0.669 17919 1565 1 261 "Average Difference" CB 67 1.121 -0.295 1.090 17919 1566 1 261 "Average Difference" HN 68 0.432 0.031 0.435 17919 1567 1 262 "Average Difference" N 68 2.609 0.627 2.552 17919 1568 1 262 "Average Difference" HA 74 0.239 -0.047 0.236 17919 1569 1 262 "Average Difference" C 71 0.830 -0.072 0.832 17919 1570 1 262 "Average Difference" CA 71 0.737 0.077 0.739 17919 1571 1 262 "Average Difference" CB 67 0.977 -0.076 0.981 17919 1572 1 262 "Average Difference" HN 68 0.492 -0.046 0.494 17919 1573 1 263 "Average Difference" N 68 2.759 0.701 2.688 17919 1574 1 263 "Average Difference" HA 74 0.251 -0.014 0.252 17919 1575 1 263 "Average Difference" C 71 0.894 -0.170 0.884 17919 1576 1 263 "Average Difference" CA 71 0.812 -0.091 0.813 17919 1577 1 263 "Average Difference" CB 67 0.967 -0.031 0.973 17919 1578 1 263 "Average Difference" HN 68 0.511 -0.022 0.515 17919 1579 1 264 "Average Difference" N 68 2.848 0.901 2.722 17919 1580 1 264 "Average Difference" HA 74 0.253 -0.000 0.255 17919 1581 1 264 "Average Difference" C 71 0.798 -0.191 0.780 17919 1582 1 264 "Average Difference" CA 71 0.705 -0.001 0.710 17919 1583 1 264 "Average Difference" CB 67 1.105 -0.002 1.113 17919 1584 1 264 "Average Difference" HN 68 0.464 -0.014 0.468 17919 1585 1 265 "Average Difference" N 68 2.394 0.651 2.321 17919 1586 1 265 "Average Difference" HA 74 0.237 0.004 0.238 17919 1587 1 265 "Average Difference" C 71 0.762 -0.112 0.759 17919 1588 1 265 "Average Difference" CA 71 0.700 -0.052 0.703 17919 1589 1 265 "Average Difference" CB 67 0.970 -0.017 0.977 17919 1590 1 265 "Average Difference" HN 68 0.451 -0.032 0.453 17919 1591 1 266 "Average Difference" N 68 2.231 0.542 2.181 17919 1592 1 266 "Average Difference" HA 74 0.259 0.009 0.261 17919 1593 1 266 "Average Difference" C 71 0.784 -0.143 0.776 17919 1594 1 266 "Average Difference" CA 71 0.677 -0.112 0.672 17919 1595 1 266 "Average Difference" CB 67 1.072 -0.001 1.080 17919 1596 1 266 "Average Difference" HN 68 0.440 -0.059 0.439 17919 1597 1 267 "Average Difference" N 68 2.534 1.104 2.298 17919 1598 1 267 "Average Difference" HA 74 0.243 -0.055 0.239 17919 1599 1 267 "Average Difference" C 71 0.877 -0.215 0.856 17919 1600 1 267 "Average Difference" CA 71 0.740 0.024 0.745 17919 1601 1 267 "Average Difference" CB 67 1.100 -0.174 1.094 17919 1602 1 267 "Average Difference" HN 68 0.488 -0.018 0.491 17919 1603 1 268 "Average Difference" N 68 2.741 0.999 2.571 17919 1604 1 268 "Average Difference" HA 74 0.193 -0.008 0.195 17919 1605 1 268 "Average Difference" C 71 0.827 -0.190 0.810 17919 1606 1 268 "Average Difference" CA 71 0.789 -0.135 0.783 17919 1607 1 268 "Average Difference" CB 67 1.033 0.065 1.038 17919 1608 1 268 "Average Difference" HN 68 0.460 -0.028 0.463 17919 1609 1 269 "Average Difference" N 68 2.492 0.902 2.340 17919 1610 1 269 "Average Difference" HA 74 0.231 -0.025 0.231 17919 1611 1 269 "Average Difference" C 71 0.895 -0.170 0.885 17919 1612 1 269 "Average Difference" CA 71 0.790 -0.046 0.794 17919 1613 1 269 "Average Difference" CB 67 1.062 0.005 1.070 17919 1614 1 269 "Average Difference" HN 68 0.494 -0.062 0.493 17919 1615 1 270 "Average Difference" N 68 2.587 0.922 2.435 17919 1616 1 270 "Average Difference" HA 74 0.238 -0.020 0.239 17919 1617 1 270 "Average Difference" C 71 0.905 -0.146 0.900 17919 1618 1 270 "Average Difference" CA 71 0.737 0.004 0.742 17919 1619 1 270 "Average Difference" CB 67 1.026 -0.082 1.030 17919 1620 1 270 "Average Difference" HN 68 0.472 -0.013 0.475 17919 1621 1 271 "Average Difference" N 68 2.578 1.008 2.390 17919 1622 1 271 "Average Difference" HA 74 0.256 -0.024 0.256 17919 1623 1 271 "Average Difference" C 71 0.787 -0.147 0.779 17919 1624 1 271 "Average Difference" CA 71 0.675 -0.048 0.678 17919 1625 1 271 "Average Difference" CB 67 0.961 0.084 0.965 17919 1626 1 271 "Average Difference" HN 68 0.483 -0.013 0.486 17919 1627 1 272 "Average Difference" N 68 2.284 1.008 2.065 17919 1628 1 272 "Average Difference" HA 74 0.230 -0.032 0.229 17919 1629 1 272 "Average Difference" C 71 0.821 -0.196 0.803 17919 1630 1 272 "Average Difference" CA 71 0.702 0.039 0.706 17919 1631 1 272 "Average Difference" CB 67 0.962 -0.057 0.968 17919 1632 1 272 "Average Difference" HN 68 0.396 -0.010 0.399 17919 1633 1 273 "Average Difference" N 68 2.414 0.902 2.256 17919 1634 1 273 "Average Difference" HA 74 0.218 -0.030 0.217 17919 1635 1 273 "Average Difference" C 71 0.792 -0.111 0.790 17919 1636 1 273 "Average Difference" CA 71 0.717 -0.008 0.723 17919 1637 1 273 "Average Difference" CB 67 1.080 -0.100 1.083 17919 1638 1 273 "Average Difference" HN 68 0.464 0.009 0.467 17919 1639 1 274 "Average Difference" N 68 2.519 1.173 2.246 17919 1640 1 274 "Average Difference" HA 74 0.246 -0.050 0.243 17919 1641 1 274 "Average Difference" C 71 0.825 -0.101 0.825 17919 1642 1 274 "Average Difference" CA 71 0.658 0.041 0.662 17919 1643 1 274 "Average Difference" CB 67 1.083 -0.145 1.082 17919 1644 1 274 "Average Difference" HN 68 0.476 -0.051 0.477 17919 1645 1 275 "Average Difference" N 68 2.608 0.960 2.443 17919 1646 1 275 "Average Difference" HA 74 0.210 -0.027 0.210 17919 1647 1 275 "Average Difference" C 71 0.848 -0.081 0.850 17919 1648 1 275 "Average Difference" CA 71 0.623 0.016 0.627 17919 1649 1 275 "Average Difference" CB 67 1.098 -0.094 1.102 17919 1650 1 275 "Average Difference" HN 68 0.452 -0.030 0.455 17919 1651 1 276 "Average Difference" N 68 2.820 1.218 2.562 17919 1652 1 276 "Average Difference" HA 74 0.260 -0.022 0.261 17919 1653 1 276 "Average Difference" C 71 0.834 -0.202 0.815 17919 1654 1 276 "Average Difference" CA 71 0.708 -0.073 0.709 17919 1655 1 276 "Average Difference" CB 67 1.054 -0.043 1.061 17919 1656 1 276 "Average Difference" HN 68 0.435 -0.006 0.438 17919 1657 1 277 "Average Difference" N 68 2.286 1.068 2.036 17919 1658 1 277 "Average Difference" HA 74 0.234 -0.048 0.231 17919 1659 1 277 "Average Difference" C 71 0.841 -0.133 0.836 17919 1660 1 277 "Average Difference" CA 71 0.656 -0.063 0.658 17919 1661 1 277 "Average Difference" CB 67 1.057 0.021 1.065 17919 1662 1 277 "Average Difference" HN 68 0.436 0.009 0.439 17919 1663 1 278 "Average Difference" N 68 2.677 1.100 2.458 17919 1664 1 278 "Average Difference" HA 74 0.221 -0.032 0.220 17919 1665 1 278 "Average Difference" C 71 0.869 -0.017 0.875 17919 1666 1 278 "Average Difference" CA 71 0.653 0.043 0.656 17919 1667 1 278 "Average Difference" CB 67 1.041 -0.130 1.040 17919 1668 1 278 "Average Difference" HN 68 0.476 0.046 0.477 17919 1669 1 279 "Average Difference" N 68 2.517 0.918 2.361 17919 1670 1 279 "Average Difference" HA 74 0.216 -0.022 0.216 17919 1671 1 279 "Average Difference" C 71 0.817 -0.092 0.818 17919 1672 1 279 "Average Difference" CA 71 0.694 -0.057 0.697 17919 1673 1 279 "Average Difference" CB 67 1.119 -0.098 1.123 17919 1674 1 279 "Average Difference" HN 68 0.430 -0.007 0.433 17919 1675 1 280 "Average Difference" N 68 2.661 1.086 2.448 17919 1676 1 280 "Average Difference" HA 74 0.238 -0.002 0.240 17919 1677 1 280 "Average Difference" C 71 0.854 -0.198 0.837 17919 1678 1 280 "Average Difference" CA 71 0.740 -0.053 0.744 17919 1679 1 280 "Average Difference" CB 67 1.053 0.047 1.060 17919 1680 1 280 "Average Difference" HN 68 0.436 0.000 0.440 17919 1681 1 281 "Average Difference" N 68 2.505 1.079 2.278 17919 1682 1 281 "Average Difference" HA 74 0.229 -0.039 0.227 17919 1683 1 281 "Average Difference" C 71 0.809 -0.144 0.801 17919 1684 1 281 "Average Difference" CA 71 0.747 -0.109 0.745 17919 1685 1 281 "Average Difference" CB 67 1.019 -0.041 1.026 17919 1686 1 281 "Average Difference" HN 68 0.460 -0.016 0.463 17919 1687 1 282 "Average Difference" N 68 2.260 0.786 2.135 17919 1688 1 282 "Average Difference" HA 74 0.246 -0.006 0.248 17919 1689 1 282 "Average Difference" C 71 0.858 -0.163 0.848 17919 1690 1 282 "Average Difference" CA 71 0.637 -0.056 0.639 17919 1691 1 282 "Average Difference" CB 67 0.940 -0.030 0.947 17919 1692 1 282 "Average Difference" HN 68 0.432 -0.023 0.435 17919 1693 1 283 "Average Difference" N 68 2.940 0.940 2.806 17919 1694 1 283 "Average Difference" HA 74 0.231 -0.003 0.233 17919 1695 1 283 "Average Difference" C 71 0.749 -0.179 0.733 17919 1696 1 283 "Average Difference" CA 71 0.777 -0.089 0.777 17919 1697 1 283 "Average Difference" CB 67 1.009 -0.047 1.015 17919 1698 1 283 "Average Difference" HN 68 0.456 -0.032 0.459 17919 1699 1 284 "Average Difference" N 68 2.715 1.040 2.526 17919 1700 1 284 "Average Difference" HA 74 0.225 -0.013 0.227 17919 1701 1 284 "Average Difference" C 71 0.876 -0.147 0.869 17919 1702 1 284 "Average Difference" CA 71 0.769 -0.132 0.763 17919 1703 1 284 "Average Difference" CB 67 1.116 -0.052 1.124 17919 1704 1 284 "Average Difference" HN 68 0.463 -0.021 0.466 17919 1705 1 285 "Average Difference" N 68 2.599 1.011 2.413 17919 1706 1 285 "Average Difference" HA 74 0.244 -0.050 0.240 17919 1707 1 285 "Average Difference" C 71 0.855 -0.121 0.852 17919 1708 1 285 "Average Difference" CA 71 0.706 -0.017 0.711 17919 1709 1 285 "Average Difference" CB 67 0.975 -0.061 0.980 17919 1710 1 285 "Average Difference" HN 68 0.437 -0.002 0.440 17919 1711 1 286 "Average Difference" N 68 2.436 0.796 2.319 17919 1712 1 286 "Average Difference" HA 74 0.235 0.003 0.236 17919 1713 1 286 "Average Difference" C 71 0.814 -0.113 0.812 17919 1714 1 286 "Average Difference" CA 71 0.691 -0.094 0.689 17919 1715 1 286 "Average Difference" CB 67 1.016 -0.011 1.023 17919 1716 1 286 "Average Difference" HN 68 0.416 -0.004 0.419 17919 1717 1 287 "Average Difference" N 68 2.624 0.930 2.471 17919 1718 1 287 "Average Difference" HA 74 0.252 -0.029 0.252 17919 1719 1 287 "Average Difference" C 71 0.865 -0.155 0.857 17919 1720 1 287 "Average Difference" CA 71 0.684 0.021 0.689 17919 1721 1 287 "Average Difference" CB 67 0.990 0.002 0.997 17919 1722 1 287 "Average Difference" HN 68 0.472 0.019 0.475 17919 1723 1 288 "Average Difference" N 68 2.221 0.717 2.117 17919 1724 1 288 "Average Difference" HA 74 0.237 -0.027 0.237 17919 1725 1 288 "Average Difference" C 71 0.822 -0.130 0.817 17919 1726 1 288 "Average Difference" CA 71 0.714 -0.067 0.716 17919 1727 1 288 "Average Difference" CB 67 0.882 -0.047 0.888 17919 1728 1 288 "Average Difference" HN 68 0.460 -0.025 0.463 17919 1729 1 289 "Average Difference" N 68 2.656 0.851 2.535 17919 1730 1 289 "Average Difference" HA 74 0.219 -0.033 0.218 17919 1731 1 289 "Average Difference" C 71 0.809 -0.097 0.809 17919 1732 1 289 "Average Difference" CA 71 0.737 -0.036 0.742 17919 1733 1 289 "Average Difference" CB 67 0.968 -0.042 0.974 17919 1734 1 289 "Average Difference" HN 68 0.447 0.009 0.451 17919 1735 1 290 "Average Difference" N 68 2.462 1.138 2.199 17919 1736 1 290 "Average Difference" HA 74 0.201 -0.010 0.202 17919 1737 1 290 "Average Difference" C 71 0.762 -0.100 0.760 17919 1738 1 290 "Average Difference" CA 71 0.669 -0.076 0.670 17919 1739 1 290 "Average Difference" CB 67 1.058 -0.120 1.059 17919 1740 1 290 "Average Difference" HN 68 0.452 0.018 0.455 17919 1741 1 291 "Average Difference" N 68 2.611 1.111 2.380 17919 1742 1 291 "Average Difference" HA 74 0.234 -0.009 0.235 17919 1743 1 291 "Average Difference" C 71 0.883 -0.153 0.876 17919 1744 1 291 "Average Difference" CA 71 0.700 -0.058 0.703 17919 1745 1 291 "Average Difference" CB 67 1.052 0.048 1.058 17919 1746 1 291 "Average Difference" HN 68 0.433 0.043 0.434 17919 1747 1 292 "Average Difference" N 68 2.503 0.812 2.385 17919 1748 1 292 "Average Difference" HA 74 0.244 -0.001 0.246 17919 1749 1 292 "Average Difference" C 71 0.872 -0.165 0.863 17919 1750 1 292 "Average Difference" CA 71 0.722 -0.074 0.723 17919 1751 1 292 "Average Difference" CB 67 0.963 -0.027 0.970 17919 1752 1 292 "Average Difference" HN 68 0.413 0.006 0.416 17919 1753 1 293 "Average Difference" N 68 2.590 0.942 2.431 17919 1754 1 293 "Average Difference" HA 74 0.217 -0.045 0.214 17919 1755 1 293 "Average Difference" C 71 0.899 -0.070 0.903 17919 1756 1 293 "Average Difference" CA 71 0.745 -0.037 0.749 17919 1757 1 293 "Average Difference" CB 67 0.961 -0.071 0.965 17919 1758 1 293 "Average Difference" HN 68 0.493 -0.043 0.494 17919 1759 1 294 "Average Difference" N 68 2.526 1.039 2.319 17919 1760 1 294 "Average Difference" HA 74 0.253 -0.001 0.255 17919 1761 1 294 "Average Difference" C 71 0.830 -0.157 0.821 17919 1762 1 294 "Average Difference" CA 71 0.628 0.029 0.631 17919 1763 1 294 "Average Difference" CB 67 1.064 0.076 1.069 17919 1764 1 294 "Average Difference" HN 68 0.440 0.012 0.443 17919 1765 1 295 "Average Difference" N 68 2.405 0.960 2.222 17919 1766 1 295 "Average Difference" HA 74 0.236 -0.038 0.235 17919 1767 1 295 "Average Difference" C 71 0.845 -0.126 0.842 17919 1768 1 295 "Average Difference" CA 71 0.721 -0.013 0.726 17919 1769 1 295 "Average Difference" CB 67 1.050 -0.037 1.057 17919 1770 1 295 "Average Difference" HN 68 0.458 -0.048 0.459 17919 1771 1 296 "Average Difference" N 68 2.290 1.163 1.987 17919 1772 1 296 "Average Difference" HA 74 0.225 -0.014 0.227 17919 1773 1 296 "Average Difference" C 71 0.775 -0.103 0.773 17919 1774 1 296 "Average Difference" CA 71 0.562 -0.081 0.560 17919 1775 1 296 "Average Difference" CB 67 0.968 -0.040 0.974 17919 1776 1 296 "Average Difference" HN 68 0.430 0.001 0.433 17919 1777 1 297 "Average Difference" N 68 2.247 1.123 1.961 17919 1778 1 297 "Average Difference" HA 74 0.224 -0.014 0.225 17919 1779 1 297 "Average Difference" C 71 0.771 -0.128 0.766 17919 1780 1 297 "Average Difference" CA 71 0.585 -0.044 0.588 17919 1781 1 297 "Average Difference" CB 67 0.926 -0.006 0.933 17919 1782 1 297 "Average Difference" HN 68 0.440 -0.003 0.444 17919 1783 1 298 "Average Difference" N 68 3.108 0.878 3.004 17919 1784 1 298 "Average Difference" HA 74 0.248 0.007 0.249 17919 1785 1 298 "Average Difference" C 71 0.841 -0.123 0.838 17919 1786 1 298 "Average Difference" CA 71 0.790 0.020 0.795 17919 1787 1 298 "Average Difference" CB 67 1.179 -0.018 1.187 17919 1788 1 298 "Average Difference" HN 68 0.460 -0.005 0.463 17919 1789 1 299 "Average Difference" N 68 2.590 0.698 2.513 17919 1790 1 299 "Average Difference" HA 74 0.250 -0.010 0.251 17919 1791 1 299 "Average Difference" C 71 0.835 -0.103 0.834 17919 1792 1 299 "Average Difference" CA 71 0.748 -0.000 0.753 17919 1793 1 299 "Average Difference" CB 67 0.987 -0.007 0.994 17919 1794 1 299 "Average Difference" HN 68 0.455 -0.005 0.459 17919 1795 1 300 "Average Difference" N 68 2.560 1.099 2.330 17919 1796 1 300 "Average Difference" HA 74 0.219 -0.022 0.219 17919 1797 1 300 "Average Difference" C 71 0.800 -0.159 0.789 17919 1798 1 300 "Average Difference" CA 71 0.659 -0.131 0.650 17919 1799 1 300 "Average Difference" CB 67 1.069 -0.103 1.072 17919 1800 1 300 "Average Difference" HN 68 0.476 -0.004 0.479 17919 1801 1 301 "Average Difference" N 68 2.462 0.872 2.319 17919 1802 1 301 "Average Difference" HA 74 0.265 -0.020 0.266 17919 1803 1 301 "Average Difference" C 71 0.840 -0.197 0.823 17919 1804 1 301 "Average Difference" CA 71 0.791 -0.132 0.785 17919 1805 1 301 "Average Difference" CB 67 1.155 -0.037 1.163 17919 1806 1 301 "Average Difference" HN 68 0.489 -0.079 0.486 17919 stop_ save_ save_delta_chem_shifts_average _Entity_delta_chem_shifts.Sf_category delta_chem_shifts _Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts_average _Entity_delta_chem_shifts.Model_type average _Entity_delta_chem_shifts.Entry_ID 17919 _Entity_delta_chem_shifts.ID 2 _Entity_delta_chem_shifts.Details ; This saveframe contains the averaged SPARTA chemical shift over all the models used. ; loop_ _Delta_CS.Atom_chem_shift_ID _Delta_CS.Entity_delta_chem_shifts_ID _Delta_CS.Assembly_atom_ID _Delta_CS.Entity_assembly_ID _Delta_CS.Entity_ID _Delta_CS.Comp_index_ID _Delta_CS.Seq_ID _Delta_CS.Comp_ID _Delta_CS.Atom_ID _Delta_CS.Atom_type _Delta_CS.Auth_seq_ID _Delta_CS.Original_CS_value _Delta_CS.Corrected_CS_value _Delta_CS.Sparta_CS_value _Delta_CS.Delta_CS_value _Delta_CS.Entry_ID 1 1 . 1 1 2 2 GLN N N 2 123.220 123.220 121.545 1.675 17919 2 1 . 1 1 2 2 GLN HA H 2 5.249 5.249 5.208 0.041 17919 3 1 . 1 1 2 2 GLN C C 2 175.920 175.920 175.172 0.748 17919 4 1 . 1 1 2 2 GLN CA C 2 55.080 55.080 54.856 0.224 17919 5 1 . 1 1 2 2 GLN CB C 2 30.760 30.760 30.464 0.296 17919 6 1 . 1 1 2 2 GLN H H 2 8.900 8.900 8.416 0.484 17919 7 1 . 1 1 3 3 ILE N N 3 115.340 115.340 117.079 -1.739 17919 8 1 . 1 1 3 3 ILE HA H 3 4.213 4.213 4.393 -0.180 17919 9 1 . 1 1 3 3 ILE C C 3 172.450 172.450 173.510 -1.060 17919 10 1 . 1 1 3 3 ILE CA C 3 59.570 59.570 59.287 0.283 17919 11 1 . 1 1 3 3 ILE CB C 3 42.210 42.210 41.589 0.621 17919 12 1 . 1 1 3 3 ILE H H 3 8.320 8.320 8.336 -0.016 17919 13 1 . 1 1 4 4 PHE N N 4 118.110 118.110 119.832 -1.722 17919 14 1 . 1 1 4 4 PHE HA H 4 5.630 5.630 5.375 0.255 17919 15 1 . 1 1 4 4 PHE C C 4 175.320 175.320 175.213 0.107 17919 16 1 . 1 1 4 4 PHE CA C 4 55.210 55.210 55.540 -0.330 17919 17 1 . 1 1 4 4 PHE CB C 4 41.480 41.480 41.652 -0.172 17919 18 1 . 1 1 4 4 PHE H H 4 8.610 8.610 8.394 0.216 17919 19 1 . 1 1 5 5 VAL N N 5 121.000 121.000 122.089 -1.089 17919 20 1 . 1 1 5 5 VAL HA H 5 4.725 4.725 4.810 -0.085 17919 21 1 . 1 1 5 5 VAL C C 5 174.870 174.870 174.849 0.021 17919 22 1 . 1 1 5 5 VAL CA C 5 60.620 60.620 61.211 -0.591 17919 23 1 . 1 1 5 5 VAL CB C 5 34.230 34.230 33.951 0.279 17919 24 1 . 1 1 5 5 VAL H H 5 9.300 9.300 9.036 0.264 17919 25 1 . 1 1 6 6 LYS N N 6 127.520 127.520 128.625 -1.105 17919 26 1 . 1 1 6 6 LYS HA H 6 5.367 5.367 5.191 0.176 17919 27 1 . 1 1 6 6 LYS C C 6 177.140 177.140 176.408 0.732 17919 28 1 . 1 1 6 6 LYS CA C 6 54.520 54.520 54.529 -0.009 17919 29 1 . 1 1 6 6 LYS CB C 6 35.050 35.050 34.970 0.080 17919 30 1 . 1 1 6 6 LYS H H 6 8.820 8.820 9.032 -0.212 17919 31 1 . 1 1 7 7 THR N N 7 115.400 115.400 117.083 -1.683 17919 32 1 . 1 1 7 7 THR HA H 7 4.970 4.970 4.636 0.334 17919 33 1 . 1 1 7 7 THR C C 7 176.910 176.910 176.215 0.695 17919 34 1 . 1 1 7 7 THR CA C 7 60.470 60.470 60.758 -0.287 17919 35 1 . 1 1 7 7 THR CB C 7 70.630 70.630 70.467 0.163 17919 36 1 . 1 1 7 7 THR H H 7 8.730 8.730 8.586 0.144 17919 37 1 . 1 1 8 8 LEU N N 8 121.330 121.330 121.569 -0.239 17919 38 1 . 1 1 8 8 LEU HA H 8 4.310 4.310 4.283 0.027 17919 39 1 . 1 1 8 8 LEU C C 8 178.800 178.800 177.691 1.109 17919 40 1 . 1 1 8 8 LEU CA C 8 57.580 57.580 57.398 0.182 17919 41 1 . 1 1 8 8 LEU CB C 8 41.970 41.970 41.883 0.087 17919 42 1 . 1 1 8 8 LEU H H 8 9.100 9.100 8.693 0.407 17919 43 1 . 1 1 9 9 THR N N 9 105.590 105.590 108.322 -2.732 17919 44 1 . 1 1 9 9 THR HA H 9 4.428 4.428 4.329 0.099 17919 45 1 . 1 1 9 9 THR C C 9 175.520 175.520 175.552 -0.032 17919 46 1 . 1 1 9 9 THR CA C 9 61.400 61.400 61.914 -0.514 17919 47 1 . 1 1 9 9 THR CB C 9 69.140 69.140 69.004 0.136 17919 48 1 . 1 1 9 9 THR H H 9 7.630 7.630 7.698 -0.068 17919 49 1 . 1 1 10 10 GLY N N 10 108.890 108.890 110.861 -1.971 17919 50 1 . 1 1 10 10 GLY C C 10 174.070 174.070 173.834 0.236 17919 51 1 . 1 1 10 10 GLY CA C 10 45.460 45.460 45.058 0.401 17919 52 1 . 1 1 10 10 GLY H H 10 7.810 7.810 7.921 -0.111 17919 53 1 . 1 1 11 11 LYS N N 11 121.600 121.600 121.468 0.132 17919 54 1 . 1 1 11 11 LYS HA H 11 4.361 4.361 4.442 -0.081 17919 55 1 . 1 1 11 11 LYS C C 11 175.940 175.940 175.515 0.425 17919 56 1 . 1 1 11 11 LYS CA C 11 56.280 56.280 55.927 0.353 17919 57 1 . 1 1 11 11 LYS CB C 11 33.200 33.200 33.582 -0.382 17919 58 1 . 1 1 11 11 LYS H H 11 7.280 7.280 7.780 -0.500 17919 59 1 . 1 1 12 12 THR N N 12 120.440 120.440 119.283 1.157 17919 60 1 . 1 1 12 12 THR HA H 12 5.046 5.046 5.016 0.030 17919 61 1 . 1 1 12 12 THR C C 12 174.320 174.320 174.362 -0.042 17919 62 1 . 1 1 12 12 THR CA C 12 62.390 62.390 61.839 0.551 17919 63 1 . 1 1 12 12 THR CB C 12 69.910 69.910 69.966 -0.055 17919 64 1 . 1 1 12 12 THR H H 12 8.650 8.650 8.327 0.323 17919 65 1 . 1 1 13 13 ILE N N 13 127.110 127.110 125.312 1.798 17919 66 1 . 1 1 13 13 ILE HA H 13 4.544 4.544 4.572 -0.028 17919 67 1 . 1 1 13 13 ILE C C 13 175.220 175.220 174.867 0.353 17919 68 1 . 1 1 13 13 ILE CA C 13 59.980 59.980 59.988 -0.008 17919 69 1 . 1 1 13 13 ILE CB C 13 40.950 40.950 40.675 0.275 17919 70 1 . 1 1 13 13 ILE H H 13 9.450 9.450 8.954 0.496 17919 71 1 . 1 1 14 14 THR N N 14 121.520 121.520 121.944 -0.424 17919 72 1 . 1 1 14 14 THR HA H 14 4.964 4.964 4.943 0.021 17919 73 1 . 1 1 14 14 THR C C 14 173.790 173.790 173.838 -0.048 17919 74 1 . 1 1 14 14 THR CA C 14 61.940 61.940 62.046 -0.106 17919 75 1 . 1 1 14 14 THR CB C 14 69.650 69.650 69.788 -0.138 17919 76 1 . 1 1 14 14 THR H H 14 8.710 8.710 8.454 0.256 17919 77 1 . 1 1 15 15 LEU N N 15 124.800 124.800 126.694 -1.894 17919 78 1 . 1 1 15 15 LEU HA H 15 4.780 4.780 4.729 0.051 17919 79 1 . 1 1 15 15 LEU C C 15 174.670 174.670 175.167 -0.497 17919 80 1 . 1 1 15 15 LEU CA C 15 52.830 52.830 53.703 -0.873 17919 81 1 . 1 1 15 15 LEU CB C 15 47.070 47.070 45.287 1.783 17919 82 1 . 1 1 15 15 LEU H H 15 8.710 8.710 8.582 0.128 17919 83 1 . 1 1 16 16 GLU N N 16 122.160 122.160 123.273 -1.113 17919 84 1 . 1 1 16 16 GLU HA H 16 4.917 4.917 4.986 -0.069 17919 85 1 . 1 1 16 16 GLU C C 16 175.860 175.860 175.838 0.022 17919 86 1 . 1 1 16 16 GLU CA C 16 54.820 54.820 55.301 -0.481 17919 87 1 . 1 1 16 16 GLU CB C 16 29.450 29.450 30.391 -0.941 17919 88 1 . 1 1 16 16 GLU H H 16 8.140 8.140 8.618 -0.478 17919 89 1 . 1 1 17 17 VAL N N 17 117.210 117.210 119.780 -2.570 17919 90 1 . 1 1 17 17 VAL HA H 17 4.714 4.714 4.798 -0.084 17919 91 1 . 1 1 17 17 VAL C C 17 174.160 174.160 174.725 -0.565 17919 92 1 . 1 1 17 17 VAL CA C 17 58.430 58.430 59.140 -0.710 17919 93 1 . 1 1 17 17 VAL CB C 17 36.400 36.400 35.328 1.072 17919 94 1 . 1 1 17 17 VAL H H 17 8.900 8.900 8.621 0.279 17919 95 1 . 1 1 18 18 GLU N N 18 118.990 118.990 120.686 -1.696 17919 96 1 . 1 1 18 18 GLU HA H 18 5.079 5.079 4.835 0.244 17919 97 1 . 1 1 18 18 GLU C C 18 176.160 176.160 175.439 0.721 17919 98 1 . 1 1 18 18 GLU CA C 18 52.720 52.720 52.869 -0.149 17919 99 1 . 1 1 18 18 GLU CB C 18 30.310 30.310 30.913 -0.603 17919 100 1 . 1 1 18 18 GLU H H 18 8.640 8.640 8.607 0.033 17919 101 1 . 1 1 19 19 PRO HA H 19 4.141 4.141 4.282 -0.141 17919 102 1 . 1 1 19 19 PRO C C 19 175.310 175.310 177.668 -2.358 17919 103 1 . 1 1 19 19 PRO CA C 19 65.470 65.470 65.375 0.095 17919 104 1 . 1 1 19 19 PRO CB C 19 31.950 31.950 31.965 -0.015 17919 105 1 . 1 1 20 20 SER N N 20 103.400 103.400 110.340 -6.940 17919 106 1 . 1 1 20 20 SER HA H 20 4.370 4.370 4.316 0.054 17919 107 1 . 1 1 20 20 SER C C 20 174.660 174.660 174.407 0.253 17919 108 1 . 1 1 20 20 SER CA C 20 57.400 57.400 58.850 -1.450 17919 109 1 . 1 1 20 20 SER CB C 20 63.370 63.370 62.865 0.505 17919 110 1 . 1 1 20 20 SER H H 20 7.040 7.040 8.081 -1.041 17919 111 1 . 1 1 21 21 ASP N N 21 123.480 123.480 123.795 -0.315 17919 112 1 . 1 1 21 21 ASP HA H 21 4.695 4.695 4.682 0.013 17919 113 1 . 1 1 21 21 ASP C C 21 176.360 176.360 175.881 0.479 17919 114 1 . 1 1 21 21 ASP CA C 21 55.700 55.700 55.149 0.551 17919 115 1 . 1 1 21 21 ASP CB C 21 40.800 40.800 41.665 -0.865 17919 116 1 . 1 1 21 21 ASP H H 21 8.030 8.030 7.767 0.263 17919 117 1 . 1 1 22 22 THR N N 22 108.800 108.800 113.071 -4.271 17919 118 1 . 1 1 22 22 THR HA H 22 4.920 4.920 4.736 0.184 17919 119 1 . 1 1 22 22 THR C C 22 176.750 176.750 176.071 0.679 17919 120 1 . 1 1 22 22 THR CA C 22 59.690 59.690 61.239 -1.549 17919 121 1 . 1 1 22 22 THR CB C 22 71.200 71.200 70.580 0.620 17919 122 1 . 1 1 22 22 THR H H 22 7.900 7.900 8.273 -0.373 17919 123 1 . 1 1 23 23 ILE N N 23 121.190 121.190 122.531 -1.341 17919 124 1 . 1 1 23 23 ILE HA H 23 3.657 3.657 3.783 -0.126 17919 125 1 . 1 1 23 23 ILE C C 23 179.040 179.040 177.704 1.336 17919 126 1 . 1 1 23 23 ILE CA C 23 62.260 62.260 62.681 -0.421 17919 127 1 . 1 1 23 23 ILE CB C 23 34.350 34.350 36.381 -2.031 17919 128 1 . 1 1 23 23 ILE H H 23 8.560 8.560 8.789 -0.229 17919 129 1 . 1 1 24 24 GLU N N 24 120.830 120.830 120.706 0.124 17919 130 1 . 1 1 24 24 GLU HA H 24 3.917 3.917 3.900 0.017 17919 131 1 . 1 1 24 24 GLU C C 24 178.640 178.640 178.569 0.071 17919 132 1 . 1 1 24 24 GLU CA C 24 60.220 60.220 59.960 0.260 17919 133 1 . 1 1 24 24 GLU CB C 24 28.280 28.280 29.368 -1.088 17919 134 1 . 1 1 24 24 GLU H H 24 9.760 9.760 8.289 1.471 17919 135 1 . 1 1 25 25 ASN N N 25 120.570 120.570 117.827 2.743 17919 136 1 . 1 1 25 25 ASN HA H 25 4.525 4.525 4.513 0.012 17919 137 1 . 1 1 25 25 ASN C C 25 178.380 178.380 177.901 0.479 17919 138 1 . 1 1 25 25 ASN CA C 25 56.060 56.060 55.952 0.108 17919 139 1 . 1 1 25 25 ASN CB C 25 38.450 38.450 38.496 -0.046 17919 140 1 . 1 1 25 25 ASN H H 25 7.920 7.920 7.725 0.195 17919 141 1 . 1 1 26 26 VAL N N 26 121.710 121.710 120.522 1.188 17919 142 1 . 1 1 26 26 VAL HA H 26 3.397 3.397 3.611 -0.214 17919 143 1 . 1 1 26 26 VAL C C 26 177.950 177.950 177.703 0.247 17919 144 1 . 1 1 26 26 VAL CA C 26 67.660 67.660 66.396 1.264 17919 145 1 . 1 1 26 26 VAL CB C 26 30.840 30.840 31.354 -0.514 17919 146 1 . 1 1 26 26 VAL H H 26 8.070 8.070 8.034 0.036 17919 147 1 . 1 1 27 27 LYS N N 27 118.860 118.860 119.947 -1.087 17919 148 1 . 1 1 27 27 LYS HA H 27 4.580 4.580 4.178 0.402 17919 149 1 . 1 1 27 27 LYS C C 27 180.550 180.550 179.037 1.513 17919 150 1 . 1 1 27 27 LYS CA C 27 59.250 59.250 59.566 -0.316 17919 151 1 . 1 1 27 27 LYS CB C 27 33.730 33.730 32.219 1.511 17919 152 1 . 1 1 27 27 LYS H H 27 8.560 8.560 8.155 0.405 17919 153 1 . 1 1 28 28 ALA N N 28 123.440 123.440 121.763 1.677 17919 154 1 . 1 1 28 28 ALA HA H 28 4.160 4.160 4.097 0.063 17919 155 1 . 1 1 28 28 ALA C C 28 180.300 180.300 179.139 1.161 17919 156 1 . 1 1 28 28 ALA CA C 28 55.370 55.370 55.001 0.369 17919 157 1 . 1 1 28 28 ALA CB C 28 17.710 17.710 18.385 -0.675 17919 158 1 . 1 1 28 28 ALA H H 28 8.060 8.060 8.166 -0.106 17919 159 1 . 1 1 29 29 LYS N N 29 119.940 119.940 119.295 0.645 17919 160 1 . 1 1 29 29 LYS HA H 29 4.207 4.207 4.044 0.163 17919 161 1 . 1 1 29 29 LYS C C 29 180.320 180.320 179.031 1.289 17919 162 1 . 1 1 29 29 LYS CA C 29 59.650 59.650 59.252 0.398 17919 163 1 . 1 1 29 29 LYS CB C 29 33.290 33.290 32.336 0.954 17919 164 1 . 1 1 29 29 LYS H H 29 7.850 7.850 7.641 0.209 17919 165 1 . 1 1 30 30 ILE N N 30 121.080 121.080 120.179 0.901 17919 166 1 . 1 1 30 30 ILE HA H 30 3.507 3.507 3.626 -0.119 17919 167 1 . 1 1 30 30 ILE C C 30 178.310 178.310 177.439 0.871 17919 168 1 . 1 1 30 30 ILE CA C 30 66.150 66.150 65.141 1.009 17919 169 1 . 1 1 30 30 ILE CB C 30 36.800 36.800 37.605 -0.805 17919 170 1 . 1 1 30 30 ILE H H 30 8.280 8.280 8.087 0.193 17919 171 1 . 1 1 31 31 GLN N N 31 123.490 123.490 120.353 3.137 17919 172 1 . 1 1 31 31 GLN HA H 31 3.829 3.829 3.994 -0.165 17919 173 1 . 1 1 31 31 GLN C C 31 178.890 178.890 178.270 0.620 17919 174 1 . 1 1 31 31 GLN CA C 31 60.000 60.000 59.166 0.834 17919 175 1 . 1 1 31 31 GLN CB C 31 27.720 27.720 28.445 -0.725 17919 176 1 . 1 1 31 31 GLN H H 31 8.580 8.580 8.111 0.469 17919 177 1 . 1 1 32 32 ASP N N 32 119.360 119.360 119.101 0.259 17919 178 1 . 1 1 32 32 ASP HA H 32 4.354 4.354 4.415 -0.061 17919 179 1 . 1 1 32 32 ASP C C 32 177.250 177.250 177.857 -0.607 17919 180 1 . 1 1 32 32 ASP CA C 32 57.190 57.190 56.682 0.508 17919 181 1 . 1 1 32 32 ASP CB C 32 40.580 40.580 40.783 -0.203 17919 182 1 . 1 1 32 32 ASP H H 32 8.010 8.010 8.056 -0.046 17919 183 1 . 1 1 33 33 LYS N N 33 115.130 115.130 118.026 -2.896 17919 184 1 . 1 1 33 33 LYS HA H 33 4.337 4.337 4.316 0.021 17919 185 1 . 1 1 33 33 LYS C C 33 177.870 177.870 178.020 -0.150 17919 186 1 . 1 1 33 33 LYS CA C 33 58.050 58.050 57.867 0.183 17919 187 1 . 1 1 33 33 LYS CB C 33 34.170 34.170 33.562 0.608 17919 188 1 . 1 1 33 33 LYS H H 33 7.430 7.430 7.596 -0.166 17919 189 1 . 1 1 34 34 GLU N N 34 113.870 113.870 115.292 -1.422 17919 190 1 . 1 1 34 34 GLU HA H 34 4.625 4.625 4.476 0.149 17919 191 1 . 1 1 34 34 GLU C C 34 177.840 177.840 177.096 0.744 17919 192 1 . 1 1 34 34 GLU CA C 34 55.170 55.170 55.964 -0.794 17919 193 1 . 1 1 34 34 GLU CB C 34 32.660 32.660 31.400 1.260 17919 194 1 . 1 1 34 34 GLU H H 34 8.740 8.740 8.131 0.609 17919 195 1 . 1 1 35 35 GLY N N 35 108.650 108.650 108.923 -0.273 17919 196 1 . 1 1 35 35 GLY C C 35 173.960 173.960 174.409 -0.449 17919 197 1 . 1 1 35 35 GLY CA C 35 46.080 46.080 45.756 0.324 17919 198 1 . 1 1 35 35 GLY H H 35 8.530 8.530 8.079 0.451 17919 199 1 . 1 1 36 36 ILE N N 36 119.880 119.880 121.049 -1.169 17919 200 1 . 1 1 36 36 ILE HA H 36 4.445 4.445 4.353 0.092 17919 201 1 . 1 1 36 36 ILE C C 36 173.590 173.590 174.170 -0.580 17919 202 1 . 1 1 36 36 ILE CA C 36 57.750 57.750 57.833 -0.083 17919 203 1 . 1 1 36 36 ILE CB C 36 40.580 40.580 38.284 2.296 17919 204 1 . 1 1 36 36 ILE H H 36 6.150 6.150 7.626 -1.476 17919 205 1 . 1 1 37 37 PRO HA H 37 4.634 4.634 4.723 -0.089 17919 206 1 . 1 1 37 37 PRO C C 37 176.940 176.940 176.179 0.761 17919 207 1 . 1 1 37 37 PRO CA C 37 61.660 61.660 61.537 0.123 17919 208 1 . 1 1 37 37 PRO CB C 37 31.850 31.850 31.293 0.557 17919 209 1 . 1 1 38 38 PRO HA H 38 4.117 4.117 4.184 -0.067 17919 210 1 . 1 1 38 38 PRO C C 38 178.320 178.320 178.273 0.047 17919 211 1 . 1 1 38 38 PRO CA C 38 66.260 66.260 65.646 0.614 17919 212 1 . 1 1 38 38 PRO CB C 38 32.890 32.890 31.845 1.045 17919 213 1 . 1 1 39 39 ASP N N 39 113.380 113.380 116.054 -2.674 17919 214 1 . 1 1 39 39 ASP HA H 39 4.430 4.430 4.370 0.060 17919 215 1 . 1 1 39 39 ASP C C 39 177.090 177.090 177.513 -0.423 17919 216 1 . 1 1 39 39 ASP CA C 39 55.640 55.640 56.617 -0.977 17919 217 1 . 1 1 39 39 ASP CB C 39 39.540 39.540 40.285 -0.745 17919 218 1 . 1 1 39 39 ASP H H 39 8.550 8.550 8.653 -0.103 17919 219 1 . 1 1 40 40 GLN N N 40 116.780 116.780 116.874 -0.094 17919 220 1 . 1 1 40 40 GLN HA H 40 4.464 4.464 4.331 0.133 17919 221 1 . 1 1 40 40 GLN C C 40 175.380 175.380 175.980 -0.600 17919 222 1 . 1 1 40 40 GLN CA C 40 55.640 55.640 56.178 -0.538 17919 223 1 . 1 1 40 40 GLN CB C 40 30.140 30.140 29.514 0.626 17919 224 1 . 1 1 40 40 GLN H H 40 7.820 7.820 7.834 -0.014 17919 225 1 . 1 1 41 41 GLN N N 41 117.720 117.720 119.187 -1.467 17919 226 1 . 1 1 41 41 GLN HA H 41 4.244 4.244 4.479 -0.235 17919 227 1 . 1 1 41 41 GLN C C 41 176.300 176.300 175.231 1.069 17919 228 1 . 1 1 41 41 GLN CA C 41 56.470 56.470 55.985 0.485 17919 229 1 . 1 1 41 41 GLN CB C 41 31.650 31.650 29.749 1.901 17919 230 1 . 1 1 41 41 GLN H H 41 7.480 7.480 7.444 0.036 17919 231 1 . 1 1 42 42 ARG N N 42 122.680 122.680 124.156 -1.476 17919 232 1 . 1 1 42 42 ARG HA H 42 4.500 4.500 4.617 -0.117 17919 233 1 . 1 1 42 42 ARG C C 42 174.050 174.050 174.306 -0.256 17919 234 1 . 1 1 42 42 ARG CA C 42 55.050 55.050 54.743 0.306 17919 235 1 . 1 1 42 42 ARG CB C 42 31.750 31.750 32.575 -0.826 17919 236 1 . 1 1 42 42 ARG H H 42 8.530 8.530 8.483 0.047 17919 237 1 . 1 1 43 43 LEU N N 43 124.040 124.040 126.021 -1.981 17919 238 1 . 1 1 43 43 LEU C C 43 175.290 175.290 175.629 -0.339 17919 239 1 . 1 1 43 43 LEU CA C 43 52.980 52.980 53.945 -0.965 17919 240 1 . 1 1 43 43 LEU CB C 43 45.790 45.790 43.967 1.823 17919 241 1 . 1 1 43 43 LEU H H 43 8.820 8.820 8.743 0.077 17919 242 1 . 1 1 44 44 ILE N N 44 121.920 121.920 121.883 0.037 17919 243 1 . 1 1 44 44 ILE HA H 44 4.992 4.992 5.005 -0.013 17919 244 1 . 1 1 44 44 ILE C C 44 176.060 176.060 174.321 1.739 17919 245 1 . 1 1 44 44 ILE CA C 44 58.980 58.980 59.840 -0.860 17919 246 1 . 1 1 44 44 ILE CB C 44 41.420 41.420 41.130 0.290 17919 247 1 . 1 1 44 44 ILE H H 44 9.030 9.030 8.691 0.339 17919 248 1 . 1 1 45 45 PHE N N 45 125.390 125.390 127.181 -1.791 17919 249 1 . 1 1 45 45 PHE HA H 45 5.045 5.045 4.988 0.057 17919 250 1 . 1 1 45 45 PHE C C 45 174.470 174.470 174.546 -0.076 17919 251 1 . 1 1 45 45 PHE CA C 45 57.020 57.020 56.618 0.402 17919 252 1 . 1 1 45 45 PHE CB C 45 43.760 43.760 42.836 0.924 17919 253 1 . 1 1 45 45 PHE H H 45 8.830 8.830 8.748 0.082 17919 254 1 . 1 1 46 46 ALA N N 46 132.200 132.200 129.181 3.019 17919 255 1 . 1 1 46 46 ALA HA H 46 3.690 3.690 3.692 -0.002 17919 256 1 . 1 1 46 46 ALA C C 46 177.290 177.290 177.618 -0.328 17919 257 1 . 1 1 46 46 ALA CA C 46 52.540 52.540 52.588 -0.048 17919 258 1 . 1 1 46 46 ALA CB C 46 16.570 16.570 16.596 -0.026 17919 259 1 . 1 1 46 46 ALA H H 46 8.810 8.810 8.719 0.091 17919 260 1 . 1 1 47 47 GLY N N 47 102.340 102.340 104.122 -1.782 17919 261 1 . 1 1 47 47 GLY C C 47 173.810 173.810 174.299 -0.489 17919 262 1 . 1 1 47 47 GLY CA C 47 45.350 45.350 45.155 0.195 17919 263 1 . 1 1 47 47 GLY H H 47 8.130 8.130 8.461 -0.331 17919 264 1 . 1 1 48 48 LYS N N 48 121.570 121.570 121.318 0.252 17919 265 1 . 1 1 48 48 LYS HA H 48 4.622 4.622 4.583 0.039 17919 266 1 . 1 1 48 48 LYS C C 48 174.700 174.700 175.363 -0.663 17919 267 1 . 1 1 48 48 LYS CA C 48 54.550 54.550 54.874 -0.324 17919 268 1 . 1 1 48 48 LYS CB C 48 34.530 34.530 34.321 0.209 17919 269 1 . 1 1 48 48 LYS H H 48 7.980 7.980 7.838 0.142 17919 270 1 . 1 1 49 49 GLN N N 49 122.410 122.410 123.978 -1.568 17919 271 1 . 1 1 49 49 GLN HA H 49 4.560 4.560 4.500 0.060 17919 272 1 . 1 1 49 49 GLN C C 49 175.670 175.670 175.650 0.020 17919 273 1 . 1 1 49 49 GLN CA C 49 55.740 55.740 56.050 -0.310 17919 274 1 . 1 1 49 49 GLN CB C 49 29.000 29.000 29.330 -0.330 17919 275 1 . 1 1 49 49 GLN H H 49 8.600 8.600 8.579 0.021 17919 276 1 . 1 1 50 50 LEU N N 50 125.520 125.520 127.182 -1.662 17919 277 1 . 1 1 50 50 LEU HA H 50 4.090 4.090 4.157 -0.067 17919 278 1 . 1 1 50 50 LEU C C 50 176.660 176.660 176.200 0.460 17919 279 1 . 1 1 50 50 LEU CA C 50 54.240 54.240 54.175 0.065 17919 280 1 . 1 1 50 50 LEU CB C 50 41.570 41.570 42.104 -0.534 17919 281 1 . 1 1 50 50 LEU H H 50 8.530 8.530 8.437 0.093 17919 282 1 . 1 1 51 51 GLU N N 51 122.940 122.940 123.130 -0.190 17919 283 1 . 1 1 51 51 GLU HA H 51 4.488 4.488 4.498 -0.010 17919 284 1 . 1 1 51 51 GLU C C 51 175.870 175.870 176.764 -0.894 17919 285 1 . 1 1 51 51 GLU CA C 51 55.960 55.960 55.434 0.526 17919 286 1 . 1 1 51 51 GLU CB C 51 31.570 31.570 31.759 -0.189 17919 287 1 . 1 1 51 51 GLU H H 51 8.400 8.400 8.410 -0.010 17919 288 1 . 1 1 52 52 ASP N N 52 120.030 120.030 124.822 -4.792 17919 289 1 . 1 1 52 52 ASP HA H 52 4.359 4.359 4.462 -0.103 17919 290 1 . 1 1 52 52 ASP C C 52 177.330 177.330 177.659 -0.329 17919 291 1 . 1 1 52 52 ASP CA C 52 56.960 56.960 57.315 -0.355 17919 292 1 . 1 1 52 52 ASP CB C 52 40.850 40.850 40.833 0.017 17919 293 1 . 1 1 52 52 ASP H H 52 8.160 8.160 8.828 -0.668 17919 294 1 . 1 1 53 53 GLY N N 53 106.660 106.660 105.584 1.076 17919 295 1 . 1 1 53 53 GLY C C 53 174.870 174.870 174.284 0.586 17919 296 1 . 1 1 53 53 GLY CA C 53 45.170 45.170 44.889 0.281 17919 297 1 . 1 1 53 53 GLY H H 53 9.390 9.390 8.428 0.962 17919 298 1 . 1 1 54 54 ARG N N 54 119.050 119.050 120.464 -1.414 17919 299 1 . 1 1 54 54 ARG HA H 54 4.695 4.695 4.620 0.075 17919 300 1 . 1 1 54 54 ARG C C 54 175.350 175.350 175.433 -0.083 17919 301 1 . 1 1 54 54 ARG CA C 54 54.390 54.390 54.503 -0.113 17919 302 1 . 1 1 54 54 ARG CB C 54 32.650 32.650 32.561 0.089 17919 303 1 . 1 1 54 54 ARG H H 54 7.460 7.460 7.520 -0.060 17919 304 1 . 1 1 55 55 THR N N 55 108.400 108.400 112.438 -4.038 17919 305 1 . 1 1 55 55 THR HA H 55 5.240 5.240 4.969 0.271 17919 306 1 . 1 1 55 55 THR C C 55 176.560 176.560 176.175 0.385 17919 307 1 . 1 1 55 55 THR CA C 55 59.690 59.690 60.414 -0.724 17919 308 1 . 1 1 55 55 THR CB C 55 72.260 72.260 70.948 1.312 17919 309 1 . 1 1 55 55 THR H H 55 8.730 8.730 8.723 0.007 17919 310 1 . 1 1 56 56 LEU N N 56 117.920 117.920 121.831 -3.911 17919 311 1 . 1 1 56 56 LEU HA H 56 4.060 4.060 4.003 0.057 17919 312 1 . 1 1 56 56 LEU C C 56 180.810 180.810 178.857 1.953 17919 313 1 . 1 1 56 56 LEU CA C 56 58.710 58.710 58.421 0.289 17919 314 1 . 1 1 56 56 LEU CB C 56 40.370 40.370 41.319 -0.949 17919 315 1 . 1 1 56 56 LEU H H 56 8.140 8.140 8.542 -0.402 17919 316 1 . 1 1 57 57 SER N N 57 113.330 113.330 114.412 -1.082 17919 317 1 . 1 1 57 57 SER HA H 57 4.370 4.370 4.158 0.212 17919 318 1 . 1 1 57 57 SER C C 57 178.310 178.310 176.744 1.566 17919 319 1 . 1 1 57 57 SER CA C 57 61.080 61.080 61.704 -0.624 17919 320 1 . 1 1 57 57 SER CB C 57 62.530 62.530 62.643 -0.114 17919 321 1 . 1 1 57 57 SER H H 57 8.470 8.470 8.115 0.355 17919 322 1 . 1 1 58 58 ASP N N 58 124.190 124.190 122.233 1.957 17919 323 1 . 1 1 58 58 ASP HA H 58 4.296 4.296 4.325 -0.029 17919 324 1 . 1 1 58 58 ASP C C 58 177.400 177.400 177.224 0.176 17919 325 1 . 1 1 58 58 ASP CA C 58 57.180 57.180 56.681 0.499 17919 326 1 . 1 1 58 58 ASP CB C 58 40.100 40.100 40.466 -0.366 17919 327 1 . 1 1 58 58 ASP H H 58 7.930 7.930 7.798 0.132 17919 328 1 . 1 1 59 59 TYR N N 59 115.510 115.510 115.586 -0.076 17919 329 1 . 1 1 59 59 TYR HA H 59 4.670 4.670 4.615 0.055 17919 330 1 . 1 1 59 59 TYR C C 59 174.700 174.700 175.070 -0.370 17919 331 1 . 1 1 59 59 TYR CA C 59 58.250 58.250 57.393 0.857 17919 332 1 . 1 1 59 59 TYR CB C 59 40.070 40.070 38.358 1.712 17919 333 1 . 1 1 59 59 TYR H H 59 7.250 7.250 7.343 -0.093 17919 334 1 . 1 1 60 60 ASN N N 60 115.900 115.900 116.713 -0.813 17919 335 1 . 1 1 60 60 ASN HA H 60 4.355 4.355 4.380 -0.025 17919 336 1 . 1 1 60 60 ASN C C 60 174.340 174.340 174.551 -0.211 17919 337 1 . 1 1 60 60 ASN CA C 60 54.120 54.120 54.209 -0.089 17919 338 1 . 1 1 60 60 ASN CB C 60 37.410 37.410 37.287 0.123 17919 339 1 . 1 1 60 60 ASN H H 60 8.150 8.150 7.848 0.302 17919 340 1 . 1 1 61 61 ILE N N 61 118.600 118.600 119.852 -1.252 17919 341 1 . 1 1 61 61 ILE HA H 61 3.393 3.393 3.822 -0.429 17919 342 1 . 1 1 61 61 ILE C C 61 174.610 174.610 175.254 -0.644 17919 343 1 . 1 1 61 61 ILE CA C 61 62.420 62.420 61.695 0.725 17919 344 1 . 1 1 61 61 ILE CB C 61 36.740 36.740 37.427 -0.687 17919 345 1 . 1 1 61 61 ILE H H 61 7.250 7.250 7.909 -0.659 17919 346 1 . 1 1 62 62 GLN N N 62 124.740 124.740 125.601 -0.861 17919 347 1 . 1 1 62 62 GLN HA H 62 4.506 4.506 4.677 -0.171 17919 348 1 . 1 1 62 62 GLN C C 62 175.970 175.970 175.559 0.411 17919 349 1 . 1 1 62 62 GLN CA C 62 53.660 53.660 53.615 0.045 17919 350 1 . 1 1 62 62 GLN CB C 62 31.650 31.650 31.532 0.118 17919 351 1 . 1 1 62 62 GLN H H 62 7.610 7.610 8.040 -0.430 17919 352 1 . 1 1 63 63 LYS N N 63 120.300 120.300 121.113 -0.813 17919 353 1 . 1 1 63 63 LYS HA H 63 4.001 4.001 4.012 -0.011 17919 354 1 . 1 1 63 63 LYS C C 63 175.810 175.810 176.926 -1.116 17919 355 1 . 1 1 63 63 LYS CA C 63 57.790 57.790 57.797 -0.007 17919 356 1 . 1 1 63 63 LYS CB C 63 32.650 32.650 32.015 0.635 17919 357 1 . 1 1 63 63 LYS H H 63 8.490 8.490 8.590 -0.100 17919 358 1 . 1 1 64 64 GLU N N 64 113.950 113.950 119.010 -5.060 17919 359 1 . 1 1 64 64 GLU HA H 64 3.465 3.465 3.648 -0.183 17919 360 1 . 1 1 64 64 GLU C C 64 175.250 175.250 175.780 -0.530 17919 361 1 . 1 1 64 64 GLU CA C 64 57.890 57.890 57.760 0.130 17919 362 1 . 1 1 64 64 GLU CB C 64 25.900 25.900 28.485 -2.585 17919 363 1 . 1 1 64 64 GLU H H 64 9.280 9.280 8.790 0.490 17919 364 1 . 1 1 65 65 SER N N 65 114.730 114.730 115.395 -0.665 17919 365 1 . 1 1 65 65 SER HA H 65 4.640 4.640 4.495 0.145 17919 366 1 . 1 1 65 65 SER C C 65 172.160 172.160 173.971 -1.811 17919 367 1 . 1 1 65 65 SER CA C 65 60.890 60.890 60.018 0.872 17919 368 1 . 1 1 65 65 SER CB C 65 64.910 64.910 64.032 0.878 17919 369 1 . 1 1 65 65 SER H H 65 7.670 7.670 7.579 0.091 17919 370 1 . 1 1 66 66 THR N N 66 117.110 117.110 119.891 -2.781 17919 371 1 . 1 1 66 66 THR HA H 66 5.270 5.270 5.057 0.213 17919 372 1 . 1 1 66 66 THR C C 66 173.950 173.950 174.111 -0.161 17919 373 1 . 1 1 66 66 THR CA C 66 62.340 62.340 62.231 0.109 17919 374 1 . 1 1 66 66 THR CB C 66 70.080 70.080 70.103 -0.023 17919 375 1 . 1 1 66 66 THR H H 66 8.730 8.730 8.442 0.288 17919 376 1 . 1 1 67 67 LEU N N 67 127.110 127.110 127.125 -0.015 17919 377 1 . 1 1 67 67 LEU HA H 67 5.060 5.060 4.896 0.164 17919 378 1 . 1 1 67 67 LEU C C 67 175.770 175.770 175.506 0.264 17919 379 1 . 1 1 67 67 LEU CA C 67 53.900 53.900 53.864 0.036 17919 380 1 . 1 1 67 67 LEU CB C 67 44.260 44.260 44.244 0.016 17919 381 1 . 1 1 67 67 LEU H H 67 9.410 9.410 8.978 0.432 17919 382 1 . 1 1 68 68 HIS N N 68 118.380 118.380 121.019 -2.639 17919 383 1 . 1 1 68 68 HIS HA H 68 5.240 5.240 5.329 -0.089 17919 384 1 . 1 1 68 68 HIS C C 68 173.150 173.150 174.000 -0.850 17919 385 1 . 1 1 68 68 HIS CA C 68 55.000 55.000 54.376 0.624 17919 386 1 . 1 1 68 68 HIS CB C 68 30.530 30.530 32.209 -1.679 17919 387 1 . 1 1 68 68 HIS H H 68 9.230 9.230 8.871 0.359 17919 388 1 . 1 1 69 69 LEU N N 69 124.460 124.460 127.479 -3.019 17919 389 1 . 1 1 69 69 LEU HA H 69 5.190 5.190 4.967 0.223 17919 390 1 . 1 1 69 69 LEU C C 69 175.270 175.270 174.451 0.819 17919 391 1 . 1 1 69 69 LEU CA C 69 53.890 53.890 54.075 -0.185 17919 392 1 . 1 1 69 69 LEU CB C 69 44.380 44.380 44.245 0.136 17919 393 1 . 1 1 69 69 LEU H H 69 8.340 8.340 8.181 0.159 17919 394 1 . 1 1 70 70 VAL N N 70 126.940 126.940 124.801 2.139 17919 395 1 . 1 1 70 70 VAL HA H 70 4.350 4.350 4.430 -0.080 17919 396 1 . 1 1 70 70 VAL C C 70 174.000 174.000 174.248 -0.248 17919 397 1 . 1 1 70 70 VAL CA C 70 60.800 60.800 60.366 0.434 17919 398 1 . 1 1 70 70 VAL CB C 70 34.910 34.910 34.912 -0.002 17919 399 1 . 1 1 70 70 VAL H H 70 9.200 9.200 8.673 0.527 17919 400 1 . 1 1 71 71 LEU N N 71 123.130 123.130 124.356 -1.226 17919 401 1 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.954 0.106 17919 402 1 . 1 1 71 71 LEU C C 71 177.830 177.830 177.067 0.763 17919 403 1 . 1 1 71 71 LEU CA C 71 53.940 53.940 53.568 0.372 17919 404 1 . 1 1 71 71 LEU CB C 71 42.850 42.850 43.235 -0.385 17919 405 1 . 1 1 71 71 LEU H H 71 8.120 8.120 8.403 -0.283 17919 406 1 . 1 1 72 72 ARG N N 72 123.490 123.490 123.823 -0.333 17919 407 1 . 1 1 72 72 ARG HA H 72 4.301 4.301 4.404 -0.103 17919 408 1 . 1 1 72 72 ARG C C 72 175.350 175.350 175.519 -0.169 17919 409 1 . 1 1 72 72 ARG CA C 72 55.610 55.610 55.917 -0.307 17919 410 1 . 1 1 72 72 ARG CB C 72 31.350 31.350 30.635 0.715 17919 411 1 . 1 1 72 72 ARG H H 72 8.580 8.580 8.363 0.217 17919 stop_ save_